0 B10R0.41 C#CC(CC)OCCCCC 34a_100000758843_100000718602 [0,0,0,0,0,0|3,0,1]=4 1 B10R0.41 C#CC(CC)OCCCCC 7a_100000758843_100000210326 [0,0,0,0,0,0|3,0,1]=4 2 B10R0.41 C#CC(CCCCCBr)OC 34a_200010408556_200000210301 [0,0,0,0,0,0|2,0,1]=3 3 B10R0.41 C#CC(CCCCCBr)OC 7a_200010408556_200000210301 [0,0,0,0,0,0|2,0,1]=3 4 B10R0.41 C#CC(CCCCCBr)O[13CH3] 34a_200010408556_200025704644 [0,0,0,0,0,0|2,0,1]=3 5 B10R0.41 C#CC(CCCCCBr)O[13CH3] 7a_200010408556_200025704644 [0,0,0,0,0,0|2,0,1]=3 6 B10R0.41 C#CCCNCC(OC)OC 34a_100000755551_100000211822 [0,0,0,0,0,0|1,0,2]=3 7 B10R0.41 C#CCCOCC(CC)OC 34a_100011934954_100000688953 [0,0,0,0,0,0|2,0,2]=4 8 B10R0.41 C#CCCOCC(CC)OC 7a_100011934954_100000688953 [0,0,0,0,0,0|2,0,2]=4 9 B10R0.41 C#CCCOCC(OC)OC 34a_100011215631_100000211822 [0,0,0,0,0,0|1,0,2]=3 10 B10R0.41 C#CCCOCC(OC)OC 34a_100011216393_100000688953 [0,0,0,0,0,0|1,0,2]=3 11 B10R0.41 C#CCCSCC(OC)OC 62a_100000688953_100000751394 [0,0,0,0,0,0|1,0,2]=3 12 B10R0.41 C#CCCSCC(OC)OC 62a_100000751394_100000688953 [0,0,0,0,0,0|1,0,2]=3 13 B10R0.41 C#CCNCCC(OC)OC 34a_100000212058_100000139399 [0,0,0,0,0,0|1,0,2]=3 14 B10R0.41 C#CCOCCC(OC)OC 34a_100000210247_100000139399 [0,0,0,0,0,0|1,0,2]=3 15 B10R0.41 C#CCSCCC(OC)OC 62a_100000038162_100000139399 [0,0,0,0,0,0|1,0,2]=3 16 B10R0.41 C/C=C/COCC(CC)OC 34a_100011934954_100102629194 [0,0,0,0,0,0|2,0,2]=4 17 B10R0.41 C/C=C/COCC(CC)OC 7a_100011934954_100102629194 [0,0,0,0,0,0|2,0,2]=4 18 B10R0.41 C/C=C/COCC(OC)OC 34a_100011216393_100102629194 [0,0,0,0,0,0|1,0,2]=3 19 B10R0.41 C/C=C/COCC(OC)OC 34a_100016270725_100000211822 [0,0,0,0,0,0|1,0,2]=3 20 B10R0.41 C/C=C/CSCC(OC)OC 62a_100000751394_100102629194 [0,0,0,0,0,0|1,0,2]=3 21 B10R0.41 C/C=C/CSCC(OC)OC 62a_100102629194_100000751394 [0,0,0,0,0,0|1,0,2]=3 22 B10R0.41 C=CC(CC)OCCCCC 34a_100000766422_100000718602 [0,0,0,0,0,0|3,0,1]=4 23 B10R0.41 C=CC(CC)OCCCCC 7a_100000766422_100000210326 [0,0,0,0,0,0|3,0,1]=4 24 B10R0.41 C=CC(CCCCCC)OC 34a_200011215977_200000210301 [0,0,0,0,0,0|1,0,1]=2 25 B10R0.41 C=CC(CCCCCC)OC 7a_200011215977_200000210301 [0,0,0,0,0,0|1,0,1]=2 26 B10R0.41 C=CC(CCCCCC)O[13CH3] 34a_200011215977_200025704644 [0,0,0,0,0,0|1,0,1]=2 27 B10R0.41 C=CC(CCCCCC)O[13CH3] 7a_200011215977_200025704644 [0,0,0,0,0,0|1,0,1]=2 28 B10R0.41 C=CCCNCC(OC)OC 2230a_100015191253_100000751394 [0,0,0,0,0,0|1,0,2]=3 29 B10R0.41 C=CCCNCC(OC)OC 270004a_100015191253_100000752162 [0,0,0,0,0,0|1,0,2]=3 30 B10R0.41 C=CCCOCC(CC)OC 34a_100011934954_100000754431 [0,0,0,0,0,0|2,0,2]=4 31 B10R0.41 C=CCCOCC(CC)OC 7a_100011934954_100000754431 [0,0,0,0,0,0|2,0,2]=4 32 B10R0.41 C=CCCOCC(OC)OC 34a_100011205117_100000211822 [0,0,0,0,0,0|1,0,2]=3 33 B10R0.41 C=CCCOCC(OC)OC 34a_100011216393_100000754431 [0,0,0,0,0,0|1,0,2]=3 34 B10R0.41 C=CCCSCC(OC)OC 62a_100000751394_100000754431 [0,0,0,0,0,0|1,0,2]=3 35 B10R0.41 C=CCCSCC(OC)OC 62a_100000754431_100000751394 [0,0,0,0,0,0|1,0,2]=3 36 B10R0.41 C=CCNCCC(OC)OC 2230a_100020586998_100009813347 [0,0,0,0,0,0|1,0,2]=3 37 B10R0.41 C=CCOCCC(OC)OC 34a_200000210373_100000139399 [0,0,0,0,0,0|1,0,2]=3 38 B10R0.41 C=CCSCCC(OC)OC 62a_100000139399_100000210623 [0,0,0,0,0,0|1,0,2]=3 39 B10R0.41 C=CCSCCC(OC)OC 62a_100000210623_100000139399 [0,0,0,0,0,0|1,0,2]=3 40 B10R0.41 CC#CCNCC(OC)OC 2230a_100000685387_100000751394 [0,0,0,0,0,0|1,0,2]=3 41 B10R0.41 CC#CCNCC(OC)OC 34a_100000685387_100000211822 [0,0,0,0,0,0|1,0,2]=3 42 B10R0.41 CC#CCOCC(CC)OC 34a_100011934954_100000748600 [0,0,0,0,0,0|2,0,2]=4 43 B10R0.41 CC#CCOCC(CC)OC 7a_100011934954_100000748600 [0,0,0,0,0,0|2,0,2]=4 44 B10R0.41 CC#CCOCC(OC)OC 34a_100000761923_100000211822 [0,0,0,0,0,0|1,0,2]=3 45 B10R0.41 CC#CCOCC(OC)OC 34a_100011216393_100000748600 [0,0,0,0,0,0|1,0,2]=3 46 B10R0.41 CC#CCSCC(OC)OC 62a_100000748600_100000751394 [0,0,0,0,0,0|1,0,2]=3 47 B10R0.41 CC#CCSCC(OC)OC 62a_100000751394_100000748600 [0,0,0,0,0,0|1,0,2]=3 48 B10R0.41 CC=CCOCC(CC)OC 34a_100011934954_100000070051 [0,0,0,0,0,0|2,0,2]=4 49 B10R0.41 CC=CCOCC(CC)OC 7a_100011934954_100000070051 [0,0,0,0,0,0|2,0,2]=4 50 B10R0.41 CC=CCOCC(OC)OC 34a_100011216393_100000070051 [0,0,0,0,0,0|1,0,2]=3 51 B10R0.41 CC=CCSCC(OC)OC 62a_100000070051_100000751394 [0,0,0,0,0,0|1,0,2]=3 52 B10R0.41 CC=CCSCC(OC)OC 62a_100000751394_100000070051 [0,0,0,0,0,0|1,0,2]=3 53 B10R0.41 CCC(CC)CNCCCF 2230a_100015189416_100011215472 [0,0,0,0,0,0|4,0,0]=4 54 B10R0.41 CCC(CC)CNCCCF 2230a_100102946423_100011934791 [0,0,0,0,0,0|4,0,0]=4 55 B10R0.41 CCC(CC)CNCCCF 269862a_100015189416_100000211137 [0,0,0,0,0,0|4,0,0]=4 56 B10R0.41 CCC(CC)CNCCCF 270004a_100015189416_100000211137 [0,0,0,0,0,0|4,0,0]=4 57 B10R0.41 CCC(CC)CNCCCF 34a_100015189416_100011215472 [0,0,0,0,0,0|4,0,0]=4 58 B10R0.41 CCC(CC)CNCCCO 2230a_100102946423_100000230001 [0,0,0,0,0,0|4,0,0]=4 59 B10R0.41 CCC(CC)CNCCCO 269862a_100000182051_100000211137 [0,0,0,0,0,0|4,0,0]=4 60 B10R0.41 CCC(CC)CNCCCO 270004a_100000182051_100000211137 [0,0,0,0,0,0|4,0,0]=4 61 B10R0.41 CCC(CC)CNCCOC 2230a_100000209980_100011215472 [0,0,0,0,0,0|4,0,0]=4 62 B10R0.41 CCC(CC)CNCCOC 2230a_100102946423_100011201679 [0,0,0,0,0,0|4,0,0]=4 63 B10R0.41 CCC(CC)CNCCOC 269862a_100000209980_100000211137 [0,0,0,0,0,0|4,0,0]=4 64 B10R0.41 CCC(CC)CNCCOC 270004a_100000209980_100000211137 [0,0,0,0,0,0|4,0,0]=4 65 B10R0.41 CCC(CC)CNCCSC 2230a_100020590264_100011215472 [0,0,0,0,0,0|4,0,0]=4 66 B10R0.41 CCC(CC)CNCCSC 2230a_100102946423_100000751147 [0,0,0,0,0,0|4,0,0]=4 67 B10R0.41 CCC(CC)CNCCSC 269862a_100020590264_100000211137 [0,0,0,0,0,0|4,0,0]=4 68 B10R0.41 CCC(CC)CNCCSC 270004a_100020590264_100000211137 [0,0,0,0,0,0|4,0,0]=4 69 B10R0.41 CCC(CC)COCCCBr 34a_100011217188_100011215472 [0,0,0,0,0,0|4,0,0]=4 70 B10R0.41 CCC(CC)COCCCCl 34a_100000230001_100011215472 [0,0,0,0,0,0|4,0,0]=4 71 B10R0.41 CCC(CC)COCCCF 34a_100000759539_100011215472 [0,0,0,0,0,0|4,0,0]=4 72 B10R0.41 CCC(CC)COCCCF 7a_100000703878_100011934791 [0,0,0,0,0,0|4,0,0]=4 73 B10R0.41 CCC(CC)COCCCN 34a_100000182051_100011215472 [0,0,0,0,0,0|4,0,0]=4 74 B10R0.41 CCC(CC)COCCCO 7a_100000703878_100011215043 [0,0,0,0,0,0|4,0,0]=4 75 B10R0.41 CCC(CC)COCCOC 34a_100000210237_100011215472 [0,0,0,0,0,0|4,0,0]=4 76 B10R0.41 CCC(CC)COCCOC 7a_100000703878_100000233755 [0,0,0,0,0,0|4,0,0]=4 77 B10R0.41 CCC(CC)COCCSC 34a_100000230434_100011215472 [0,0,0,0,0,0|4,0,0]=4 78 B10R0.41 CCC(CC)COCCSC 7a_100000230434_100011215472 [0,0,0,0,0,0|4,0,0]=4 79 B10R0.41 CCC(CC)COCCSC 7a_100000703878_100000212216 [0,0,0,0,0,0|4,0,0]=4 80 B10R0.41 CCC(CC)CSCCCF 62a_100011215472_100011934791 [0,0,0,0,0,0|4,0,0]=4 81 B10R0.41 CCC(CC)CSCCCF 62a_100011934791_100011215472 [0,0,0,0,0,0|4,0,0]=4 82 B10R0.41 CCC(CC)CSCCCO 62a_100011215043_100011215472 [0,0,0,0,0,0|4,0,0]=4 83 B10R0.41 CCC(CC)CSCCCO 62a_100011215472_100011215043 [0,0,0,0,0,0|4,0,0]=4 84 B10R0.41 CCC(CC)CSCCOC 62a_100000233755_100011215472 [0,0,0,0,0,0|4,0,0]=4 85 B10R0.41 CCC(CC)CSCCOC 62a_100011215472_100000233755 [0,0,0,0,0,0|4,0,0]=4 86 B10R0.41 CCC(CC)CSCCSC 62a_100000212216_100011215472 [0,0,0,0,0,0|4,0,0]=4 87 B10R0.41 CCC(CC)CSCCSC 62a_100011215472_100000751147 [0,0,0,0,0,0|4,0,0]=4 88 B10R0.41 CCC(CC)NCCCCF 2230a_100000199018_100000729493 [0,0,0,0,0,0|4,0,0]=4 89 B10R0.41 CCC(CC)NCCCCO 2230a_100000199018_100000210776 [0,0,0,0,0,0|4,0,0]=4 90 B10R0.41 CCC(CC)NCCCCO 270004a_100000750430_100000210860 [0,0,0,0,0,0|4,0,0]=4 91 B10R0.41 CCC(CC)NCCCOC 2230a_100000199018_100000740836 [0,0,0,0,0,0|4,0,0]=4 92 B10R0.41 CCC(CC)NCCCOC 270004a_100150723488_100000210860 [0,0,0,0,0,0|4,0,0]=4 93 B10R0.41 CCC(CC)NCCCSC 270004a_100000749238_100000210860 [0,0,0,0,0,0|4,0,0]=4 94 B10R0.41 CCC(CC)OCCCCCl 7a_100000210776_100000210505 [0,0,0,0,0,0|4,0,0]=4 95 B10R0.41 CCC(CC)OCCCCF 7a_100000688536_100000729493 [0,0,0,0,0,0|4,0,0]=4 96 B10R0.41 CCC(CC)OCCCCF 7a_100011995726_100000210505 [0,0,0,0,0,0|4,0,0]=4 97 B10R0.41 CCC(CC)OCCCCO 7a_100000688536_100000210776 [0,0,0,0,0,0|4,0,0]=4 98 B10R0.41 CCC(CC)OCCCOC 7a_100000688536_100000740836 [0,0,0,0,0,0|4,0,0]=4 99 B10R0.41 CCC(CC)OCCCSC 7a_100000690336_100000210505 [0,0,0,0,0,0|4,0,0]=4 100 B10R0.41 CCC(CC)SCCCCF 62a_100000210505_100000729493 [0,0,0,0,0,0|4,0,0]=4 101 B10R0.41 CCC(CC)SCCCCF 62a_100000729493_100000210505 [0,0,0,0,0,0|4,0,0]=4 102 B10R0.41 CCC(CC)SCCCCO 62a_100000210505_100000210776 [0,0,0,0,0,0|4,0,0]=4 103 B10R0.41 CCC(CC)SCCCCO 62a_100000210776_100000210505 [0,0,0,0,0,0|4,0,0]=4 104 B10R0.41 CCC(CC)SCCCOC 62a_100000210505_100000709357 [0,0,0,0,0,0|4,0,0]=4 105 B10R0.41 CCC(CC)SCCCOC 62a_100000709357_100000210505 [0,0,0,0,0,0|4,0,0]=4 106 B10R0.41 CCC(COCCC#N)OC 7a_100011934954_100000184422 [0,0,0,0,0,0|3,0,1]=4 107 B10R0.41 CCC(COCCCF)OC 34a_100011934954_100011934791 [0,0,0,0,0,0|3,0,0]=3 108 B10R0.41 CCC(COCCCF)OC 7a_100011934954_100011934791 [0,0,0,0,0,0|3,0,0]=3 109 B10R0.41 CCC(COCCCO)OC 34a_100011934954_100000230001 [0,0,0,0,0,0|3,0,0]=3 110 B10R0.41 CCC(COCCCO)OC 7a_100011934954_100011215043 [0,0,0,0,0,0|3,0,0]=3 111 B10R0.41 CCC(COCCOC)OC 34a_100011934954_100011201679 [0,0,0,0,0,0|3,0,0]=3 112 B10R0.41 CCC(COCCOC)OC 7a_100011934954_100000233755 [0,0,0,0,0,0|3,0,0]=3 113 B10R0.41 CCC(COCCSC)OC 34a_100011934954_100000212216 [0,0,0,0,0,0|3,0,0]=3 114 B10R0.41 CCC(COCCSC)OC 7a_100011934954_100000212216 [0,0,0,0,0,0|3,0,0]=3 115 B10R0.41 CCCCCCC(CC)NC 270004a_106832991635_100011219640 [0,0,0,0,0,0|2,0,0]=2 116 B10R0.41 CCCCCCC(CC)OC 34a_100011215785_200000210301 [0,0,0,0,0,0|1,0,0]=1 117 B10R0.41 CCCCCCC(CC)OC 7a_100011215785_200000210301 [0,0,0,0,0,0|1,0,0]=1 118 B10R0.41 CCCCCCC(CC)O[13CH3] 34a_100011215785_200025704644 [0,0,0,0,0,0|1,0,0]=1 119 B10R0.41 CCCCCCC(CC)O[13CH3] 7a_100011215785_200025704644 [0,0,0,0,0,0|1,0,0]=1 120 B10R0.41 CCCCCCN(CC)CC 2230a_100000724800_100000210314 [0,0,0,0,0,0|3,0,0]=3 121 B10R0.41 CCCCCCN(CC)CC 269956a_100000042499_100000210757 [0,0,0,0,0,0|3,0,0]=3 122 B10R0.41 CCCCCCN(CC)CC 269982a_100000724800_100000210757 [0,0,0,0,0,0|3,0,0]=3 123 B10R0.41 CCCCCNC(CC)CC 2230a_100000199018_100000210326 [0,0,0,0,0,0|3,0,0]=3 124 B10R0.41 CCCCCNC(CC)CC 270004a_100000209983_100000210860 [0,0,0,0,0,0|3,0,0]=3 125 B10R0.41 CCCCCN[C@@H](CC)CO 2230a_100000709445_100000210326 [0,0,0,0,0,0|4,0,0]=4 126 B10R0.41 CCCCCOC(CC)CC 7a_100000210253_100000210505 [0,0,0,0,0,0|3,0,0]=3 127 B10R0.41 CCCCCOC(CC)CC 7a_100000688536_100000210326 [0,0,0,0,0,0|3,0,0]=3 128 B10R0.41 CCCCCSC(CC)CC 62a_100000210326_100000210505 [0,0,0,0,0,0|3,0,0]=3 129 B10R0.41 CCCCCSC(CC)CC 62a_100000210505_100000210326 [0,0,0,0,0,0|3,0,0]=3 130 B10R0.41 CCCCNCC(CC)CC 2230a_100000102301_100011215472 [0,0,0,0,0,0|3,0,0]=3 131 B10R0.41 CCCCNCC(CC)CC 2230a_100102946423_100000210211 [0,0,0,0,0,0|3,0,0]=3 132 B10R0.41 CCCCNCC(CC)CC 269862a_100000102301_100000211137 [0,0,0,0,0,0|3,0,0]=3 133 B10R0.41 CCCCNCC(CC)CC 270004a_100000102301_100000211137 [0,0,0,0,0,0|3,0,0]=3 134 B10R0.41 CCCCNCC(CC)CC 7a_106832991798_100011215472 [0,0,0,0,0,0|3,0,0]=3 135 B10R0.41 CCCCNCC(OC)OC 2230a_100000102301_100000751394 [0,0,0,0,0,0|1,0,0]=1 136 B10R0.41 CCCCNCC(OC)OC 270004a_100000102301_100000752162 [0,0,0,0,0,0|1,0,0]=1 137 B10R0.41 CCCCNCC(OC)OC 7a_106832991798_100000751394 [0,0,0,0,0,0|1,0,0]=1 138 B10R0.41 CCCCOCC(CC)CC 34a_100000210227_100011215472 [0,0,0,0,0,0|3,0,0]=3 139 B10R0.41 CCCCOCC(CC)CC 7a_100000210227_100011215472 [0,0,0,0,0,0|3,0,0]=3 140 B10R0.41 CCCCOCC(CC)CC 7a_100000703878_100000210211 [0,0,0,0,0,0|3,0,0]=3 141 B10R0.41 CCCCOCC(CC)OC 34a_100011934954_100000210210 [0,0,0,0,0,0|2,0,0]=2 142 B10R0.41 CCCCOCC(CC)OC 7a_100011934954_100000210211 [0,0,0,0,0,0|2,0,0]=2 143 B10R0.41 CCCCOCC(OC)OC 34a_100000210227_100000211822 [0,0,0,0,0,0|1,0,0]=1 144 B10R0.41 CCCCOCC(OC)OC 34a_100011216393_100000210210 [0,0,0,0,0,0|1,0,0]=1 145 B10R0.41 CCCCOCC(OC)OC 7a_100000210227_100000751394 [0,0,0,0,0,0|1,0,0]=1 146 B10R0.41 CCCCOCN(CC)CC 2230a_100000724800_100011995733 [0,0,0,0,0,0|4,0,0]=4 147 B10R0.41 CCCCOCN(CC)CC 269956a_100000042499_100011995733 [0,0,0,0,0,0|4,0,0]=4 148 B10R0.41 CCCCOCN(CC)CC 269982a_100000724800_100011995733 [0,0,0,0,0,0|4,0,0]=4 149 B10R0.41 CCCCOCN(CC)CC 7a_200015374951_100000210211 [0,0,0,0,0,0|4,0,0]=4 150 B10R0.41 CCCCSCC(CC)CC 62a_100000210211_100011215472 [0,0,0,0,0,0|3,0,0]=3 151 B10R0.41 CCCCSCC(CC)CC 62a_100011215472_100000210210 [0,0,0,0,0,0|3,0,0]=3 152 B10R0.41 CCCCSCC(OC)OC 62a_100000210211_100000751394 [0,0,0,0,0,0|1,0,0]=1 153 B10R0.41 CCCCSCC(OC)OC 62a_100000751394_100000210210 [0,0,0,0,0,0|1,0,0]=1 154 B10R0.41 CCCNCCN(CC)CC 2230a_100015382049_100000210303 [0,0,0,0,0,0|4,0,0]=4 155 B10R0.41 CCCNN=CC(OC)OC 4a_100000740057_100000752162 [0,0,0,0,0,0|2,0,1]=3 156 B10R0.41 CCCOCCC(OC)OC 34a_100000210258_100000139399 [0,0,0,0,0,0|1,0,0]=1 157 B10R0.41 CCCOCCN(CC)CC 2230a_100000724800_100011215938 [0,0,0,0,0,0|4,0,0]=4 158 B10R0.41 CCCOCCN(CC)CC 269956a_100000042499_100011215938 [0,0,0,0,0,0|4,0,0]=4 159 B10R0.41 CCCOCCN(CC)CC 269982a_100000724800_100011215938 [0,0,0,0,0,0|4,0,0]=4 160 B10R0.41 CCCOCCN(CC)CC 7a_100016990331_100000210303 [0,0,0,0,0,0|4,0,0]=4 161 B10R0.41 CCCSCCC(OC)OC 62a_100000139399_100000210303 [0,0,0,0,0,0|1,0,0]=1 162 B10R0.41 CCCSCCC(OC)OC 62a_100000210303_100000139399 [0,0,0,0,0,0|1,0,0]=1 163 B10R0.41 CCCSCCN(CC)CC 62a_100000210303_100000700428 [0,0,0,0,0,0|4,0,0]=4 164 B10R0.41 CCN(CC)CCCCCF 2230a_100000724800_100000729378 [0,0,0,0,0,0|4,0,0]=4 165 B10R0.41 CCN(CC)CCCCCF 269956a_100000042499_100000729378 [0,0,0,0,0,0|4,0,0]=4 166 B10R0.41 CCN(CC)CCCCCF 269982a_100000724800_100000729378 [0,0,0,0,0,0|4,0,0]=4 167 B10R0.41 CCN(CC)CCCCCO 2230a_100000724800_100000746330 [0,0,0,0,0,0|4,0,0]=4 168 B10R0.41 CCN(CC)CCCCCO 269956a_100000042499_100000746330 [0,0,0,0,0,0|4,0,0]=4 169 B10R0.41 CCN(CC)CCCCCO 269982a_100000724800_100000746330 [0,0,0,0,0,0|4,0,0]=4 170 B10R0.41 CCN(CC)CCCCNC 2230a_100000743895_200000210301 [0,0,0,0,0,0|4,0,0]=4 171 B10R0.41 CCN(CC)CCCCN[13CH3] 2230a_100000743895_200025704644 [0,0,0,0,0,0|4,0,0]=4 172 B10R0.41 CCN(CC)CCCCOC 2230a_100000724800_100000730899 [0,0,0,0,0,0|4,0,0]=4 173 B10R0.41 CCN(CC)CCCCOC 269956a_100000042499_100000730899 [0,0,0,0,0,0|4,0,0]=4 174 B10R0.41 CCN(CC)CCCCOC 269982a_100000724800_100000730899 [0,0,0,0,0,0|4,0,0]=4 175 B10R0.41 CCN(CC)CCCCOC 7a_100011305530_200000210301 [0,0,0,0,0,0|4,0,0]=4 176 B10R0.41 CCN(CC)CCCCO[13CH3] 7a_100011305530_200025704644 [0,0,0,0,0,0|4,0,0]=4 177 B10R0.41 CCNCCCC(OC)OC 2230a_100015525214_100000069011 [0,0,0,0,0,0|1,0,0]=1 178 B10R0.41 CCNCCCN(CC)CC 2230a_100015525214_100000709985 [0,0,0,0,0,0|4,0,0]=4 179 B10R0.41 CCOCCCC(OC)OC 34a_100121572206_100000069011 [0,0,0,0,0,0|1,0,0]=1 180 B10R0.41 CCOCCCN(CC)CC 2230a_100000724800_100012232248 [0,0,0,0,0,0|4,0,0]=4 181 B10R0.41 CCOCCCN(CC)CC 269956a_100000042499_100012232248 [0,0,0,0,0,0|4,0,0]=4 182 B10R0.41 CCOCCCN(CC)CC 269982a_100000724800_100012232248 [0,0,0,0,0,0|4,0,0]=4 183 B10R0.41 CCOCCCN(CC)CC 7a_100000212844_100000210202 [0,0,0,0,0,0|4,0,0]=4 184 B10R0.41 CCOCCNC(CC)CC 2230a_100000199018_100011215890 [0,0,0,0,0,0|4,0,0]=4 185 B10R0.41 CCOCCNC(CC)CC 270004a_102516460346_100000210860 [0,0,0,0,0,0|4,0,0]=4 186 B10R0.41 CCOCCOC(CC)CC 7a_100000210136_100000210505 [0,0,0,0,0,0|4,0,0]=4 187 B10R0.41 CCOCCOC(CC)CC 7a_100000688536_100011215890 [0,0,0,0,0,0|4,0,0]=4 188 B10R0.41 CCOCCSC(CC)CC 62a_100000210147_100000210505 [0,0,0,0,0,0|4,0,0]=4 189 B10R0.41 CCOCCSC(CC)CC 62a_100000210505_100011215890 [0,0,0,0,0,0|4,0,0]=4 190 B10R0.41 CCOCSCC(CC)CC 62a_100000739092_100011215472 [0,0,0,0,0,0|4,0,0]=4 191 B10R0.41 CCOCSCC(CC)CC 62a_100011215472_100000739092 [0,0,0,0,0,0|4,0,0]=4 192 B10R0.41 CCOCSCC(OC)OC 62a_100000739092_100000751394 [0,0,0,0,0,0|2,0,0]=2 193 B10R0.41 CCOCSCC(OC)OC 62a_100000751394_100000739092 [0,0,0,0,0,0|2,0,0]=2 194 B10R0.41 CCSCCCC(OC)OC 62a_100000069011_100000210202 [0,0,0,0,0,0|1,0,0]=1 195 B10R0.41 CCSCCCC(OC)OC 62a_100000210202_100000069011 [0,0,0,0,0,0|1,0,0]=1 196 B10R0.41 CCSCCCN(CC)CC 62a_100000210202_100000709985 [0,0,0,0,0,0|4,0,0]=4 197 B10R0.41 CCSCCNC(CC)CC 2230a_100000199018_100000757381 [0,0,0,0,0,0|4,0,0]=4 198 B10R0.41 CCSCCNC(CC)CC 270004a_100000106463_100000210860 [0,0,0,0,0,0|4,0,0]=4 199 B10R0.41 CCSCCOC(CC)CC 7a_100000212035_100000210505 [0,0,0,0,0,0|4,0,0]=4 200 B10R0.41 CCSCCOC(CC)CC 7a_100000688536_100000757381 [0,0,0,0,0,0|4,0,0]=4 201 B10R0.41 CCSCCSC(CC)CC 62a_100000210505_100000757381 [0,0,0,0,0,0|4,0,0]=4 202 B10R0.41 CCSCCSC(CC)CC 62a_100000757381_100000210505 [0,0,0,0,0,0|4,0,0]=4 203 B10R0.41 COC(C=NNCCO)OC 4a_100000210001_100000752162 [0,0,0,0,0,0|3,0,1]=4 204 B10R0.41 COC(CCCSCF)OC 62a_100000069011_100015361967 [0,0,0,0,0,0|2,0,0]=2 205 B10R0.41 COC(CCCSCF)OC 62a_100015361967_100000069011 [0,0,0,0,0,0|2,0,0]=2 206 B10R0.41 COC(CCNCCF)OC 34a_100000724931_100000139399 [0,0,0,0,0,0|2,0,0]=2 207 B10R0.41 COC(CCNCCO)OC 2230a_100016997473_100009813347 [0,0,0,0,0,0|2,0,0]=2 208 B10R0.41 COC(CCNCCO)OC 34a_100016990907_100000139399 [0,0,0,0,0,0|2,0,0]=2 209 B10R0.41 COC(CCOCCBr)OC 34a_100000211926_100000139399 [0,0,0,0,0,0|2,0,0]=2 210 B10R0.41 COC(CCOCCN)OC 34a_100000210304_100000139399 [0,0,0,0,0,0|2,0,0]=2 211 B10R0.41 COC(CCSCC#N)OC 62a_100000139399_100011215382 [0,0,0,0,0,0|2,0,1]=3 212 B10R0.41 COC(CCSCC#N)OC 62a_100011215382_100000139399 [0,0,0,0,0,0|2,0,1]=3 213 B10R0.41 COC(CCSCC=O)OC 62a_100000139399_200015260668 [0,0,0,0,0,0|2,0,1]=3 214 B10R0.41 COC(CCSCC=O)OC 62a_200015260668_100000139399 [0,0,0,0,0,0|2,0,1]=3 215 B10R0.41 COC(CCSCCF)OC 62a_100000139399_100011217306 [0,0,0,0,0,0|2,0,0]=2 216 B10R0.41 COC(CCSCCF)OC 62a_100011217306_100000139399 [0,0,0,0,0,0|2,0,0]=2 217 B10R0.41 COC(CCSCCO)OC 62a_100000139399_100000211926 [0,0,0,0,0,0|2,0,0]=2 218 B10R0.41 COC(CCSCCO)OC 62a_100000211926_100000139399 [0,0,0,0,0,0|2,0,0]=2 219 B10R0.41 COC(CCSCSC)OC 62a_100000139399_100011218213 [0,0,0,0,0,0|2,0,0]=2 220 B10R0.41 COC(CCSCSC)OC 62a_100011218213_100000139399 [0,0,0,0,0,0|2,0,0]=2 221 B10R0.41 COC(CNCCC#N)OC 270004a_100000720768_100000752162 [0,0,0,0,0,0|2,0,1]=3 222 B10R0.41 COC(CNCCCF)OC 2230a_100015189416_100000751394 [0,0,0,0,0,0|2,0,0]=2 223 B10R0.41 COC(CNCCCF)OC 270004a_100015189416_100000752162 [0,0,0,0,0,0|2,0,0]=2 224 B10R0.41 COC(CNCCCF)OC 34a_100015189416_100000211822 [0,0,0,0,0,0|2,0,0]=2 225 B10R0.41 COC(CNCCCO)OC 270004a_100000182051_100000752162 [0,0,0,0,0,0|2,0,0]=2 226 B10R0.41 COC(CNCCSC)OC 2230a_100020590264_100000751394 [0,0,0,0,0,0|2,0,0]=2 227 B10R0.41 COC(CNCCSC)OC 270004a_100020590264_100000752162 [0,0,0,0,0,0|2,0,0]=2 228 B10R0.41 COC(COCCCBr)OC 34a_100011217188_100000211822 [0,0,0,0,0,0|2,0,0]=2 229 B10R0.41 COC(COCCCCl)OC 34a_100000230001_100000211822 [0,0,0,0,0,0|2,0,0]=2 230 B10R0.41 COC(COCCCF)OC 34a_100000759539_100000211822 [0,0,0,0,0,0|2,0,0]=2 231 B10R0.41 COC(COCCCF)OC 34a_100011216393_100011934791 [0,0,0,0,0,0|2,0,0]=2 232 B10R0.41 COC(COCCCN)OC 34a_100000182051_100000211822 [0,0,0,0,0,0|2,0,0]=2 233 B10R0.41 COC(COCCCO)OC 34a_100011216393_100000230001 [0,0,0,0,0,0|2,0,0]=2 234 B10R0.41 COC(COCCON)OC 34a_100000700252_100000211822 [0,0,0,0,0,0|3,0,0]=3 235 B10R0.41 COC(COCCSC)OC 34a_100000230434_100000211822 [0,0,0,0,0,0|2,0,0]=2 236 B10R0.41 COC(COCCSC)OC 34a_100011216393_100000212216 [0,0,0,0,0,0|2,0,0]=2 237 B10R0.41 COC(COCCSC)OC 7a_100000230434_100000751394 [0,0,0,0,0,0|2,0,0]=2 238 B10R0.41 COC(CSCCC#N)OC 62a_100000751394_100011215226 [0,0,0,0,0,0|2,0,1]=3 239 B10R0.41 COC(CSCCC#N)OC 62a_100011215226_100000751394 [0,0,0,0,0,0|2,0,1]=3 240 B10R0.41 COC(CSCCCF)OC 62a_100000751394_100011934791 [0,0,0,0,0,0|2,0,0]=2 241 B10R0.41 COC(CSCCCF)OC 62a_100011934791_100000751394 [0,0,0,0,0,0|2,0,0]=2 242 B10R0.41 COC(CSCCCO)OC 62a_100000751394_100011215043 [0,0,0,0,0,0|2,0,0]=2 243 B10R0.41 COC(CSCCCO)OC 62a_100011215043_100000751394 [0,0,0,0,0,0|2,0,0]=2 244 B10R0.41 COC(CSCCSC)OC 62a_100000212216_100000751394 [0,0,0,0,0,0|2,0,0]=2 245 B10R0.41 COC(CSCCSC)OC 62a_100000751394_100000751147 [0,0,0,0,0,0|2,0,0]=2 246 B10R0.41 COC(CSCSC#N)OC 62a_100000211825_100000751394 [0,0,0,0,0,0|3,0,1]=4 247 B10R0.41 COC(CSCSC#N)OC 62a_100000751394_100000211825 [0,0,0,0,0,0|3,0,1]=4 248 B10R0.41 COCCNCC(OC)OC 2230a_100000209980_100000751394 [0,0,0,0,0,0|2,0,0]=2 249 B10R0.41 COCCNCC(OC)OC 270004a_100000209980_100000752162 [0,0,0,0,0,0|2,0,0]=2 250 B10R0.41 COCCOCC(OC)OC 34a_100000210237_100000211822 [0,0,0,0,0,0|2,0,0]=2 251 B10R0.41 COCCOCC(OC)OC 34a_100011216393_100011201679 [0,0,0,0,0,0|2,0,0]=2 252 B10R0.41 COCCSCC(OC)OC 62a_100000233755_100000751394 [0,0,0,0,0,0|2,0,0]=2 253 B10R0.41 COCCSCC(OC)OC 62a_100000751394_100000233755 [0,0,0,0,0,0|2,0,0]=2 254 B10R0.41 COCSCCC(OC)OC 62a_100000139399_100000766300 [0,0,0,0,0,0|2,0,0]=2 255 B10R0.41 COCSCCC(OC)OC 62a_100000766300_100000139399 [0,0,0,0,0,0|2,0,0]=2 256 B9R0.46 C#CC(C)NCCCCC 2230a_100000707721_100000210326 [1,0,0,0,0,0|2,0,1]=4 257 B9R0.46 C#CC(C)NCCCCC 34a_100000707721_100000718602 [1,0,0,0,0,0|2,0,1]=4 258 B9R0.46 C#CC(C)OCCCCC 34a_100000210253_200000035995 [1,0,0,0,0,0|2,0,1]=4 259 B9R0.46 C#CC(C)SCCCCC 62a_200000035995_100000210326 [1,0,0,0,0,0|2,0,1]=4 260 B9R0.46 C#CCCCSC(C)OC 62a_100009879195_100011215417 [1,0,0,0,0,0|1,0,2]=4 261 B9R0.46 C#CCCCSC(C)OC 62a_100011215417_100009879195 [1,0,0,0,0,0|1,0,2]=4 262 B9R0.46 C#CCCNC[C@@H](C)OC 2230a_100020591295_100000688953 [1,0,0,0,0,0|1,0,2]=4 263 B9R0.46 C#CCCOCC(C)OC 34a_100000690652_100000688953 [1,0,0,0,0,0|1,0,2]=4 264 B9R0.46 C#CCOCCC(C)OC 7a_100000764861_100000038162 [1,0,0,0,0,0|1,0,2]=4 265 B9R0.46 C#C[C@@H](C)OCCCCC 34a_100009815206_100000718602 [1,0,0,0,0,0|2,0,1]=4 266 B9R0.46 C#C[C@@H](C)OCCCCC 7a_100009815206_100000210326 [1,0,0,0,0,0|2,0,1]=4 267 B9R0.46 C/C=C/COCC(C)OC 34a_100000690652_100102629194 [1,0,0,0,0,0|1,0,2]=4 268 B9R0.46 C=CC(C)COCCCC 34a_100011215527_100000210210 [1,0,0,0,0,0|2,0,1]=4 269 B9R0.46 C=CC(C)COCCCC 7a_100011215527_100000210211 [1,0,0,0,0,0|2,0,1]=4 270 B9R0.46 C=CC(C)OCCCCC 34a_100000695699_100000718602 [1,0,0,0,0,0|2,0,1]=4 271 B9R0.46 C=CC(C)SCCCCC 62a_100011215867_100000210326 [1,0,0,0,0,0|2,0,1]=4 272 B9R0.46 C=CC(O)CNCCCC 2230a_100000102301_100000730141 [1,0,0,0,0,0|2,0,1]=4 273 B9R0.46 C=CC(O)CNCCCC 7a_106832991798_100000730141 [1,0,0,0,0,0|2,0,1]=4 274 B9R0.46 C=CC(O)COCCCC 34a_100000210227_100000730141 [1,0,0,0,0,0|2,0,1]=4 275 B9R0.46 C=CC(O)COCCCC 7a_100000210227_100000730141 [1,0,0,0,0,0|2,0,1]=4 276 B9R0.46 C=CC(O)CSCCCC 62a_100000210211_100000730141 [1,0,0,0,0,0|2,0,1]=4 277 B9R0.46 C=CC(O)CSCCCC 62a_100000730141_100000210210 [1,0,0,0,0,0|2,0,1]=4 278 B9R0.46 C=CCCCSC(C)OC 62a_100009879195_100000757094 [1,0,0,0,0,0|1,0,2]=4 279 B9R0.46 C=CCCCSC(C)OC 62a_100011713584_100009879195 [1,0,0,0,0,0|1,0,2]=4 280 B9R0.46 C=CCCNC[C@@H](C)OC 2230a_100020591295_100000754431 [1,0,0,0,0,0|1,0,2]=4 281 B9R0.46 C=CCCOCC(C)OC 34a_100000690652_100000754431 [1,0,0,0,0,0|1,0,2]=4 282 B9R0.46 C=CCOCCC(C)OC 7a_100000764861_100015514636 [1,0,0,0,0,0|1,0,2]=4 283 B9R0.46 CC#CCNC[C@@H](C)OC 2230a_100020591295_100000748600 [1,0,0,0,0,0|1,0,2]=4 284 B9R0.46 CC#CCOCC(C)OC 34a_100000690652_100000748600 [1,0,0,0,0,0|1,0,2]=4 285 B9R0.46 CC/C=C\CSC(C)OC 62a_100009879195_100103147603 [1,0,0,0,0,0|1,0,2]=4 286 B9R0.46 CC/C=C\CSC(C)OC 62a_100103147603_100009879195 [1,0,0,0,0,0|1,0,2]=4 287 B9R0.46 CC=CCNC[C@@H](C)OC 2230a_100020591295_100000070051 [1,0,0,0,0,0|1,0,2]=4 288 B9R0.46 CC=CCOCC(C)OC 34a_100000690652_100000070051 [1,0,0,0,0,0|1,0,2]=4 289 B9R0.46 CCC#CCSC(C)OC 62a_100009813939_100009879195 [1,0,0,0,0,0|1,0,2]=4 290 B9R0.46 CCC#CCSC(C)OC 62a_100009879195_100009813939 [1,0,0,0,0,0|1,0,2]=4 291 B9R0.46 CCC(C)CCCOCF 7a_100011216074_100015361967 [1,0,0,0,0,0|3,0,0]=4 292 B9R0.46 CCC(C)CCNCCF 2230a_100020591266_100011217306 [1,0,0,0,0,0|3,0,0]=4 293 B9R0.46 CCC(C)CCNCCO 2230a_100020591266_100000211926 [1,0,0,0,0,0|3,0,0]=4 294 B9R0.46 CCC(C)CCNCOC 2230a_100020591266_100000766300 [1,0,0,0,0,0|3,0,0]=4 295 B9R0.46 CCC(C)CCNCSC 2230a_100020591266_100011218213 [1,0,0,0,0,0|3,0,0]=4 296 B9R0.46 CCC(C)CCOCCF 7a_100011215188_100011217306 [1,0,0,0,0,0|3,0,0]=4 297 B9R0.46 CCC(C)CCOCCO 7a_100011215188_100000211926 [1,0,0,0,0,0|3,0,0]=4 298 B9R0.46 CCC(C)CNCCCF 2230a_100015189416_100000748023 [1,0,0,0,0,0|3,0,0]=4 299 B9R0.46 CCC(C)CNCCCF 2230a_100020588543_100011934791 [1,0,0,0,0,0|3,0,0]=4 300 B9R0.46 CCC(C)CNCCCF 270004a_100015189416_100000243153 [1,0,0,0,0,0|3,0,0]=4 301 B9R0.46 CCC(C)CNCCCF 34a_100015189416_100000748023 [1,0,0,0,0,0|3,0,0]=4 302 B9R0.46 CCC(C)CNCCCO 2230a_100020588543_100000230001 [1,0,0,0,0,0|3,0,0]=4 303 B9R0.46 CCC(C)CNCCCO 270004a_100000182051_100000243153 [1,0,0,0,0,0|3,0,0]=4 304 B9R0.46 CCC(C)CNCCOC 2230a_100000209980_100000748023 [1,0,0,0,0,0|3,0,0]=4 305 B9R0.46 CCC(C)CNCCOC 2230a_100020588543_100011201679 [1,0,0,0,0,0|3,0,0]=4 306 B9R0.46 CCC(C)CNCCOC 270004a_100000209980_100000243153 [1,0,0,0,0,0|3,0,0]=4 307 B9R0.46 CCC(C)CNCCSC 2230a_100020588543_100000751147 [1,0,0,0,0,0|3,0,0]=4 308 B9R0.46 CCC(C)CNCCSC 2230a_100020590264_100000748023 [1,0,0,0,0,0|3,0,0]=4 309 B9R0.46 CCC(C)CNCCSC 270004a_100020590264_100000243153 [1,0,0,0,0,0|3,0,0]=4 310 B9R0.46 CCC(C)COCCCBr 34a_100011217188_100000748023 [1,0,0,0,0,0|3,0,0]=4 311 B9R0.46 CCC(C)COCCCCl 34a_100000230001_100000748023 [1,0,0,0,0,0|3,0,0]=4 312 B9R0.46 CCC(C)COCCCF 34a_100000759539_100000748023 [1,0,0,0,0,0|3,0,0]=4 313 B9R0.46 CCC(C)COCCCN 34a_100000182051_100000748023 [1,0,0,0,0,0|3,0,0]=4 314 B9R0.46 CCC(C)COCCOC 34a_100000210237_100000748023 [1,0,0,0,0,0|3,0,0]=4 315 B9R0.46 CCC(C)COCCSC 34a_100000230434_100000748023 [1,0,0,0,0,0|3,0,0]=4 316 B9R0.46 CCC(C)COCCSC 7a_100000230434_100000748023 [1,0,0,0,0,0|3,0,0]=4 317 B9R0.46 CCC(C)CSCCCF 62a_100000748023_100011934791 [1,0,0,0,0,0|3,0,0]=4 318 B9R0.46 CCC(C)CSCCCF 62a_100011934791_100000748023 [1,0,0,0,0,0|3,0,0]=4 319 B9R0.46 CCC(C)CSCCCO 62a_100000748023_100011215043 [1,0,0,0,0,0|3,0,0]=4 320 B9R0.46 CCC(C)CSCCCO 62a_100011215043_100000748023 [1,0,0,0,0,0|3,0,0]=4 321 B9R0.46 CCC(C)CSCCOC 62a_100000233755_100000748023 [1,0,0,0,0,0|3,0,0]=4 322 B9R0.46 CCC(C)CSCCOC 62a_100000748023_100000233755 [1,0,0,0,0,0|3,0,0]=4 323 B9R0.46 CCC(C)CSCCSC 62a_100000212216_100000748023 [1,0,0,0,0,0|3,0,0]=4 324 B9R0.46 CCC(C)CSCCSC 62a_100000748023_100000751147 [1,0,0,0,0,0|3,0,0]=4 325 B9R0.46 CCC(C)NCCCCF 2230a_100000209981_100000729493 [1,0,0,0,0,0|3,0,0]=4 326 B9R0.46 CCC(C)NCCCCO 2230a_100000209981_100000210776 [1,0,0,0,0,0|3,0,0]=4 327 B9R0.46 CCC(C)NCCCCO 2230a_100000750430_100000758301 [1,0,0,0,0,0|3,0,0]=4 328 B9R0.46 CCC(C)NCCCCO 34a_100000750430_100011215416 [1,0,0,0,0,0|3,0,0]=4 329 B9R0.46 CCC(C)NCCCOC 2230a_100000209981_100000740836 [1,0,0,0,0,0|3,0,0]=4 330 B9R0.46 CCC(C)NCCCOC 34a_100150723488_100011215416 [1,0,0,0,0,0|3,0,0]=4 331 B9R0.46 CCC(C)NCCCSC 2230a_100000749238_100000758301 [1,0,0,0,0,0|3,0,0]=4 332 B9R0.46 CCC(C)OCCCCBr 34a_100011216708_100011215416 [1,0,0,0,0,0|3,0,0]=4 333 B9R0.46 CCC(C)OCCCCCl 34a_100000210776_100011215416 [1,0,0,0,0,0|3,0,0]=4 334 B9R0.46 CCC(C)OCCCCCl 7a_100000210776_100000758301 [1,0,0,0,0,0|3,0,0]=4 335 B9R0.46 CCC(C)OCCCCF 34a_100011995726_100011215416 [1,0,0,0,0,0|3,0,0]=4 336 B9R0.46 CCC(C)OCCCCF 7a_100000210228_100000729493 [1,0,0,0,0,0|3,0,0]=4 337 B9R0.46 CCC(C)OCCCCF 7a_100011995726_100000758301 [1,0,0,0,0,0|3,0,0]=4 338 B9R0.46 CCC(C)OCCCCI 34a_200012148704_100011215416 [1,0,0,0,0,0|3,0,0]=4 339 B9R0.46 CCC(C)OCCCCN 34a_100000750430_100011215416 [1,0,0,0,0,0|3,0,0]=4 340 B9R0.46 CCC(C)OCCCCO 7a_100000210228_100000210776 [1,0,0,0,0,0|3,0,0]=4 341 B9R0.46 CCC(C)OCCCNC 34a_100000213112_100011215416 [1,0,0,0,0,0|3,0,0]=4 342 B9R0.46 CCC(C)OCCCOC 34a_100000740835_100011215416 [1,0,0,0,0,0|3,0,0]=4 343 B9R0.46 CCC(C)OCCCOC 7a_100000210228_100000740836 [1,0,0,0,0,0|3,0,0]=4 344 B9R0.46 CCC(C)OCCCSC 34a_100000690336_100011215416 [1,0,0,0,0,0|3,0,0]=4 345 B9R0.46 CCC(C)OCCCSC 7a_100000690336_100000758301 [1,0,0,0,0,0|3,0,0]=4 346 B9R0.46 CCC(C)SCCCCF 62a_100000729493_100000758301 [1,0,0,0,0,0|3,0,0]=4 347 B9R0.46 CCC(C)SCCCCF 62a_100000758301_100000729493 [1,0,0,0,0,0|3,0,0]=4 348 B9R0.46 CCC(C)SCCCCO 62a_100000210776_100000758301 [1,0,0,0,0,0|3,0,0]=4 349 B9R0.46 CCC(C)SCCCCO 62a_100000758301_100000210776 [1,0,0,0,0,0|3,0,0]=4 350 B9R0.46 CCC(C)SCCCOC 62a_100000709357_100000758301 [1,0,0,0,0,0|3,0,0]=4 351 B9R0.46 CCC(C)SCCCOC 62a_100000758301_100000709357 [1,0,0,0,0,0|3,0,0]=4 352 B9R0.46 CCC(O)CNCCCF 2230a_100011218483_100011934791 [1,0,0,0,0,0|3,0,0]=4 353 B9R0.46 CCC(O)CNCCCF 2230a_100015189416_100011218378 [1,0,0,0,0,0|3,0,0]=4 354 B9R0.46 CCC(O)CNCCCF 34a_100015189416_100011218378 [1,0,0,0,0,0|3,0,0]=4 355 B9R0.46 CCC(O)CNCCCO 2230a_100011218483_100000230001 [1,0,0,0,0,0|3,0,0]=4 356 B9R0.46 CCC(O)CNCCOC 2230a_100000209980_100011218378 [1,0,0,0,0,0|3,0,0]=4 357 B9R0.46 CCC(O)CNCCOC 2230a_100011218483_100011201679 [1,0,0,0,0,0|3,0,0]=4 358 B9R0.46 CCC(O)CNCCSC 2230a_100011218483_100000751147 [1,0,0,0,0,0|3,0,0]=4 359 B9R0.46 CCC(O)CNCCSC 2230a_100020590264_100011218378 [1,0,0,0,0,0|3,0,0]=4 360 B9R0.46 CCC(O)COCCCBr 34a_100011217188_100011218378 [1,0,0,0,0,0|3,0,0]=4 361 B9R0.46 CCC(O)COCCCCl 34a_100000230001_100011218378 [1,0,0,0,0,0|3,0,0]=4 362 B9R0.46 CCC(O)COCCCF 34a_100000759539_100011218378 [1,0,0,0,0,0|3,0,0]=4 363 B9R0.46 CCC(O)COCCCN 34a_100000182051_100011218378 [1,0,0,0,0,0|3,0,0]=4 364 B9R0.46 CCC(O)COCCOC 34a_100000210237_100011218378 [1,0,0,0,0,0|3,0,0]=4 365 B9R0.46 CCC(O)COCCSC 34a_100000230434_100011218378 [1,0,0,0,0,0|3,0,0]=4 366 B9R0.46 CCC(O)COCCSC 7a_100000230434_100011218378 [1,0,0,0,0,0|3,0,0]=4 367 B9R0.46 CCC(O)CSCCCF 62a_100011218378_100011934791 [1,0,0,0,0,0|3,0,0]=4 368 B9R0.46 CCC(O)CSCCCF 62a_100011934791_100011218378 [1,0,0,0,0,0|3,0,0]=4 369 B9R0.46 CCC(O)CSCCCO 62a_100011215043_100011218378 [1,0,0,0,0,0|3,0,0]=4 370 B9R0.46 CCC(O)CSCCCO 62a_100011218378_100011215043 [1,0,0,0,0,0|3,0,0]=4 371 B9R0.46 CCC(O)CSCCOC 62a_100000233755_100011218378 [1,0,0,0,0,0|3,0,0]=4 372 B9R0.46 CCC(O)CSCCOC 62a_100011218378_100000233755 [1,0,0,0,0,0|3,0,0]=4 373 B9R0.46 CCC(O)CSCCSC 62a_100000212216_100011218378 [1,0,0,0,0,0|3,0,0]=4 374 B9R0.46 CCC(O)CSCCSC 62a_100011218378_100000751147 [1,0,0,0,0,0|3,0,0]=4 375 B9R0.46 CCCCCCC(=O)CC 1458a_100000210414_100000210757 [1,0,0,0,0,0|1,0,2]=4 376 B9R0.46 CCCCCCC(=O)CC 1458a_100102632555_100000210202 [1,0,0,0,0,0|1,0,2]=4 377 B9R0.46 CCCCCCC(=O)NC 11a_106832991635_100102632555 [1,0,0,0,0,0|1,0,2]=4 378 B9R0.46 CCCCCCC(=O)NC 1626a_100102657272_100102632555 [1,0,0,0,0,0|1,0,2]=4 379 B9R0.46 CCCCCCC(=O)NC 240690a_100102657272_100102632555 [1,0,0,0,0,0|1,0,2]=4 380 B9R0.46 CCCCCCC(=O)NC 527a_100102657272_100102632555 [1,0,0,0,0,0|1,0,2]=4 381 B9R0.46 CCCCCCC(C)NC 2230a_100000210919_200000210301 [1,0,0,0,0,0|1,0,0]=2 382 B9R0.46 CCCCCCC(C)NC 2230a_106832991635_100011215978 [1,0,0,0,0,0|1,0,0]=2 383 B9R0.46 CCCCCCC(C)NC 270004a_106832991635_100000210826 [1,0,0,0,0,0|1,0,0]=2 384 B9R0.46 CCCCCCC(C)NC 34a_100000210919_200000210301 [1,0,0,0,0,0|1,0,0]=2 385 B9R0.46 CCCCCCC(C)NC 34a_100102657272_100011215978 [1,0,0,0,0,0|1,0,0]=2 386 B9R0.46 CCCCCCC(C)NC 7a_106832991635_100011215978 [1,0,0,0,0,0|1,0,0]=2 387 B9R0.46 CCCCCCC(C)N[13CH3] 2230a_100000210919_200025704644 [1,0,0,0,0,0|1,0,0]=2 388 B9R0.46 CCCCCCC(C)N[13CH3] 34a_100000210919_200025704644 [1,0,0,0,0,0|1,0,0]=2 389 B9R0.46 CCCCCCC(C)OC 34a_100000210265_200000210301 [1,0,0,0,0,0|0,0,0]=1 390 B9R0.46 CCCCCCC(C)OC 34a_100138415774_100011215978 [1,0,0,0,0,0|0,0,0]=1 391 B9R0.46 CCCCCCC(C)OC 7a_100000210265_200000210301 [1,0,0,0,0,0|0,0,0]=1 392 B9R0.46 CCCCCCC(C)O[13CH3] 34a_100000210265_200025704644 [1,0,0,0,0,0|0,0,0]=1 393 B9R0.46 CCCCCCC(C)O[13CH3] 7a_100000210265_200025704644 [1,0,0,0,0,0|0,0,0]=1 394 B9R0.46 CCCCCCC(C)SC 62a_100011215978_200000210301 [1,0,0,0,0,0|0,1,0]=2 395 B9R0.46 CCCCCCC(C)SC 62a_200000210301_100011215978 [1,0,0,0,0,0|0,1,0]=2 396 B9R0.46 CCCCCCC(C)S[13CH3] 62a_100011215978_200025704644 [1,0,0,0,0,0|0,1,0]=2 397 B9R0.46 CCCCCCC(C)S[13CH3] 62a_200025704644_100011215978 [1,0,0,0,0,0|0,1,0]=2 398 B9R0.46 CCCCCCN(C)CC 2230a_100000225621_100000210314 [1,0,0,0,0,0|2,0,0]=3 399 B9R0.46 CCCCCCN(C)CC 2230a_106256046315_100000210202 [1,0,0,0,0,0|2,0,0]=3 400 B9R0.46 CCCCCCN(C)CC 269982a_100000225621_100000210757 [1,0,0,0,0,0|2,0,0]=3 401 B9R0.46 CCCCCCN(C)CC 269982a_106256046315_100000204670 [1,0,0,0,0,0|2,0,0]=3 402 B9R0.46 CCCCCCN(C)CF 269982a_106256046315_100015361967 [1,0,0,0,0,0|3,0,0]=4 403 B9R0.46 CCCCCNC(C)C#N 2230a_100000209983_100000184139 [1,0,0,0,0,0|3,0,0]=4 404 B9R0.46 CCCCCNC(C)C#N 2230a_100000737613_100000210326 [1,0,0,0,0,0|3,0,0]=4 405 B9R0.46 CCCCCNC(C)CC 2230a_100000209981_100000210326 [1,0,0,0,0,0|2,0,0]=3 406 B9R0.46 CCCCCNC(C)CC 2230a_100000209983_100000758301 [1,0,0,0,0,0|2,0,0]=3 407 B9R0.46 CCCCCNC(C)CO 2230a_100000209983_100012180447 [1,0,0,0,0,0|3,0,0]=4 408 B9R0.46 CCCCCN[C@H](C)CO 2230a_100000737577_100000210326 [1,0,0,0,0,0|3,0,0]=4 409 B9R0.46 CCCCCOC(C)C#N 34a_100011218135_100000718602 [1,0,0,0,0,0|3,0,0]=4 410 B9R0.46 CCCCCOC(C)C#N 7a_100000210253_100000703298 [1,0,0,0,0,0|3,0,0]=4 411 B9R0.46 CCCCCOC(C)CC 34a_100000210253_100011215416 [1,0,0,0,0,0|2,0,0]=3 412 B9R0.46 CCCCCOC(C)CC 7a_100000210228_100000210326 [1,0,0,0,0,0|2,0,0]=3 413 B9R0.46 CCCCCOC(C)CC 7a_100000210253_100000758301 [1,0,0,0,0,0|2,0,0]=3 414 B9R0.46 CCCCCOC(C)CF 34a_100016041109_100000718602 [1,0,0,0,0,0|3,0,0]=4 415 B9R0.46 CCCCCOC(C)CF 7a_100016041109_100000210326 [1,0,0,0,0,0|3,0,0]=4 416 B9R0.46 CCCCCOC(C)CN 34a_100000210904_100000718602 [1,0,0,0,0,0|3,0,0]=4 417 B9R0.46 CCCCCOC(C)CO 34a_100000210253_100012180447 [1,0,0,0,0,0|3,0,0]=4 418 B9R0.46 CCCCCOC(C)CO 7a_100000210253_100012180447 [1,0,0,0,0,0|3,0,0]=4 419 B9R0.46 CCCCCSC(C)C#N 62a_100000210326_100000703298 [1,0,0,0,0,0|3,0,0]=4 420 B9R0.46 CCCCCSC(C)C#N 62a_100000703298_100000210326 [1,0,0,0,0,0|3,0,0]=4 421 B9R0.46 CCCCCSC(C)CC 62a_100000210326_100000758301 [1,0,0,0,0,0|2,0,0]=3 422 B9R0.46 CCCCCSC(C)CC 62a_100000758301_100000210326 [1,0,0,0,0,0|2,0,0]=3 423 B9R0.46 CCCCCSC(C)CO 62a_100012180447_100000210326 [1,0,0,0,0,0|3,0,0]=4 424 B9R0.46 CCCCCSC(C)OC 62a_100000210326_100009879195 [1,0,0,0,0,0|1,0,0]=2 425 B9R0.46 CCCCCSC(C)OC 62a_100009879195_100000210326 [1,0,0,0,0,0|1,0,0]=2 426 B9R0.46 CCCCCS[C@H](C)CO 62a_100000210326_100016084084 [1,0,0,0,0,0|3,0,0]=4 427 B9R0.46 CCCCCS[C@H](C)CO 62a_100016084084_100000210326 [1,0,0,0,0,0|3,0,0]=4 428 B9R0.46 CCCCNCC(=O)OC 2230a_100000102301_100000747449 [1,0,0,0,0,0|1,0,2]=4 429 B9R0.46 CCCCNCC(=O)OC 7a_106832991798_100000747449 [1,0,0,0,0,0|1,0,2]=4 430 B9R0.46 CCCCNCC(C)CC 2230a_100000102301_100000748023 [1,0,0,0,0,0|2,0,0]=3 431 B9R0.46 CCCCNCC(C)CC 2230a_100020588543_100000210211 [1,0,0,0,0,0|2,0,0]=3 432 B9R0.46 CCCCNCC(C)CC 270004a_100000102301_100000243153 [1,0,0,0,0,0|2,0,0]=3 433 B9R0.46 CCCCNCC(C)CC 7a_106832991798_100000748023 [1,0,0,0,0,0|2,0,0]=3 434 B9R0.46 CCCCNCC(C)CO 34a_100000744482_100000210210 [1,0,0,0,0,0|3,0,0]=4 435 B9R0.46 CCCCNCC(O)CC 2230a_100000102301_100011218378 [1,0,0,0,0,0|2,0,0]=3 436 B9R0.46 CCCCNCC(O)CC 2230a_100011218483_100000210211 [1,0,0,0,0,0|2,0,0]=3 437 B9R0.46 CCCCNCC(O)CC 7a_106832991798_100011218378 [1,0,0,0,0,0|2,0,0]=3 438 B9R0.46 CCCCNCC(O)CO 2230a_100000102301_100011219619 [1,0,0,0,0,0|3,0,0]=4 439 B9R0.46 CCCCNCC(O)CO 7a_106832991798_100011219619 [1,0,0,0,0,0|3,0,0]=4 440 B9R0.46 CCCCNC[C@@H](C)CC 2230a_100000102301_100009816398 [1,0,0,0,0,0|2,0,0]=3 441 B9R0.46 CCCCNC[C@@H](C)CC 7a_106832991798_100009816398 [1,0,0,0,0,0|2,0,0]=3 442 B9R0.46 CCCCNC[C@@H](C)CO 2230a_100000102301_100000059175 [1,0,0,0,0,0|3,0,0]=4 443 B9R0.46 CCCCNC[C@@H](C)CO 7a_106832991798_100000059175 [1,0,0,0,0,0|3,0,0]=4 444 B9R0.46 CCCCNC[C@@H](C)OC 2230a_100020591295_100000210211 [1,0,0,0,0,0|1,0,0]=2 445 B9R0.46 CCCCNC[C@@H](O)CF 2230a_100000102301_100015614560 [1,0,0,0,0,0|3,0,0]=4 446 B9R0.46 CCCCNC[C@@H](O)CF 7a_106832991798_100015614560 [1,0,0,0,0,0|3,0,0]=4 447 B9R0.46 CCCCNC[C@@H](O)CO 2230a_100000102301_100009815848 [1,0,0,0,0,0|3,0,0]=4 448 B9R0.46 CCCCNC[C@@H](O)CO 7a_106832991798_100009815848 [1,0,0,0,0,0|3,0,0]=4 449 B9R0.46 CCCCNC[C@H](O)CO 2230a_100020644852_100000210211 [1,0,0,0,0,0|3,0,0]=4 450 B9R0.46 CCCCOCC(=O)OC 34a_100000210227_100000747449 [1,0,0,0,0,0|1,0,2]=4 451 B9R0.46 CCCCOCC(=O)OC 7a_100000210227_100000747449 [1,0,0,0,0,0|1,0,2]=4 452 B9R0.46 CCCCOCC(C)CC 34a_100000210227_100000748023 [1,0,0,0,0,0|2,0,0]=3 453 B9R0.46 CCCCOCC(C)CC 7a_100000210227_100000748023 [1,0,0,0,0,0|2,0,0]=3 454 B9R0.46 CCCCOCC(C)CN 34a_100000744482_100000210210 [1,0,0,0,0,0|3,0,0]=4 455 B9R0.46 CCCCOCC(C)OC 34a_100000690652_100000210210 [1,0,0,0,0,0|1,0,0]=2 456 B9R0.46 CCCCOCC(C)OC 34a_100011217071_200000210301 [1,0,0,0,0,0|1,0,0]=2 457 B9R0.46 CCCCOCC(C)OC 7a_100011217071_200000210301 [1,0,0,0,0,0|1,0,0]=2 458 B9R0.46 CCCCOCC(C)O[13CH3] 34a_100011217071_200025704644 [1,0,0,0,0,0|1,0,0]=2 459 B9R0.46 CCCCOCC(C)O[13CH3] 7a_100011217071_200025704644 [1,0,0,0,0,0|1,0,0]=2 460 B9R0.46 CCCCOCC(O)CC 34a_100000210227_100011218378 [1,0,0,0,0,0|2,0,0]=3 461 B9R0.46 CCCCOCC(O)CC 7a_100000210227_100011218378 [1,0,0,0,0,0|2,0,0]=3 462 B9R0.46 CCCCOCC(O)CO 34a_100000210227_100011219619 [1,0,0,0,0,0|3,0,0]=4 463 B9R0.46 CCCCOCC(O)CO 7a_100000210227_100011219619 [1,0,0,0,0,0|3,0,0]=4 464 B9R0.46 CCCCOCN(C)CC 2230a_100000225621_100011995733 [1,0,0,0,0,0|3,0,0]=4 465 B9R0.46 CCCCOCN(C)CC 269982a_100000225621_100011995733 [1,0,0,0,0,0|3,0,0]=4 466 B9R0.46 CCCCOC[C@@H](C)CC 34a_100000210227_100009816398 [1,0,0,0,0,0|2,0,0]=3 467 B9R0.46 CCCCOC[C@@H](C)CC 7a_100000210227_100009816398 [1,0,0,0,0,0|2,0,0]=3 468 B9R0.46 CCCCOC[C@@H](C)CC 7a_100009816381_100000210211 [1,0,0,0,0,0|2,0,0]=3 469 B9R0.46 CCCCOC[C@@H](C)CO 34a_100000210227_100000059175 [1,0,0,0,0,0|3,0,0]=4 470 B9R0.46 CCCCOC[C@@H](C)CO 7a_100000210227_100000059175 [1,0,0,0,0,0|3,0,0]=4 471 B9R0.46 CCCCOC[C@@H](O)CF 34a_100000210227_100015614560 [1,0,0,0,0,0|3,0,0]=4 472 B9R0.46 CCCCOC[C@@H](O)CF 7a_100000210227_100015614560 [1,0,0,0,0,0|3,0,0]=4 473 B9R0.46 CCCCOC[C@@H](O)CO 34a_100000210227_100009815848 [1,0,0,0,0,0|3,0,0]=4 474 B9R0.46 CCCCOC[C@@H](O)CO 7a_100000210227_100009815848 [1,0,0,0,0,0|3,0,0]=4 475 B9R0.46 CCCCSCC(=O)OC 62a_100000210211_100000747449 [1,0,0,0,0,0|1,0,2]=4 476 B9R0.46 CCCCSCC(=O)OC 62a_100000747449_100000210210 [1,0,0,0,0,0|1,0,2]=4 477 B9R0.46 CCCCSCC(C)CC 62a_100000210211_100000748023 [1,0,0,0,0,0|2,0,0]=3 478 B9R0.46 CCCCSCC(C)CC 62a_100000748023_100000210210 [1,0,0,0,0,0|2,0,0]=3 479 B9R0.46 CCCCSCC(O)CC 62a_100000210211_100011218378 [1,0,0,0,0,0|2,0,0]=3 480 B9R0.46 CCCCSCC(O)CC 62a_100011218378_100000210210 [1,0,0,0,0,0|2,0,0]=3 481 B9R0.46 CCCCSCC(O)CO 62a_100000210211_100011219619 [1,0,0,0,0,0|3,0,0]=4 482 B9R0.46 CCCCSCC(O)CO 62a_100011219619_100000210210 [1,0,0,0,0,0|3,0,0]=4 483 B9R0.46 CCCCSC[C@@H](C)CC 62a_100000210211_100009816398 [1,0,0,0,0,0|2,0,0]=3 484 B9R0.46 CCCCSC[C@@H](C)CC 62a_100009816398_100000210210 [1,0,0,0,0,0|2,0,0]=3 485 B9R0.46 CCCCSC[C@@H](C)CO 62a_100000059175_100000210210 [1,0,0,0,0,0|3,0,0]=4 486 B9R0.46 CCCCSC[C@@H](C)CO 62a_100000210211_100000059175 [1,0,0,0,0,0|3,0,0]=4 487 B9R0.46 CCCCSC[C@@H](O)CF 62a_100000210211_100015614560 [1,0,0,0,0,0|3,0,0]=4 488 B9R0.46 CCCCSC[C@@H](O)CF 62a_100015614560_100000210210 [1,0,0,0,0,0|3,0,0]=4 489 B9R0.46 CCCCSC[C@@H](O)CO 62a_100000210211_100009815848 [1,0,0,0,0,0|3,0,0]=4 490 B9R0.46 CCCCSC[C@@H](O)CO 62a_100009815848_100000210210 [1,0,0,0,0,0|3,0,0]=4 491 B9R0.46 CCCNCCC(C)CC 2230a_100020591266_100000210303 [1,0,0,0,0,0|2,0,0]=3 492 B9R0.46 CCCNCCC(C)CO 2230a_106354213184_100000210303 [1,0,0,0,0,0|3,0,0]=4 493 B9R0.46 CCCNCCC(C)CO 34a_106354213184_100000210303 [1,0,0,0,0,0|3,0,0]=4 494 B9R0.46 CCCOCCC(=O)OC 34a_100000210258_100000742370 [1,0,0,0,0,0|1,0,2]=4 495 B9R0.46 CCCOCCC(C)CC 7a_100011215188_100000210303 [1,0,0,0,0,0|2,0,0]=3 496 B9R0.46 CCCOCCC(C)OC 7a_100000764861_100000210303 [1,0,0,0,0,0|1,0,0]=2 497 B9R0.46 CCCOCCN(C)CC 2230a_100000225621_100011215938 [1,0,0,0,0,0|3,0,0]=4 498 B9R0.46 CCCOCCN(C)CC 269982a_100000225621_100011215938 [1,0,0,0,0,0|3,0,0]=4 499 B9R0.46 CCCSCCC(=O)OC 62a_100000204255_100000210303 [1,0,0,0,0,0|1,0,2]=4 500 B9R0.46 CCCSCCC(=O)OC 62a_100000210303_100000204255 [1,0,0,0,0,0|1,0,2]=4 501 B9R0.46 CCN(C)CCCCCF 2230a_100000225621_100000729378 [1,0,0,0,0,0|3,0,0]=4 502 B9R0.46 CCN(C)CCCCCF 269982a_100000225621_100000729378 [1,0,0,0,0,0|3,0,0]=4 503 B9R0.46 CCN(C)CCCCCO 2230a_100000225621_100000746330 [1,0,0,0,0,0|3,0,0]=4 504 B9R0.46 CCN(C)CCCCCO 2230a_100000722520_100000210202 [1,0,0,0,0,0|3,0,0]=4 505 B9R0.46 CCN(C)CCCCCO 269982a_100000225621_100000746330 [1,0,0,0,0,0|3,0,0]=4 506 B9R0.46 CCN(C)CCCCCO 269982a_100000722520_100000204670 [1,0,0,0,0,0|3,0,0]=4 507 B9R0.46 CCN(C)CCCCOC 2230a_100000225621_100000730899 [1,0,0,0,0,0|3,0,0]=4 508 B9R0.46 CCN(C)CCCCOC 269982a_100000225621_100000730899 [1,0,0,0,0,0|3,0,0]=4 509 B9R0.46 CCNCCCC(=O)OC 2230a_100015525214_100011218270 [1,0,0,0,0,0|1,0,2]=4 510 B9R0.46 CCNCCCN(C)CC 2230a_100015525214_100015186262 [1,0,0,0,0,0|3,0,0]=4 511 B9R0.46 CCOCCCC(=O)OC 34a_100121572206_100000742333 [1,0,0,0,0,0|1,0,2]=4 512 B9R0.46 CCOCCCC(C)CC 7a_100011216074_100000210202 [1,0,0,0,0,0|2,0,0]=3 513 B9R0.46 CCOCCCN(C)CC 2230a_100000225621_100012232248 [1,0,0,0,0,0|3,0,0]=4 514 B9R0.46 CCOCCCN(C)CC 269982a_100000225621_100012232248 [1,0,0,0,0,0|3,0,0]=4 515 B9R0.46 CCOCCC[C@@H](C)CN 34a_100160569302_100000210202 [1,0,0,0,0,0|3,0,0]=4 516 B9R0.46 CCOCCNC(C)CC 2230a_100000209981_100011215890 [1,0,0,0,0,0|3,0,0]=4 517 B9R0.46 CCOCCNC(C)CC 2230a_102516460346_100000758301 [1,0,0,0,0,0|3,0,0]=4 518 B9R0.46 CCOCCNC(C)CC 34a_102516460346_100011215416 [1,0,0,0,0,0|3,0,0]=4 519 B9R0.46 CCOCCOC(C)CC 34a_100000210136_100011215416 [1,0,0,0,0,0|3,0,0]=4 520 B9R0.46 CCOCCOC(C)CC 7a_100000210136_100000758301 [1,0,0,0,0,0|3,0,0]=4 521 B9R0.46 CCOCCOC(C)CC 7a_100000210228_100011215890 [1,0,0,0,0,0|3,0,0]=4 522 B9R0.46 CCOCCSC(C)CC 62a_100000210147_100000758301 [1,0,0,0,0,0|3,0,0]=4 523 B9R0.46 CCOCCSC(C)CC 62a_100000758301_100011215890 [1,0,0,0,0,0|3,0,0]=4 524 B9R0.46 CCOCCSC(C)OC 62a_100000210147_100009879195 [1,0,0,0,0,0|2,0,0]=3 525 B9R0.46 CCOCCSC(C)OC 62a_100009879195_100011215890 [1,0,0,0,0,0|2,0,0]=3 526 B9R0.46 CCOCSCC(C)CC 62a_100000739092_100000748023 [1,0,0,0,0,0|3,0,0]=4 527 B9R0.46 CCOCSCC(C)CC 62a_100000748023_100000739092 [1,0,0,0,0,0|3,0,0]=4 528 B9R0.46 CCOCSCC(O)CC 62a_100000739092_100011218378 [1,0,0,0,0,0|3,0,0]=4 529 B9R0.46 CCOCSCC(O)CC 62a_100011218378_100000739092 [1,0,0,0,0,0|3,0,0]=4 530 B9R0.46 CCOCSC[C@@H](C)CC 62a_100000739092_100009816398 [1,0,0,0,0,0|3,0,0]=4 531 B9R0.46 CCOCSC[C@@H](C)CC 62a_100009816398_100000739092 [1,0,0,0,0,0|3,0,0]=4 532 B9R0.46 CCSCCCC(=O)OC 62a_100000210202_100011218270 [1,0,0,0,0,0|1,0,2]=4 533 B9R0.46 CCSCCCC(=O)OC 62a_100011218270_100000210202 [1,0,0,0,0,0|1,0,2]=4 534 B9R0.46 CCSCCCN(C)CC 62a_100000210202_100015186262 [1,0,0,0,0,0|3,0,0]=4 535 B9R0.46 CCSCCNC(C)CC 2230a_100000106463_100000758301 [1,0,0,0,0,0|3,0,0]=4 536 B9R0.46 CCSCCNC(C)CC 2230a_100000209981_100000757381 [1,0,0,0,0,0|3,0,0]=4 537 B9R0.46 CCSCCOC(C)CC 34a_100000212035_100011215416 [1,0,0,0,0,0|3,0,0]=4 538 B9R0.46 CCSCCOC(C)CC 7a_100000210228_100000757381 [1,0,0,0,0,0|3,0,0]=4 539 B9R0.46 CCSCCOC(C)CC 7a_100000212035_100000758301 [1,0,0,0,0,0|3,0,0]=4 540 B9R0.46 CCSCCSC(C)CC 62a_100000757381_100000758301 [1,0,0,0,0,0|3,0,0]=4 541 B9R0.46 CCSCCSC(C)CC 62a_100000758301_100000757381 [1,0,0,0,0,0|3,0,0]=4 542 B9R0.46 CCSCCSC(C)OC 62a_100000757381_100009879195 [1,0,0,0,0,0|2,0,0]=3 543 B9R0.46 CCSCCSC(C)OC 62a_100009879195_100000757381 [1,0,0,0,0,0|2,0,0]=3 544 B9R0.46 CC[C@H](C)CNCCCF 2230a_100015189416_100009816398 [1,0,0,0,0,0|3,0,0]=4 545 B9R0.46 CC[C@H](C)CNCCCF 34a_100015189416_100009816398 [1,0,0,0,0,0|3,0,0]=4 546 B9R0.46 CC[C@H](C)CNCCOC 2230a_100000209980_100009816398 [1,0,0,0,0,0|3,0,0]=4 547 B9R0.46 CC[C@H](C)CNCCSC 2230a_100020590264_100009816398 [1,0,0,0,0,0|3,0,0]=4 548 B9R0.46 CC[C@H](C)COCCCBr 34a_100011217188_100009816398 [1,0,0,0,0,0|3,0,0]=4 549 B9R0.46 CC[C@H](C)COCCCCl 34a_100000230001_100009816398 [1,0,0,0,0,0|3,0,0]=4 550 B9R0.46 CC[C@H](C)COCCCF 34a_100000759539_100009816398 [1,0,0,0,0,0|3,0,0]=4 551 B9R0.46 CC[C@H](C)COCCCF 7a_100009816381_100011934791 [1,0,0,0,0,0|3,0,0]=4 552 B9R0.46 CC[C@H](C)COCCCN 34a_100000182051_100009816398 [1,0,0,0,0,0|3,0,0]=4 553 B9R0.46 CC[C@H](C)COCCCO 7a_100009816381_100011215043 [1,0,0,0,0,0|3,0,0]=4 554 B9R0.46 CC[C@H](C)COCCOC 34a_100000210237_100009816398 [1,0,0,0,0,0|3,0,0]=4 555 B9R0.46 CC[C@H](C)COCCOC 7a_100009816381_100000233755 [1,0,0,0,0,0|3,0,0]=4 556 B9R0.46 CC[C@H](C)COCCSC 34a_100000230434_100009816398 [1,0,0,0,0,0|3,0,0]=4 557 B9R0.46 CC[C@H](C)COCCSC 7a_100000230434_100009816398 [1,0,0,0,0,0|3,0,0]=4 558 B9R0.46 CC[C@H](C)COCCSC 7a_100009816381_100000212216 [1,0,0,0,0,0|3,0,0]=4 559 B9R0.46 CC[C@H](C)CSCCCF 62a_100009816398_100011934791 [1,0,0,0,0,0|3,0,0]=4 560 B9R0.46 CC[C@H](C)CSCCCF 62a_100011934791_100009816398 [1,0,0,0,0,0|3,0,0]=4 561 B9R0.46 CC[C@H](C)CSCCCO 62a_100009816398_100011215043 [1,0,0,0,0,0|3,0,0]=4 562 B9R0.46 CC[C@H](C)CSCCCO 62a_100011215043_100009816398 [1,0,0,0,0,0|3,0,0]=4 563 B9R0.46 CC[C@H](C)CSCCOC 62a_100000233755_100009816398 [1,0,0,0,0,0|3,0,0]=4 564 B9R0.46 CC[C@H](C)CSCCOC 62a_100009816398_100000233755 [1,0,0,0,0,0|3,0,0]=4 565 B9R0.46 CC[C@H](C)CSCCSC 62a_100000212216_100009816398 [1,0,0,0,0,0|3,0,0]=4 566 B9R0.46 CC[C@H](C)CSCCSC 62a_100009816398_100000751147 [1,0,0,0,0,0|3,0,0]=4 567 B9R0.46 CNCCCCC(=O)OC 2230a_106832991635_100000204269 [1,0,0,0,0,0|1,0,2]=4 568 B9R0.46 CNCCCCC(=O)OC 34a_100102657272_100000204269 [1,0,0,0,0,0|1,0,2]=4 569 B9R0.46 CNCCCCC(=O)OC 7a_106832991635_100000204269 [1,0,0,0,0,0|1,0,2]=4 570 B9R0.46 COC(=O)CCCCO[13CH3] 34a_100000059025_200025704644 [1,0,0,0,0,0|1,0,2]=4 571 B9R0.46 COC(=O)CCCCO[13CH3] 7a_100000059025_200025704644 [1,0,0,0,0,0|1,0,2]=4 572 B9R0.46 COC(=O)CCCCSC 62a_100000204269_200000210301 [1,0,0,0,0,0|1,0,2]=4 573 B9R0.46 COC(=O)CCCCSC 62a_200000210301_100000204269 [1,0,0,0,0,0|1,0,2]=4 574 B9R0.46 COC(=O)CCCCS[13CH3] 62a_100000204269_200025704644 [1,0,0,0,0,0|1,0,2]=4 575 B9R0.46 COC(=O)CCCCS[13CH3] 62a_200025704644_100000204269 [1,0,0,0,0,0|1,0,2]=4 576 B9R0.46 COC(C)CCOCC#N 7a_100000764861_100011215382 [1,0,0,0,0,0|2,0,1]=4 577 B9R0.46 COC(C)CCOCC=O 7a_100000764861_200015260668 [1,0,0,0,0,0|2,0,1]=4 578 B9R0.46 COC(C)CCOCCF 7a_100000764861_100011217306 [1,0,0,0,0,0|2,0,0]=3 579 B9R0.46 COC(C)CCOCCO 7a_100000764861_100000211926 [1,0,0,0,0,0|2,0,0]=3 580 B9R0.46 COC(C)COCCCF 34a_100000690652_100011934791 [1,0,0,0,0,0|2,0,0]=3 581 B9R0.46 COC(C)COCCCO 34a_100000690652_100000230001 [1,0,0,0,0,0|2,0,0]=3 582 B9R0.46 COC(C)COCCSC 34a_100000690652_100000212216 [1,0,0,0,0,0|2,0,0]=3 583 B9R0.46 COC(C)SCCCC#N 62a_100000687738_100009879195 [1,0,0,0,0,0|2,0,1]=4 584 B9R0.46 COC(C)SCCCC#N 62a_100009879195_100000687738 [1,0,0,0,0,0|2,0,1]=4 585 B9R0.46 COC(C)SCCCC=O 62a_100009879195_200011292268 [1,0,0,0,0,0|2,0,1]=4 586 B9R0.46 COC(C)SCCCC=O 62a_200011292268_100009879195 [1,0,0,0,0,0|2,0,1]=4 587 B9R0.46 COC(C)SCCCCF 62a_100000729493_100009879195 [1,0,0,0,0,0|2,0,0]=3 588 B9R0.46 COC(C)SCCCCF 62a_100009879195_100000729493 [1,0,0,0,0,0|2,0,0]=3 589 B9R0.46 COC(C)SCCCCO 62a_100000210776_100009879195 [1,0,0,0,0,0|2,0,0]=3 590 B9R0.46 COC(C)SCCCCO 62a_100009879195_100000210776 [1,0,0,0,0,0|2,0,0]=3 591 B9R0.46 COCCCCC(=O)OC 34a_100000059025_200000210301 [1,0,0,0,0,0|1,0,2]=4 592 B9R0.46 COCCCCC(=O)OC 34a_100138415774_100000204269 [1,0,0,0,0,0|1,0,2]=4 593 B9R0.46 COCCCCC(=O)OC 7a_100000059025_200000210301 [1,0,0,0,0,0|1,0,2]=4 594 B9R0.46 COCCCSC(C)OC 62a_100000709357_100009879195 [1,0,0,0,0,0|2,0,0]=3 595 B9R0.46 COCCCSC(C)OC 62a_100009879195_100000709357 [1,0,0,0,0,0|2,0,0]=3 596 B9R0.46 COCCNC[C@@H](C)OC 2230a_100020591295_100011201679 [1,0,0,0,0,0|2,0,0]=3 597 B9R0.46 COCCOCC(C)OC 34a_100000690652_100011201679 [1,0,0,0,0,0|2,0,0]=3 598 B9R0.46 CO[C@H](C)CNCCC#N 2230a_100020591295_100011215226 [1,0,0,0,0,0|2,0,1]=4 599 B9R0.46 CO[C@H](C)CNCCCF 2230a_100020591295_100011934791 [1,0,0,0,0,0|2,0,0]=3 600 B9R0.46 CO[C@H](C)CNCCCO 2230a_100020591295_100000230001 [1,0,0,0,0,0|2,0,0]=3 601 B9R0.46 CO[C@H](C)CNCCSC 2230a_100020591295_100000751147 [1,0,0,0,0,0|2,0,0]=3 602 B9R0.50 C#CC(CCCCC)OC 34a_100011216489_200000210301 [1,0,0,0,0,0|1,0,1]=3 603 B9R0.50 C#CC(CCCCC)OC 7a_100011216489_200000210301 [1,0,0,0,0,0|1,0,1]=3 604 B9R0.50 C#CC(CCCCC)O[13CH3] 34a_100011216489_200025704644 [1,0,0,0,0,0|1,0,1]=3 605 B9R0.50 C#CC(CCCCC)O[13CH3] 7a_100011216489_200025704644 [1,0,0,0,0,0|1,0,1]=3 606 B9R0.50 C#CCNCC(OC)OC 34a_100000212058_100000211822 [1,0,0,0,0,0|1,0,2]=4 607 B9R0.50 C#CCOCC(OC)OC 34a_100000210247_100000211822 [1,0,0,0,0,0|1,0,2]=4 608 B9R0.50 C#CCOCC(OC)OC 34a_100011216393_100000184674 [1,0,0,0,0,0|1,0,2]=4 609 B9R0.50 C#CCSCC(OC)OC 62a_100000038162_100000751394 [1,0,0,0,0,0|1,0,2]=4 610 B9R0.50 C=CC(CCCCC)OC 34a_100011216863_200000210301 [1,0,0,0,0,0|1,0,1]=3 611 B9R0.50 C=CC(CCCCC)OC 7a_100011216863_200000210301 [1,0,0,0,0,0|1,0,1]=3 612 B9R0.50 C=CC(CCCCC)O[13CH3] 34a_100011216863_200025704644 [1,0,0,0,0,0|1,0,1]=3 613 B9R0.50 C=CC(CCCCC)O[13CH3] 7a_100011216863_200025704644 [1,0,0,0,0,0|1,0,1]=3 614 B9R0.50 C=CCNCC(OC)OC 2230a_100020586998_100000751394 [1,0,0,0,0,0|1,0,2]=4 615 B9R0.50 C=CCNCC(OC)OC 270004a_100020586998_100000752162 [1,0,0,0,0,0|1,0,2]=4 616 B9R0.50 C=CCOCC(OC)OC 34a_100011216393_100015514636 [1,0,0,0,0,0|1,0,2]=4 617 B9R0.50 C=CCOCC(OC)OC 34a_200000210373_100000211822 [1,0,0,0,0,0|1,0,2]=4 618 B9R0.50 C=CCSCC(OC)OC 62a_100000210623_100000751394 [1,0,0,0,0,0|1,0,2]=4 619 B9R0.50 C=CCSCC(OC)OC 62a_100000751394_100000210623 [1,0,0,0,0,0|1,0,2]=4 620 B9R0.50 CCC(COCCF)OC 34a_100011934954_100011217306 [1,0,0,0,0,0|3,0,0]=4 621 B9R0.50 CCC(COCCF)OC 7a_100011934954_100011217306 [1,0,0,0,0,0|3,0,0]=4 622 B9R0.50 CCC(COCCO)OC 34a_100011934954_100000211926 [1,0,0,0,0,0|3,0,0]=4 623 B9R0.50 CCC(COCCO)OC 7a_100011934954_100000211926 [1,0,0,0,0,0|3,0,0]=4 624 B9R0.50 CCC(COCSC)OC 34a_100011934954_100011218213 [1,0,0,0,0,0|3,0,0]=4 625 B9R0.50 CCCCCC(CC)NC 270004a_106832991635_100011215316 [1,0,0,0,0,0|2,0,0]=3 626 B9R0.50 CCCCCC(CC)OC 34a_100011215405_200000210301 [1,0,0,0,0,0|1,0,0]=2 627 B9R0.50 CCCCCC(CC)OC 7a_100011215405_200000210301 [1,0,0,0,0,0|1,0,0]=2 628 B9R0.50 CCCCCC(CC)O[13CH3] 34a_100011215405_200025704644 [1,0,0,0,0,0|1,0,0]=2 629 B9R0.50 CCCCCC(CC)O[13CH3] 7a_100011215405_200025704644 [1,0,0,0,0,0|1,0,0]=2 630 B9R0.50 CCCCCN(CC)CC 2230a_100000724800_100000210326 [1,0,0,0,0,0|3,0,0]=4 631 B9R0.50 CCCCCN(CC)CC 269956a_100000042499_100000210326 [1,0,0,0,0,0|3,0,0]=4 632 B9R0.50 CCCCCN(CC)CC 269982a_100000724800_100000210215 [1,0,0,0,0,0|3,0,0]=4 633 B9R0.50 CCCCNC(CC)CC 2230a_100000199018_100000210211 [1,0,0,0,0,0|3,0,0]=4 634 B9R0.50 CCCCNC(CC)CC 270004a_100000102301_100000210860 [1,0,0,0,0,0|3,0,0]=4 635 B9R0.50 CCCCNC(CC)CC 7a_106832991798_100000210505 [1,0,0,0,0,0|3,0,0]=4 636 B9R0.50 CCCCOC(CC)CC 7a_100000210227_100000210505 [1,0,0,0,0,0|3,0,0]=4 637 B9R0.50 CCCCOC(CC)CC 7a_100000688536_100000210211 [1,0,0,0,0,0|3,0,0]=4 638 B9R0.50 CCCCSC(CC)CC 62a_100000210211_100000210505 [1,0,0,0,0,0|3,0,0]=4 639 B9R0.50 CCCCSC(CC)CC 62a_100000210505_100000210210 [1,0,0,0,0,0|3,0,0]=4 640 B9R0.50 CCCNCC(CC)CC 2230a_100102946423_100000210303 [1,0,0,0,0,0|3,0,0]=4 641 B9R0.50 CCCNCC(CC)CC 269862a_100020643023_100000211137 [1,0,0,0,0,0|3,0,0]=4 642 B9R0.50 CCCNCC(CC)CC 270004a_100020643023_100000211137 [1,0,0,0,0,0|3,0,0]=4 643 B9R0.50 CCCNCC(OC)OC 270004a_100020643023_100000752162 [1,0,0,0,0,0|1,0,0]=2 644 B9R0.50 CCCOCC(CC)CC 34a_100000210258_100011215472 [1,0,0,0,0,0|3,0,0]=4 645 B9R0.50 CCCOCC(CC)CC 7a_100000703878_100000210303 [1,0,0,0,0,0|3,0,0]=4 646 B9R0.50 CCCOCC(CC)OC 34a_100011934954_100000210303 [1,0,0,0,0,0|2,0,0]=3 647 B9R0.50 CCCOCC(CC)OC 7a_100011934954_100000210303 [1,0,0,0,0,0|2,0,0]=3 648 B9R0.50 CCCOCC(OC)OC 34a_100000210258_100000211822 [1,0,0,0,0,0|1,0,0]=2 649 B9R0.50 CCCOCC(OC)OC 34a_100011216393_100000210303 [1,0,0,0,0,0|1,0,0]=2 650 B9R0.50 CCCSCC(CC)CC 62a_100000210303_100011215472 [1,0,0,0,0,0|3,0,0]=4 651 B9R0.50 CCCSCC(CC)CC 62a_100011215472_100000210303 [1,0,0,0,0,0|3,0,0]=4 652 B9R0.50 CCCSCC(OC)OC 62a_100000210303_100000751394 [1,0,0,0,0,0|1,0,0]=2 653 B9R0.50 CCCSCC(OC)OC 62a_100000751394_100000210303 [1,0,0,0,0,0|1,0,0]=2 654 B9R0.50 CCNCCC(OC)OC 2230a_100015525214_100009813347 [1,0,0,0,0,0|1,0,0]=2 655 B9R0.50 CCNN=CC(OC)OC 4a_100000756455_100000752162 [1,0,0,0,0,0|2,0,1]=4 656 B9R0.50 CCOCCC(OC)OC 34a_100121572206_100000139399 [1,0,0,0,0,0|1,0,0]=2 657 B9R0.50 CCSCCC(OC)OC 62a_100000139399_100000210202 [1,0,0,0,0,0|1,0,0]=2 658 B9R0.50 CCSCCC(OC)OC 62a_100000210202_100000139399 [1,0,0,0,0,0|1,0,0]=2 659 B9R0.50 CNCCCC(OC)OC 2230a_106832991635_100000069011 [1,0,0,0,0,0|1,0,0]=2 660 B9R0.50 CNCCCC(OC)OC 34a_100102657272_100000069011 [1,0,0,0,0,0|1,0,0]=2 661 B9R0.50 CNCCCC(OC)OC 7a_106832991635_100000069011 [1,0,0,0,0,0|1,0,0]=2 662 B9R0.50 COC(CCCSC)OC 62a_100000069011_200000210301 [1,0,0,0,0,0|1,0,0]=2 663 B9R0.50 COC(CCCSC)OC 62a_200000210301_100000069011 [1,0,0,0,0,0|1,0,0]=2 664 B9R0.50 COC(CCCS[13CH3])OC 62a_100000069011_200025704644 [1,0,0,0,0,0|1,0,0]=2 665 B9R0.50 COC(CCCS[13CH3])OC 62a_200025704644_100000069011 [1,0,0,0,0,0|1,0,0]=2 666 B9R0.50 COC(CCSCF)OC 62a_100000139399_100015361967 [1,0,0,0,0,0|2,0,0]=3 667 B9R0.50 COC(CCSCF)OC 62a_100015361967_100000139399 [1,0,0,0,0,0|2,0,0]=3 668 B9R0.50 COC(CNCCF)OC 34a_100000724931_100000211822 [1,0,0,0,0,0|2,0,0]=3 669 B9R0.50 COC(CNCCO)OC 2230a_100016997473_100000751394 [1,0,0,0,0,0|2,0,0]=3 670 B9R0.50 COC(CNCCO)OC 270004a_100000210304_100000752162 [1,0,0,0,0,0|2,0,0]=3 671 B9R0.50 COC(CNCCO)OC 34a_100016990907_100000211822 [1,0,0,0,0,0|2,0,0]=3 672 B9R0.50 COC(COCC=O)OC 34a_100011216393_200009817547 [1,0,0,0,0,0|2,0,1]=4 673 B9R0.50 COC(COCCBr)OC 34a_100000211926_100000211822 [1,0,0,0,0,0|2,0,0]=3 674 B9R0.50 COC(COCCF)OC 34a_100011216393_100011217306 [1,0,0,0,0,0|2,0,0]=3 675 B9R0.50 COC(COCCN)OC 34a_100000210304_100000211822 [1,0,0,0,0,0|2,0,0]=3 676 B9R0.50 COC(COCCO)OC 34a_100011216393_100000211926 [1,0,0,0,0,0|2,0,0]=3 677 B9R0.50 COC(COCSC)OC 34a_100011216393_100011218213 [1,0,0,0,0,0|2,0,0]=3 678 B9R0.50 COC(CSCC#N)OC 62a_100000751394_100011215382 [1,0,0,0,0,0|2,0,1]=4 679 B9R0.50 COC(CSCC#N)OC 62a_100011215382_100000751394 [1,0,0,0,0,0|2,0,1]=4 680 B9R0.50 COC(CSCC=O)OC 62a_100000751394_200015260668 [1,0,0,0,0,0|2,0,1]=4 681 B9R0.50 COC(CSCC=O)OC 62a_200015260668_100000751394 [1,0,0,0,0,0|2,0,1]=4 682 B9R0.50 COC(CSCCF)OC 62a_100000751394_100011217306 [1,0,0,0,0,0|2,0,0]=3 683 B9R0.50 COC(CSCCF)OC 62a_100011217306_100000751394 [1,0,0,0,0,0|2,0,0]=3 684 B9R0.50 COC(CSCCO)OC 62a_100000211926_100000751394 [1,0,0,0,0,0|2,0,0]=3 685 B9R0.50 COC(CSCCO)OC 62a_100000751394_100000211926 [1,0,0,0,0,0|2,0,0]=3 686 B9R0.50 COC(CSCSC)OC 62a_100000751394_100011218213 [1,0,0,0,0,0|2,0,0]=3 687 B9R0.50 COC(CSCSC)OC 62a_100011218213_100000751394 [1,0,0,0,0,0|2,0,0]=3 688 B9R0.50 COCCCC(OC)OC 34a_100138415774_100000069011 [1,0,0,0,0,0|1,0,0]=2 689 B9R0.50 COCSCC(OC)OC 62a_100000751394_100000766300 [1,0,0,0,0,0|2,0,0]=3 690 B9R0.50 COCSCC(OC)OC 62a_100000766300_100000751394 [1,0,0,0,0,0|2,0,0]=3 691 B11R0.9 C#CCC(=O)CCC(OC)OC 1458a_100011220946_100000139399 [0,1,0,0,0,0|0,0,3]=4 692 B11R0.9 C#CCC(=O)CCC(OC)OC 1458a_200000082759_100000184674 [0,1,0,0,0,0|0,0,3]=4 693 B11R0.9 C#CCC(C)OCC(OC)OC 34a_100000685586_100000211822 [0,1,0,0,0,0|1,0,2]=4 694 B11R0.9 C#CCC(C)OCC(OC)OC 7a_100000685586_100000751394 [0,1,0,0,0,0|1,0,2]=4 695 B11R0.9 C#CCN(C)CCC(OC)OC 2230a_100000225692_100009813347 [0,1,0,0,0,0|1,0,2]=4 696 B11R0.9 C#CCN(C)CCC(OC)OC 34a_100000225692_100000139399 [0,1,0,0,0,0|1,0,2]=4 697 B11R0.9 C/C=C/C(C)OCC(OC)OC 34a_200102604097_100000211822 [0,1,0,0,0,0|1,0,2]=4 698 B11R0.9 C=CCC(=O)CCC(OC)OC 1458a_100000210193_100000139399 [0,1,0,0,0,0|0,0,3]=4 699 B11R0.9 C=CCC(=O)CCC(OC)OC 1458a_200000082759_100000210623 [0,1,0,0,0,0|0,0,3]=4 700 B11R0.9 C=CCN(C)CCC(OC)OC 2230a_100000225617_100009813347 [0,1,0,0,0,0|1,0,2]=4 701 B11R0.9 C=CCN(C)CCC(OC)OC 269982a_100000225617_100000139399 [0,1,0,0,0,0|1,0,2]=4 702 B11R0.9 C=CC[C@@H](C)OCC(OC)OC 34a_100000731007_100000211822 [0,1,0,0,0,0|1,0,2]=4 703 B11R0.9 C=CC[C@@H](C)OCC(OC)OC 7a_100000731007_100000751394 [0,1,0,0,0,0|1,0,2]=4 704 B11R0.9 CC#CC(=O)CCC(OC)OC 1458a_100000763181_100000139399 [0,1,0,0,0,0|0,0,3]=4 705 B11R0.9 CC#CC(C)OCC(OC)OC 34a_100011216543_100000211822 [0,1,0,0,0,0|1,0,2]=4 706 B11R0.9 CC=CC(=O)CCC(OC)OC 1458a_100000210699_100000139399 [0,1,0,0,0,0|0,0,3]=4 707 B11R0.9 CCC(CNC(C)COC)OC 270004a_100000731041_100000749346 [0,1,0,0,0,0|3,0,0]=4 708 B11R0.9 CCC(CNC(C)CSC)OC 270004a_100000731041_100011216314 [0,1,0,0,0,0|3,0,0]=4 709 B11R0.9 CCC(COC(C)CCO)OC 34a_100011934954_100009893172 [0,1,0,0,0,0|3,0,0]=4 710 B11R0.9 CCC(COC(C)CCO)OC 7a_100011934954_100009893172 [0,1,0,0,0,0|3,0,0]=4 711 B11R0.9 CCC(COC(C)COC)OC 34a_100011934954_100000765312 [0,1,0,0,0,0|3,0,0]=4 712 B11R0.9 CCC(COC(C)COC)OC 7a_100011934954_100000765312 [0,1,0,0,0,0|3,0,0]=4 713 B11R0.9 CCCC(=O)CCC(OC)OC 1458a_100000211992_100000139399 [0,1,0,0,0,0|0,0,1]=2 714 B11R0.9 CCCC(=O)CCC(OC)OC 1458a_200000082759_100000210303 [0,1,0,0,0,0|0,0,1]=2 715 B11R0.9 CCCC(=O)NCC(CC)OC 11a_100000731041_100000211992 [0,1,0,0,0,0|2,0,1]=4 716 B11R0.9 CCCC(=O)NCC(CC)OC 1626a_100000731041_100000211992 [0,1,0,0,0,0|2,0,1]=4 717 B11R0.9 CCCC(=O)NCC(CC)OC 240690a_100000731041_100000211992 [0,1,0,0,0,0|2,0,1]=4 718 B11R0.9 CCCC(=O)NCC(CC)OC 527a_100000731041_100000211992 [0,1,0,0,0,0|2,0,1]=4 719 B11R0.9 CCCC(=O)NCC(OC)OC 11a_100000210479_100000211992 [0,1,0,0,0,0|1,0,1]=3 720 B11R0.9 CCCC(=O)NCC(OC)OC 1626a_100000210479_100000211992 [0,1,0,0,0,0|1,0,1]=3 721 B11R0.9 CCCC(=O)NCC(OC)OC 240690a_100000210479_100000211992 [0,1,0,0,0,0|1,0,1]=3 722 B11R0.9 CCCC(=O)NCC(OC)OC 527a_100000210479_100000211992 [0,1,0,0,0,0|1,0,1]=3 723 B11R0.9 CCCC(C)CNC(CC)CC 2230a_100000199018_100011216630 [0,1,0,0,0,0|3,0,0]=4 724 B11R0.9 CCCC(C)CNC(CC)CC 270004a_100000199018_100000243154 [0,1,0,0,0,0|3,0,0]=4 725 B11R0.9 CCCC(C)COC(CC)CC 7a_100000688023_100000210505 [0,1,0,0,0,0|3,0,0]=4 726 B11R0.9 CCCC(C)COC(CC)CC 7a_100000688536_100011216630 [0,1,0,0,0,0|3,0,0]=4 727 B11R0.9 CCCC(C)CSC(CC)CC 62a_100000210505_100011216630 [0,1,0,0,0,0|3,0,0]=4 728 B11R0.9 CCCC(C)CSC(CC)CC 62a_100011216630_100000210505 [0,1,0,0,0,0|3,0,0]=4 729 B11R0.9 CCCC(C)NCC(CC)CC 2230a_100000741246_100011215472 [0,1,0,0,0,0|3,0,0]=4 730 B11R0.9 CCCC(C)NCC(CC)CC 2230a_100102946423_100000766640 [0,1,0,0,0,0|3,0,0]=4 731 B11R0.9 CCCC(C)NCC(CC)CC 269862a_100000741246_100000211137 [0,1,0,0,0,0|3,0,0]=4 732 B11R0.9 CCCC(C)NCC(CC)CC 270004a_100000741246_100000211137 [0,1,0,0,0,0|3,0,0]=4 733 B11R0.9 CCCC(C)NCC(CC)CC 270004a_100102946423_100000211909 [0,1,0,0,0,0|3,0,0]=4 734 B11R0.9 CCCC(C)NCC(CC)OC 270004a_100000731041_100000211909 [0,1,0,0,0,0|2,0,0]=3 735 B11R0.9 CCCC(C)NCC(OC)OC 2230a_100000741246_100000751394 [0,1,0,0,0,0|1,0,0]=2 736 B11R0.9 CCCC(C)NCC(OC)OC 270004a_100000210479_100000211909 [0,1,0,0,0,0|1,0,0]=2 737 B11R0.9 CCCC(C)NCC(OC)OC 270004a_100000741246_100000752162 [0,1,0,0,0,0|1,0,0]=2 738 B11R0.9 CCCC(C)OCC(CC)CC 34a_100000764384_100011215472 [0,1,0,0,0,0|3,0,0]=4 739 B11R0.9 CCCC(C)OCC(CC)CC 7a_100000703878_100000766640 [0,1,0,0,0,0|3,0,0]=4 740 B11R0.9 CCCC(C)OCC(CC)CC 7a_100000764384_100011215472 [0,1,0,0,0,0|3,0,0]=4 741 B11R0.9 CCCC(C)OCC(CC)OC 34a_100011934954_100000766640 [0,1,0,0,0,0|2,0,0]=3 742 B11R0.9 CCCC(C)OCC(CC)OC 7a_100011934954_100000766640 [0,1,0,0,0,0|2,0,0]=3 743 B11R0.9 CCCC(C)OCC(OC)OC 34a_100000764384_100000211822 [0,1,0,0,0,0|1,0,0]=2 744 B11R0.9 CCCC(C)OCC(OC)OC 34a_100011216393_100000766640 [0,1,0,0,0,0|1,0,0]=2 745 B11R0.9 CCCC(C)OCC(OC)OC 7a_100000764384_100000751394 [0,1,0,0,0,0|1,0,0]=2 746 B11R0.9 CCCC(C)SCC(CC)CC 62a_100000766640_100011215472 [0,1,0,0,0,0|3,0,0]=4 747 B11R0.9 CCCC(C)SCC(CC)CC 62a_100011215472_100000766640 [0,1,0,0,0,0|3,0,0]=4 748 B11R0.9 CCCC(C)SCC(OC)OC 62a_100000751394_100000766640 [0,1,0,0,0,0|1,0,0]=2 749 B11R0.9 CCCC(C)SCC(OC)OC 62a_100000766640_100000751394 [0,1,0,0,0,0|1,0,0]=2 750 B11R0.9 CCCN(C)CCC(OC)OC 2230a_100000747261_100009813347 [0,1,0,0,0,0|1,0,0]=2 751 B11R0.9 CCCN(C)CCC(OC)OC 269982a_100000747261_100000139399 [0,1,0,0,0,0|1,0,0]=2 752 B11R0.9 CCNC(=O)CCC(OC)OC 11a_100015525214_200000082759 [0,1,0,0,0,0|1,0,1]=3 753 B11R0.9 CCNC(=O)CCC(OC)OC 240690a_100015525214_200000082759 [0,1,0,0,0,0|1,0,1]=3 754 B11R0.9 CCNC(=O)CCC(OC)OC 527a_100015525214_200000082759 [0,1,0,0,0,0|1,0,1]=3 755 B11R0.9 CCNC(=O)NCC(OC)OC 2708a_100000210479_100015525214 [0,1,0,0,0,0|2,0,1]=4 756 B11R0.9 CCNC(=O)NCC(OC)OC 273464a_100000210479_100015525214 [0,1,0,0,0,0|2,0,1]=4 757 B11R0.9 CCNC(=O)NCC(OC)OC 273464a_100015525214_100000210479 [0,1,0,0,0,0|2,0,1]=4 758 B11R0.9 CCNC(=O)NCC(OC)OC 512a_100000210479_100015525214 [0,1,0,0,0,0|2,0,1]=4 759 B11R0.9 CCNC(=O)NCC(OC)OC 512a_100015525214_100000210479 [0,1,0,0,0,0|2,0,1]=4 760 B11R0.9 CNNC(=O)CCC(OC)OC 22a_100016993582_200000082759 [0,1,0,0,0,0|2,0,1]=4 761 B11R0.9 COC(CCC(=O)CC#N)OC 1458a_100051588842_100000139399 [0,1,0,0,0,0|1,0,2]=4 762 B11R0.9 COC(CCC(=O)CC#N)OC 1458a_200000082759_100011214920 [0,1,0,0,0,0|1,0,2]=4 763 B11R0.9 COC(CCC(=O)CCF)OC 1458a_200000082759_100011217306 [0,1,0,0,0,0|1,0,1]=3 764 B11R0.9 COC(CCC(=O)CCO)OC 1458a_100011216618_100000139399 [0,1,0,0,0,0|1,0,1]=3 765 B11R0.9 COC(CCC(=O)CCO)OC 1458a_200000082759_100000211926 [0,1,0,0,0,0|1,0,1]=3 766 B11R0.9 COC(CCC(=O)CSC)OC 1458a_100000184570_100000139399 [0,1,0,0,0,0|1,0,1]=3 767 B11R0.9 COC(CCN(C)CC#N)OC 2230a_100000748184_100009813347 [0,1,0,0,0,0|2,0,1]=4 768 B11R0.9 COC(CCN(C)CCO)OC 2230a_100000210263_100009813347 [0,1,0,0,0,0|2,0,0]=3 769 B11R0.9 COC(CCN(C)CCO)OC 269982a_100000210263_100000139399 [0,1,0,0,0,0|2,0,0]=3 770 B11R0.9 COC(CNC(=O)CCO)OC 240690a_100000210479_100011216618 [0,1,0,0,0,0|2,0,1]=4 771 B11R0.9 COC(CNC(=O)CSC)OC 11a_100000210479_100000184570 [0,1,0,0,0,0|2,0,1]=4 772 B11R0.9 COC(CNC(=O)CSC)OC 1626a_100000210479_100000184570 [0,1,0,0,0,0|2,0,1]=4 773 B11R0.9 COC(CNC(=O)CSC)OC 240690a_100000210479_100000184570 [0,1,0,0,0,0|2,0,1]=4 774 B11R0.9 COC(CNC(=O)CSC)OC 527a_100000210479_100000184570 [0,1,0,0,0,0|2,0,1]=4 775 B11R0.9 COC(CNC(C)CSC)OC 270004a_100000210479_100011216314 [0,1,0,0,0,0|2,0,0]=3 776 B11R0.9 COC(CN[C@@H](C)CC#N)OC 2230a_100016994482_100000751394 [0,1,0,0,0,0|2,0,1]=4 777 B11R0.9 COC(CN[C@H](C)CCO)OC 2230a_100000706166_100000751394 [0,1,0,0,0,0|2,0,0]=3 778 B11R0.9 COC(CN[C@H](C)CCO)OC 270004a_100000706166_100000752162 [0,1,0,0,0,0|2,0,0]=3 779 B11R0.9 COC(CN[C@H](C)CCO)OC 34a_100000706166_100000211822 [0,1,0,0,0,0|2,0,0]=3 780 B11R0.9 COC(COC(C)CCBr)OC 34a_100012276601_100000211822 [0,1,0,0,0,0|2,0,0]=3 781 B11R0.9 COC(COC(C)CCO)OC 34a_100011216393_100009893172 [0,1,0,0,0,0|2,0,0]=3 782 B11R0.9 COC(CSC(C)CC#N)OC 62a_100000751394_100009813641 [0,1,0,0,0,0|2,0,1]=4 783 B11R0.9 COC(CSC(C)CC#N)OC 62a_100009813641_100000751394 [0,1,0,0,0,0|2,0,1]=4 784 B11R0.9 COC(CSC(C)CCO)OC 62a_100000751394_100009893172 [0,1,0,0,0,0|2,0,0]=3 785 B11R0.9 COC(CSC(C)CCO)OC 62a_100009893172_100000751394 [0,1,0,0,0,0|2,0,0]=3 786 B11R0.9 COCC(=O)CCC(OC)OC 1458a_100000210968_100000139399 [0,1,0,0,0,0|1,0,1]=3 787 B11R0.9 COCC(=O)NCC(OC)OC 11a_100000210479_100000210968 [0,1,0,0,0,0|2,0,1]=4 788 B11R0.9 COCC(=O)NCC(OC)OC 1626a_100000210479_100000210968 [0,1,0,0,0,0|2,0,1]=4 789 B11R0.9 COCC(=O)NCC(OC)OC 240690a_100000210479_100000210968 [0,1,0,0,0,0|2,0,1]=4 790 B11R0.9 COCC(=O)NCC(OC)OC 527a_100000210479_100000210968 [0,1,0,0,0,0|2,0,1]=4 791 B11R0.9 COCC(C)NCC(OC)OC 270004a_100000210479_100000749346 [0,1,0,0,0,0|2,0,0]=3 792 B11R0.9 COCC(C)OCC(OC)OC 34a_100011216393_100000765312 [0,1,0,0,0,0|2,0,0]=3 793 B11R0.9 COCC(C)SCC(OC)OC 62a_100000751394_100000765312 [0,1,0,0,0,0|2,0,0]=3 794 B11R0.9 COCC(C)SCC(OC)OC 62a_100000765312_100000751394 [0,1,0,0,0,0|2,0,0]=3 795 B11R0.9 COC[C@@H](C)NCC(OC)OC 2230a_100000764878_100000751394 [0,1,0,0,0,0|2,0,0]=3 796 B11R0.9 COC[C@@H](C)NCC(OC)OC 270004a_100000764878_100000752162 [0,1,0,0,0,0|2,0,0]=3 797 B11R0.9 COC[C@@H](C)OCC(OC)OC 34a_100011934205_100000211822 [0,1,0,0,0,0|2,0,0]=3 798 B11R0.22 C=C(Br)CCOCC(OC)OC 34a_100009813270_100000211822 [0,1,0,0,0,0|1,0,2]=4 799 B11R0.22 C=C(C)CCOCC(CC)OC 34a_100011934954_100000730704 [0,1,0,0,0,0|2,0,1]=4 800 B11R0.22 C=C(C)CCOCC(CC)OC 7a_100011934954_100000730704 [0,1,0,0,0,0|2,0,1]=4 801 B11R0.22 C=C(C)CCOCC(OC)OC 34a_100000764851_100000211822 [0,1,0,0,0,0|1,0,1]=3 802 B11R0.22 C=C(C)CCOCC(OC)OC 34a_100011216393_100000730704 [0,1,0,0,0,0|1,0,1]=3 803 B11R0.22 C=C(C)CCSCC(OC)OC 62a_100000730704_100000751394 [0,1,0,0,0,0|1,0,1]=3 804 B11R0.22 C=C(C)CCSCC(OC)OC 62a_100000751394_100000730704 [0,1,0,0,0,0|1,0,1]=3 805 B11R0.22 C=C(C)COCCC(OC)OC 34a_100000210245_100000139399 [0,1,0,0,0,0|1,0,1]=3 806 B11R0.22 C=C(C)CSCCC(OC)OC 62a_100000139399_100000211660 [0,1,0,0,0,0|1,0,1]=3 807 B11R0.22 C=C(C)CSCCC(OC)OC 62a_100000748629_100000139399 [0,1,0,0,0,0|1,0,1]=3 808 B11R0.22 C=C(F)COCCC(OC)OC 34a_200010262243_100000139399 [0,1,0,0,0,0|1,0,2]=4 809 B11R0.22 C=C(F)CSCCC(OC)OC 62a_100000042424_100000139399 [0,1,0,0,0,0|1,0,2]=4 810 B11R0.22 C=C(F)CSCCC(OC)OC 62a_100000139399_100000042424 [0,1,0,0,0,0|1,0,2]=4 811 B11R0.22 CCC(CC)CNCCC(C)C 2230a_100102946423_100000210312 [0,1,0,0,0,0|3,0,0]=4 812 B11R0.22 CCC(CC)CNCCC(C)C 269862a_100000210545_100000211137 [0,1,0,0,0,0|3,0,0]=4 813 B11R0.22 CCC(CC)CNCCC(C)C 269862a_100102946423_100000185833 [0,1,0,0,0,0|3,0,0]=4 814 B11R0.22 CCC(CC)CNCCC(C)C 270004a_100000210545_100000211137 [0,1,0,0,0,0|3,0,0]=4 815 B11R0.22 CCC(CC)CNCCC(C)O 2230a_100102946423_100012276601 [0,1,0,0,0,0|3,0,0]=4 816 B11R0.22 CCC(CC)CNCCC(C)O 2230a_200000755665_100011215472 [0,1,0,0,0,0|3,0,0]=4 817 B11R0.22 CCC(CC)CNCCC(C)O 269862a_200000755665_100000211137 [0,1,0,0,0,0|3,0,0]=4 818 B11R0.22 CCC(CC)CNCCC(C)O 270004a_200000755665_100000211137 [0,1,0,0,0,0|3,0,0]=4 819 B11R0.22 CCC(CC)COCCC(C)Br 34a_100009893172_100011215472 [0,1,0,0,0,0|3,0,0]=4 820 B11R0.22 CCC(CC)COCCC(C)C 34a_100000210254_100011215472 [0,1,0,0,0,0|3,0,0]=4 821 B11R0.22 CCC(CC)COCCC(C)C 7a_100000210254_100011215472 [0,1,0,0,0,0|3,0,0]=4 822 B11R0.22 CCC(CC)COCCC(C)C 7a_100000703878_100000210626 [0,1,0,0,0,0|3,0,0]=4 823 B11R0.22 CCC(CC)COCCC(C)O 7a_100000703878_100012276601 [0,1,0,0,0,0|3,0,0]=4 824 B11R0.22 CCC(CC)COCC[C@@H](C)N 34a_100000706166_100011215472 [0,1,0,0,0,0|3,0,0]=4 825 B11R0.22 CCC(CC)CSCCC(C)C 62a_100000210312_100011215472 [0,1,0,0,0,0|3,0,0]=4 826 B11R0.22 CCC(CC)CSCCC(C)C 62a_100011215472_100000210312 [0,1,0,0,0,0|3,0,0]=4 827 B11R0.22 CCC(CC)CSCCC(C)O 62a_100011215472_100012276601 [0,1,0,0,0,0|3,0,0]=4 828 B11R0.22 CCC(CC)CSCCC(C)O 62a_100012276601_100011215472 [0,1,0,0,0,0|3,0,0]=4 829 B11R0.22 CCC(CC)NCCCC(C)C 2230a_100000199018_100011214892 [0,1,0,0,0,0|3,0,0]=4 830 B11R0.22 CCC(CC)NCCCC(C)C 270004a_200000737386_100000210860 [0,1,0,0,0,0|3,0,0]=4 831 B11R0.22 CCC(CC)NCCCC(C)O 2230a_100000199018_200000718107 [0,1,0,0,0,0|3,0,0]=4 832 B11R0.22 CCC(CC)OCCCC(C)C 7a_100000210774_100000210505 [0,1,0,0,0,0|3,0,0]=4 833 B11R0.22 CCC(CC)OCCCC(C)C 7a_100000688536_100011214892 [0,1,0,0,0,0|3,0,0]=4 834 B11R0.22 CCC(CC)OCCCC(C)O 7a_100000688536_200000718107 [0,1,0,0,0,0|3,0,0]=4 835 B11R0.22 CCC(CC)SCCCC(C)C 62a_100000210505_100011214892 [0,1,0,0,0,0|3,0,0]=4 836 B11R0.22 CCC(CC)SCCCC(C)C 62a_100011214892_100000210505 [0,1,0,0,0,0|3,0,0]=4 837 B11R0.22 CCC(CC)SCCCC(C)O 62a_100000210505_200000718107 [0,1,0,0,0,0|3,0,0]=4 838 B11R0.22 CCC(CC)SCCCC(C)O 62a_200000718107_100000210505 [0,1,0,0,0,0|3,0,0]=4 839 B11R0.22 CCC(CNCCC(C)C)OC 269862a_100000731041_100000185833 [0,1,0,0,0,0|2,0,0]=3 840 B11R0.22 CCC(COCCC(=O)C)OC 7a_100011934954_100000053229 [0,1,0,0,0,0|2,0,1]=4 841 B11R0.22 CCC(COCCC(C)C)OC 34a_100011934954_100000210312 [0,1,0,0,0,0|2,0,0]=3 842 B11R0.22 CCC(COCCC(C)C)OC 7a_100011934954_100000210626 [0,1,0,0,0,0|2,0,0]=3 843 B11R0.22 CCC(COCCC(C)O)OC 34a_100011934954_100012276601 [0,1,0,0,0,0|2,0,0]=3 844 B11R0.22 CCC(COCCC(C)O)OC 7a_100011934954_100012276601 [0,1,0,0,0,0|2,0,0]=3 845 B11R0.22 CCC(COCCN(C)C)OC 7a_100011934954_100000755713 [0,1,0,0,0,0|3,0,0]=4 846 B11R0.22 CCC(COCOC(C)C)OC 34a_100011934954_100000709892 [0,1,0,0,0,0|3,0,0]=4 847 B11R0.22 CCN(CC)CCCCC(C)C 2230a_100000724800_100011216152 [0,1,0,0,0,0|3,0,0]=4 848 B11R0.22 CCN(CC)CCCCC(C)C 269956a_100000042499_100011216152 [0,1,0,0,0,0|3,0,0]=4 849 B11R0.22 CCN(CC)CCCCC(C)C 269982a_100000724800_100011216152 [0,1,0,0,0,0|3,0,0]=4 850 B11R0.22 COC(C=NNCC(C)O)OC 4a_200000730056_100000752162 [0,1,0,0,0,0|2,0,1]=4 851 B11R0.22 COC(CCCNC(=O)C)OC 11a_100000034021_100015343762 [0,1,0,0,0,0|1,0,1]=3 852 B11R0.22 COC(CCCNC(=O)C)OC 1626a_100000034021_100015343762 [0,1,0,0,0,0|1,0,1]=3 853 B11R0.22 COC(CCCNC(=O)C)OC 240690a_100000034021_100015343762 [0,1,0,0,0,0|1,0,1]=3 854 B11R0.22 COC(CCCNC(=O)C)OC 527a_100000034021_100103153847 [0,1,0,0,0,0|1,0,1]=3 855 B11R0.22 COC(CCCNC(C)C)OC 2230a_100138425928_100000069011 [0,1,0,0,0,0|1,0,0]=2 856 B11R0.22 COC(CCCNC(C)C)OC 34a_100138425928_100000069011 [0,1,0,0,0,0|1,0,0]=2 857 B11R0.22 COC(CCCOC(C)C)OC 34a_100000212225_100000069011 [0,1,0,0,0,0|1,0,0]=2 858 B11R0.22 COC(CCCSC(C)C)OC 62a_100000069011_100000210206 [0,1,0,0,0,0|1,0,0]=2 859 B11R0.22 COC(CCCSC(C)C)OC 62a_100000210206_100000069011 [0,1,0,0,0,0|1,0,0]=2 860 B11R0.22 COC(CCNCC(=O)N)OC 2230a_100000711301_100009813347 [0,1,0,0,0,0|2,0,1]=4 861 B11R0.22 COC(CCNCC(=O)O)OC 269956a_100016091260_100000139399 [0,1,0,0,0,0|2,0,1]=4 862 B11R0.22 COC(CCNCC(C)C)OC 2230a_100000210953_100009813347 [0,1,0,0,0,0|1,0,0]=2 863 B11R0.22 COC(CCNCC(C)C)OC 34a_100000210953_100000139399 [0,1,0,0,0,0|1,0,0]=2 864 B11R0.22 COC(CCNCC(C)O)OC 2230a_100000210904_100009813347 [0,1,0,0,0,0|1,0,0]=2 865 B11R0.22 COC(CCNCC(C)O)OC 34a_100000210904_100000139399 [0,1,0,0,0,0|1,0,0]=2 866 B11R0.22 COC(CCNCC(F)F)OC 34a_100000765723_100000139399 [0,1,0,0,0,0|2,0,0]=3 867 B11R0.22 COC(CCOCC(=O)C)OC 34a_100000211253_100000139399 [0,1,0,0,0,0|1,0,1]=3 868 B11R0.22 COC(CCOCC(C)Br)OC 34a_100012180447_100000139399 [0,1,0,0,0,0|1,0,0]=2 869 B11R0.22 COC(CCOCC(C)C)OC 34a_100000210257_100000139399 [0,1,0,0,0,0|1,0,0]=2 870 B11R0.22 COC(CCOCC(C)F)OC 34a_100015925927_100000139399 [0,1,0,0,0,0|1,0,0]=2 871 B11R0.22 COC(CCOCC(F)F)OC 34a_100000743014_100000139399 [0,1,0,0,0,0|2,0,0]=3 872 B11R0.22 COC(CCOC[C@@H](C)Cl)OC 34a_100016084084_100000139399 [0,1,0,0,0,0|1,0,0]=2 873 B11R0.22 COC(CCOC[C@@H](C)N)OC 34a_100000737577_100000139399 [0,1,0,0,0,0|1,0,0]=2 874 B11R0.22 COC(CCSCC(=O)N)OC 62a_100000139399_100000747473 [0,1,0,0,0,0|2,0,1]=4 875 B11R0.22 COC(CCSCC(=O)N)OC 62a_100000747473_100000139399 [0,1,0,0,0,0|2,0,1]=4 876 B11R0.22 COC(CCSCC(=O)[O-])OC 62a_100000139399_100020667443 [0,1,0,0,0,0|2,0,1]=4 877 B11R0.22 COC(CCSCC(=O)[O-])OC 62a_100020667443_100000139399 [0,1,0,0,0,0|2,0,1]=4 878 B11R0.22 COC(CCSCC(C)C)OC 62a_100000139399_100000210760 [0,1,0,0,0,0|1,0,0]=2 879 B11R0.22 COC(CCSCC(C)C)OC 62a_100000210624_100000139399 [0,1,0,0,0,0|1,0,0]=2 880 B11R0.22 COC(CCSCC(C)O)OC 62a_100000139399_100011218427 [0,1,0,0,0,0|1,0,0]=2 881 B11R0.22 COC(CCSCC(C)O)OC 62a_100011218427_100000139399 [0,1,0,0,0,0|1,0,0]=2 882 B11R0.22 COC(CCSCC(F)F)OC 62a_100000139399_100011934356 [0,1,0,0,0,0|2,0,0]=3 883 B11R0.22 COC(CCSCC(F)F)OC 62a_100011934356_100000139399 [0,1,0,0,0,0|2,0,0]=3 884 B11R0.22 COC(CCSC[C@@H](C)O)OC 62a_100000139399_100009817552 [0,1,0,0,0,0|1,0,0]=2 885 B11R0.22 COC(CCSC[C@@H](C)O)OC 62a_100009817552_100000139399 [0,1,0,0,0,0|1,0,0]=2 886 B11R0.22 COC(CCSC[N+](=O)[O-])OC 62a_100000139399_100000761209 [0,1,0,0,0,0|3,0,0]=4 887 B11R0.22 COC(CNCC=C(C)C)OC 270004a_100000718196_100000752162 [0,1,0,0,0,0|1,0,2]=4 888 B11R0.22 COC(CNCC=C(C)C)OC 34a_100000718196_100000211822 [0,1,0,0,0,0|1,0,2]=4 889 B11R0.22 COC(CNCCC(C)C)OC 270004a_100000210545_100000752162 [0,1,0,0,0,0|1,0,0]=2 890 B11R0.22 COC(CNCCC(C)O)OC 2230a_200000755665_100000751394 [0,1,0,0,0,0|1,0,0]=2 891 B11R0.22 COC(CNCCC(C)O)OC 270004a_200000755665_100000752162 [0,1,0,0,0,0|1,0,0]=2 892 B11R0.22 COC(CNCCN(C)C)OC 270004a_100000210585_100000752162 [0,1,0,0,0,0|2,0,0]=3 893 B11R0.22 COC(COCC=C(C)C)OC 34a_100000753907_100000211822 [0,1,0,0,0,0|1,0,2]=4 894 B11R0.22 COC(COCC=C(C)C)OC 34a_100011216393_100000761012 [0,1,0,0,0,0|1,0,2]=4 895 B11R0.22 COC(COCCC(=O)C)OC 34a_100000759926_100000211822 [0,1,0,0,0,0|1,0,1]=3 896 B11R0.22 COC(COCCC(=O)C)OC 7a_100000759926_100000751394 [0,1,0,0,0,0|1,0,1]=3 897 B11R0.22 COC(COCCC(=O)N)OC 34a_100000757172_100000211822 [0,1,0,0,0,0|2,0,1]=4 898 B11R0.22 COC(COCCC(=O)N)OC 34a_100011216393_100000731001 [0,1,0,0,0,0|2,0,1]=4 899 B11R0.22 COC(COCCC(=O)N)OC 7a_100000757172_100000751394 [0,1,0,0,0,0|2,0,1]=4 900 B11R0.22 COC(COCCC(C)Br)OC 34a_100009893172_100000211822 [0,1,0,0,0,0|1,0,0]=2 901 B11R0.22 COC(COCCC(C)C)OC 34a_100000210254_100000211822 [0,1,0,0,0,0|1,0,0]=2 902 B11R0.22 COC(COCCC(C)C)OC 34a_100011216393_100000210312 [0,1,0,0,0,0|1,0,0]=2 903 B11R0.22 COC(COCCC(C)C)OC 7a_100000210254_100000751394 [0,1,0,0,0,0|1,0,0]=2 904 B11R0.22 COC(COCCC(C)O)OC 34a_100011216393_100012276601 [0,1,0,0,0,0|1,0,0]=2 905 B11R0.22 COC(COCCC(F)F)OC 34a_100103093639_100000211822 [0,1,0,0,0,0|2,0,0]=3 906 B11R0.22 COC(COCC[C@@H](C)N)OC 34a_100000706166_100000211822 [0,1,0,0,0,0|1,0,0]=2 907 B11R0.22 COC(COCOC(=O)C)OC 34a_100011216393_100009813279 [0,1,0,0,0,0|2,0,1]=4 908 B11R0.22 COC(COCOC(C)C)OC 34a_100011216393_100000709892 [0,1,0,0,0,0|2,0,0]=3 909 B11R0.22 COC(CSCC=C(C)C)OC 62a_100000751394_100000761012 [0,1,0,0,0,0|1,0,2]=4 910 B11R0.22 COC(CSCC=C(C)C)OC 62a_100000761012_100000751394 [0,1,0,0,0,0|1,0,2]=4 911 B11R0.22 COC(CSCCC(=O)C)OC 62a_100000053229_100000751394 [0,1,0,0,0,0|1,0,1]=3 912 B11R0.22 COC(CSCCC(=O)C)OC 62a_100000751394_100000053229 [0,1,0,0,0,0|1,0,1]=3 913 B11R0.22 COC(CSCCC(=O)N)OC 62a_100000744528_100000751394 [0,1,0,0,0,0|2,0,1]=4 914 B11R0.22 COC(CSCCC(=O)N)OC 62a_100000751394_100000744528 [0,1,0,0,0,0|2,0,1]=4 915 B11R0.22 COC(CSCCC(C)C)OC 62a_100000210312_100000751394 [0,1,0,0,0,0|1,0,0]=2 916 B11R0.22 COC(CSCCC(C)C)OC 62a_100000751394_100000210312 [0,1,0,0,0,0|1,0,0]=2 917 B11R0.22 COC(CSCCC(C)O)OC 62a_100000751394_100012276601 [0,1,0,0,0,0|1,0,0]=2 918 B11R0.22 COC(CSCCC(C)O)OC 62a_100012276601_100000751394 [0,1,0,0,0,0|1,0,0]=2 919 B11R0.22 COC(CSCCN(C)C)OC 62a_100000751394_100000755713 [0,1,0,0,0,0|2,0,0]=3 920 B11R0.22 COC(CSCOC(=O)C)OC 62a_100000076356_100000751394 [0,1,0,0,0,0|2,0,1]=4 921 B11R0.22 COC(CSCOC(=O)C)OC 62a_100000751394_100000076356 [0,1,0,0,0,0|2,0,1]=4 922 B11R0.22 COC(CSCOC(C)C)OC 62a_100000709892_100000751394 [0,1,0,0,0,0|2,0,0]=3 923 B11R0.22 COC(CSCOC(C)C)OC 62a_100000751394_100000709892 [0,1,0,0,0,0|2,0,0]=3 924 B11R0.72 C#CCCC(=O)CC(OC)OC 1458a_100000082724_100000753159 [0,1,0,0,0,0|0,0,3]=4 925 B11R0.72 C#CCCC(=O)CC(OC)OC 1458a_100000692101_100000751394 [0,1,0,0,0,0|0,0,3]=4 926 B11R0.72 C#CCCN(C)CC(OC)OC 269982a_100000225562_100000730999 [0,1,0,0,0,0|1,0,2]=4 927 B11R0.72 C#CCOC(C)CC(OC)OC 7a_100011018202_100000038162 [0,1,0,0,0,0|1,0,2]=4 928 B11R0.72 C/C=C/CC(=O)CC(OC)OC 1458a_100000082724_100102629194 [0,1,0,0,0,0|0,0,3]=4 929 B11R0.72 C/C=C/CN(C)CC(OC)OC 269982a_100000225562_100102629194 [0,1,0,0,0,0|1,0,2]=4 930 B11R0.72 C=CCCC(=O)CC(OC)OC 1458a_100000082724_100000754431 [0,1,0,0,0,0|0,0,3]=4 931 B11R0.72 C=CCCC(=O)CC(OC)OC 1458a_100000749702_100000751394 [0,1,0,0,0,0|0,0,3]=4 932 B11R0.72 C=CCCN(C)CC(OC)OC 2230a_100020639649_100000751394 [0,1,0,0,0,0|1,0,2]=4 933 B11R0.72 C=CCCN(C)CC(OC)OC 269982a_100000225562_100000754431 [0,1,0,0,0,0|1,0,2]=4 934 B11R0.72 C=CCCN(C)CC(OC)OC 270004a_100020639649_100000752162 [0,1,0,0,0,0|1,0,2]=4 935 B11R0.72 C=CCNC(C)CC(OC)OC 270004a_100020586998_100000210484 [0,1,0,0,0,0|1,0,2]=4 936 B11R0.72 C=CCOC(C)CC(OC)OC 7a_100011018202_100015514636 [0,1,0,0,0,0|1,0,2]=4 937 B11R0.72 CC#CCC(=O)CC(OC)OC 1458a_100000082724_100000748600 [0,1,0,0,0,0|0,0,3]=4 938 B11R0.72 CC=CCC(=O)CC(OC)OC 1458a_100000082724_100000070051 [0,1,0,0,0,0|0,0,3]=4 939 B11R0.72 CC=CCC(=O)CC(OC)OC 1458a_100121576822_100000751394 [0,1,0,0,0,0|0,0,3]=4 940 B11R0.72 CCC#CC(=O)CC(OC)OC 1458a_100011827653_100000751394 [0,1,0,0,0,0|0,0,3]=4 941 B11R0.72 CCC=CC(=O)CC(OC)OC 1458a_100000212282_100000751394 [0,1,0,0,0,0|0,0,3]=4 942 B11R0.72 CCCCC(=O)CC(CC)CC 1458a_100000210183_100011215472 [0,1,0,0,0,0|2,0,1]=4 943 B11R0.72 CCCCC(=O)CC(OC)OC 1458a_100000082724_100000210211 [0,1,0,0,0,0|0,0,1]=2 944 B11R0.72 CCCCC(=O)CC(OC)OC 1458a_100000210183_100000751394 [0,1,0,0,0,0|0,0,1]=2 945 B11R0.72 CCCCC(C)NC(CC)CC 2230a_100000199018_200011215066 [0,1,0,0,0,0|3,0,0]=4 946 B11R0.72 CCCCC(C)NC(CC)CC 270004a_100000126638_100000210860 [0,1,0,0,0,0|3,0,0]=4 947 B11R0.72 CCCCC(C)NC(CC)CC 270004a_100000199018_100000210087 [0,1,0,0,0,0|3,0,0]=4 948 B11R0.72 CCCCC(C)OC(CC)CC 7a_100000687866_100000210505 [0,1,0,0,0,0|3,0,0]=4 949 B11R0.72 CCCCC(C)OC(CC)CC 7a_100000688536_200011215066 [0,1,0,0,0,0|3,0,0]=4 950 B11R0.72 CCCCC(C)SC(CC)CC 62a_100000210505_200011215066 [0,1,0,0,0,0|3,0,0]=4 951 B11R0.72 CCCCC(C)SC(CC)CC 62a_200011215066_100000210505 [0,1,0,0,0,0|3,0,0]=4 952 B11R0.72 CCCCN(C)CC(CC)CC 2230a_100000207549_100011215472 [0,1,0,0,0,0|3,0,0]=4 953 B11R0.72 CCCCN(C)CC(CC)CC 269982a_100000207549_100011215472 [0,1,0,0,0,0|3,0,0]=4 954 B11R0.72 CCCCN(C)CC(CC)CC 270004a_100000207549_100000211137 [0,1,0,0,0,0|3,0,0]=4 955 B11R0.72 CCCCN(C)CC(OC)OC 2230a_100000207549_100000751394 [0,1,0,0,0,0|1,0,0]=2 956 B11R0.72 CCCCN(C)CC(OC)OC 269982a_100000225562_100000210211 [0,1,0,0,0,0|1,0,0]=2 957 B11R0.72 CCCCN(C)CC(OC)OC 270004a_100000207549_100000752162 [0,1,0,0,0,0|1,0,0]=2 958 B11R0.72 CCCNC(=O)CC(OC)OC 11a_100020643023_100000082724 [0,1,0,0,0,0|1,0,1]=3 959 B11R0.72 CCCNC(=O)CC(OC)OC 1626a_100020643023_100000082724 [0,1,0,0,0,0|1,0,1]=3 960 B11R0.72 CCCNC(=O)CC(OC)OC 240690a_100020643023_100000082724 [0,1,0,0,0,0|1,0,1]=3 961 B11R0.72 CCCNC(=O)CC(OC)OC 527a_100020643023_100000082724 [0,1,0,0,0,0|1,0,1]=3 962 B11R0.72 CCCNC(C)CC(OC)OC 270004a_100020643023_100000210484 [0,1,0,0,0,0|1,0,0]=2 963 B11R0.72 CCCOC(C)CC(OC)OC 7a_100011018202_100000210303 [0,1,0,0,0,0|1,0,0]=2 964 B11R0.72 CCNN=C(C)CC(OC)OC 4a_100000756455_100000210484 [0,1,0,0,0,0|2,0,1]=4 965 B11R0.72 CCNNC(=O)CC(OC)OC 22a_100000756455_100000082724 [0,1,0,0,0,0|2,0,1]=4 966 B11R0.72 CCOCC(=O)CC(OC)OC 1458a_100000211967_100000751394 [0,1,0,0,0,0|1,0,1]=3 967 B11R0.72 CCOCN(C)CC(OC)OC 269982a_100000225562_100000739092 [0,1,0,0,0,0|2,0,0]=3 968 B11R0.72 CCSCC(=O)CC(OC)OC 1458a_100000230394_100000751394 [0,1,0,0,0,0|1,0,1]=3 969 B11R0.72 COC(CC(=O)CCC#N)OC 1458a_100000082724_100011215226 [0,1,0,0,0,0|1,0,2]=4 970 B11R0.72 COC(CC(=O)CCC#N)OC 1458a_100011934036_100000751394 [0,1,0,0,0,0|1,0,2]=4 971 B11R0.72 COC(CC(=O)CCCF)OC 1458a_100000082724_100011934791 [0,1,0,0,0,0|1,0,1]=3 972 B11R0.72 COC(CC(=O)CCCO)OC 1458a_100000082724_100011215043 [0,1,0,0,0,0|1,0,1]=3 973 B11R0.72 COC(CC(=O)CCSC)OC 1458a_100000082724_100000751147 [0,1,0,0,0,0|1,0,1]=3 974 B11R0.72 COC(CC(=O)CCSC)OC 1458a_100000174002_100000751394 [0,1,0,0,0,0|1,0,1]=3 975 B11R0.72 COC(CC(=O)NCCF)OC 11a_100000724931_100000082724 [0,1,0,0,0,0|2,0,1]=4 976 B11R0.72 COC(CC(=O)NCCF)OC 1626a_100000724931_100000082724 [0,1,0,0,0,0|2,0,1]=4 977 B11R0.72 COC(CC(=O)NCCF)OC 240690a_100000724931_100000082724 [0,1,0,0,0,0|2,0,1]=4 978 B11R0.72 COC(CC(=O)NCCF)OC 527a_100000724931_100000082724 [0,1,0,0,0,0|2,0,1]=4 979 B11R0.72 COC(CC(=O)NCCO)OC 240690a_100000210304_100000082724 [0,1,0,0,0,0|2,0,1]=4 980 B11R0.72 COC(CC(=O)NCCO)OC 527a_100000210304_100000082724 [0,1,0,0,0,0|2,0,1]=4 981 B11R0.72 COC(CC(C)NCCO)OC 270004a_100000210304_100000210484 [0,1,0,0,0,0|2,0,0]=3 982 B11R0.72 COC(CC(C)OCC#N)OC 7a_100011018202_100011215382 [0,1,0,0,0,0|2,0,1]=4 983 B11R0.72 COC(CC(C)OCC=O)OC 7a_100011018202_200015260668 [0,1,0,0,0,0|2,0,1]=4 984 B11R0.72 COC(CC(C)OCCF)OC 7a_100011018202_100011217306 [0,1,0,0,0,0|2,0,0]=3 985 B11R0.72 COC(CC(C)OCCO)OC 7a_100011018202_100000211926 [0,1,0,0,0,0|2,0,0]=3 986 B11R0.72 COC(CN(C)CCC#N)OC 2230a_100000184479_100000751394 [0,1,0,0,0,0|2,0,1]=4 987 B11R0.72 COC(CN(C)CCC#N)OC 269982a_100000225562_100011215226 [0,1,0,0,0,0|2,0,1]=4 988 B11R0.72 COC(CN(C)CCC#N)OC 270004a_100000184479_100000752162 [0,1,0,0,0,0|2,0,1]=4 989 B11R0.72 COC(CN(C)CCCF)OC 269982a_100000225562_100011934791 [0,1,0,0,0,0|2,0,0]=3 990 B11R0.72 COC(CN(C)CCCO)OC 2230a_100000213112_100000751394 [0,1,0,0,0,0|2,0,0]=3 991 B11R0.72 COC(CN(C)CCCO)OC 269982a_100000225562_100011215043 [0,1,0,0,0,0|2,0,0]=3 992 B11R0.72 COC(CN(C)CCCO)OC 270004a_100000213112_100000752162 [0,1,0,0,0,0|2,0,0]=3 993 B11R0.72 COC(CN(C)CCSC)OC 2230a_100000686725_100000751394 [0,1,0,0,0,0|2,0,0]=3 994 B11R0.72 COC(CN(C)CCSC)OC 269982a_100000225562_100000212216 [0,1,0,0,0,0|2,0,0]=3 995 B11R0.72 COC(CN(C)CCSC)OC 270004a_100000686725_100000752162 [0,1,0,0,0,0|2,0,0]=3 996 B11R0.72 COCCC(=O)CC(OC)OC 1458a_100000082724_100000233755 [0,1,0,0,0,0|1,0,1]=3 997 B11R0.72 COCCC(=O)CC(OC)OC 1458a_100000749529_100000751394 [0,1,0,0,0,0|1,0,1]=3 998 B11R0.72 COCCN(C)CC(OC)OC 2230a_100000743101_100000751394 [0,1,0,0,0,0|2,0,0]=3 999 B11R0.72 COCCN(C)CC(OC)OC 269982a_100000225562_100000233755 [0,1,0,0,0,0|2,0,0]=3 1000 B11R0.72 COCCN(C)CC(OC)OC 270004a_100000743101_100000752162 [0,1,0,0,0,0|2,0,0]=3 1001 B11R0.76 CCCCCCC(CC)N(C)C 270004a_100102631434_100011219640 [0,1,0,0,0,0|2,0,0]=3 1002 B11R0.76 CCCCCCN(CC)C(C)C 2230a_100000223864_100000210314 [0,1,0,0,0,0|3,0,0]=4 1003 B11R0.76 CCCCCCN(CC)C(C)C 269982a_100000223864_100000210757 [0,1,0,0,0,0|3,0,0]=4 1004 B11R0.76 CCCCCNC(CC)C(C)C 270004a_100000209983_100000210600 [0,1,0,0,0,0|3,0,0]=4 1005 B11R0.76 CCCCCN[C@@H](CC)[C@@H](C)O 2230a_100161114882_100000210326 [0,1,0,0,0,0|3,0,0]=4 1006 B11R0.76 CCCCCN[C@@H](CC)[C@@H](C)O 34a_100161114882_100000718602 [0,1,0,0,0,0|3,0,0]=4 1007 B11R0.76 CCCCCOC(CC)C(C)C 34a_100011218073_100000718602 [0,1,0,0,0,0|3,0,0]=4 1008 B11R0.76 CCCCCOC(CC)C(C)C 7a_100011218073_100000210326 [0,1,0,0,0,0|3,0,0]=4 1009 B11R0.76 CCCCNCC(CC)C(C)C 269862a_100000102301_100011214906 [0,1,0,0,0,0|3,0,0]=4 1010 B11R0.76 CCCCOCC(CC)C(C)C 34a_100011995916_100000210210 [0,1,0,0,0,0|3,0,0]=4 1011 B11R0.76 CCCCOCC(CC)C(C)C 7a_100011995916_100000210211 [0,1,0,0,0,0|3,0,0]=4 1012 B11R0.124 C#CC(CC)OCCCCCC 34a_100000758843_100000210314 [0,1,0,0,0,0|2,0,1]=4 1013 B11R0.124 C#CC(CC)OCCCCCC 7a_100000758843_100000210314 [0,1,0,0,0,0|2,0,1]=4 1014 B11R0.124 C#CCCCNCC(OC)OC 270004a_100000718082_100000752162 [0,1,0,0,0,0|0,0,2]=3 1015 B11R0.124 C#CCCCNCC(OC)OC 34a_100000718082_100000211822 [0,1,0,0,0,0|0,0,2]=3 1016 B11R0.124 C#CCCCOCC(CC)OC 34a_100011934954_100000695029 [0,1,0,0,0,0|1,0,2]=4 1017 B11R0.124 C#CCCCOCC(CC)OC 7a_100011934954_100011215417 [0,1,0,0,0,0|1,0,2]=4 1018 B11R0.124 C#CCCCOCC(OC)OC 34a_100000215630_100000211822 [0,1,0,0,0,0|0,0,2]=3 1019 B11R0.124 C#CCCCOCC(OC)OC 34a_100011216393_100000695029 [0,1,0,0,0,0|0,0,2]=3 1020 B11R0.124 C#CCCCOCC(OC)OC 7a_100000215630_100000751394 [0,1,0,0,0,0|0,0,2]=3 1021 B11R0.124 C#CCCCSCC(OC)OC 62a_100000751394_100011215417 [0,1,0,0,0,0|0,0,2]=3 1022 B11R0.124 C#CCCCSCC(OC)OC 62a_100011215417_100000751394 [0,1,0,0,0,0|0,0,2]=3 1023 B11R0.124 C#CCCNCCC(OC)OC 34a_100000755551_100000139399 [0,1,0,0,0,0|0,0,2]=3 1024 B11R0.124 C#CCCOCCC(OC)OC 34a_100011215631_100000139399 [0,1,0,0,0,0|0,0,2]=3 1025 B11R0.124 C#CCCSCCC(OC)OC 62a_100000139399_100000688953 [0,1,0,0,0,0|0,0,2]=3 1026 B11R0.124 C#CCCSCCC(OC)OC 62a_100000688953_100000139399 [0,1,0,0,0,0|0,0,2]=3 1027 B11R0.124 C#CCNCCCC(OC)OC 34a_100000212058_100000069011 [0,1,0,0,0,0|0,0,2]=3 1028 B11R0.124 C#CCOCCCC(OC)OC 34a_100000210247_100000069011 [0,1,0,0,0,0|0,0,2]=3 1029 B11R0.124 C#CCSCCCC(OC)OC 62a_100000038162_100000069011 [0,1,0,0,0,0|0,0,2]=3 1030 B11R0.124 C/C=C/CCOCC(OC)OC 34a_100016278192_100000211822 [0,1,0,0,0,0|0,0,2]=3 1031 B11R0.124 C/C=C/COCCC(OC)OC 34a_100016270725_100000139399 [0,1,0,0,0,0|0,0,2]=3 1032 B11R0.124 C/C=C/CSCCC(OC)OC 62a_100000139399_100102629194 [0,1,0,0,0,0|0,0,2]=3 1033 B11R0.124 C/C=C/CSCCC(OC)OC 62a_100102629194_100000139399 [0,1,0,0,0,0|0,0,2]=3 1034 B11R0.124 C=CC(CC)OCCCCCC 34a_100000766422_100000210314 [0,1,0,0,0,0|2,0,1]=4 1035 B11R0.124 C=CC(CC)OCCCCCC 7a_100000766422_100000210314 [0,1,0,0,0,0|2,0,1]=4 1036 B11R0.124 C=CC(CCCCCCC)OC 34a_200011934235_200000210301 [0,1,0,0,0,0|1,0,1]=3 1037 B11R0.124 C=CC(CCCCCCC)OC 7a_200011934235_200000210301 [0,1,0,0,0,0|1,0,1]=3 1038 B11R0.124 C=CC(CCCCCCC)O[13CH3] 34a_200011934235_200025704644 [0,1,0,0,0,0|1,0,1]=3 1039 B11R0.124 C=CC(CCCCCCC)O[13CH3] 7a_200011934235_200025704644 [0,1,0,0,0,0|1,0,1]=3 1040 B11R0.124 C=CCCCNCC(OC)OC 2230a_100000700776_100000751394 [0,1,0,0,0,0|0,0,2]=3 1041 B11R0.124 C=CCCCNCC(OC)OC 270004a_100000700776_100000752162 [0,1,0,0,0,0|0,0,2]=3 1042 B11R0.124 C=CCCCNCC(OC)OC 34a_100000700776_100000211822 [0,1,0,0,0,0|0,0,2]=3 1043 B11R0.124 C=CCCCOCC(CC)OC 34a_100011934954_100000757094 [0,1,0,0,0,0|1,0,2]=4 1044 B11R0.124 C=CCCCOCC(CC)OC 7a_100011934954_100000757094 [0,1,0,0,0,0|1,0,2]=4 1045 B11R0.124 C=CCCCOCC(OC)OC 34a_100000758997_100000211822 [0,1,0,0,0,0|0,0,2]=3 1046 B11R0.124 C=CCCCOCC(OC)OC 34a_100011216393_100000757094 [0,1,0,0,0,0|0,0,2]=3 1047 B11R0.124 C=CCCCOCC(OC)OC 7a_100000758997_100000751394 [0,1,0,0,0,0|0,0,2]=3 1048 B11R0.124 C=CCCCSCC(OC)OC 62a_100000751394_100000757094 [0,1,0,0,0,0|0,0,2]=3 1049 B11R0.124 C=CCCCSCC(OC)OC 62a_100011713584_100000751394 [0,1,0,0,0,0|0,0,2]=3 1050 B11R0.124 C=CCCNCCC(OC)OC 2230a_100015191253_100009813347 [0,1,0,0,0,0|0,0,2]=3 1051 B11R0.124 C=CCCOCCC(OC)OC 34a_100011205117_100000139399 [0,1,0,0,0,0|0,0,2]=3 1052 B11R0.124 C=CCCSCCC(OC)OC 62a_100000139399_100000754431 [0,1,0,0,0,0|0,0,2]=3 1053 B11R0.124 C=CCCSCCC(OC)OC 62a_100000754431_100000139399 [0,1,0,0,0,0|0,0,2]=3 1054 B11R0.124 C=CCNCCCC(OC)OC 2230a_100020586998_100000069011 [0,1,0,0,0,0|0,0,2]=3 1055 B11R0.124 C=CCOCCCC(OC)OC 34a_200000210373_100000069011 [0,1,0,0,0,0|0,0,2]=3 1056 B11R0.124 C=CCSCCCC(OC)OC 62a_100000069011_100000210623 [0,1,0,0,0,0|0,0,2]=3 1057 B11R0.124 C=CCSCCCC(OC)OC 62a_100000210623_100000069011 [0,1,0,0,0,0|0,0,2]=3 1058 B11R0.124 C=COCCOCC(OC)OC 34a_100000033082_100000211822 [0,1,0,0,0,0|1,0,2]=4 1059 B11R0.124 C=COCCOCC(OC)OC 34a_100011216393_100000039644 [0,1,0,0,0,0|1,0,2]=4 1060 B11R0.124 C=COCCSCC(OC)OC 62a_100000039644_100000751394 [0,1,0,0,0,0|1,0,2]=4 1061 B11R0.124 C=COCCSCC(OC)OC 62a_100000751394_100000039644 [0,1,0,0,0,0|1,0,2]=4 1062 B11R0.124 CC#CCCOCC(OC)OC 34a_100000750427_100000211822 [0,1,0,0,0,0|0,0,2]=3 1063 B11R0.124 CC#CCNCCC(OC)OC 2230a_100000685387_100009813347 [0,1,0,0,0,0|0,0,2]=3 1064 B11R0.124 CC#CCNCCC(OC)OC 34a_100000685387_100000139399 [0,1,0,0,0,0|0,0,2]=3 1065 B11R0.124 CC#CCOCCC(OC)OC 34a_100000761923_100000139399 [0,1,0,0,0,0|0,0,2]=3 1066 B11R0.124 CC#CCSCCC(OC)OC 62a_100000139399_100000748600 [0,1,0,0,0,0|0,0,2]=3 1067 B11R0.124 CC#CCSCCC(OC)OC 62a_100000748600_100000139399 [0,1,0,0,0,0|0,0,2]=3 1068 B11R0.124 CC/C=C\COCC(CC)OC 34a_100011934954_100103147603 [0,1,0,0,0,0|1,0,2]=4 1069 B11R0.124 CC/C=C\COCC(CC)OC 7a_100011934954_100103147603 [0,1,0,0,0,0|1,0,2]=4 1070 B11R0.124 CC/C=C\COCC(OC)OC 34a_100011216393_100103147603 [0,1,0,0,0,0|0,0,2]=3 1071 B11R0.124 CC/C=C\COCC(OC)OC 34a_100016268518_100000211822 [0,1,0,0,0,0|0,0,2]=3 1072 B11R0.124 CC/C=C\CSCC(OC)OC 62a_100000751394_100103147603 [0,1,0,0,0,0|0,0,2]=3 1073 B11R0.124 CC/C=C\CSCC(OC)OC 62a_100103147603_100000751394 [0,1,0,0,0,0|0,0,2]=3 1074 B11R0.124 CC=CCSCCC(OC)OC 62a_100000070051_100000139399 [0,1,0,0,0,0|0,0,2]=3 1075 B11R0.124 CC=CCSCCC(OC)OC 62a_100000139399_100000070051 [0,1,0,0,0,0|0,0,2]=3 1076 B11R0.124 CCC#CCOCC(CC)OC 34a_100011934954_100009813939 [0,1,0,0,0,0|1,0,2]=4 1077 B11R0.124 CCC#CCOCC(CC)OC 7a_100011934954_100009813939 [0,1,0,0,0,0|1,0,2]=4 1078 B11R0.124 CCC#CCOCC(OC)OC 34a_100000032950_100000211822 [0,1,0,0,0,0|0,0,2]=3 1079 B11R0.124 CCC#CCOCC(OC)OC 34a_100011216393_100009813939 [0,1,0,0,0,0|0,0,2]=3 1080 B11R0.124 CCC#CCSCC(OC)OC 62a_100000751394_100009813939 [0,1,0,0,0,0|0,0,2]=3 1081 B11R0.124 CCC#CCSCC(OC)OC 62a_100009813939_100000751394 [0,1,0,0,0,0|0,0,2]=3 1082 B11R0.124 CCC(CC)CNCCCCF 2230a_100102946423_100000729493 [0,1,0,0,0,0|3,0,0]=4 1083 B11R0.124 CCC(CC)CNCCCCO 2230a_100000750430_100011215472 [0,1,0,0,0,0|3,0,0]=4 1084 B11R0.124 CCC(CC)CNCCCCO 2230a_100102946423_100000210776 [0,1,0,0,0,0|3,0,0]=4 1085 B11R0.124 CCC(CC)CNCCCCO 269862a_100000750430_100000211137 [0,1,0,0,0,0|3,0,0]=4 1086 B11R0.124 CCC(CC)CNCCCCO 270004a_100000750430_100000211137 [0,1,0,0,0,0|3,0,0]=4 1087 B11R0.124 CCC(CC)CNCCCCO 34a_100000750430_100011215472 [0,1,0,0,0,0|3,0,0]=4 1088 B11R0.124 CCC(CC)CNCCCOC 2230a_100102946423_100000740836 [0,1,0,0,0,0|3,0,0]=4 1089 B11R0.124 CCC(CC)CNCCCOC 269862a_100150723488_100000211137 [0,1,0,0,0,0|3,0,0]=4 1090 B11R0.124 CCC(CC)CNCCCOC 270004a_100150723488_100000211137 [0,1,0,0,0,0|3,0,0]=4 1091 B11R0.124 CCC(CC)CNCCCOC 34a_100150723488_100011215472 [0,1,0,0,0,0|3,0,0]=4 1092 B11R0.124 CCC(CC)CNCCCSC 2230a_100000749238_100011215472 [0,1,0,0,0,0|3,0,0]=4 1093 B11R0.124 CCC(CC)CNCCCSC 269862a_100000749238_100000211137 [0,1,0,0,0,0|3,0,0]=4 1094 B11R0.124 CCC(CC)CNCCCSC 270004a_100000749238_100000211137 [0,1,0,0,0,0|3,0,0]=4 1095 B11R0.124 CCC(CC)COCCCCBr 34a_100011216708_100011215472 [0,1,0,0,0,0|3,0,0]=4 1096 B11R0.124 CCC(CC)COCCCCCl 34a_100000210776_100011215472 [0,1,0,0,0,0|3,0,0]=4 1097 B11R0.124 CCC(CC)COCCCCCl 7a_100000210776_100011215472 [0,1,0,0,0,0|3,0,0]=4 1098 B11R0.124 CCC(CC)COCCCCF 34a_100011995726_100011215472 [0,1,0,0,0,0|3,0,0]=4 1099 B11R0.124 CCC(CC)COCCCCF 7a_100000703878_100000729493 [0,1,0,0,0,0|3,0,0]=4 1100 B11R0.124 CCC(CC)COCCCCF 7a_100011995726_100011215472 [0,1,0,0,0,0|3,0,0]=4 1101 B11R0.124 CCC(CC)COCCCCI 34a_200012148704_100011215472 [0,1,0,0,0,0|3,0,0]=4 1102 B11R0.124 CCC(CC)COCCCCN 34a_100000750430_100011215472 [0,1,0,0,0,0|3,0,0]=4 1103 B11R0.124 CCC(CC)COCCCCO 7a_100000703878_100000210776 [0,1,0,0,0,0|3,0,0]=4 1104 B11R0.124 CCC(CC)COCCCNC 34a_100000213112_100011215472 [0,1,0,0,0,0|3,0,0]=4 1105 B11R0.124 CCC(CC)COCCCOC 34a_100000740835_100011215472 [0,1,0,0,0,0|3,0,0]=4 1106 B11R0.124 CCC(CC)COCCCOC 7a_100000703878_100000740836 [0,1,0,0,0,0|3,0,0]=4 1107 B11R0.124 CCC(CC)COCCCSC 34a_100000690336_100011215472 [0,1,0,0,0,0|3,0,0]=4 1108 B11R0.124 CCC(CC)COCCCSC 7a_100000690336_100011215472 [0,1,0,0,0,0|3,0,0]=4 1109 B11R0.124 CCC(CC)CSCCCCF 62a_100000729493_100011215472 [0,1,0,0,0,0|3,0,0]=4 1110 B11R0.124 CCC(CC)CSCCCCF 62a_100011215472_100000729493 [0,1,0,0,0,0|3,0,0]=4 1111 B11R0.124 CCC(CC)CSCCCCO 62a_100000210776_100011215472 [0,1,0,0,0,0|3,0,0]=4 1112 B11R0.124 CCC(CC)CSCCCCO 62a_100011215472_100000210776 [0,1,0,0,0,0|3,0,0]=4 1113 B11R0.124 CCC(CC)CSCCCOC 62a_100000709357_100011215472 [0,1,0,0,0,0|3,0,0]=4 1114 B11R0.124 CCC(CC)CSCCCOC 62a_100011215472_100000709357 [0,1,0,0,0,0|3,0,0]=4 1115 B11R0.124 CCC(CC)NCCCCCF 2230a_100000199018_100000729378 [0,1,0,0,0,0|3,0,0]=4 1116 B11R0.124 CCC(CC)NCCCCCO 2230a_100000199018_100000746330 [0,1,0,0,0,0|3,0,0]=4 1117 B11R0.124 CCC(CC)NCCCCCO 270004a_100000762737_100000210860 [0,1,0,0,0,0|3,0,0]=4 1118 B11R0.124 CCC(CC)NCCCCOC 2230a_100000199018_100000730899 [0,1,0,0,0,0|3,0,0]=4 1119 B11R0.124 CCC(CC)OCCCCCBr 7a_100000746331_100000210505 [0,1,0,0,0,0|3,0,0]=4 1120 B11R0.124 CCC(CC)OCCCCCCl 7a_100000746330_100000210505 [0,1,0,0,0,0|3,0,0]=4 1121 B11R0.124 CCC(CC)OCCCCCF 7a_100000688536_100000729378 [0,1,0,0,0,0|3,0,0]=4 1122 B11R0.124 CCC(CC)OCCCCCI 7a_200012148887_100000210505 [0,1,0,0,0,0|3,0,0]=4 1123 B11R0.124 CCC(CC)OCCCCCO 7a_100000688536_100000746330 [0,1,0,0,0,0|3,0,0]=4 1124 B11R0.124 CCC(CC)OCCCCOC 7a_100000688536_100000730899 [0,1,0,0,0,0|3,0,0]=4 1125 B11R0.124 CCC(CC)OCCCCSC 7a_100011217163_100000210505 [0,1,0,0,0,0|3,0,0]=4 1126 B11R0.124 CCC(CC)SCCCCCF 62a_100000210505_100000729378 [0,1,0,0,0,0|3,0,0]=4 1127 B11R0.124 CCC(CC)SCCCCCF 62a_100000729378_100000210505 [0,1,0,0,0,0|3,0,0]=4 1128 B11R0.124 CCC(CC)SCCCCCO 62a_100000210505_100000746330 [0,1,0,0,0,0|3,0,0]=4 1129 B11R0.124 CCC(CC)SCCCCCO 62a_100000746330_100000210505 [0,1,0,0,0,0|3,0,0]=4 1130 B11R0.124 CCC(CC)SCCCCOC 62a_100000210505_100000730899 [0,1,0,0,0,0|3,0,0]=4 1131 B11R0.124 CCC(CC)SCCCCOC 62a_100000730899_100000210505 [0,1,0,0,0,0|3,0,0]=4 1132 B11R0.124 CCC(COCCCC#N)OC 7a_100011934954_100000687738 [0,1,0,0,0,0|2,0,1]=4 1133 B11R0.124 CCC(COCCCC=O)OC 7a_100011934954_200011292268 [0,1,0,0,0,0|2,0,1]=4 1134 B11R0.124 CCC(COCCCCF)OC 34a_100011934954_100000729493 [0,1,0,0,0,0|2,0,0]=3 1135 B11R0.124 CCC(COCCCCF)OC 7a_100011934954_100000729493 [0,1,0,0,0,0|2,0,0]=3 1136 B11R0.124 CCC(COCCCCO)OC 34a_100011934954_100011216708 [0,1,0,0,0,0|2,0,0]=3 1137 B11R0.124 CCC(COCCCCO)OC 7a_100011934954_100000210776 [0,1,0,0,0,0|2,0,0]=3 1138 B11R0.124 CCC(COCCCOC)OC 34a_100011934954_100000740836 [0,1,0,0,0,0|2,0,0]=3 1139 B11R0.124 CCC(COCCCOC)OC 7a_100011934954_100000740836 [0,1,0,0,0,0|2,0,0]=3 1140 B11R0.124 CCCCCCCC(CC)NC 270004a_106832991635_200011217162 [0,1,0,0,0,0|2,0,0]=3 1141 B11R0.124 CCCCCCCC(CC)OC 34a_200011217053_200000210301 [0,1,0,0,0,0|1,0,0]=2 1142 B11R0.124 CCCCCCCC(CC)OC 7a_200011217053_200000210301 [0,1,0,0,0,0|1,0,0]=2 1143 B11R0.124 CCCCCCCC(CC)O[13CH3] 34a_200011217053_200025704644 [0,1,0,0,0,0|1,0,0]=2 1144 B11R0.124 CCCCCCCC(CC)O[13CH3] 7a_200011217053_200025704644 [0,1,0,0,0,0|1,0,0]=2 1145 B11R0.124 CCCCCCCN(CC)CC 2230a_100000228213_100000210202 [0,1,0,0,0,0|3,0,0]=4 1146 B11R0.124 CCCCCCCN(CC)CC 2230a_100000724800_100000210681 [0,1,0,0,0,0|3,0,0]=4 1147 B11R0.124 CCCCCCCN(CC)CC 269956a_100000042499_100000210614 [0,1,0,0,0,0|3,0,0]=4 1148 B11R0.124 CCCCCCCN(CC)CC 269982a_100000228213_100000204670 [0,1,0,0,0,0|3,0,0]=4 1149 B11R0.124 CCCCCCCN(CC)CC 269982a_100000724800_100000210681 [0,1,0,0,0,0|3,0,0]=4 1150 B11R0.124 CCCCCCNC(CC)CC 2230a_100000199018_100000210314 [0,1,0,0,0,0|2,0,0]=3 1151 B11R0.124 CCCCCCNC(CC)CC 270004a_100000210581_100000210860 [0,1,0,0,0,0|2,0,0]=3 1152 B11R0.124 CCCCCCN[C@@H](CC)CO 2230a_100000709445_100000210314 [0,1,0,0,0,0|3,0,0]=4 1153 B11R0.124 CCCCCCOC(CC)CC 7a_100000210259_100000210505 [0,1,0,0,0,0|2,0,0]=3 1154 B11R0.124 CCCCCCOC(CC)CC 7a_100000688536_100000210314 [0,1,0,0,0,0|2,0,0]=3 1155 B11R0.124 CCCCCCSC(CC)CC 62a_100000210314_100000210505 [0,1,0,0,0,0|2,0,0]=3 1156 B11R0.124 CCCCCCSC(CC)CC 62a_100000210505_100000210757 [0,1,0,0,0,0|2,0,0]=3 1157 B11R0.124 CCCCCNCC(CC)CC 2230a_100000209983_100011215472 [0,1,0,0,0,0|2,0,0]=3 1158 B11R0.124 CCCCCNCC(CC)CC 2230a_100102946423_100000210326 [0,1,0,0,0,0|2,0,0]=3 1159 B11R0.124 CCCCCNCC(CC)CC 269862a_100000209983_100000211137 [0,1,0,0,0,0|2,0,0]=3 1160 B11R0.124 CCCCCNCC(CC)CC 270004a_100000209983_100000211137 [0,1,0,0,0,0|2,0,0]=3 1161 B11R0.124 CCCCCNCC(OC)OC 2230a_100000209983_100000751394 [0,1,0,0,0,0|0,0,0]=1 1162 B11R0.124 CCCCCNCC(OC)OC 270004a_100000209983_100000752162 [0,1,0,0,0,0|0,0,0]=1 1163 B11R0.124 CCCCCOCC(CC)CC 34a_100000210253_100011215472 [0,1,0,0,0,0|2,0,0]=3 1164 B11R0.124 CCCCCOCC(CC)CC 7a_100000210253_100011215472 [0,1,0,0,0,0|2,0,0]=3 1165 B11R0.124 CCCCCOCC(CC)CC 7a_100000703878_100000210326 [0,1,0,0,0,0|2,0,0]=3 1166 B11R0.124 CCCCCOCC(CC)OC 34a_100011934954_100000718602 [0,1,0,0,0,0|1,0,0]=2 1167 B11R0.124 CCCCCOCC(CC)OC 7a_100011934954_100000210326 [0,1,0,0,0,0|1,0,0]=2 1168 B11R0.124 CCCCCOCC(OC)OC 34a_100000210253_100000211822 [0,1,0,0,0,0|0,0,0]=1 1169 B11R0.124 CCCCCOCC(OC)OC 34a_100011216393_100000718602 [0,1,0,0,0,0|0,0,0]=1 1170 B11R0.124 CCCCCOCC(OC)OC 7a_100000210253_100000751394 [0,1,0,0,0,0|0,0,0]=1 1171 B11R0.124 CCCCCOCN(CC)CC 7a_200015374951_100000210326 [0,1,0,0,0,0|3,0,0]=4 1172 B11R0.124 CCCCCSCC(CC)CC 62a_100000210326_100011215472 [0,1,0,0,0,0|2,0,0]=3 1173 B11R0.124 CCCCCSCC(CC)CC 62a_100011215472_100000210326 [0,1,0,0,0,0|2,0,0]=3 1174 B11R0.124 CCCCCSCC(OC)OC 62a_100000210326_100000751394 [0,1,0,0,0,0|0,0,0]=1 1175 B11R0.124 CCCCCSCC(OC)OC 62a_100000751394_100000210326 [0,1,0,0,0,0|0,0,0]=1 1176 B11R0.124 CCCCNCCC(OC)OC 2230a_100000102301_100009813347 [0,1,0,0,0,0|0,0,0]=1 1177 B11R0.124 CCCCNCCC(OC)OC 7a_106832991798_100009813347 [0,1,0,0,0,0|0,0,0]=1 1178 B11R0.124 CCCCNCCN(CC)CC 2230a_100000102301_100000700428 [0,1,0,0,0,0|3,0,0]=4 1179 B11R0.124 CCCCNCCN(CC)CC 2230a_100015382049_100000210211 [0,1,0,0,0,0|3,0,0]=4 1180 B11R0.124 CCCCNCCN(CC)CC 7a_106832991798_100000700428 [0,1,0,0,0,0|3,0,0]=4 1181 B11R0.124 CCCCNN=CC(OC)OC 4a_100025702795_100000752162 [0,1,0,0,0,0|1,0,1]=3 1182 B11R0.124 CCCCOCCC(OC)OC 34a_100000210227_100000139399 [0,1,0,0,0,0|0,0,0]=1 1183 B11R0.124 CCCCOCCC(OC)OC 7a_100000210227_100009813347 [0,1,0,0,0,0|0,0,0]=1 1184 B11R0.124 CCCCOCCN(CC)CC 2230a_100000724800_100000743108 [0,1,0,0,0,0|3,0,0]=4 1185 B11R0.124 CCCCOCCN(CC)CC 269956a_100000042499_100000743108 [0,1,0,0,0,0|3,0,0]=4 1186 B11R0.124 CCCCOCCN(CC)CC 269982a_100000724800_100000743108 [0,1,0,0,0,0|3,0,0]=4 1187 B11R0.124 CCCCOCCN(CC)CC 7a_100000210227_100000700428 [0,1,0,0,0,0|3,0,0]=4 1188 B11R0.124 CCCCOCCN(CC)CC 7a_100016990331_100000210211 [0,1,0,0,0,0|3,0,0]=4 1189 B11R0.124 CCCCOCNC(CC)CC 2230a_100000199018_100011995733 [0,1,0,0,0,0|3,0,0]=4 1190 B11R0.124 CCCCOCSC(CC)CC 62a_100000210505_100011995733 [0,1,0,0,0,0|3,0,0]=4 1191 B11R0.124 CCCCOCSC(CC)CC 62a_100011995733_100000210505 [0,1,0,0,0,0|3,0,0]=4 1192 B11R0.124 CCCCSCCC(OC)OC 62a_100000139399_100000210210 [0,1,0,0,0,0|0,0,0]=1 1193 B11R0.124 CCCCSCCC(OC)OC 62a_100000210211_100000139399 [0,1,0,0,0,0|0,0,0]=1 1194 B11R0.124 CCCCSCCN(CC)CC 62a_100000210211_100000700428 [0,1,0,0,0,0|3,0,0]=4 1195 B11R0.124 CCCOCCCC(OC)OC 34a_100000210258_100000069011 [0,1,0,0,0,0|0,0,0]=1 1196 B11R0.124 CCCOCCCN(CC)CC 7a_100000212844_100000210303 [0,1,0,0,0,0|3,0,0]=4 1197 B11R0.124 CCCOCCNC(CC)CC 2230a_100000199018_100011215938 [0,1,0,0,0,0|3,0,0]=4 1198 B11R0.124 CCCOCCNC(CC)CC 270004a_100161115042_100000210860 [0,1,0,0,0,0|3,0,0]=4 1199 B11R0.124 CCCOCCOC(CC)CC 7a_100000688536_100011215938 [0,1,0,0,0,0|3,0,0]=4 1200 B11R0.124 CCCOCCOC(CC)CC 7a_100000752267_100000210505 [0,1,0,0,0,0|3,0,0]=4 1201 B11R0.124 CCCOCCSC(CC)CC 62a_100000210505_100011215938 [0,1,0,0,0,0|3,0,0]=4 1202 B11R0.124 CCCOCCSC(CC)CC 62a_100011215938_100000210505 [0,1,0,0,0,0|3,0,0]=4 1203 B11R0.124 CCCSCCCC(OC)OC 62a_100000069011_100000210303 [0,1,0,0,0,0|0,0,0]=1 1204 B11R0.124 CCCSCCCC(OC)OC 62a_100000210303_100000069011 [0,1,0,0,0,0|0,0,0]=1 1205 B11R0.124 CCCSCCCN(CC)CC 62a_100000210303_100000709985 [0,1,0,0,0,0|3,0,0]=4 1206 B11R0.124 CCCSCCNC(CC)CC 270004a_100020603323_100000210860 [0,1,0,0,0,0|3,0,0]=4 1207 B11R0.124 CCCSCCOC(CC)CC 7a_200000230433_100000210505 [0,1,0,0,0,0|3,0,0]=4 1208 B11R0.124 CCN(CC)CCCCCCF 2230a_100000724800_100015922095 [0,1,0,0,0,0|3,0,0]=4 1209 B11R0.124 CCN(CC)CCCCCCF 269956a_100000042499_100015922095 [0,1,0,0,0,0|3,0,0]=4 1210 B11R0.124 CCN(CC)CCCCCCF 269982a_100000724800_100015922095 [0,1,0,0,0,0|3,0,0]=4 1211 B11R0.124 CCN(CC)CCCCCCO 2230a_100000724800_100000766143 [0,1,0,0,0,0|3,0,0]=4 1212 B11R0.124 CCN(CC)CCCCCCO 269956a_100000042499_100000766143 [0,1,0,0,0,0|3,0,0]=4 1213 B11R0.124 CCN(CC)CCCCCCO 269982a_100000724800_100000766143 [0,1,0,0,0,0|3,0,0]=4 1214 B11R0.124 CCN(CC)CCCCCNC 2230a_100011491781_200000210301 [0,1,0,0,0,0|3,0,0]=4 1215 B11R0.124 CCN(CC)CCCCCN[13CH3] 2230a_100011491781_200025704644 [0,1,0,0,0,0|3,0,0]=4 1216 B11R0.124 CCN(CC)CCCCCOC 7a_200011629222_200000210301 [0,1,0,0,0,0|3,0,0]=4 1217 B11R0.124 CCN(CC)CCCCCO[13CH3] 7a_200011629222_200025704644 [0,1,0,0,0,0|3,0,0]=4 1218 B11R0.124 CCNCCCCN(CC)CC 2230a_100000743895_100000210202 [0,1,0,0,0,0|3,0,0]=4 1219 B11R0.124 CCOCCCCN(CC)CC 7a_100011305530_100000210202 [0,1,0,0,0,0|3,0,0]=4 1220 B11R0.124 CCOCCCNC(CC)CC 2230a_100000199018_100012232248 [0,1,0,0,0,0|3,0,0]=4 1221 B11R0.124 CCOCCCNC(CC)CC 270004a_100000210961_100000210860 [0,1,0,0,0,0|3,0,0]=4 1222 B11R0.124 CCOCCCOC(CC)CC 7a_100000688536_100012232248 [0,1,0,0,0,0|3,0,0]=4 1223 B11R0.124 CCOCCCOC(CC)CC 7a_100000757476_100000210505 [0,1,0,0,0,0|3,0,0]=4 1224 B11R0.124 CCOCCCSC(CC)CC 62a_100000210505_100012232248 [0,1,0,0,0,0|3,0,0]=4 1225 B11R0.124 CCOCCCSC(CC)CC 62a_100012232248_100000210505 [0,1,0,0,0,0|3,0,0]=4 1226 B11R0.124 CCOCCNCC(CC)CC 2230a_100102946423_100011215890 [0,1,0,0,0,0|3,0,0]=4 1227 B11R0.124 CCOCCNCC(CC)CC 2230a_102516460346_100011215472 [0,1,0,0,0,0|3,0,0]=4 1228 B11R0.124 CCOCCNCC(CC)CC 269862a_100011200944_100000211137 [0,1,0,0,0,0|3,0,0]=4 1229 B11R0.124 CCOCCNCC(CC)CC 270004a_102516460346_100000211137 [0,1,0,0,0,0|3,0,0]=4 1230 B11R0.124 CCOCCNCC(CC)CC 34a_102516460346_100011215472 [0,1,0,0,0,0|3,0,0]=4 1231 B11R0.124 CCOCCNCC(OC)OC 2230a_102516460346_100000751394 [0,1,0,0,0,0|1,0,0]=2 1232 B11R0.124 CCOCCNCC(OC)OC 270004a_102516460346_100000752162 [0,1,0,0,0,0|1,0,0]=2 1233 B11R0.124 CCOCCNCC(OC)OC 34a_102516460346_100000211822 [0,1,0,0,0,0|1,0,0]=2 1234 B11R0.124 CCOCCOCC(CC)CC 34a_100000210136_100011215472 [0,1,0,0,0,0|3,0,0]=4 1235 B11R0.124 CCOCCOCC(CC)CC 7a_100000210136_100011215472 [0,1,0,0,0,0|3,0,0]=4 1236 B11R0.124 CCOCCOCC(CC)CC 7a_100000703878_100011215890 [0,1,0,0,0,0|3,0,0]=4 1237 B11R0.124 CCOCCOCC(CC)OC 34a_100011934954_100000210147 [0,1,0,0,0,0|2,0,0]=3 1238 B11R0.124 CCOCCOCC(CC)OC 7a_100011934954_100011215890 [0,1,0,0,0,0|2,0,0]=3 1239 B11R0.124 CCOCCOCC(OC)OC 34a_100000210136_100000211822 [0,1,0,0,0,0|1,0,0]=2 1240 B11R0.124 CCOCCOCC(OC)OC 34a_100011216393_100000210147 [0,1,0,0,0,0|1,0,0]=2 1241 B11R0.124 CCOCCOCC(OC)OC 7a_100000210136_100000751394 [0,1,0,0,0,0|1,0,0]=2 1242 B11R0.124 CCOCCSCC(CC)CC 62a_100000210147_100011215472 [0,1,0,0,0,0|3,0,0]=4 1243 B11R0.124 CCOCCSCC(CC)CC 62a_100011215472_100011215890 [0,1,0,0,0,0|3,0,0]=4 1244 B11R0.124 CCOCCSCC(OC)OC 62a_100000210147_100000751394 [0,1,0,0,0,0|1,0,0]=2 1245 B11R0.124 CCOCCSCC(OC)OC 62a_100000751394_100011215890 [0,1,0,0,0,0|1,0,0]=2 1246 B11R0.124 CCOCSCCC(OC)OC 62a_100000139399_100000739092 [0,1,0,0,0,0|1,0,0]=2 1247 B11R0.124 CCOCSCCC(OC)OC 62a_100000739092_100000139399 [0,1,0,0,0,0|1,0,0]=2 1248 B11R0.124 CCSCCCOC(CC)CC 7a_100011216438_100000210505 [0,1,0,0,0,0|3,0,0]=4 1249 B11R0.124 CCSCCNCC(CC)CC 2230a_100000106463_100011215472 [0,1,0,0,0,0|3,0,0]=4 1250 B11R0.124 CCSCCNCC(CC)CC 2230a_100102946423_100000757381 [0,1,0,0,0,0|3,0,0]=4 1251 B11R0.124 CCSCCNCC(CC)CC 269862a_100000106463_100000211137 [0,1,0,0,0,0|3,0,0]=4 1252 B11R0.124 CCSCCNCC(CC)CC 270004a_100000106463_100000211137 [0,1,0,0,0,0|3,0,0]=4 1253 B11R0.124 CCSCCNCC(OC)OC 2230a_100000106463_100000751394 [0,1,0,0,0,0|1,0,0]=2 1254 B11R0.124 CCSCCNCC(OC)OC 270004a_100000106463_100000752162 [0,1,0,0,0,0|1,0,0]=2 1255 B11R0.124 CCSCCOCC(CC)CC 34a_100000212035_100011215472 [0,1,0,0,0,0|3,0,0]=4 1256 B11R0.124 CCSCCOCC(CC)CC 7a_100000212035_100011215472 [0,1,0,0,0,0|3,0,0]=4 1257 B11R0.124 CCSCCOCC(CC)CC 7a_100000703878_100000757381 [0,1,0,0,0,0|3,0,0]=4 1258 B11R0.124 CCSCCOCC(CC)OC 34a_100011934954_100000757381 [0,1,0,0,0,0|2,0,0]=3 1259 B11R0.124 CCSCCOCC(CC)OC 7a_100011934954_100000757381 [0,1,0,0,0,0|2,0,0]=3 1260 B11R0.124 CCSCCOCC(OC)OC 34a_100000212035_100000211822 [0,1,0,0,0,0|1,0,0]=2 1261 B11R0.124 CCSCCOCC(OC)OC 34a_100011216393_100000757381 [0,1,0,0,0,0|1,0,0]=2 1262 B11R0.124 CCSCCOCC(OC)OC 7a_100000212035_100000751394 [0,1,0,0,0,0|1,0,0]=2 1263 B11R0.124 CCSCCSCC(CC)CC 62a_100000757381_100011215472 [0,1,0,0,0,0|3,0,0]=4 1264 B11R0.124 CCSCCSCC(CC)CC 62a_100011215472_100000757381 [0,1,0,0,0,0|3,0,0]=4 1265 B11R0.124 CCSCCSCC(OC)OC 62a_100000751394_100000757381 [0,1,0,0,0,0|1,0,0]=2 1266 B11R0.124 CCSCCSCC(OC)OC 62a_100000757381_100000751394 [0,1,0,0,0,0|1,0,0]=2 1267 B11R0.124 CNCCCOCC(OC)OC 34a_100000213112_100000211822 [0,1,0,0,0,0|1,0,0]=2 1268 B11R0.124 COC(CCCNCCF)OC 34a_100000724931_100000069011 [0,1,0,0,0,0|1,0,0]=2 1269 B11R0.124 COC(CCCNCCO)OC 2230a_100016997473_100000069011 [0,1,0,0,0,0|1,0,0]=2 1270 B11R0.124 COC(CCCNCCO)OC 34a_100016990907_100000069011 [0,1,0,0,0,0|1,0,0]=2 1271 B11R0.124 COC(CCCOCCBr)OC 34a_100000211926_100000069011 [0,1,0,0,0,0|1,0,0]=2 1272 B11R0.124 COC(CCCOCCN)OC 34a_100000210304_100000069011 [0,1,0,0,0,0|1,0,0]=2 1273 B11R0.124 COC(CCCSCC#N)OC 62a_100000069011_100011215382 [0,1,0,0,0,0|1,0,1]=3 1274 B11R0.124 COC(CCCSCC#N)OC 62a_100011215382_100000069011 [0,1,0,0,0,0|1,0,1]=3 1275 B11R0.124 COC(CCCSCC=O)OC 62a_100000069011_200015260668 [0,1,0,0,0,0|1,0,1]=3 1276 B11R0.124 COC(CCCSCC=O)OC 62a_200015260668_100000069011 [0,1,0,0,0,0|1,0,1]=3 1277 B11R0.124 COC(CCCSCCF)OC 62a_100000069011_100011217306 [0,1,0,0,0,0|1,0,0]=2 1278 B11R0.124 COC(CCCSCCF)OC 62a_100011217306_100000069011 [0,1,0,0,0,0|1,0,0]=2 1279 B11R0.124 COC(CCCSCCO)OC 62a_100000069011_100000211926 [0,1,0,0,0,0|1,0,0]=2 1280 B11R0.124 COC(CCCSCCO)OC 62a_100000211926_100000069011 [0,1,0,0,0,0|1,0,0]=2 1281 B11R0.124 COC(CCCSCSC)OC 62a_100000069011_100011218213 [0,1,0,0,0,0|1,0,0]=2 1282 B11R0.124 COC(CCCSCSC)OC 62a_100011218213_100000069011 [0,1,0,0,0,0|1,0,0]=2 1283 B11R0.124 COC(CCNCCCF)OC 2230a_100015189416_100009813347 [0,1,0,0,0,0|1,0,0]=2 1284 B11R0.124 COC(CCNCCCF)OC 34a_100015189416_100000139399 [0,1,0,0,0,0|1,0,0]=2 1285 B11R0.124 COC(CCNCCSC)OC 2230a_100020590264_100009813347 [0,1,0,0,0,0|1,0,0]=2 1286 B11R0.124 COC(CCOCCCBr)OC 34a_100011217188_100000139399 [0,1,0,0,0,0|1,0,0]=2 1287 B11R0.124 COC(CCOCCCCl)OC 34a_100000230001_100000139399 [0,1,0,0,0,0|1,0,0]=2 1288 B11R0.124 COC(CCOCCCF)OC 34a_100000759539_100000139399 [0,1,0,0,0,0|1,0,0]=2 1289 B11R0.124 COC(CCOCCCN)OC 34a_100000182051_100000139399 [0,1,0,0,0,0|1,0,0]=2 1290 B11R0.124 COC(CCOCCON)OC 34a_100000700252_100000139399 [0,1,0,0,0,0|2,0,0]=3 1291 B11R0.124 COC(CCOCCSC)OC 34a_100000230434_100000139399 [0,1,0,0,0,0|1,0,0]=2 1292 B11R0.124 COC(CCOCCSC)OC 7a_100000230434_100009813347 [0,1,0,0,0,0|1,0,0]=2 1293 B11R0.124 COC(CCSCCC#N)OC 62a_100000139399_100011215226 [0,1,0,0,0,0|1,0,1]=3 1294 B11R0.124 COC(CCSCCC#N)OC 62a_100011215226_100000139399 [0,1,0,0,0,0|1,0,1]=3 1295 B11R0.124 COC(CCSCCCF)OC 62a_100000139399_100011934791 [0,1,0,0,0,0|1,0,0]=2 1296 B11R0.124 COC(CCSCCCF)OC 62a_100011934791_100000139399 [0,1,0,0,0,0|1,0,0]=2 1297 B11R0.124 COC(CCSCCCO)OC 62a_100000139399_100011215043 [0,1,0,0,0,0|1,0,0]=2 1298 B11R0.124 COC(CCSCCCO)OC 62a_100011215043_100000139399 [0,1,0,0,0,0|1,0,0]=2 1299 B11R0.124 COC(CCSCCSC)OC 62a_100000139399_100000751147 [0,1,0,0,0,0|1,0,0]=2 1300 B11R0.124 COC(CCSCCSC)OC 62a_100000212216_100000139399 [0,1,0,0,0,0|1,0,0]=2 1301 B11R0.124 COC(CCSCSC#N)OC 62a_100000139399_100000211825 [0,1,0,0,0,0|2,0,1]=4 1302 B11R0.124 COC(CCSCSC#N)OC 62a_100000211825_100000139399 [0,1,0,0,0,0|2,0,1]=4 1303 B11R0.124 COC(CNCCCCO)OC 2230a_100000750430_100000751394 [0,1,0,0,0,0|1,0,0]=2 1304 B11R0.124 COC(CNCCCCO)OC 270004a_100000750430_100000752162 [0,1,0,0,0,0|1,0,0]=2 1305 B11R0.124 COC(CNCCCCO)OC 34a_100000750430_100000211822 [0,1,0,0,0,0|1,0,0]=2 1306 B11R0.124 COC(CNCCCSC)OC 2230a_100000749238_100000751394 [0,1,0,0,0,0|1,0,0]=2 1307 B11R0.124 COC(CNCCCSC)OC 270004a_100000749238_100000752162 [0,1,0,0,0,0|1,0,0]=2 1308 B11R0.124 COC(COCC#CCCl)OC 34a_200000047223_100000211822 [0,1,0,0,0,0|1,0,2]=4 1309 B11R0.124 COC(COCC#CCO)OC 34a_100011216393_200000047223 [0,1,0,0,0,0|1,0,2]=4 1310 B11R0.124 COC(COCCCCBr)OC 34a_100011216708_100000211822 [0,1,0,0,0,0|1,0,0]=2 1311 B11R0.124 COC(COCCCCCl)OC 34a_100000210776_100000211822 [0,1,0,0,0,0|1,0,0]=2 1312 B11R0.124 COC(COCCCCCl)OC 7a_100000210776_100000751394 [0,1,0,0,0,0|1,0,0]=2 1313 B11R0.124 COC(COCCCCF)OC 34a_100011216393_100000729493 [0,1,0,0,0,0|1,0,0]=2 1314 B11R0.124 COC(COCCCCF)OC 34a_100011995726_100000211822 [0,1,0,0,0,0|1,0,0]=2 1315 B11R0.124 COC(COCCCCF)OC 7a_100011995726_100000751394 [0,1,0,0,0,0|1,0,0]=2 1316 B11R0.124 COC(COCCCCI)OC 34a_200012148704_100000211822 [0,1,0,0,0,0|1,0,0]=2 1317 B11R0.124 COC(COCCCCN)OC 34a_100000750430_100000211822 [0,1,0,0,0,0|1,0,0]=2 1318 B11R0.124 COC(COCCCCO)OC 34a_100011216393_100011216708 [0,1,0,0,0,0|1,0,0]=2 1319 B11R0.124 COC(COCCCSC)OC 34a_100000690336_100000211822 [0,1,0,0,0,0|1,0,0]=2 1320 B11R0.124 COC(COCCCSC)OC 7a_100000690336_100000751394 [0,1,0,0,0,0|1,0,0]=2 1321 B11R0.124 COC(CSCC#CCO)OC 62a_100000751394_200000047223 [0,1,0,0,0,0|1,0,2]=4 1322 B11R0.124 COC(CSCC#CCO)OC 62a_200000047223_100000751394 [0,1,0,0,0,0|1,0,2]=4 1323 B11R0.124 COC(CSCCCC#N)OC 62a_100000687738_100000751394 [0,1,0,0,0,0|1,0,1]=3 1324 B11R0.124 COC(CSCCCC#N)OC 62a_100000751394_100000687738 [0,1,0,0,0,0|1,0,1]=3 1325 B11R0.124 COC(CSCCCC=O)OC 62a_100000751394_200011292268 [0,1,0,0,0,0|1,0,1]=3 1326 B11R0.124 COC(CSCCCC=O)OC 62a_200011292268_100000751394 [0,1,0,0,0,0|1,0,1]=3 1327 B11R0.124 COC(CSCCCCF)OC 62a_100000729493_100000751394 [0,1,0,0,0,0|1,0,0]=2 1328 B11R0.124 COC(CSCCCCF)OC 62a_100000751394_100000729493 [0,1,0,0,0,0|1,0,0]=2 1329 B11R0.124 COC(CSCCCCO)OC 62a_100000210776_100000751394 [0,1,0,0,0,0|1,0,0]=2 1330 B11R0.124 COC(CSCCCCO)OC 62a_100000751394_100000210776 [0,1,0,0,0,0|1,0,0]=2 1331 B11R0.124 COC(CSCCSC#N)OC 62a_100000034367_100000751394 [0,1,0,0,0,0|2,0,1]=4 1332 B11R0.124 COC(CSCCSC#N)OC 62a_100000751394_100000034367 [0,1,0,0,0,0|2,0,1]=4 1333 B11R0.124 COCCCNCC(OC)OC 270004a_100150723488_100000752162 [0,1,0,0,0,0|1,0,0]=2 1334 B11R0.124 COCCCNCC(OC)OC 34a_100150723488_100000211822 [0,1,0,0,0,0|1,0,0]=2 1335 B11R0.124 COCCCOCC(OC)OC 34a_100000740835_100000211822 [0,1,0,0,0,0|1,0,0]=2 1336 B11R0.124 COCCCOCC(OC)OC 34a_100011216393_100000740836 [0,1,0,0,0,0|1,0,0]=2 1337 B11R0.124 COCCCSCC(OC)OC 62a_100000709357_100000751394 [0,1,0,0,0,0|1,0,0]=2 1338 B11R0.124 COCCCSCC(OC)OC 62a_100000751394_100000709357 [0,1,0,0,0,0|1,0,0]=2 1339 B11R0.124 COCCNCCC(OC)OC 2230a_100000209980_100009813347 [0,1,0,0,0,0|1,0,0]=2 1340 B11R0.124 COCCOCCC(OC)OC 34a_100000210237_100000139399 [0,1,0,0,0,0|1,0,0]=2 1341 B11R0.124 COCCSCCC(OC)OC 62a_100000139399_100000233755 [0,1,0,0,0,0|1,0,0]=2 1342 B11R0.124 COCCSCCC(OC)OC 62a_100000233755_100000139399 [0,1,0,0,0,0|1,0,0]=2 1343 B11R0.124 COCSCCCC(OC)OC 62a_100000069011_100000766300 [0,1,0,0,0,0|1,0,0]=2 1344 B11R0.124 COCSCCCC(OC)OC 62a_100000766300_100000069011 [0,1,0,0,0,0|1,0,0]=2 1345 B11R0.157 C#CCCCC(=O)C(OC)OC 1458a_100000046285_100000731252 [0,1,0,0,0,0|0,0,3]=4 1346 B11R0.157 C#CCCNC(C)C(OC)OC 34a_100000755551_100011222894 [0,1,0,0,0,0|1,0,2]=4 1347 B11R0.157 C#CCCOC(C)C(OC)OC 34a_100000754440_100000688953 [0,1,0,0,0,0|1,0,2]=4 1348 B11R0.157 C#CCCOC(C)C(OC)OC 34a_100011215631_100011222894 [0,1,0,0,0,0|1,0,2]=4 1349 B11R0.157 C#CCCOC(C)C(OC)OC 7a_100000754440_100000688953 [0,1,0,0,0,0|1,0,2]=4 1350 B11R0.157 C#CCCSC(C)C(OC)OC 62a_100000688953_100011222894 [0,1,0,0,0,0|1,0,2]=4 1351 B11R0.157 C#CCCSC(C)C(OC)OC 62a_100011222894_100000688953 [0,1,0,0,0,0|1,0,2]=4 1352 B11R0.157 C/C=C/COC(C)C(OC)OC 34a_100000754440_100102629194 [0,1,0,0,0,0|1,0,2]=4 1353 B11R0.157 C/C=C/COC(C)C(OC)OC 34a_100016270725_100011222894 [0,1,0,0,0,0|1,0,2]=4 1354 B11R0.157 C/C=C/COC(C)C(OC)OC 7a_100000754440_100102629194 [0,1,0,0,0,0|1,0,2]=4 1355 B11R0.157 C/C=C/CSC(C)C(OC)OC 62a_100011222894_100102629194 [0,1,0,0,0,0|1,0,2]=4 1356 B11R0.157 C/C=C/CSC(C)C(OC)OC 62a_100102629194_100011222894 [0,1,0,0,0,0|1,0,2]=4 1357 B11R0.157 C=CCCCC(=O)C(OC)OC 1458a_100000046285_100000757094 [0,1,0,0,0,0|0,0,3]=4 1358 B11R0.157 C=CCCNC(C)C(OC)OC 270004a_100015191253_100000211384 [0,1,0,0,0,0|1,0,2]=4 1359 B11R0.157 C=CCCOC(C)C(OC)OC 34a_100000754440_100000754431 [0,1,0,0,0,0|1,0,2]=4 1360 B11R0.157 C=CCCOC(C)C(OC)OC 34a_100011205117_100011222894 [0,1,0,0,0,0|1,0,2]=4 1361 B11R0.157 C=CCCOC(C)C(OC)OC 7a_100000754440_100000754431 [0,1,0,0,0,0|1,0,2]=4 1362 B11R0.157 C=CCCSC(C)C(OC)OC 62a_100000754431_100011222894 [0,1,0,0,0,0|1,0,2]=4 1363 B11R0.157 C=CCCSC(C)C(OC)OC 62a_100011222894_100000754431 [0,1,0,0,0,0|1,0,2]=4 1364 B11R0.157 CC#CCNC(C)C(OC)OC 34a_100000685387_100011222894 [0,1,0,0,0,0|1,0,2]=4 1365 B11R0.157 CC#CCOC(C)C(OC)OC 34a_100000754440_100000748600 [0,1,0,0,0,0|1,0,2]=4 1366 B11R0.157 CC#CCOC(C)C(OC)OC 34a_100000761923_100011222894 [0,1,0,0,0,0|1,0,2]=4 1367 B11R0.157 CC#CCOC(C)C(OC)OC 7a_100000754440_100000748600 [0,1,0,0,0,0|1,0,2]=4 1368 B11R0.157 CC#CCSC(C)C(OC)OC 62a_100000748600_100011222894 [0,1,0,0,0,0|1,0,2]=4 1369 B11R0.157 CC#CCSC(C)C(OC)OC 62a_100011222894_100000748600 [0,1,0,0,0,0|1,0,2]=4 1370 B11R0.157 CC/C=C\CC(=O)C(OC)OC 1458a_100000046285_100103147603 [0,1,0,0,0,0|0,0,3]=4 1371 B11R0.157 CC=CCOC(C)C(OC)OC 34a_100000754440_100000070051 [0,1,0,0,0,0|1,0,2]=4 1372 B11R0.157 CC=CCOC(C)C(OC)OC 7a_100000754440_100000070051 [0,1,0,0,0,0|1,0,2]=4 1373 B11R0.157 CC=CCSC(C)C(OC)OC 62a_100000070051_100011222894 [0,1,0,0,0,0|1,0,2]=4 1374 B11R0.157 CC=CCSC(C)C(OC)OC 62a_100011222894_100000070051 [0,1,0,0,0,0|1,0,2]=4 1375 B11R0.157 CCC#CCC(=O)C(OC)OC 1458a_100000046285_100009813939 [0,1,0,0,0,0|0,0,3]=4 1376 B11R0.157 CCC(OC)C(=O)CCCCF 1458a_100000747056_100000729493 [0,1,0,0,0,0|2,0,1]=4 1377 B11R0.157 CCC(OC)C(=O)CCCCO 1458a_100000747056_100000210776 [0,1,0,0,0,0|2,0,1]=4 1378 B11R0.157 CCC(OC)C(=O)CCCOC 1458a_100000747056_100000740836 [0,1,0,0,0,0|2,0,1]=4 1379 B11R0.157 CCCCCC(=O)C(CC)CC 1458a_100000211163_100000210326 [0,1,0,0,0,0|2,0,1]=4 1380 B11R0.157 CCCCCC(=O)C(CC)CC 1458a_100000212188_100000210505 [0,1,0,0,0,0|2,0,1]=4 1381 B11R0.157 CCCCCC(=O)C(CC)OC 1458a_100000747056_100000210326 [0,1,0,0,0,0|1,0,1]=3 1382 B11R0.157 CCCCCC(=O)C(OC)OC 1458a_100000046285_100000210326 [0,1,0,0,0,0|0,0,1]=2 1383 B11R0.157 CCCCCC(C)N(CC)CC 2230a_100000724800_200011218191 [0,1,0,0,0,0|3,0,0]=4 1384 B11R0.157 CCCCCC(C)N(CC)CC 269956a_100000042499_200011218191 [0,1,0,0,0,0|3,0,0]=4 1385 B11R0.157 CCCCCC(C)N(CC)CC 269982a_100000724800_200011218191 [0,1,0,0,0,0|3,0,0]=4 1386 B11R0.157 CCCCCC(C)N(CC)CC 270004a_100000724800_100000211708 [0,1,0,0,0,0|3,0,0]=4 1387 B11R0.157 CCCCCN(C)C(CC)CC 2230a_100000737045_100000210326 [0,1,0,0,0,0|3,0,0]=4 1388 B11R0.157 CCCCCN(C)C(CC)CC 269982a_100000223495_100000210505 [0,1,0,0,0,0|3,0,0]=4 1389 B11R0.157 CCCCCN(C)C(CC)CC 269982a_100000737045_100000210215 [0,1,0,0,0,0|3,0,0]=4 1390 B11R0.157 CCCCCN(C)C(CC)CC 270004a_100000223495_100000210860 [0,1,0,0,0,0|3,0,0]=4 1391 B11R0.157 CCCCNC(=O)C(CC)OC 11a_100000102301_100000747056 [0,1,0,0,0,0|2,0,1]=4 1392 B11R0.157 CCCCNC(=O)C(CC)OC 1626a_100000102301_100000747056 [0,1,0,0,0,0|2,0,1]=4 1393 B11R0.157 CCCCNC(=O)C(CC)OC 240690a_100000102301_100000747056 [0,1,0,0,0,0|2,0,1]=4 1394 B11R0.157 CCCCNC(=O)C(CC)OC 527a_100000102301_100000747056 [0,1,0,0,0,0|2,0,1]=4 1395 B11R0.157 CCCCNC(=O)C(OC)OC 11a_100000102301_100000046285 [0,1,0,0,0,0|1,0,1]=3 1396 B11R0.157 CCCCNC(=O)C(OC)OC 240690a_100000102301_100000046285 [0,1,0,0,0,0|1,0,1]=3 1397 B11R0.157 CCCCNC(=O)C(OC)OC 527a_100000102301_100000046285 [0,1,0,0,0,0|1,0,1]=3 1398 B11R0.157 CCCCNC(C)C(CC)CC 269862a_100000102301_100011393642 [0,1,0,0,0,0|3,0,0]=4 1399 B11R0.157 CCCCNC(C)C(CC)CC 270004a_100000102301_100011393642 [0,1,0,0,0,0|3,0,0]=4 1400 B11R0.157 CCCCNC(C)C(OC)OC 270004a_100000102301_100000211384 [0,1,0,0,0,0|1,0,0]=2 1401 B11R0.157 CCCCOC(=O)[C@H](CC)OC 34a_100020628826_200000210301 [0,1,0,0,0,0|2,0,1]=4 1402 B11R0.157 CCCCOC(=O)[C@H](CC)OC 7a_100020628826_200000210301 [0,1,0,0,0,0|2,0,1]=4 1403 B11R0.157 CCCCOC(=O)[C@H](CC)O[13CH3] 34a_100020628826_200025704644 [0,1,0,0,0,0|2,0,1]=4 1404 B11R0.157 CCCCOC(=O)[C@H](CC)O[13CH3] 7a_100020628826_200025704644 [0,1,0,0,0,0|2,0,1]=4 1405 B11R0.157 CCCCOC(C)C(OC)OC 34a_100000210227_100011222894 [0,1,0,0,0,0|1,0,0]=2 1406 B11R0.157 CCCCOC(C)C(OC)OC 34a_100000754440_100000210210 [0,1,0,0,0,0|1,0,0]=2 1407 B11R0.157 CCCCOC(C)C(OC)OC 7a_100000754440_100000210211 [0,1,0,0,0,0|1,0,0]=2 1408 B11R0.157 CCCCSC(C)C(OC)OC 62a_100000210211_100011222894 [0,1,0,0,0,0|1,0,0]=2 1409 B11R0.157 CCCCSC(C)C(OC)OC 62a_100011222894_100000210210 [0,1,0,0,0,0|1,0,0]=2 1410 B11R0.157 CCCNN=C(C)C(OC)OC 4a_100000740057_100000211384 [0,1,0,0,0,0|2,0,1]=4 1411 B11R0.157 CCCNNC(=O)C(OC)OC 22a_100000740057_100000046285 [0,1,0,0,0,0|2,0,1]=4 1412 B11R0.157 CCOCCC(=O)C(CC)OC 1458a_100000747056_100011215890 [0,1,0,0,0,0|2,0,1]=4 1413 B11R0.157 CCOCCC(=O)C(OC)OC 1458a_100000046285_100011215890 [0,1,0,0,0,0|1,0,1]=3 1414 B11R0.157 CCOCSC(C)C(OC)OC 62a_100000739092_100011222894 [0,1,0,0,0,0|2,0,0]=3 1415 B11R0.157 CCOCSC(C)C(OC)OC 62a_100011222894_100000739092 [0,1,0,0,0,0|2,0,0]=3 1416 B11R0.157 CCSCCC(=O)C(CC)OC 1458a_100000747056_100000757381 [0,1,0,0,0,0|2,0,1]=4 1417 B11R0.157 CCSCCC(=O)C(OC)OC 1458a_100000046285_100000757381 [0,1,0,0,0,0|1,0,1]=3 1418 B11R0.157 COC(OC)C(=O)CCCC#N 1458a_100000046285_100000211468 [0,1,0,0,0,0|1,0,2]=4 1419 B11R0.157 COC(OC)C(=O)CCCCF 1458a_100000046285_100000729493 [0,1,0,0,0,0|1,0,1]=3 1420 B11R0.157 COC(OC)C(=O)CCCCO 1458a_100000046285_100000210776 [0,1,0,0,0,0|1,0,1]=3 1421 B11R0.157 COC(OC)C(=O)NCCCF 11a_100015189416_100000046285 [0,1,0,0,0,0|2,0,1]=4 1422 B11R0.157 COC(OC)C(=O)NCCCF 240690a_100015189416_100000046285 [0,1,0,0,0,0|2,0,1]=4 1423 B11R0.157 COC(OC)C(=O)NCCCF 527a_100015189416_100000046285 [0,1,0,0,0,0|2,0,1]=4 1424 B11R0.157 COC(OC)C(=O)NCCCO 240690a_100000182051_100000046285 [0,1,0,0,0,0|2,0,1]=4 1425 B11R0.157 COC(OC)C(=O)NCCCO 527a_100000182051_100000046285 [0,1,0,0,0,0|2,0,1]=4 1426 B11R0.157 COC(OC)C(=O)NCCSC 11a_100020590264_100000046285 [0,1,0,0,0,0|2,0,1]=4 1427 B11R0.157 COC(OC)C(=O)NCCSC 240690a_100020590264_100000046285 [0,1,0,0,0,0|2,0,1]=4 1428 B11R0.157 COC(OC)C(=O)NCCSC 527a_100020590264_100000046285 [0,1,0,0,0,0|2,0,1]=4 1429 B11R0.157 COC(OC)C(C)NCCC#N 270004a_100000720768_100000211384 [0,1,0,0,0,0|2,0,1]=4 1430 B11R0.157 COC(OC)C(C)NCCCF 270004a_100015189416_100000211384 [0,1,0,0,0,0|2,0,0]=3 1431 B11R0.157 COC(OC)C(C)NCCCF 34a_100015189416_100011222894 [0,1,0,0,0,0|2,0,0]=3 1432 B11R0.157 COC(OC)C(C)NCCCO 270004a_100000182051_100000211384 [0,1,0,0,0,0|2,0,0]=3 1433 B11R0.157 COC(OC)C(C)NCCSC 270004a_100020590264_100000211384 [0,1,0,0,0,0|2,0,0]=3 1434 B11R0.157 COC(OC)C(C)OCCC#N 7a_100000754440_100000184422 [0,1,0,0,0,0|2,0,1]=4 1435 B11R0.157 COC(OC)C(C)OCCCBr 34a_100011217188_100011222894 [0,1,0,0,0,0|2,0,0]=3 1436 B11R0.157 COC(OC)C(C)OCCCCl 34a_100000230001_100011222894 [0,1,0,0,0,0|2,0,0]=3 1437 B11R0.157 COC(OC)C(C)OCCCF 34a_100000754440_100011934791 [0,1,0,0,0,0|2,0,0]=3 1438 B11R0.157 COC(OC)C(C)OCCCF 34a_100000759539_100011222894 [0,1,0,0,0,0|2,0,0]=3 1439 B11R0.157 COC(OC)C(C)OCCCF 7a_100000754440_100011934791 [0,1,0,0,0,0|2,0,0]=3 1440 B11R0.157 COC(OC)C(C)OCCCN 34a_100000182051_100011222894 [0,1,0,0,0,0|2,0,0]=3 1441 B11R0.157 COC(OC)C(C)OCCCO 34a_100000754440_100000230001 [0,1,0,0,0,0|2,0,0]=3 1442 B11R0.157 COC(OC)C(C)OCCCO 7a_100000754440_100011215043 [0,1,0,0,0,0|2,0,0]=3 1443 B11R0.157 COC(OC)C(C)OCCON 34a_100000700252_100011222894 [0,1,0,0,0,0|3,0,0]=4 1444 B11R0.157 COC(OC)C(C)OCCSC 34a_100000230434_100011222894 [0,1,0,0,0,0|2,0,0]=3 1445 B11R0.157 COC(OC)C(C)OCCSC 34a_100000754440_100000212216 [0,1,0,0,0,0|2,0,0]=3 1446 B11R0.157 COC(OC)C(C)OCCSC 7a_100000754440_100000212216 [0,1,0,0,0,0|2,0,0]=3 1447 B11R0.157 COC(OC)C(C)SCCC#N 62a_100011215226_100011222894 [0,1,0,0,0,0|2,0,1]=4 1448 B11R0.157 COC(OC)C(C)SCCC#N 62a_100011222894_100011215226 [0,1,0,0,0,0|2,0,1]=4 1449 B11R0.157 COC(OC)C(C)SCCCF 62a_100011222894_100011934791 [0,1,0,0,0,0|2,0,0]=3 1450 B11R0.157 COC(OC)C(C)SCCCF 62a_100011934791_100011222894 [0,1,0,0,0,0|2,0,0]=3 1451 B11R0.157 COC(OC)C(C)SCCCO 62a_100011215043_100011222894 [0,1,0,0,0,0|2,0,0]=3 1452 B11R0.157 COC(OC)C(C)SCCCO 62a_100011222894_100011215043 [0,1,0,0,0,0|2,0,0]=3 1453 B11R0.157 COC(OC)C(C)SCCSC 62a_100000212216_100011222894 [0,1,0,0,0,0|2,0,0]=3 1454 B11R0.157 COC(OC)C(C)SCCSC 62a_100011222894_100000751147 [0,1,0,0,0,0|2,0,0]=3 1455 B11R0.157 COCCCC(=O)C(OC)OC 1458a_100000046285_100000740836 [0,1,0,0,0,0|1,0,1]=3 1456 B11R0.157 COCCNC(=O)C(OC)OC 240690a_100000209980_100000046285 [0,1,0,0,0,0|2,0,1]=4 1457 B11R0.157 COCCNC(=O)C(OC)OC 527a_100000209980_100000046285 [0,1,0,0,0,0|2,0,1]=4 1458 B11R0.157 COCCNC(C)C(OC)OC 270004a_100000209980_100000211384 [0,1,0,0,0,0|2,0,0]=3 1459 B11R0.157 COCCOC(C)C(OC)OC 34a_100000210237_100011222894 [0,1,0,0,0,0|2,0,0]=3 1460 B11R0.157 COCCOC(C)C(OC)OC 34a_100000754440_100011201679 [0,1,0,0,0,0|2,0,0]=3 1461 B11R0.157 COCCOC(C)C(OC)OC 7a_100000754440_100000233755 [0,1,0,0,0,0|2,0,0]=3 1462 B11R0.157 COCCSC(C)C(OC)OC 62a_100000233755_100011222894 [0,1,0,0,0,0|2,0,0]=3 1463 B11R0.157 COCCSC(C)C(OC)OC 62a_100011222894_100000233755 [0,1,0,0,0,0|2,0,0]=3 1464 B11R0.161 C#CC(CCCCCBr)OCC 34a_200010408556_100000210202 [0,1,0,0,0,0|2,0,1]=4 1465 B11R0.161 C#CC(CCCCCBr)OCC 7a_200010408556_100000210202 [0,1,0,0,0,0|2,0,1]=4 1466 B11R0.161 C#CC(CCCCCBr)OCF 34a_200010408556_100015361967 [0,1,0,0,0,0|2,0,1]=4 1467 B11R0.161 C#CC(CCCCCBr)OCF 7a_200010408556_100015361967 [0,1,0,0,0,0|2,0,1]=4 1468 B11R0.161 C=CC(CCCCCC)OCC 34a_200011215977_100000210202 [0,1,0,0,0,0|1,0,1]=3 1469 B11R0.161 C=CC(CCCCCC)OCC 7a_200011215977_100000210202 [0,1,0,0,0,0|1,0,1]=3 1470 B11R0.161 C=CC(CCCCCC)OCF 34a_200011215977_100015361967 [0,1,0,0,0,0|1,0,1]=3 1471 B11R0.161 C=CC(CCCCCC)OCF 7a_200011215977_100015361967 [0,1,0,0,0,0|1,0,1]=3 1472 B11R0.161 CC#CC(CC)OCCCCC 34a_200011219922_100000718602 [0,1,0,0,0,0|3,0,0]=4 1473 B11R0.161 CC#CC(CC)OCCCCC 7a_200011219922_100000210326 [0,1,0,0,0,0|3,0,0]=4 1474 B11R0.161 CCC(COC)NCCCCF 2230a_100000757820_100000729493 [0,1,0,0,0,0|3,0,0]=4 1475 B11R0.161 CCC(COC)NCCCCO 2230a_100000757820_100000210776 [0,1,0,0,0,0|3,0,0]=4 1476 B11R0.161 CCC(COC)NCCCCO 270004a_100000750430_100000757811 [0,1,0,0,0,0|3,0,0]=4 1477 B11R0.161 CCC(COC)NCCCOC 2230a_100000757820_100000740836 [0,1,0,0,0,0|3,0,0]=4 1478 B11R0.161 CCC(COC)NCCCOC 270004a_100150723488_100000757811 [0,1,0,0,0,0|3,0,0]=4 1479 B11R0.161 CCC(COC)NCCCSC 270004a_100000749238_100000757811 [0,1,0,0,0,0|3,0,0]=4 1480 B11R0.161 CCC(COC)OCCCCF 7a_200011214946_100000729493 [0,1,0,0,0,0|3,0,0]=4 1481 B11R0.161 CCC(COC)OCCCCO 7a_200011214946_100000210776 [0,1,0,0,0,0|3,0,0]=4 1482 B11R0.161 CCC(COC)OCCCOC 7a_200011214946_100000740836 [0,1,0,0,0,0|3,0,0]=4 1483 B11R0.161 CCCCCCC(CC)NCC 270004a_100015525214_100011219640 [0,1,0,0,0,0|2,0,0]=3 1484 B11R0.161 CCCCCCC(CC)OCC 34a_100011215785_100000210202 [0,1,0,0,0,0|1,0,0]=2 1485 B11R0.161 CCCCCCC(CC)OCC 7a_100011215785_100000210202 [0,1,0,0,0,0|1,0,0]=2 1486 B11R0.161 CCCCCCC(CC)OCF 34a_100011215785_100015361967 [0,1,0,0,0,0|1,0,0]=2 1487 B11R0.161 CCCCCCC(CC)OCF 7a_100011215785_100015361967 [0,1,0,0,0,0|1,0,0]=2 1488 B11R0.161 CCCCCCC(CCC)NC 270004a_106832991635_200011215359 [0,1,0,0,0,0|2,0,0]=3 1489 B11R0.161 CCCCCCC(CCC)OC 34a_200011215193_200000210301 [0,1,0,0,0,0|1,0,0]=2 1490 B11R0.161 CCCCCCC(CCC)OC 7a_200011215193_200000210301 [0,1,0,0,0,0|1,0,0]=2 1491 B11R0.161 CCCCCCC(CCC)O[13CH3] 34a_200011215193_200025704644 [0,1,0,0,0,0|1,0,0]=2 1492 B11R0.161 CCCCCCC(CCC)O[13CH3] 7a_200011215193_200025704644 [0,1,0,0,0,0|1,0,0]=2 1493 B11R0.161 CCCCCCN(CC)CCC 2230a_100000226822_100000210314 [0,1,0,0,0,0|3,0,0]=4 1494 B11R0.161 CCCCCCN(CC)CCC 269982a_100000226822_100000210757 [0,1,0,0,0,0|3,0,0]=4 1495 B11R0.161 CCCCCCN(CC)CCO 2230a_100000210973_100000210314 [0,1,0,0,0,0|3,0,0]=4 1496 B11R0.161 CCCCCCN(CC)CCO 269982a_100000210973_100000210757 [0,1,0,0,0,0|3,0,0]=4 1497 B11R0.161 CCCCCNC(CC)CCC 2230a_100000747048_100000210326 [0,1,0,0,0,0|3,0,0]=4 1498 B11R0.161 CCCCCNC(CC)CCC 270004a_100000209983_100000687865 [0,1,0,0,0,0|3,0,0]=4 1499 B11R0.161 CCCCCNC(CC)COC 2230a_100000757820_100000210326 [0,1,0,0,0,0|2,0,0]=3 1500 B11R0.161 CCCCCNC(CC)COC 270004a_100000209983_100000757811 [0,1,0,0,0,0|2,0,0]=3 1501 B11R0.161 CCCCCNC(CO)COC 2230a_100000724102_100000210326 [0,1,0,0,0,0|3,0,0]=4 1502 B11R0.161 CCCCCNC(CO)COC 34a_100000724102_100000718602 [0,1,0,0,0,0|3,0,0]=4 1503 B11R0.161 CCCCCOC(CC)CCC 34a_100000687864_100000718602 [0,1,0,0,0,0|3,0,0]=4 1504 B11R0.161 CCCCCOC(CC)CCC 7a_100000210253_100011219200 [0,1,0,0,0,0|3,0,0]=4 1505 B11R0.161 CCCCCOC(CC)CCC 7a_100000687864_100000210326 [0,1,0,0,0,0|3,0,0]=4 1506 B11R0.161 CCCCCOC(CC)COC 7a_200011214946_100000210326 [0,1,0,0,0,0|2,0,0]=3 1507 B11R0.161 CCCCCOC(CCl)COC 34a_100011215053_100000718602 [0,1,0,0,0,0|3,0,0]=4 1508 B11R0.161 CCCCCOC(CN)COC 34a_100000756049_100000718602 [0,1,0,0,0,0|3,0,0]=4 1509 B11R0.161 CCCCCSC(CC)CCC 62a_100000210326_100011219200 [0,1,0,0,0,0|3,0,0]=4 1510 B11R0.161 CCCCCSC(CC)CCC 62a_100011219200_100000210326 [0,1,0,0,0,0|3,0,0]=4 1511 B11R0.161 CCCCNCC(CC)OCC 2230a_100015183923_100000210211 [0,1,0,0,0,0|2,0,0]=3 1512 B11R0.161 CCCCNCC(CC)OCC 34a_100015183923_100000210210 [0,1,0,0,0,0|2,0,0]=3 1513 B11R0.161 CCCOCCC(CCC)SC 34a_100000032865_100000210303 [0,1,0,0,0,0|2,1,0]=4 1514 B11R0.161 CCCOCCC(CCC)SC 7a_100000032865_100000210303 [0,1,0,0,0,0|2,1,0]=4 1515 B11R0.161 CCOC(CC)CNCCCF 2230a_100015183923_100011934791 [0,1,0,0,0,0|3,0,0]=4 1516 B11R0.161 CCOC(CC)CNCCCF 34a_100015183923_100011934791 [0,1,0,0,0,0|3,0,0]=4 1517 B11R0.161 CCOC(CC)CNCCCO 2230a_100015183923_100000230001 [0,1,0,0,0,0|3,0,0]=4 1518 B11R0.161 CCOC(CC)CNCCCO 34a_100015183923_100000230001 [0,1,0,0,0,0|3,0,0]=4 1519 B11R0.161 CCOC(CC)CNCCOC 2230a_100015183923_100011201679 [0,1,0,0,0,0|3,0,0]=4 1520 B11R0.161 CCOC(CC)CNCCOC 34a_100015183923_100011201679 [0,1,0,0,0,0|3,0,0]=4 1521 B11R0.161 CCOC(CC)CNCCSC 2230a_100015183923_100000751147 [0,1,0,0,0,0|3,0,0]=4 1522 B11R0.161 CCOC(CC)CNCCSC 34a_100015183923_100000212216 [0,1,0,0,0,0|3,0,0]=4 1523 B11R0.161 CCOCCNC(CC)COC 2230a_100000757820_100011215890 [0,1,0,0,0,0|3,0,0]=4 1524 B11R0.161 CCOCCNC(CC)COC 270004a_102516460346_100000757811 [0,1,0,0,0,0|3,0,0]=4 1525 B11R0.161 CCOCCOC(CC)COC 7a_200011214946_100011215890 [0,1,0,0,0,0|3,0,0]=4 1526 B11R0.161 CCSCCNC(CC)COC 2230a_100000757820_100000757381 [0,1,0,0,0,0|3,0,0]=4 1527 B11R0.161 CCSCCNC(CC)COC 270004a_100000106463_100000757811 [0,1,0,0,0,0|3,0,0]=4 1528 B11R0.161 CCSCCOC(CC)COC 7a_200011214946_100000757381 [0,1,0,0,0,0|3,0,0]=4 1529 B11R0.200 C#CC(=O)CCCC(OC)OC 1458a_100000211873_100000069011 [0,1,0,0,0,0|0,0,3]=4 1530 B11R0.200 C#CC(C)NCCC(OC)OC 2230a_100000707721_100009813347 [0,1,0,0,0,0|1,0,2]=4 1531 B11R0.200 C#CC(C)NCCC(OC)OC 34a_100000707721_100000139399 [0,1,0,0,0,0|1,0,2]=4 1532 B11R0.200 C#CC(C)SCCC(OC)OC 62a_200000035995_100000139399 [0,1,0,0,0,0|1,0,2]=4 1533 B11R0.200 C#C[C@@H](C)OCCC(OC)OC 34a_100009815206_100000139399 [0,1,0,0,0,0|1,0,2]=4 1534 B11R0.200 C#C[C@@H](C)OCCC(OC)OC 7a_100009815206_100009813347 [0,1,0,0,0,0|1,0,2]=4 1535 B11R0.200 C=CC(=O)CCCC(OC)OC 1458a_100000185746_100000069011 [0,1,0,0,0,0|0,0,3]=4 1536 B11R0.200 C=CC(C)COCC(OC)OC 34a_100011215527_100000211822 [0,1,0,0,0,0|1,0,2]=4 1537 B11R0.200 C=CC(C)COCC(OC)OC 7a_100011215527_100000751394 [0,1,0,0,0,0|1,0,2]=4 1538 B11R0.200 C=CC(C)OCCC(OC)OC 34a_100000695699_100000139399 [0,1,0,0,0,0|1,0,2]=4 1539 B11R0.200 C=CC(C)SCCC(OC)OC 62a_100011215867_100000139399 [0,1,0,0,0,0|1,0,2]=4 1540 B11R0.200 C=CC(O)COCC(OC)OC 34a_100011216393_100000730141 [0,1,0,0,0,0|1,0,2]=4 1541 B11R0.200 C=CC(O)CSCC(OC)OC 62a_100000730141_100000751394 [0,1,0,0,0,0|1,0,2]=4 1542 B11R0.200 C=CC(O)CSCC(OC)OC 62a_100000751394_100000730141 [0,1,0,0,0,0|1,0,2]=4 1543 B11R0.200 C=C[C@H](N)COCC(OC)OC 34a_100016989147_100000211822 [0,1,0,0,0,0|1,0,2]=4 1544 B11R0.200 CCC(=O)CCCC(OC)OC 1458a_100000210414_100000069011 [0,1,0,0,0,0|0,0,1]=2 1545 B11R0.200 CCC(=O)COCC(CC)OC 7a_100011934954_100000747405 [0,1,0,0,0,0|2,0,1]=4 1546 B11R0.200 CCC(=O)COCC(OC)OC 34a_100000725409_100000211822 [0,1,0,0,0,0|1,0,1]=3 1547 B11R0.200 CCC(=O)CSCC(OC)OC 62a_100000747405_100000751394 [0,1,0,0,0,0|1,0,1]=3 1548 B11R0.200 CCC(=O)CSCC(OC)OC 62a_100000751394_100000747405 [0,1,0,0,0,0|1,0,1]=3 1549 B11R0.200 CCC(C)CCNC(CC)CC 270004a_100020591266_100000210860 [0,1,0,0,0,0|3,0,0]=4 1550 B11R0.200 CCC(C)CCOC(CC)CC 7a_100011215188_100000210505 [0,1,0,0,0,0|3,0,0]=4 1551 B11R0.200 CCC(C)CNCC(CC)CC 2230a_100020588543_100011215472 [0,1,0,0,0,0|3,0,0]=4 1552 B11R0.200 CCC(C)CNCC(CC)CC 2230a_100102946423_100000748023 [0,1,0,0,0,0|3,0,0]=4 1553 B11R0.200 CCC(C)CNCC(CC)CC 269862a_100020588543_100000211137 [0,1,0,0,0,0|3,0,0]=4 1554 B11R0.200 CCC(C)CNCC(CC)CC 270004a_100020588543_100000211137 [0,1,0,0,0,0|3,0,0]=4 1555 B11R0.200 CCC(C)CNCC(CC)CC 270004a_100102946423_100000243153 [0,1,0,0,0,0|3,0,0]=4 1556 B11R0.200 CCC(C)CNCC(CC)OC 270004a_100000731041_100000243153 [0,1,0,0,0,0|2,0,0]=3 1557 B11R0.200 CCC(C)CNCC(OC)OC 2230a_100020588543_100000751394 [0,1,0,0,0,0|1,0,0]=2 1558 B11R0.200 CCC(C)CNCC(OC)OC 270004a_100000210479_100000243153 [0,1,0,0,0,0|1,0,0]=2 1559 B11R0.200 CCC(C)CNCC(OC)OC 270004a_100020588543_100000752162 [0,1,0,0,0,0|1,0,0]=2 1560 B11R0.200 CCC(C)COCC(CC)CC 7a_100000703878_100000748023 [0,1,0,0,0,0|3,0,0]=4 1561 B11R0.200 CCC(C)COCC(CC)OC 34a_100011934954_100000748023 [0,1,0,0,0,0|2,0,0]=3 1562 B11R0.200 CCC(C)COCC(CC)OC 7a_100011934954_100000748023 [0,1,0,0,0,0|2,0,0]=3 1563 B11R0.200 CCC(C)COCC(OC)OC 34a_100011216393_100000748023 [0,1,0,0,0,0|1,0,0]=2 1564 B11R0.200 CCC(C)CSCC(CC)CC 62a_100000748023_100011215472 [0,1,0,0,0,0|3,0,0]=4 1565 B11R0.200 CCC(C)CSCC(CC)CC 62a_100011215472_100000748023 [0,1,0,0,0,0|3,0,0]=4 1566 B11R0.200 CCC(C)CSCC(OC)OC 62a_100000748023_100000751394 [0,1,0,0,0,0|1,0,0]=2 1567 B11R0.200 CCC(C)CSCC(OC)OC 62a_100000751394_100000748023 [0,1,0,0,0,0|1,0,0]=2 1568 B11R0.200 CCC(C)NCCC(OC)OC 2230a_100000209981_100009813347 [0,1,0,0,0,0|1,0,0]=2 1569 B11R0.200 CCC(C)NN=CC(OC)OC 4a_100000718999_100000752162 [0,1,0,0,0,0|2,0,1]=4 1570 B11R0.200 CCC(C)OCCC(OC)OC 7a_100000210228_100009813347 [0,1,0,0,0,0|1,0,0]=2 1571 B11R0.200 CCC(C)SCCC(OC)OC 62a_100000139399_100000758301 [0,1,0,0,0,0|1,0,0]=2 1572 B11R0.200 CCC(C)SCCC(OC)OC 62a_100000758301_100000139399 [0,1,0,0,0,0|1,0,0]=2 1573 B11R0.200 CCC(CC)CNC[C@@H](C)CC 2230a_100102946423_100009816398 [0,1,0,0,0,0|3,0,0]=4 1574 B11R0.200 CCC(CC)COC[C@@H](C)CC 7a_100000703878_100009816398 [0,1,0,0,0,0|3,0,0]=4 1575 B11R0.200 CCC(CC)COC[C@@H](C)CC 7a_100009816381_100011215472 [0,1,0,0,0,0|3,0,0]=4 1576 B11R0.200 CCC(CC)CSC[C@@H](C)CC 62a_100009816398_100011215472 [0,1,0,0,0,0|3,0,0]=4 1577 B11R0.200 CCC(CC)CSC[C@@H](C)CC 62a_100011215472_100009816398 [0,1,0,0,0,0|3,0,0]=4 1578 B11R0.200 CCC(COCC(O)CO)OC 34a_100011934954_100011219619 [0,1,0,0,0,0|3,0,0]=4 1579 B11R0.200 CCC(COCC(O)CO)OC 7a_100011934954_100011219619 [0,1,0,0,0,0|3,0,0]=4 1580 B11R0.200 CCC(COC[C@@H](C)CC)OC 34a_100011934954_100009816398 [0,1,0,0,0,0|2,0,0]=3 1581 B11R0.200 CCC(COC[C@@H](C)CC)OC 7a_100011934954_100009816398 [0,1,0,0,0,0|2,0,0]=3 1582 B11R0.200 CCC(COC[C@@H](C)CO)OC 34a_100011934954_100000059175 [0,1,0,0,0,0|3,0,0]=4 1583 B11R0.200 CCC(COC[C@@H](C)CO)OC 7a_100011934954_100000059175 [0,1,0,0,0,0|3,0,0]=4 1584 B11R0.200 CCC(COC[C@@H](O)CF)OC 34a_100011934954_100015614560 [0,1,0,0,0,0|3,0,0]=4 1585 B11R0.200 CCC(COC[C@@H](O)CF)OC 7a_100011934954_100015614560 [0,1,0,0,0,0|3,0,0]=4 1586 B11R0.200 CCC(COC[C@@H](O)CO)OC 34a_100011934954_100009815848 [0,1,0,0,0,0|3,0,0]=4 1587 B11R0.200 CCC(COC[C@@H](O)CO)OC 7a_100011934954_100009815848 [0,1,0,0,0,0|3,0,0]=4 1588 B11R0.200 CCC(O)CNCC(CC)CC 2230a_100011218483_100011215472 [0,1,0,0,0,0|3,0,0]=4 1589 B11R0.200 CCC(O)CNCC(CC)CC 2230a_100102946423_100011218378 [0,1,0,0,0,0|3,0,0]=4 1590 B11R0.200 CCC(O)CNCC(CC)CC 269862a_100011218483_100000211137 [0,1,0,0,0,0|3,0,0]=4 1591 B11R0.200 CCC(O)CNCC(CC)CC 270004a_100011218483_100000211137 [0,1,0,0,0,0|3,0,0]=4 1592 B11R0.200 CCC(O)CNCC(OC)OC 2230a_100011218483_100000751394 [0,1,0,0,0,0|1,0,0]=2 1593 B11R0.200 CCC(O)CNCC(OC)OC 270004a_100011218483_100000752162 [0,1,0,0,0,0|1,0,0]=2 1594 B11R0.200 CCC(O)COCC(CC)CC 7a_100000703878_100011218378 [0,1,0,0,0,0|3,0,0]=4 1595 B11R0.200 CCC(O)COCC(CC)OC 34a_100011934954_100011218378 [0,1,0,0,0,0|2,0,0]=3 1596 B11R0.200 CCC(O)COCC(CC)OC 7a_100011934954_100011218378 [0,1,0,0,0,0|2,0,0]=3 1597 B11R0.200 CCC(O)COCC(OC)OC 34a_100011216393_100011218378 [0,1,0,0,0,0|1,0,0]=2 1598 B11R0.200 CCC(O)CSCC(CC)CC 62a_100011215472_100011218378 [0,1,0,0,0,0|3,0,0]=4 1599 B11R0.200 CCC(O)CSCC(CC)CC 62a_100011218378_100011215472 [0,1,0,0,0,0|3,0,0]=4 1600 B11R0.200 CCC(O)CSCC(OC)OC 62a_100000751394_100011218378 [0,1,0,0,0,0|1,0,0]=2 1601 B11R0.200 CCC(O)CSCC(OC)OC 62a_100011218378_100000751394 [0,1,0,0,0,0|1,0,0]=2 1602 B11R0.200 CCN(C)CCCC(OC)OC 2230a_100000225621_100000069011 [0,1,0,0,0,0|1,0,0]=2 1603 B11R0.200 CCN(C)CCCC(OC)OC 269982a_100000225621_100000069011 [0,1,0,0,0,0|1,0,0]=2 1604 B11R0.200 CC[C@H](C)COCC(OC)OC 34a_100011216393_100009816398 [0,1,0,0,0,0|1,0,0]=2 1605 B11R0.200 CC[C@H](C)COCC(OC)OC 7a_100009816381_100000751394 [0,1,0,0,0,0|1,0,0]=2 1606 B11R0.200 CC[C@H](C)CSCC(OC)OC 62a_100000751394_100009816398 [0,1,0,0,0,0|1,0,0]=2 1607 B11R0.200 CC[C@H](C)CSCC(OC)OC 62a_100009816398_100000751394 [0,1,0,0,0,0|1,0,0]=2 1608 B11R0.200 CNC(=O)CNCC(OC)OC 2230a_100000693194_100000751394 [0,1,0,0,0,0|2,0,1]=4 1609 B11R0.200 CNC(=O)CNCC(OC)OC 270004a_100000693194_100000752162 [0,1,0,0,0,0|2,0,1]=4 1610 B11R0.200 CNC(=O)COCC(OC)OC 34a_100000750040_100000211822 [0,1,0,0,0,0|2,0,1]=4 1611 B11R0.200 CNC(=O)COCC(OC)OC 34a_100011216393_100000183359 [0,1,0,0,0,0|2,0,1]=4 1612 B11R0.200 CNC(=O)CSCC(OC)OC 62a_100000183359_100000751394 [0,1,0,0,0,0|2,0,1]=4 1613 B11R0.200 CNC(=O)CSCC(OC)OC 62a_100000751394_100000183359 [0,1,0,0,0,0|2,0,1]=4 1614 B11R0.200 COC(=O)COCC(OC)OC 34a_100011216393_100000747449 [0,1,0,0,0,0|2,0,1]=4 1615 B11R0.200 COC(=O)CSCC(OC)OC 62a_100000747449_100000751394 [0,1,0,0,0,0|2,0,1]=4 1616 B11R0.200 COC(=O)CSCC(OC)OC 62a_100000751394_100000747449 [0,1,0,0,0,0|2,0,1]=4 1617 B11R0.200 COC(C)COCC(OC)OC 34a_100000690652_100000211822 [0,1,0,0,0,0|2,0,0]=3 1618 B11R0.200 COC(CCCC(=O)CO)OC 1458a_100000210174_100000069011 [0,1,0,0,0,0|1,0,1]=3 1619 B11R0.200 COC(CCNC(C)C#N)OC 2230a_100000737613_100009813347 [0,1,0,0,0,0|2,0,1]=4 1620 B11R0.200 COC(CCN[C@H](C)CO)OC 2230a_100000737577_100009813347 [0,1,0,0,0,0|2,0,0]=3 1621 B11R0.200 COC(CCOC(C)C#N)OC 34a_100011218135_100000139399 [0,1,0,0,0,0|2,0,1]=4 1622 B11R0.200 COC(CCOC(C)CF)OC 34a_100016041109_100000139399 [0,1,0,0,0,0|2,0,0]=3 1623 B11R0.200 COC(CCOC(C)CF)OC 7a_100016041109_100009813347 [0,1,0,0,0,0|2,0,0]=3 1624 B11R0.200 COC(CCOC(C)CN)OC 34a_100000210904_100000139399 [0,1,0,0,0,0|2,0,0]=3 1625 B11R0.200 COC(CCSC(C)C#N)OC 62a_100000139399_100000703298 [0,1,0,0,0,0|2,0,1]=4 1626 B11R0.200 COC(CCSC(C)C#N)OC 62a_100000703298_100000139399 [0,1,0,0,0,0|2,0,1]=4 1627 B11R0.200 COC(CCSC(C)CO)OC 62a_100012180447_100000139399 [0,1,0,0,0,0|2,0,0]=3 1628 B11R0.200 COC(CCSC(C)OC)OC 62a_100000139399_100009879195 [0,1,0,0,0,0|2,0,0]=3 1629 B11R0.200 COC(CCSC(C)OC)OC 62a_100009879195_100000139399 [0,1,0,0,0,0|2,0,0]=3 1630 B11R0.200 COC(CCSC(F)C#N)OC 62a_100000139399_200000117898 [0,1,0,0,0,0|2,0,1]=4 1631 B11R0.200 COC(CCSC(F)C#N)OC 62a_200000117898_100000139399 [0,1,0,0,0,0|2,0,1]=4 1632 B11R0.200 COC(CCS[C@H](C)CO)OC 62a_100000139399_100016084084 [0,1,0,0,0,0|2,0,0]=3 1633 B11R0.200 COC(CCS[C@H](C)CO)OC 62a_100016084084_100000139399 [0,1,0,0,0,0|2,0,0]=3 1634 B11R0.200 COC(CNCC(C)CO)OC 34a_100000744482_100000211822 [0,1,0,0,0,0|2,0,0]=3 1635 B11R0.200 COC(CNC[C@@H](C)OC)OC 2230a_100020591295_100000751394 [0,1,0,0,0,0|2,0,0]=3 1636 B11R0.200 COC(CNC[C@@H](C)OC)OC 270004a_100020591295_100000752162 [0,1,0,0,0,0|2,0,0]=3 1637 B11R0.200 COC(CNC[C@@H](F)CO)OC 270004a_100015665980_100000752162 [0,1,0,0,0,0|2,0,0]=3 1638 B11R0.200 COC(CNC[C@@H](F)CO)OC 34a_100015665980_100000211822 [0,1,0,0,0,0|2,0,0]=3 1639 B11R0.200 COC(CNC[C@H](O)CO)OC 2230a_100020644852_100000751394 [0,1,0,0,0,0|2,0,0]=3 1640 B11R0.200 COC(COCC(C)CN)OC 34a_100000744482_100000211822 [0,1,0,0,0,0|2,0,0]=3 1641 B11R0.200 COC(COCC(Cl)CCl)OC 34a_100000033668_100000211822 [0,1,0,0,0,0|2,0,0]=3 1642 B11R0.200 COC(COCC(O)CO)OC 34a_100011216393_100011219619 [0,1,0,0,0,0|2,0,0]=3 1643 B11R0.200 COC(COC[C@@H](C)CO)OC 34a_100011216393_100000059175 [0,1,0,0,0,0|2,0,0]=3 1644 B11R0.200 COC(COC[C@@H](O)CF)OC 34a_100011216393_100015614560 [0,1,0,0,0,0|2,0,0]=3 1645 B11R0.200 COC(COC[C@@H](O)CO)OC 34a_100011216393_100009815848 [0,1,0,0,0,0|2,0,0]=3 1646 B11R0.200 COC(COC[C@H](F)CN)OC 34a_100015665980_100000211822 [0,1,0,0,0,0|2,0,0]=3 1647 B11R0.200 COC(CSCC(O)CO)OC 62a_100000751394_100011219619 [0,1,0,0,0,0|2,0,0]=3 1648 B11R0.200 COC(CSCC(O)CO)OC 62a_100011219619_100000751394 [0,1,0,0,0,0|2,0,0]=3 1649 B11R0.200 COC(CSC[C@@H](C)CO)OC 62a_100000059175_100000751394 [0,1,0,0,0,0|2,0,0]=3 1650 B11R0.200 COC(CSC[C@@H](C)CO)OC 62a_100000751394_100000059175 [0,1,0,0,0,0|2,0,0]=3 1651 B11R0.200 COC(CSC[C@@H](O)CF)OC 62a_100000751394_100015614560 [0,1,0,0,0,0|2,0,0]=3 1652 B11R0.200 COC(CSC[C@@H](O)CF)OC 62a_100015614560_100000751394 [0,1,0,0,0,0|2,0,0]=3 1653 B11R0.200 COC(CSC[C@@H](O)CO)OC 62a_100000751394_100009815848 [0,1,0,0,0,0|2,0,0]=3 1654 B11R0.200 COC(CSC[C@@H](O)CO)OC 62a_100009815848_100000751394 [0,1,0,0,0,0|2,0,0]=3 1655 B11R0.305 C#CC(C)(CCCCCC)OC 34a_200000042405_200000210301 [0,1,0,0,0,0|1,0,1]=3 1656 B11R0.305 C#CC(C)(CCCCCC)OC 7a_200000042405_200000210301 [0,1,0,0,0,0|1,0,1]=3 1657 B11R0.305 C#CC(C)(CCCCCC)O[13CH3] 34a_200000042405_200025704644 [0,1,0,0,0,0|1,0,1]=3 1658 B11R0.305 C#CC(C)(CCCCCC)O[13CH3] 7a_200000042405_200025704644 [0,1,0,0,0,0|1,0,1]=3 1659 B11R0.305 C#CCCNCC(C)(OC)OC 2230a_100000732740_100000688953 [0,1,0,0,0,0|1,0,2]=4 1660 B11R0.305 C#CCCNCC(C)(OC)OC 34a_100000755551_100000766008 [0,1,0,0,0,0|1,0,2]=4 1661 B11R0.305 C#CCCOCC(C)(OC)OC 34a_100011215631_100000766008 [0,1,0,0,0,0|1,0,2]=4 1662 B11R0.305 C#CCCSCC(C)(OC)OC 62a_100000688953_100000766008 [0,1,0,0,0,0|1,0,2]=4 1663 B11R0.305 C#CCCSCC(C)(OC)OC 62a_100000766008_100000688953 [0,1,0,0,0,0|1,0,2]=4 1664 B11R0.305 C/C=C/COCC(C)(OC)OC 34a_100016270725_100000766008 [0,1,0,0,0,0|1,0,2]=4 1665 B11R0.305 C/C=C/CSCC(C)(OC)OC 62a_100000766008_100102629194 [0,1,0,0,0,0|1,0,2]=4 1666 B11R0.305 C/C=C/CSCC(C)(OC)OC 62a_100102629194_100000766008 [0,1,0,0,0,0|1,0,2]=4 1667 B11R0.305 C=CCCNCC(C)(OC)OC 2230a_100000732740_100000754431 [0,1,0,0,0,0|1,0,2]=4 1668 B11R0.305 C=CCCNCC(C)(OC)OC 2230a_100015191253_100000064154 [0,1,0,0,0,0|1,0,2]=4 1669 B11R0.305 C=CCCOCC(C)(OC)OC 34a_100011205117_100000766008 [0,1,0,0,0,0|1,0,2]=4 1670 B11R0.305 C=CCCSCC(C)(OC)OC 62a_100000754431_100000766008 [0,1,0,0,0,0|1,0,2]=4 1671 B11R0.305 C=CCCSCC(C)(OC)OC 62a_100000766008_100000754431 [0,1,0,0,0,0|1,0,2]=4 1672 B11R0.305 CC#CCNCC(C)(OC)OC 2230a_100000685387_100000064154 [0,1,0,0,0,0|1,0,2]=4 1673 B11R0.305 CC#CCNCC(C)(OC)OC 2230a_100000732740_100000748600 [0,1,0,0,0,0|1,0,2]=4 1674 B11R0.305 CC#CCNCC(C)(OC)OC 34a_100000685387_100000766008 [0,1,0,0,0,0|1,0,2]=4 1675 B11R0.305 CC#CCOCC(C)(OC)OC 34a_100000761923_100000766008 [0,1,0,0,0,0|1,0,2]=4 1676 B11R0.305 CC#CCSCC(C)(OC)OC 62a_100000748600_100000766008 [0,1,0,0,0,0|1,0,2]=4 1677 B11R0.305 CC#CCSCC(C)(OC)OC 62a_100000766008_100000748600 [0,1,0,0,0,0|1,0,2]=4 1678 B11R0.305 CC=CCNCC(C)(OC)OC 2230a_100000732740_100000070051 [0,1,0,0,0,0|1,0,2]=4 1679 B11R0.305 CC=CCSCC(C)(OC)OC 62a_100000070051_100000766008 [0,1,0,0,0,0|1,0,2]=4 1680 B11R0.305 CC=CCSCC(C)(OC)OC 62a_100000766008_100000070051 [0,1,0,0,0,0|1,0,2]=4 1681 B11R0.305 CCCCCOC(C)(CC)CC 7a_100000210253_100009817345 [0,1,0,0,0,0|3,0,0]=4 1682 B11R0.305 CCCCCOC(C)(CC)CC 7a_100000755174_100000210326 [0,1,0,0,0,0|3,0,0]=4 1683 B11R0.305 CCCCCSC(C)(CC)CC 62a_100000210326_100009817345 [0,1,0,0,0,0|3,0,0]=4 1684 B11R0.305 CCCCCSC(C)(CC)CC 62a_100009817345_100000210326 [0,1,0,0,0,0|3,0,0]=4 1685 B11R0.305 CCCCNCC(C)(OC)OC 2230a_100000102301_100000064154 [0,1,0,0,0,0|1,0,0]=2 1686 B11R0.305 CCCCNCC(C)(OC)OC 2230a_100000732740_100000210211 [0,1,0,0,0,0|1,0,0]=2 1687 B11R0.305 CCCCOCC(C)(OC)OC 34a_100000210227_100000766008 [0,1,0,0,0,0|1,0,0]=2 1688 B11R0.305 CCCCOCP(=O)(OC)OC 34a_100000101693_100000210210 [0,1,0,0,0,0|2,0,0]=3 1689 B11R0.305 CCCCSCC(C)(OC)OC 62a_100000210211_100000766008 [0,1,0,0,0,0|1,0,0]=2 1690 B11R0.305 CCCCSCC(C)(OC)OC 62a_100000766008_100000210210 [0,1,0,0,0,0|1,0,0]=2 1691 B11R0.305 CCCCSC[Si](C)(OC)OC 62a_100000067953_100000210210 [0,1,0,0,0,0|1,1,0]=3 1692 B11R0.305 CCCCSC[Si](C)(OC)OC 62a_100000210211_100000067953 [0,1,0,0,0,0|1,1,0]=3 1693 B11R0.305 CCCOCCP(=O)(OC)OC 34a_200000043213_100000210303 [0,1,0,0,0,0|2,0,0]=3 1694 B11R0.305 CCOCCC[Si](C)(OC)OC 34a_100121572206_100000031653 [0,1,0,0,0,0|1,1,0]=3 1695 B11R0.305 CCOCSCC(C)(OC)OC 62a_100000739092_100000766008 [0,1,0,0,0,0|2,0,0]=3 1696 B11R0.305 CCOCSCC(C)(OC)OC 62a_100000766008_100000739092 [0,1,0,0,0,0|2,0,0]=3 1697 B11R0.305 CCOCSC[Si](C)(OC)OC 62a_100000067953_100000739092 [0,1,0,0,0,0|2,1,0]=4 1698 B11R0.305 CCOCSC[Si](C)(OC)OC 62a_100000739092_100000067953 [0,1,0,0,0,0|2,1,0]=4 1699 B11R0.305 CCSCCC[Si](C)(OC)OC 62a_100000031653_100000210202 [0,1,0,0,0,0|1,1,0]=3 1700 B11R0.305 CCSCCC[Si](C)(OC)OC 62a_100000210202_100000031653 [0,1,0,0,0,0|1,1,0]=3 1701 B11R0.305 COC(C)(CNCCC#N)OC 2230a_100000732740_100011215226 [0,1,0,0,0,0|2,0,1]=4 1702 B11R0.305 COC(C)(CNCCCF)OC 2230a_100000732740_100011934791 [0,1,0,0,0,0|2,0,0]=3 1703 B11R0.305 COC(C)(CNCCCF)OC 2230a_100015189416_100000064154 [0,1,0,0,0,0|2,0,0]=3 1704 B11R0.305 COC(C)(CNCCCF)OC 34a_100015189416_100000766008 [0,1,0,0,0,0|2,0,0]=3 1705 B11R0.305 COC(C)(CNCCCO)OC 2230a_100000732740_100000230001 [0,1,0,0,0,0|2,0,0]=3 1706 B11R0.305 COC(C)(CNCCSC)OC 2230a_100000732740_100000751147 [0,1,0,0,0,0|2,0,0]=3 1707 B11R0.305 COC(C)(CNCCSC)OC 2230a_100020590264_100000064154 [0,1,0,0,0,0|2,0,0]=3 1708 B11R0.305 COC(C)(COCCCBr)OC 34a_100011217188_100000766008 [0,1,0,0,0,0|2,0,0]=3 1709 B11R0.305 COC(C)(COCCCCl)OC 34a_100000230001_100000766008 [0,1,0,0,0,0|2,0,0]=3 1710 B11R0.305 COC(C)(COCCCF)OC 34a_100000759539_100000766008 [0,1,0,0,0,0|2,0,0]=3 1711 B11R0.305 COC(C)(COCCCN)OC 34a_100000182051_100000766008 [0,1,0,0,0,0|2,0,0]=3 1712 B11R0.305 COC(C)(COCCON)OC 34a_100000700252_100000766008 [0,1,0,0,0,0|3,0,0]=4 1713 B11R0.305 COC(C)(COCCSC)OC 34a_100000230434_100000766008 [0,1,0,0,0,0|2,0,0]=3 1714 B11R0.305 COC(C)(CSCCC#N)OC 62a_100000766008_100011215226 [0,1,0,0,0,0|2,0,1]=4 1715 B11R0.305 COC(C)(CSCCC#N)OC 62a_100011215226_100000766008 [0,1,0,0,0,0|2,0,1]=4 1716 B11R0.305 COC(C)(CSCCCF)OC 62a_100000766008_100011934791 [0,1,0,0,0,0|2,0,0]=3 1717 B11R0.305 COC(C)(CSCCCF)OC 62a_100011934791_100000766008 [0,1,0,0,0,0|2,0,0]=3 1718 B11R0.305 COC(C)(CSCCCO)OC 62a_100000766008_100011215043 [0,1,0,0,0,0|2,0,0]=3 1719 B11R0.305 COC(C)(CSCCCO)OC 62a_100011215043_100000766008 [0,1,0,0,0,0|2,0,0]=3 1720 B11R0.305 COC(C)(CSCCSC)OC 62a_100000212216_100000766008 [0,1,0,0,0,0|2,0,0]=3 1721 B11R0.305 COC(C)(CSCCSC)OC 62a_100000766008_100000751147 [0,1,0,0,0,0|2,0,0]=3 1722 B11R0.305 COCCNCC(C)(OC)OC 2230a_100000209980_100000064154 [0,1,0,0,0,0|2,0,0]=3 1723 B11R0.305 COCCNCC(C)(OC)OC 2230a_100000732740_100011201679 [0,1,0,0,0,0|2,0,0]=3 1724 B11R0.305 COCCOCC(C)(OC)OC 34a_100000210237_100000766008 [0,1,0,0,0,0|2,0,0]=3 1725 B11R0.305 COCCOCP(=O)(OC)OC 34a_100000101693_100011201679 [0,1,0,0,0,0|3,0,0]=4 1726 B11R0.305 COCCSCC(C)(OC)OC 62a_100000233755_100000766008 [0,1,0,0,0,0|2,0,0]=3 1727 B11R0.305 COCCSCC(C)(OC)OC 62a_100000766008_100000233755 [0,1,0,0,0,0|2,0,0]=3 1728 B11R0.305 COCCSC[Si](C)(OC)OC 62a_100000067953_100000233755 [0,1,0,0,0,0|2,1,0]=4 1729 B11R0.305 COCCSC[Si](C)(OC)OC 62a_100000233755_100000067953 [0,1,0,0,0,0|2,1,0]=4 1730 B11R0.305 COP(=O)(CCOCCF)OC 34a_200000043213_100011217306 [0,1,0,0,0,0|3,0,0]=4 1731 B11R0.305 COP(=O)(CCOCCO)OC 34a_200000043213_100000211926 [0,1,0,0,0,0|3,0,0]=4 1732 B11R0.305 COP(=O)(CCOCSC)OC 34a_200000043213_100011218213 [0,1,0,0,0,0|3,0,0]=4 1733 B11R0.305 COP(=O)(COCCCF)OC 34a_100000101693_100011934791 [0,1,0,0,0,0|3,0,0]=4 1734 B11R0.305 COP(=O)(COCCCO)OC 34a_100000101693_100000230001 [0,1,0,0,0,0|3,0,0]=4 1735 B11R0.305 COP(=O)(COCCSC)OC 34a_100000101693_100000212216 [0,1,0,0,0,0|3,0,0]=4 1736 B11R0.305 CO[Si](C)(CCCSCF)OC 62a_100000031653_100015361967 [0,1,0,0,0,0|2,1,0]=4 1737 B11R0.305 CO[Si](C)(CCCSCF)OC 62a_100015361967_100000031653 [0,1,0,0,0,0|2,1,0]=4 1738 B11R0.305 CO[Si](C)(CSCCCF)OC 62a_100000067953_100011934791 [0,1,0,0,0,0|2,1,0]=4 1739 B11R0.305 CO[Si](C)(CSCCCF)OC 62a_100011934791_100000067953 [0,1,0,0,0,0|2,1,0]=4 1740 B11R0.305 CO[Si](C)(CSCCCO)OC 62a_100000067953_100011215043 [0,1,0,0,0,0|2,1,0]=4 1741 B11R0.305 CO[Si](C)(CSCCCO)OC 62a_100011215043_100000067953 [0,1,0,0,0,0|2,1,0]=4 1742 B11R0.305 CO[Si](C)(CSCCSC)OC 62a_100000067953_100000751147 [0,1,0,0,0,0|2,1,0]=4 1743 B11R0.305 CO[Si](C)(CSCCSC)OC 62a_100000212216_100000067953 [0,1,0,0,0,0|2,1,0]=4 1744 B11R1.4 BrCCCOCC1OCCO1 34a_100011217188_100000755774 [0,0,0,1,0,0|2,0,0]=3 1745 B11R1.4 BrCCOCCC1OCCO1 34a_100000211926_100000740749 [0,0,0,1,0,0|2,0,0]=3 1746 B11R1.4 C#CCCNCC1OCCO1 2230a_100000036311_100000688953 [0,0,0,1,0,0|1,0,2]=4 1747 B11R1.4 C#CCCNCC1OCCO1 34a_100000036311_100000688953 [0,0,0,1,0,0|1,0,2]=4 1748 B11R1.4 C#CCCNCC1OCCO1 34a_100000755551_100000755774 [0,0,0,1,0,0|1,0,2]=4 1749 B11R1.4 C#CCCOCC1OCCO1 34a_100000087154_100000688953 [0,0,0,1,0,0|1,0,2]=4 1750 B11R1.4 C#CCCOCC1OCCO1 34a_100011215631_100000755774 [0,0,0,1,0,0|1,0,2]=4 1751 B11R1.4 C#CCCSCC1OCCO1 62a_100000688953_100000755774 [0,0,0,1,0,0|1,0,2]=4 1752 B11R1.4 C#CCCSCC1OCCO1 62a_100000755774_100000688953 [0,0,0,1,0,0|1,0,2]=4 1753 B11R1.4 C#CCNCCC1OCCO1 2230a_100000034215_100000038162 [0,0,0,1,0,0|1,0,2]=4 1754 B11R1.4 C#CCNCCC1OCCO1 34a_100000034215_100000184674 [0,0,0,1,0,0|1,0,2]=4 1755 B11R1.4 C#CCNCCC1OCCO1 34a_100000212058_100000740749 [0,0,0,1,0,0|1,0,2]=4 1756 B11R1.4 C#CCOCCC1OCCO1 34a_100000210247_100000740749 [0,0,0,1,0,0|1,0,2]=4 1757 B11R1.4 C#CCSCCC1OCCO1 62a_100000038162_100000740749 [0,0,0,1,0,0|1,0,2]=4 1758 B11R1.4 C/C=C/CNCC1OCCO1 34a_100000036311_100102629194 [0,0,0,1,0,0|1,0,2]=4 1759 B11R1.4 C/C=C/COCC1OCCO1 34a_100000087154_100102629194 [0,0,0,1,0,0|1,0,2]=4 1760 B11R1.4 C/C=C/COCC1OCCO1 34a_100016270725_100000755774 [0,0,0,1,0,0|1,0,2]=4 1761 B11R1.4 C/C=C/CSCC1OCCO1 62a_100000755774_100102629194 [0,0,0,1,0,0|1,0,2]=4 1762 B11R1.4 C/C=C/CSCC1OCCO1 62a_100102629194_100000755774 [0,0,0,1,0,0|1,0,2]=4 1763 B11R1.4 C=CCCNCC1OCCO1 2230a_100000036311_100000754431 [0,0,0,1,0,0|1,0,2]=4 1764 B11R1.4 C=CCCNCC1OCCO1 2230a_100015191253_100000755774 [0,0,0,1,0,0|1,0,2]=4 1765 B11R1.4 C=CCCNCC1OCCO1 34a_100000036311_100000754431 [0,0,0,1,0,0|1,0,2]=4 1766 B11R1.4 C=CCCOCC1OCCO1 34a_100000087154_100000754431 [0,0,0,1,0,0|1,0,2]=4 1767 B11R1.4 C=CCCOCC1OCCO1 34a_100011205117_100000755774 [0,0,0,1,0,0|1,0,2]=4 1768 B11R1.4 C=CCCSCC1OCCO1 62a_100000754431_100000755774 [0,0,0,1,0,0|1,0,2]=4 1769 B11R1.4 C=CCCSCC1OCCO1 62a_100000755774_100000754431 [0,0,0,1,0,0|1,0,2]=4 1770 B11R1.4 C=CCNCCC1OCCO1 2230a_100000034215_100000210623 [0,0,0,1,0,0|1,0,2]=4 1771 B11R1.4 C=CCNCCC1OCCO1 2230a_100020586998_100000740749 [0,0,0,1,0,0|1,0,2]=4 1772 B11R1.4 C=CCNCCC1OCCO1 34a_100000034215_100015514636 [0,0,0,1,0,0|1,0,2]=4 1773 B11R1.4 C=CCOCCC1OCCO1 34a_200000210373_100000740749 [0,0,0,1,0,0|1,0,2]=4 1774 B11R1.4 C=CCSCCC1OCCO1 62a_100000210623_100000740749 [0,0,0,1,0,0|1,0,2]=4 1775 B11R1.4 CC#CCNCC1OCCO1 2230a_100000036311_100000748600 [0,0,0,1,0,0|1,0,2]=4 1776 B11R1.4 CC#CCNCC1OCCO1 2230a_100000685387_100000755774 [0,0,0,1,0,0|1,0,2]=4 1777 B11R1.4 CC#CCNCC1OCCO1 34a_100000036311_100000748600 [0,0,0,1,0,0|1,0,2]=4 1778 B11R1.4 CC#CCNCC1OCCO1 34a_100000685387_100000755774 [0,0,0,1,0,0|1,0,2]=4 1779 B11R1.4 CC#CCOCC1OCCO1 34a_100000087154_100000748600 [0,0,0,1,0,0|1,0,2]=4 1780 B11R1.4 CC#CCOCC1OCCO1 34a_100000761923_100000755774 [0,0,0,1,0,0|1,0,2]=4 1781 B11R1.4 CC#CCSCC1OCCO1 62a_100000748600_100000755774 [0,0,0,1,0,0|1,0,2]=4 1782 B11R1.4 CC#CCSCC1OCCO1 62a_100000755774_100000748600 [0,0,0,1,0,0|1,0,2]=4 1783 B11R1.4 CC=CCNCC1OCCO1 2230a_100000036311_100000070051 [0,0,0,1,0,0|1,0,2]=4 1784 B11R1.4 CC=CCNCC1OCCO1 34a_100000036311_100000070051 [0,0,0,1,0,0|1,0,2]=4 1785 B11R1.4 CC=CCOCC1OCCO1 34a_100000087154_100000070051 [0,0,0,1,0,0|1,0,2]=4 1786 B11R1.4 CC=CCSCC1OCCO1 62a_100000070051_100000755774 [0,0,0,1,0,0|1,0,2]=4 1787 B11R1.4 CC=CCSCC1OCCO1 62a_100000755774_100000070051 [0,0,0,1,0,0|1,0,2]=4 1788 B11R1.4 CCCCCCN1CCCC1 2230a_100000188435_100000210314 [0,0,0,1,0,0|3,0,0]=4 1789 B11R1.4 CCCCCCN1CCCC1 269982a_100000188435_100000210757 [0,0,0,1,0,0|3,0,0]=4 1790 B11R1.4 CCCCCNC1CCCC1 2230a_100000209983_100000179811 [0,0,0,1,0,0|3,0,0]=4 1791 B11R1.4 CCCCCNC1CCCC1 2230a_100000211070_100000210326 [0,0,0,1,0,0|3,0,0]=4 1792 B11R1.4 CCCCCNC1CCCC1 270004a_100000209983_100000210133 [0,0,0,1,0,0|3,0,0]=4 1793 B11R1.4 CCCCCNC1CCCC1 34a_100000211070_100000718602 [0,0,0,1,0,0|3,0,0]=4 1794 B11R1.4 CCCCCOC1CCCC1 34a_100000210253_100000179811 [0,0,0,1,0,0|3,0,0]=4 1795 B11R1.4 CCCCCOC1CCCC1 34a_100000210269_100000718602 [0,0,0,1,0,0|3,0,0]=4 1796 B11R1.4 CCCCCOC1CCCC1 7a_100000210253_100000179811 [0,0,0,1,0,0|3,0,0]=4 1797 B11R1.4 CCCCCOC1CCCC1 7a_100000210269_100000210326 [0,0,0,1,0,0|3,0,0]=4 1798 B11R1.4 CCCCCOC1CCCO1 34a_100000085407_100000718602 [0,0,0,1,0,0|2,0,0]=3 1799 B11R1.4 CCCCCSC1CCCC1 62a_100000210326_100000179811 [0,0,0,1,0,0|3,0,0]=4 1800 B11R1.4 CCCCCSC1CCCC1 62a_100011217020_100000210326 [0,0,0,1,0,0|3,0,0]=4 1801 B11R1.4 CCCCNCC1CCCC1 2230a_100000102301_100000740388 [0,0,0,1,0,0|3,0,0]=4 1802 B11R1.4 CCCCNCC1CCCC1 2230a_100000737975_100000210211 [0,0,0,1,0,0|3,0,0]=4 1803 B11R1.4 CCCCNCC1CCCC1 269862a_100000102301_100000746403 [0,0,0,1,0,0|3,0,0]=4 1804 B11R1.4 CCCCNCC1CCCC1 34a_100000737975_100000210210 [0,0,0,1,0,0|3,0,0]=4 1805 B11R1.4 CCCCNCC1CCCC1 7a_106832991798_100000740388 [0,0,0,1,0,0|3,0,0]=4 1806 B11R1.4 CCCCNCC1CCCO1 2230a_100000102301_100000203698 [0,0,0,1,0,0|2,0,0]=3 1807 B11R1.4 CCCCNCC1CCCO1 7a_106832991798_100000203698 [0,0,0,1,0,0|2,0,0]=3 1808 B11R1.4 CCCCNCC1OCCO1 2230a_100000036311_100000210211 [0,0,0,1,0,0|1,0,0]=2 1809 B11R1.4 CCCCNCC1OCCO1 2230a_100000102301_100000755774 [0,0,0,1,0,0|1,0,0]=2 1810 B11R1.4 CCCCNCC1OCCO1 34a_100000036311_100000210210 [0,0,0,1,0,0|1,0,0]=2 1811 B11R1.4 CCCCNCC1OCCO1 7a_106832991798_100000755774 [0,0,0,1,0,0|1,0,0]=2 1812 B11R1.4 CCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210211 [0,0,0,1,0,0|2,0,0]=3 1813 B11R1.4 CCCCNC[C@@H]1CCCO1 34a_100020590478_100000210210 [0,0,0,1,0,0|2,0,0]=3 1814 B11R1.4 CCCCOCC1CCCC1 34a_100000210227_100000740388 [0,0,0,1,0,0|3,0,0]=4 1815 B11R1.4 CCCCOCC1CCCC1 34a_100000742336_100000210210 [0,0,0,1,0,0|3,0,0]=4 1816 B11R1.4 CCCCOCC1CCCC1 7a_100000210227_100000740388 [0,0,0,1,0,0|3,0,0]=4 1817 B11R1.4 CCCCOCC1CCCC1 7a_100000742336_100000210211 [0,0,0,1,0,0|3,0,0]=4 1818 B11R1.4 CCCCOCC1CCCO1 34a_100000210270_100000210210 [0,0,0,1,0,0|2,0,0]=3 1819 B11R1.4 CCCCOCC1CCCO1 7a_100000210227_100000203698 [0,0,0,1,0,0|2,0,0]=3 1820 B11R1.4 CCCCOCC1CCCO1 7a_100000210270_100000210211 [0,0,0,1,0,0|2,0,0]=3 1821 B11R1.4 CCCCOCC1COCO1 34a_100011216627_100000210210 [0,0,0,1,0,0|3,0,0]=4 1822 B11R1.4 CCCCOCC1OCCO1 34a_100000087154_100000210210 [0,0,0,1,0,0|1,0,0]=2 1823 B11R1.4 CCCCOCC1OCCO1 34a_100000210227_100000755774 [0,0,0,1,0,0|1,0,0]=2 1824 B11R1.4 CCCCOCC1OCCO1 7a_100000210227_100000755774 [0,0,0,1,0,0|1,0,0]=2 1825 B11R1.4 CCCCOC[C@H]1CCCN1 34a_100000745186_100000210210 [0,0,0,1,0,0|3,0,0]=4 1826 B11R1.4 CCCCSCC1CCCC1 62a_100000210211_100000740388 [0,0,0,1,0,0|3,0,0]=4 1827 B11R1.4 CCCCSCC1CCCC1 62a_100000740388_100000210210 [0,0,0,1,0,0|3,0,0]=4 1828 B11R1.4 CCCCSCC1CCCO1 62a_100000203698_100000210210 [0,0,0,1,0,0|2,0,0]=3 1829 B11R1.4 CCCCSCC1CCCO1 62a_100000210211_100000203698 [0,0,0,1,0,0|2,0,0]=3 1830 B11R1.4 CCCCSCC1OCCO1 62a_100000210211_100000755774 [0,0,0,1,0,0|1,0,0]=2 1831 B11R1.4 CCCCSCC1OCCO1 62a_100000755774_100000210210 [0,0,0,1,0,0|1,0,0]=2 1832 B11R1.4 CCCNCCC1CCCC1 2230a_100000739158_100000210303 [0,0,0,1,0,0|3,0,0]=4 1833 B11R1.4 CCCNCCC1CCCC1 34a_100000739158_100000210303 [0,0,0,1,0,0|3,0,0]=4 1834 B11R1.4 CCCNCCC1OCCO1 2230a_100000034215_100000210303 [0,0,0,1,0,0|1,0,0]=2 1835 B11R1.4 CCCNCCC1OCCO1 34a_100000034215_100000210303 [0,0,0,1,0,0|1,0,0]=2 1836 B11R1.4 CCCOCCC1CCCC1 34a_100000210258_100000760354 [0,0,0,1,0,0|3,0,0]=4 1837 B11R1.4 CCCOCCC1CCCC1 34a_100000749090_100000210303 [0,0,0,1,0,0|3,0,0]=4 1838 B11R1.4 CCCOCCC1CCCC1 7a_100000749090_100000210303 [0,0,0,1,0,0|3,0,0]=4 1839 B11R1.4 CCCOCCC1OCCO1 34a_100000210258_100000740749 [0,0,0,1,0,0|1,0,0]=2 1840 B11R1.4 CCCSCCC1CCCC1 62a_100000210303_100000760354 [0,0,0,1,0,0|3,0,0]=4 1841 B11R1.4 CCCSCCC1CCCC1 62a_100000760354_100000210303 [0,0,0,1,0,0|3,0,0]=4 1842 B11R1.4 CCCSCCC1OCCO1 62a_100000210303_100000740749 [0,0,0,1,0,0|1,0,0]=2 1843 B11R1.4 CCNCCCC1CCCC1 2230a_100000736752_100000210202 [0,0,0,1,0,0|3,0,0]=4 1844 B11R1.4 CCNCCCC1CCCC1 2230a_100015525214_100011713738 [0,0,0,1,0,0|3,0,0]=4 1845 B11R1.4 CCNCCCC1CCCC1 34a_100000736752_100000210202 [0,0,0,1,0,0|3,0,0]=4 1846 B11R1.4 CCNCCCC1OCCO1 2230a_100015525214_100000042513 [0,0,0,1,0,0|1,0,0]=2 1847 B11R1.4 CCOCCCC1CCCC1 34a_100011215328_100000210202 [0,0,0,1,0,0|3,0,0]=4 1848 B11R1.4 CCOCCCC1CCCC1 34a_100121572206_100011713738 [0,0,0,1,0,0|3,0,0]=4 1849 B11R1.4 CCOCCCC1CCCC1 7a_100011215328_100000210202 [0,0,0,1,0,0|3,0,0]=4 1850 B11R1.4 CCOCCCC1OCCO1 34a_100009871617_100000210202 [0,0,0,1,0,0|1,0,0]=2 1851 B11R1.4 CCOCCCC1OCCO1 34a_100121572206_100009861162 [0,0,0,1,0,0|1,0,0]=2 1852 B11R1.4 CCOCCCC1OCCO1 7a_100009871617_100000210202 [0,0,0,1,0,0|1,0,0]=2 1853 B11R1.4 CCOCCOC1CCCO1 34a_100000085407_100000210147 [0,0,0,1,0,0|3,0,0]=4 1854 B11R1.4 CCOCSCC1CCCO1 62a_100000203698_100000739092 [0,0,0,1,0,0|3,0,0]=4 1855 B11R1.4 CCOCSCC1CCCO1 62a_100000739092_100000203698 [0,0,0,1,0,0|3,0,0]=4 1856 B11R1.4 CCOCSCC1OCCO1 62a_100000739092_100000755774 [0,0,0,1,0,0|2,0,0]=3 1857 B11R1.4 CCOCSCC1OCCO1 62a_100000755774_100000739092 [0,0,0,1,0,0|2,0,0]=3 1858 B11R1.4 CCSCCCC1CCCC1 62a_100000210202_100011713738 [0,0,0,1,0,0|3,0,0]=4 1859 B11R1.4 CCSCCCC1CCCC1 62a_100011713738_100000210202 [0,0,0,1,0,0|3,0,0]=4 1860 B11R1.4 CCSCCCC1OCCO1 62a_100000210202_100000042513 [0,0,0,1,0,0|1,0,0]=2 1861 B11R1.4 CCSCCOC1CCCO1 34a_100000085407_100000757381 [0,0,0,1,0,0|3,0,0]=4 1862 B11R1.4 CNCCCCC1OCCO1 2230a_106832991635_100000034956 [0,0,0,1,0,0|1,0,0]=2 1863 B11R1.4 CNCCCCC1OCCO1 34a_100102657272_200009813554 [0,0,0,1,0,0|1,0,0]=2 1864 B11R1.4 CNCCCCC1OCCO1 7a_106832991635_100000034956 [0,0,0,1,0,0|1,0,0]=2 1865 B11R1.4 COCCCCC1OCCO1 34a_100138415774_200009813554 [0,0,0,1,0,0|1,0,0]=2 1866 B11R1.4 COCCCOC1CCCO1 34a_100000085407_100000740836 [0,0,0,1,0,0|3,0,0]=4 1867 B11R1.4 COCCNCC1CCCO1 2230a_100000209980_100000203698 [0,0,0,1,0,0|3,0,0]=4 1868 B11R1.4 COCCNCC1OCCO1 2230a_100000036311_100011201679 [0,0,0,1,0,0|2,0,0]=3 1869 B11R1.4 COCCNCC1OCCO1 2230a_100000209980_100000755774 [0,0,0,1,0,0|2,0,0]=3 1870 B11R1.4 COCCNCC1OCCO1 34a_100000036311_100011201679 [0,0,0,1,0,0|2,0,0]=3 1871 B11R1.4 COCCNC[C@@H]1CCCO1 2230a_100020590478_100011201679 [0,0,0,1,0,0|3,0,0]=4 1872 B11R1.4 COCCNC[C@@H]1CCCO1 34a_100020590478_100011201679 [0,0,0,1,0,0|3,0,0]=4 1873 B11R1.4 COCCOCC1CCCO1 34a_100000210270_100011201679 [0,0,0,1,0,0|3,0,0]=4 1874 B11R1.4 COCCOCC1CCCO1 7a_100000210270_100000233755 [0,0,0,1,0,0|3,0,0]=4 1875 B11R1.4 COCCOCC1OCCO1 34a_100000087154_100011201679 [0,0,0,1,0,0|2,0,0]=3 1876 B11R1.4 COCCOCC1OCCO1 34a_100000210237_100000755774 [0,0,0,1,0,0|2,0,0]=3 1877 B11R1.4 COCCSCC1CCCO1 62a_100000203698_100000233755 [0,0,0,1,0,0|3,0,0]=4 1878 B11R1.4 COCCSCC1CCCO1 62a_100000233755_100000203698 [0,0,0,1,0,0|3,0,0]=4 1879 B11R1.4 COCCSCC1OCCO1 62a_100000233755_100000755774 [0,0,0,1,0,0|2,0,0]=3 1880 B11R1.4 COCCSCC1OCCO1 62a_100000755774_100000233755 [0,0,0,1,0,0|2,0,0]=3 1881 B11R1.4 COCNCCC1OCCO1 2230a_100000034215_100000766300 [0,0,0,1,0,0|2,0,0]=3 1882 B11R1.4 COCSCCC1OCCO1 62a_100000766300_100000740749 [0,0,0,1,0,0|2,0,0]=3 1883 B11R1.4 CSCCCCC1OCCO1 62a_200000210301_100000034956 [0,0,0,1,0,0|1,0,0]=2 1884 B11R1.4 CSCCNCC1CCCO1 2230a_100020590264_100000203698 [0,0,0,1,0,0|3,0,0]=4 1885 B11R1.4 CSCCNCC1OCCO1 2230a_100000036311_100000751147 [0,0,0,1,0,0|2,0,0]=3 1886 B11R1.4 CSCCNCC1OCCO1 2230a_100020590264_100000755774 [0,0,0,1,0,0|2,0,0]=3 1887 B11R1.4 CSCCNCC1OCCO1 34a_100000036311_100000212216 [0,0,0,1,0,0|2,0,0]=3 1888 B11R1.4 CSCCNC[C@@H]1CCCO1 2230a_100020590478_100000751147 [0,0,0,1,0,0|3,0,0]=4 1889 B11R1.4 CSCCNC[C@@H]1CCCO1 34a_100020590478_100000212216 [0,0,0,1,0,0|3,0,0]=4 1890 B11R1.4 CSCCOCC1CCCO1 34a_100000210270_100000212216 [0,0,0,1,0,0|3,0,0]=4 1891 B11R1.4 CSCCOCC1CCCO1 7a_100000210270_100000212216 [0,0,0,1,0,0|3,0,0]=4 1892 B11R1.4 CSCCOCC1CCCO1 7a_100000230434_100000203698 [0,0,0,1,0,0|3,0,0]=4 1893 B11R1.4 CSCCOCC1OCCO1 34a_100000087154_100000212216 [0,0,0,1,0,0|2,0,0]=3 1894 B11R1.4 CSCCOCC1OCCO1 34a_100000230434_100000755774 [0,0,0,1,0,0|2,0,0]=3 1895 B11R1.4 CSCCOCC1OCCO1 7a_100000230434_100000755774 [0,0,0,1,0,0|2,0,0]=3 1896 B11R1.4 CSCCSCC1CCCO1 62a_100000203698_100000751147 [0,0,0,1,0,0|3,0,0]=4 1897 B11R1.4 CSCCSCC1CCCO1 62a_100000212216_100000203698 [0,0,0,1,0,0|3,0,0]=4 1898 B11R1.4 CSCCSCC1OCCO1 62a_100000212216_100000755774 [0,0,0,1,0,0|2,0,0]=3 1899 B11R1.4 CSCCSCC1OCCO1 62a_100000755774_100000751147 [0,0,0,1,0,0|2,0,0]=3 1900 B11R1.4 CSCNCCC1OCCO1 2230a_100000034215_100011218213 [0,0,0,1,0,0|2,0,0]=3 1901 B11R1.4 CSCNCCC1OCCO1 34a_100000034215_100011218213 [0,0,0,1,0,0|2,0,0]=3 1902 B11R1.4 CSCSCCC1OCCO1 62a_100011218213_100000740749 [0,0,0,1,0,0|2,0,0]=3 1903 B11R1.4 ClCCCOCC1OCCO1 34a_100000230001_100000755774 [0,0,0,1,0,0|2,0,0]=3 1904 B11R1.4 FCCCCOC1CCCO1 34a_100000085407_100000729493 [0,0,0,1,0,0|3,0,0]=4 1905 B11R1.4 FCCCNCC1CCCO1 2230a_100015189416_100000203698 [0,0,0,1,0,0|3,0,0]=4 1906 B11R1.4 FCCCNCC1OCCO1 2230a_100000036311_100011934791 [0,0,0,1,0,0|2,0,0]=3 1907 B11R1.4 FCCCNCC1OCCO1 2230a_100015189416_100000755774 [0,0,0,1,0,0|2,0,0]=3 1908 B11R1.4 FCCCNCC1OCCO1 34a_100000036311_100011934791 [0,0,0,1,0,0|2,0,0]=3 1909 B11R1.4 FCCCNCC1OCCO1 34a_100015189416_100000755774 [0,0,0,1,0,0|2,0,0]=3 1910 B11R1.4 FCCCNC[C@@H]1CCCO1 2230a_100020590478_100011934791 [0,0,0,1,0,0|3,0,0]=4 1911 B11R1.4 FCCCNC[C@@H]1CCCO1 34a_100020590478_100011934791 [0,0,0,1,0,0|3,0,0]=4 1912 B11R1.4 FCCCOCC1CCCO1 34a_100000210270_100011934791 [0,0,0,1,0,0|3,0,0]=4 1913 B11R1.4 FCCCOCC1CCCO1 7a_100000210270_100011934791 [0,0,0,1,0,0|3,0,0]=4 1914 B11R1.4 FCCCOCC1OCCO1 34a_100000087154_100011934791 [0,0,0,1,0,0|2,0,0]=3 1915 B11R1.4 FCCCOCC1OCCO1 34a_100000759539_100000755774 [0,0,0,1,0,0|2,0,0]=3 1916 B11R1.4 FCCCSCC1CCCO1 62a_100000203698_100011934791 [0,0,0,1,0,0|3,0,0]=4 1917 B11R1.4 FCCCSCC1CCCO1 62a_100011934791_100000203698 [0,0,0,1,0,0|3,0,0]=4 1918 B11R1.4 FCCCSCC1OCCO1 62a_100000755774_100011934791 [0,0,0,1,0,0|2,0,0]=3 1919 B11R1.4 FCCCSCC1OCCO1 62a_100011934791_100000755774 [0,0,0,1,0,0|2,0,0]=3 1920 B11R1.4 FCCNCCC1OCCO1 2230a_100000034215_100011217306 [0,0,0,1,0,0|2,0,0]=3 1921 B11R1.4 FCCNCCC1OCCO1 34a_100000034215_100011217306 [0,0,0,1,0,0|2,0,0]=3 1922 B11R1.4 FCCNCCC1OCCO1 34a_100000724931_100000740749 [0,0,0,1,0,0|2,0,0]=3 1923 B11R1.4 FCCSCCC1OCCO1 62a_100011217306_100000740749 [0,0,0,1,0,0|2,0,0]=3 1924 B11R1.4 FCOCCCC1OCCO1 34a_100009871617_100015361967 [0,0,0,1,0,0|2,0,0]=3 1925 B11R1.4 FCOCCCC1OCCO1 7a_100009871617_100015361967 [0,0,0,1,0,0|2,0,0]=3 1926 B11R1.4 FCSCCCC1OCCO1 62a_100015361967_100000042513 [0,0,0,1,0,0|2,0,0]=3 1927 B11R1.4 N#CCCNCC1OCCO1 2230a_100000036311_100011215226 [0,0,0,1,0,0|2,0,1]=4 1928 B11R1.4 N#CCCSCC1OCCO1 62a_100000755774_100011215226 [0,0,0,1,0,0|2,0,1]=4 1929 B11R1.4 N#CCCSCC1OCCO1 62a_100011215226_100000755774 [0,0,0,1,0,0|2,0,1]=4 1930 B11R1.4 N#CCNCCC1OCCO1 2230a_100000034215_100011215382 [0,0,0,1,0,0|2,0,1]=4 1931 B11R1.4 N#CCSCCC1OCCO1 62a_100011215382_100000740749 [0,0,0,1,0,0|2,0,1]=4 1932 B11R1.4 NCCCOCC1OCCO1 34a_100000182051_100000755774 [0,0,0,1,0,0|2,0,0]=3 1933 B11R1.4 NCCOCCC1OCCO1 34a_100000210304_100000740749 [0,0,0,1,0,0|2,0,0]=3 1934 B11R1.4 NOCCOCC1OCCO1 34a_100000700252_100000755774 [0,0,0,1,0,0|3,0,0]=4 1935 B11R1.4 O=CCNCCC1OCCO1 2230a_100000034215_200015260668 [0,0,0,1,0,0|2,0,1]=4 1936 B11R1.4 O=CCNCCC1OCCO1 34a_100000034215_200009817547 [0,0,0,1,0,0|2,0,1]=4 1937 B11R1.4 O=CCSCCC1OCCO1 62a_200015260668_100000740749 [0,0,0,1,0,0|2,0,1]=4 1938 B11R1.4 OCCCCOC1CCCO1 34a_100000085407_100011216708 [0,0,0,1,0,0|3,0,0]=4 1939 B11R1.4 OCCCNCC1OCCO1 2230a_100000036311_100000230001 [0,0,0,1,0,0|2,0,0]=3 1940 B11R1.4 OCCCNCC1OCCO1 34a_100000036311_100000230001 [0,0,0,1,0,0|2,0,0]=3 1941 B11R1.4 OCCCNC[C@@H]1CCCO1 2230a_100020590478_100000230001 [0,0,0,1,0,0|3,0,0]=4 1942 B11R1.4 OCCCNC[C@@H]1CCCO1 34a_100020590478_100000230001 [0,0,0,1,0,0|3,0,0]=4 1943 B11R1.4 OCCCOCC1CCCO1 34a_100000210270_100000230001 [0,0,0,1,0,0|3,0,0]=4 1944 B11R1.4 OCCCOCC1CCCO1 7a_100000210270_100011215043 [0,0,0,1,0,0|3,0,0]=4 1945 B11R1.4 OCCCOCC1OCCO1 34a_100000087154_100000230001 [0,0,0,1,0,0|2,0,0]=3 1946 B11R1.4 OCCCSCC1CCCO1 62a_100000203698_100011215043 [0,0,0,1,0,0|3,0,0]=4 1947 B11R1.4 OCCCSCC1CCCO1 62a_100011215043_100000203698 [0,0,0,1,0,0|3,0,0]=4 1948 B11R1.4 OCCCSCC1OCCO1 62a_100000755774_100011215043 [0,0,0,1,0,0|2,0,0]=3 1949 B11R1.4 OCCCSCC1OCCO1 62a_100011215043_100000755774 [0,0,0,1,0,0|2,0,0]=3 1950 B11R1.4 OCCNCCC1OCCO1 2230a_100000034215_100000211926 [0,0,0,1,0,0|2,0,0]=3 1951 B11R1.4 OCCNCCC1OCCO1 2230a_100016997473_100000740749 [0,0,0,1,0,0|2,0,0]=3 1952 B11R1.4 OCCNCCC1OCCO1 34a_100000034215_100000211926 [0,0,0,1,0,0|2,0,0]=3 1953 B11R1.4 OCCNCCC1OCCO1 34a_100016990907_100000740749 [0,0,0,1,0,0|2,0,0]=3 1954 B11R1.4 OCCSCCC1OCCO1 62a_100000211926_100000740749 [0,0,0,1,0,0|2,0,0]=3 1955 B11R1.4 [13CH3]SCCCCC1OCCO1 62a_200025704644_100000034956 [0,0,0,1,0,0|1,0,0]=2 1956 B11R1.12 CCC(NC)C1CCCCC1 269862a_106832991636_100011216311 [0,0,0,1,0,0|2,0,0]=3 1957 B11R1.12 CCC(NC)C1CCOCC1 269862a_106832991636_100000765628 [0,0,0,1,0,0|3,0,0]=4 1958 B11R1.12 CCC(OC)C1CCCCC1 34a_100011215090_200000210301 [0,0,0,1,0,0|1,0,0]=2 1959 B11R1.12 CCC(OC)C1CCCCC1 7a_100011215090_200000210301 [0,0,0,1,0,0|1,0,0]=2 1960 B11R1.12 CCC(OC)C1CCNCC1 34a_100011935121_200000210301 [0,0,0,1,0,0|2,0,0]=3 1961 B11R1.12 CCC(O[13CH3])C1CCCCC1 34a_100011215090_200025704644 [0,0,0,1,0,0|1,0,0]=2 1962 B11R1.12 CCC(O[13CH3])C1CCCCC1 7a_100011215090_200025704644 [0,0,0,1,0,0|1,0,0]=2 1963 B11R1.12 CCC(O[13CH3])C1CCNCC1 34a_100011935121_200025704644 [0,0,0,1,0,0|2,0,0]=3 1964 B11R1.12 CCN(CC)C1CCCCC1 2230a_100000201195_100000210202 [0,0,0,1,0,0|3,0,0]=4 1965 B11R1.12 CCN(CC)C1CCCCC1 269956a_100000042499_100000210327 [0,0,0,1,0,0|3,0,0]=4 1966 B11R1.12 CCN(CC)C1CCCCC1 269982a_100000201195_100000204670 [0,0,0,1,0,0|3,0,0]=4 1967 B11R1.12 CCN(CC)C1CCCCC1 269982a_100000724800_100000210327 [0,0,0,1,0,0|3,0,0]=4 1968 B11R1.12 CCN(CC)C1CCCCC1 270004a_100000724800_100000210434 [0,0,0,1,0,0|3,0,0]=4 1969 B11R1.12 CCN(CC)C1CCCCC1 34a_100000201195_100000210202 [0,0,0,1,0,0|3,0,0]=4 1970 B11R1.12 CC[C@H](NC)C1CCCCC1 2230a_100020639352_200000210301 [0,0,0,1,0,0|2,0,0]=3 1971 B11R1.12 CC[C@H](NC)C1CCCCC1 34a_100020639352_200000210301 [0,0,0,1,0,0|2,0,0]=3 1972 B11R1.12 CC[C@H](N[13CH3])C1CCCCC1 2230a_100020639352_200025704644 [0,0,0,1,0,0|2,0,0]=3 1973 B11R1.12 CC[C@H](N[13CH3])C1CCCCC1 34a_100020639352_200025704644 [0,0,0,1,0,0|2,0,0]=3 1974 B11R1.12 CNC(C#N)C1CCCCC1 2230a_100000767018_200000210301 [0,0,0,1,0,0|3,0,0]=4 1975 B11R1.12 CNC(C#N)C1CCCCC1 34a_100000767018_200000210301 [0,0,0,1,0,0|3,0,0]=4 1976 B11R1.12 CN[C@@H](CO)C1CCCCC1 2230a_100009817630_200000210301 [0,0,0,1,0,0|3,0,0]=4 1977 B11R1.12 CN[C@@H](CO)C1CCCCC1 34a_100009817630_200000210301 [0,0,0,1,0,0|3,0,0]=4 1978 B11R1.12 [13CH3]NC(C#N)C1CCCCC1 2230a_100000767018_200025704644 [0,0,0,1,0,0|3,0,0]=4 1979 B11R1.12 [13CH3]NC(C#N)C1CCCCC1 34a_100000767018_200025704644 [0,0,0,1,0,0|3,0,0]=4 1980 B11R1.12 [13CH3]N[C@@H](CO)C1CCCCC1 2230a_100009817630_200025704644 [0,0,0,1,0,0|3,0,0]=4 1981 B11R1.12 [13CH3]N[C@@H](CO)C1CCCCC1 34a_100009817630_200025704644 [0,0,0,1,0,0|3,0,0]=4 1982 B11R1.83 CCCC1CCC(CC1)NC 2230a_100011234333_200000210301 [0,0,0,1,0,0|2,0,0]=3 1983 B11R1.83 CCCC1CCC(CC1)NC 270004a_106832991635_100000185488 [0,0,0,1,0,0|2,0,0]=3 1984 B11R1.83 CCCC1CCC(CC1)NC 34a_100011234333_200000210301 [0,0,0,1,0,0|2,0,0]=3 1985 B11R1.83 CCCC1CCC(CC1)N[13CH3] 2230a_100011234333_200025704644 [0,0,0,1,0,0|2,0,0]=3 1986 B11R1.83 CCCC1CCC(CC1)N[13CH3] 34a_100011234333_200025704644 [0,0,0,1,0,0|2,0,0]=3 1987 B11R1.83 CCCC1CCC(CC1)OC 34a_100011218949_200000210301 [0,0,0,1,0,0|1,0,0]=2 1988 B11R1.83 CCCC1CCC(CC1)OC 7a_100011218949_200000210301 [0,0,0,1,0,0|1,0,0]=2 1989 B11R1.83 CCCC1CCC(CC1)O[13CH3] 34a_100011218949_200025704644 [0,0,0,1,0,0|1,0,0]=2 1990 B11R1.83 CCCC1CCC(CC1)O[13CH3] 7a_100011218949_200025704644 [0,0,0,1,0,0|1,0,0]=2 1991 B11R1.83 CCCC1CCN(CC1)CC 2230a_100015355601_100000210202 [0,0,0,1,0,0|3,0,0]=4 1992 B11R1.83 CCCC1CCN(CC1)CC 269982a_100015355601_100000204670 [0,0,0,1,0,0|3,0,0]=4 1993 B11R1.83 CCCC1CCN(CC1)CC 34a_100015355601_100000210202 [0,0,0,1,0,0|3,0,0]=4 1994 B11R1.83 CCCN1CCC(CC1)CC 2230a_100000754474_100000210303 [0,0,0,1,0,0|3,0,0]=4 1995 B11R1.83 CCCN1CCC(CC1)CC 269982a_100000754474_100000210303 [0,0,0,1,0,0|3,0,0]=4 1996 B11R1.83 CCCN1CCC(CC1)CC 34a_100000754474_100000210303 [0,0,0,1,0,0|3,0,0]=4 1997 B11R1.83 CCCN1CCC(CC1)NC 270004a_106832991635_100000211099 [0,0,0,1,0,0|3,0,0]=4 1998 B11R1.83 CCCN1CCC(CC1)OC 2230a_100000234800_100000210303 [0,0,0,1,0,0|2,0,0]=3 1999 B11R1.83 CCCN1CCC(CC1)OC 269982a_100000234800_100000210303 [0,0,0,1,0,0|2,0,0]=3 2000 B11R1.83 CCCN1CCC(CC1)OC 34a_100000234800_100000210303 [0,0,0,1,0,0|2,0,0]=3 2001 B11R1.83 CCCN1CCC(CC1)SC 2230a_100015202541_100000210303 [0,0,0,1,0,0|2,1,0]=4 2002 B11R1.83 CCCN1CCC(CC1)SC 269982a_100015202541_100000210303 [0,0,0,1,0,0|2,1,0]=4 2003 B11R1.83 CCCN1CCC(CC1)SC 34a_100015202541_100000210303 [0,0,0,1,0,0|2,1,0]=4 2004 B11R1.83 CCNC1CCC(CC1)CC 2230a_100011194317_100000210202 [0,0,0,1,0,0|3,0,0]=4 2005 B11R1.83 CCNC1CCC(CC1)CC 270004a_100015525214_100000210631 [0,0,0,1,0,0|3,0,0]=4 2006 B11R1.83 CCNC1CCC(CC1)CC 34a_100011194317_100000210202 [0,0,0,1,0,0|3,0,0]=4 2007 B11R1.83 CCNC1CCC(CC1)NC 270004a_100015525214_200016988011 [0,0,0,1,0,0|3,0,0]=4 2008 B11R1.83 CCNC1CCC(CC1)OC 270004a_100015525214_100000747084 [0,0,0,1,0,0|2,0,0]=3 2009 B11R1.83 CCNC1CCC(CC1)OC 34a_100015205214_100000210202 [0,0,0,1,0,0|2,0,0]=3 2010 B11R1.83 CCOC1CCC(CC1)CC 34a_100011215326_100000210202 [0,0,0,1,0,0|3,0,0]=4 2011 B11R1.83 CCOC1CCC(CC1)CC 7a_100011215326_100000210202 [0,0,0,1,0,0|3,0,0]=4 2012 B11R1.83 CCOC1CCC(CC1)NC 270004a_106832991635_100012183323 [0,0,0,1,0,0|3,0,0]=4 2013 B11R1.83 CCOC1CCC(CC1)OC 34a_100011581665_100000210202 [0,0,0,1,0,0|2,0,0]=3 2014 B11R1.83 CCOC1CCC(CC1)OC 7a_100011581665_100000210202 [0,0,0,1,0,0|2,0,0]=3 2015 B11R1.83 CCO[C@H]1CC[C@H](CC1)NC 34a_100020636401_100000210202 [0,0,0,1,0,0|3,0,0]=4 2016 B11R1.83 CNC1CCC(CC1)CCO 2230a_100000070672_200000210301 [0,0,0,1,0,0|3,0,0]=4 2017 B11R1.83 CNC1CCC(CC1)CCO 34a_100000070672_200000210301 [0,0,0,1,0,0|3,0,0]=4 2018 B11R1.83 CNCC1CCC(CC1)OC 2230a_106832991635_100013032858 [0,0,0,1,0,0|2,0,0]=3 2019 B11R1.83 CNCC1CCC(CC1)OC 34a_100102657272_100013032858 [0,0,0,1,0,0|2,0,0]=3 2020 B11R1.83 CNCC1CCC(CC1)OC 7a_106832991635_100013032858 [0,0,0,1,0,0|2,0,0]=3 2021 B11R1.83 CN[C@H]1CC[C@@H](CC1)COC 34a_100009831571_200000210301 [0,0,0,1,0,0|3,0,0]=4 2022 B11R1.83 CN[C@H]1CC[C@@H](CC1)CO[13CH3] 34a_100009831571_200025704644 [0,0,0,1,0,0|3,0,0]=4 2023 B11R1.83 COC1CCC(CC1)CCN 34a_200011935226_200000210301 [0,0,0,1,0,0|2,0,0]=3 2024 B11R1.83 COC1CCC(CC1)CSC 62a_100013032858_200000210301 [0,0,0,1,0,0|2,0,0]=3 2025 B11R1.83 COC1CCC(CC1)CSC 62a_200000210301_100013032858 [0,0,0,1,0,0|2,0,0]=3 2026 B11R1.83 COC1CCC(CC1)CS[13CH3] 62a_100013032858_200025704644 [0,0,0,1,0,0|2,0,0]=3 2027 B11R1.83 COC1CCC(CC1)CS[13CH3] 62a_200025704644_100013032858 [0,0,0,1,0,0|2,0,0]=3 2028 B11R1.83 COC1CCC(CC1)NCF 34a_100015205214_100015361967 [0,0,0,1,0,0|3,0,0]=4 2029 B11R1.83 COC1CCC(CC1)OCF 34a_100011581665_100015361967 [0,0,0,1,0,0|3,0,0]=4 2030 B11R1.83 COC1CCC(CC1)OCF 7a_100011581665_100015361967 [0,0,0,1,0,0|3,0,0]=4 2031 B11R1.83 COC1CCN(CC1)CCF 2230a_100000234800_100011217306 [0,0,0,1,0,0|3,0,0]=4 2032 B11R1.83 COC1CCN(CC1)CCF 269982a_100000234800_100011217306 [0,0,0,1,0,0|3,0,0]=4 2033 B11R1.83 COC1CCN(CC1)CCF 34a_100000234800_100011217306 [0,0,0,1,0,0|3,0,0]=4 2034 B11R1.83 COC1CCN(CC1)CCO 2230a_100000234800_100000211926 [0,0,0,1,0,0|3,0,0]=4 2035 B11R1.83 COC1CCN(CC1)CCO 269982a_100000234800_100000211926 [0,0,0,1,0,0|3,0,0]=4 2036 B11R1.83 COC1CCN(CC1)CCO 34a_100000234800_100000211926 [0,0,0,1,0,0|3,0,0]=4 2037 B11R1.83 COC1CCN(CC1)CSC 2230a_100000234800_100011218213 [0,0,0,1,0,0|3,0,0]=4 2038 B11R1.83 COC1CCN(CC1)CSC 269982a_100000234800_100011218213 [0,0,0,1,0,0|3,0,0]=4 2039 B11R1.83 COC1CCN(CC1)CSC 34a_100000234800_100011218213 [0,0,0,1,0,0|3,0,0]=4 2040 B11R1.83 COCC1CCC(CC1)OC 34a_100138415774_100013032858 [0,0,0,1,0,0|2,0,0]=3 2041 B11R1.83 COCN1CCC(CC1)OC 2230a_100000234800_100000766300 [0,0,0,1,0,0|3,0,0]=4 2042 B11R1.83 COCN1CCC(CC1)OC 269982a_100000234800_100000766300 [0,0,0,1,0,0|3,0,0]=4 2043 B11R1.83 [13CH3]NC1CCC(CC1)CCO 2230a_100000070672_200025704644 [0,0,0,1,0,0|3,0,0]=4 2044 B11R1.83 [13CH3]NC1CCC(CC1)CCO 34a_100000070672_200025704644 [0,0,0,1,0,0|3,0,0]=4 2045 B11R1.83 [13CH3]OC1CCC(CC1)CCN 34a_200011935226_200025704644 [0,0,0,1,0,0|2,0,0]=3 2046 B11R1.84 CCC(CC)CN1CCCC1 2230a_100000188435_100011215472 [0,0,0,1,0,0|3,0,0]=4 2047 B11R1.84 CCC(CC)CN1CCCC1 269982a_100000188435_100011215472 [0,0,0,1,0,0|3,0,0]=4 2048 B11R1.84 CCC(CC)CN1CCCC1 270004a_100000188435_100000211137 [0,0,0,1,0,0|3,0,0]=4 2049 B11R1.84 CCC(CC)NC1CCCC1 2230a_100000199018_100000179811 [0,0,0,1,0,0|3,0,0]=4 2050 B11R1.84 CCC(CC)NC1CCCC1 270004a_100000199018_100000210133 [0,0,0,1,0,0|3,0,0]=4 2051 B11R1.84 CCC(CC)NC1CCCC1 270004a_100000211070_100000210860 [0,0,0,1,0,0|3,0,0]=4 2052 B11R1.84 CCC(CC)OC1CCCC1 7a_100000210269_100000210505 [0,0,0,1,0,0|3,0,0]=4 2053 B11R1.84 CCC(CC)OC1CCCC1 7a_100000688536_100000179811 [0,0,0,1,0,0|3,0,0]=4 2054 B11R1.84 CCC(CC)SC1CCCC1 62a_100000210505_100000179811 [0,0,0,1,0,0|3,0,0]=4 2055 B11R1.84 CCC(CC)SC1CCCC1 62a_100011217020_100000210505 [0,0,0,1,0,0|3,0,0]=4 2056 B11R1.84 CCN(CC)CC1CCCC1 2230a_100000724800_100000740388 [0,0,0,1,0,0|3,0,0]=4 2057 B11R1.84 CCN(CC)CC1CCCC1 269956a_100000042499_100000740388 [0,0,0,1,0,0|3,0,0]=4 2058 B11R1.84 CCN(CC)CC1CCCC1 269982a_100000724800_100000740388 [0,0,0,1,0,0|3,0,0]=4 2059 B11R1.84 COC(CN1CCCC1)OC 2230a_100000188435_100000751394 [0,0,0,1,0,0|1,0,0]=2 2060 B11R1.84 COC(CN1CCCC1)OC 270004a_100000188435_100000752162 [0,0,0,1,0,0|1,0,0]=2 2061 B11R1.84 COC(CN1CCSC1)OC 2230a_100011215254_100000751394 [0,0,0,1,0,0|2,0,0]=3 2062 B11R1.84 COC(CN1CCSC1)OC 270004a_100011215254_100000752162 [0,0,0,1,0,0|2,0,0]=3 2063 B11R1.168 CCC(CC)N1CCC[C@@H]1C 269982a_100020605311_100000210505 [0,0,0,1,0,0|3,0,0]=4 2064 B11R1.168 CCC(CC)N1CCC[C@@H]1C 270004a_100020605311_100000210860 [0,0,0,1,0,0|3,0,0]=4 2065 B11R1.168 CCC(CC)N1CCC[C@H]1C 269982a_100015189458_100000210505 [0,0,0,1,0,0|3,0,0]=4 2066 B11R1.168 CCC(CC)N1CCC[C@H]1C 270004a_100015189458_100000210860 [0,0,0,1,0,0|3,0,0]=4 2067 B11R1.170 CCC(CC)CNC1CCC1 2230a_100000749019_100011215472 [0,0,0,1,0,0|3,0,0]=4 2068 B11R1.170 CCC(CC)CNC1CCC1 269862a_100000749019_100000211137 [0,0,0,1,0,0|3,0,0]=4 2069 B11R1.170 CCC(CC)CNC1CCC1 270004a_100102946423_100000241760 [0,0,0,1,0,0|3,0,0]=4 2070 B11R1.170 CCC(CC)CNC1CCC1 34a_100000749019_100011215472 [0,0,0,1,0,0|3,0,0]=4 2071 B11R1.170 CCC(CC)COC1CCC1 34a_100000748187_100011215472 [0,0,0,1,0,0|3,0,0]=4 2072 B11R1.170 CCC(CC)CSC1CCC1 62a_100011215472_100000749161 [0,0,0,1,0,0|3,0,0]=4 2073 B11R1.170 CCC(CC)NCC1CCC1 2230a_100000199018_100000763275 [0,0,0,1,0,0|3,0,0]=4 2074 B11R1.170 CCC(CC)NCC1CCC1 269862a_100000199018_100000753134 [0,0,0,1,0,0|3,0,0]=4 2075 B11R1.170 CCC(CC)NCC1CCC1 270004a_100000738700_100000210860 [0,0,0,1,0,0|3,0,0]=4 2076 B11R1.170 CCC(CC)OCC1CCC1 7a_100000688536_100000763275 [0,0,0,1,0,0|3,0,0]=4 2077 B11R1.170 CCC(CC)SCC1CCC1 62a_100000210505_100000763275 [0,0,0,1,0,0|3,0,0]=4 2078 B11R1.170 CCC(CC)SCC1CCC1 62a_100000763275_100000210505 [0,0,0,1,0,0|3,0,0]=4 2079 B11R1.170 CCC(CNC1CCC1)OC 270004a_100000731041_100000241760 [0,0,0,1,0,0|2,0,0]=3 2080 B11R1.170 CCC(COC1CCC1)OC 34a_100011934954_100000749161 [0,0,0,1,0,0|2,0,0]=3 2081 B11R1.170 CCC(COC1COC1)OC 34a_100011934954_100009818527 [0,0,0,1,0,0|3,0,0]=4 2082 B11R1.170 CCC(COC1COC1)OC 7a_100011934954_100009818527 [0,0,0,1,0,0|3,0,0]=4 2083 B11R1.170 COC(CCN1CCC1)OC 269982a_100000754969_100000139399 [0,0,0,1,0,0|1,0,0]=2 2084 B11R1.170 COC(CNC1CCC1)OC 2230a_100000749019_100000751394 [0,0,0,1,0,0|1,0,0]=2 2085 B11R1.170 COC(CNC1CCC1)OC 270004a_100000210479_100000241760 [0,0,0,1,0,0|1,0,0]=2 2086 B11R1.170 COC(CNC1CCC1)OC 34a_100000749019_100000211822 [0,0,0,1,0,0|1,0,0]=2 2087 B11R1.170 COC(CNC1COC1)OC 2230a_100016991112_100000751394 [0,0,0,1,0,0|2,0,0]=3 2088 B11R1.170 COC(CNC1COC1)OC 270004a_100016991112_100000752162 [0,0,0,1,0,0|2,0,0]=3 2089 B11R1.170 COC(CNC1CSC1)OC 270004a_100016994217_100000752162 [0,0,0,1,0,0|2,0,0]=3 2090 B11R1.170 COC(COC1CCC1)OC 34a_100000748187_100000211822 [0,0,0,1,0,0|1,0,0]=2 2091 B11R1.170 COC(COC1CCC1)OC 34a_100011216393_100000749161 [0,0,0,1,0,0|1,0,0]=2 2092 B11R1.170 COC(COC1COC1)OC 34a_100011216393_100009818527 [0,0,0,1,0,0|2,0,0]=3 2093 B11R1.170 COC(COC1CSC1)OC 7a_100000072292_100000751394 [0,0,0,1,0,0|2,0,0]=3 2094 B11R1.170 COC(CSC1CCC1)OC 62a_100000751394_100000749161 [0,0,0,1,0,0|1,0,0]=2 2095 B11R1.170 COC(CSC1COC1)OC 62a_100000751394_100009818527 [0,0,0,1,0,0|2,0,0]=3 2096 B11R1.171 CCC(CC)CNCC1CC1 2230a_100000735609_100011215472 [0,0,0,1,0,0|3,0,0]=4 2097 B11R1.171 CCC(CC)CNCC1CC1 2230a_100102946423_100000742324 [0,0,0,1,0,0|3,0,0]=4 2098 B11R1.171 CCC(CC)CNCC1CC1 269862a_100102946423_100000741477 [0,0,0,1,0,0|3,0,0]=4 2099 B11R1.171 CCC(CC)CNCC1CC1 270004a_100000735609_100000211137 [0,0,0,1,0,0|3,0,0]=4 2100 B11R1.171 CCC(CC)CNCC1CC1 34a_100000735609_100011215472 [0,0,0,1,0,0|3,0,0]=4 2101 B11R1.171 CCC(CC)COCC1CC1 34a_100000211283_100011215472 [0,0,0,1,0,0|3,0,0]=4 2102 B11R1.171 CCC(CC)COCC1CC1 7a_100000703878_100000742324 [0,0,0,1,0,0|3,0,0]=4 2103 B11R1.171 CCC(CC)CSCC1CC1 62a_100000756562_100011215472 [0,0,0,1,0,0|3,0,0]=4 2104 B11R1.171 CCC(CC)CSCC1CC1 62a_100011215472_100000742324 [0,0,0,1,0,0|3,0,0]=4 2105 B11R1.171 CCC(CC)NCCC1CC1 2230a_100000199018_100000694398 [0,0,0,1,0,0|3,0,0]=4 2106 B11R1.171 CCC(CC)NCCC1CC1 270004a_100000764129_100000210860 [0,0,0,1,0,0|3,0,0]=4 2107 B11R1.171 CCC(CC)OCCC1CC1 7a_100000688536_100000764125 [0,0,0,1,0,0|3,0,0]=4 2108 B11R1.171 CCC(CC)OCCC1CC1 7a_100000754188_100000210505 [0,0,0,1,0,0|3,0,0]=4 2109 B11R1.171 CCC(CC)SCCC1CC1 62a_100000210505_100000764125 [0,0,0,1,0,0|3,0,0]=4 2110 B11R1.171 CCC(CC)SCCC1CC1 62a_100000764125_100000210505 [0,0,0,1,0,0|3,0,0]=4 2111 B11R1.171 CCC(CNCC1CC1)OC 269862a_100000731041_100000741477 [0,0,0,1,0,0|2,0,0]=3 2112 B11R1.171 CCC(COCC1CC1)OC 34a_100011934954_100000742324 [0,0,0,1,0,0|2,0,0]=3 2113 B11R1.171 CCC(COCC1CC1)OC 7a_100011934954_100000742324 [0,0,0,1,0,0|2,0,0]=3 2114 B11R1.171 CCC(COCC1CO1)OC 34a_100011934954_102125554688 [0,0,0,1,0,0|3,0,0]=4 2115 B11R1.171 CCC(COCC1CO1)OC 7a_100011934954_102125554688 [0,0,0,1,0,0|3,0,0]=4 2116 B11R1.171 CCC(COCC1CS1)OC 7a_100011934954_100000031435 [0,0,0,1,0,0|3,0,0]=4 2117 B11R1.171 CCC(COC[C@@H]1CO1)OC 7a_100011934954_100000745022 [0,0,0,1,0,0|3,0,0]=4 2118 B11R1.171 COC(C=NNC1CC1)OC 4a_100000701032_100000752162 [0,0,0,1,0,0|2,0,1]=4 2119 B11R1.171 COC(CCNC1CC1)OC 34a_100000212008_100000139399 [0,0,0,1,0,0|1,0,0]=2 2120 B11R1.171 COC(CCSC1CC1)OC 62a_100000139399_100000211595 [0,0,0,1,0,0|1,0,0]=2 2121 B11R1.171 COC(CNCC1CC1)OC 2230a_100000735609_100000751394 [0,0,0,1,0,0|1,0,0]=2 2122 B11R1.171 COC(CNCC1CC1)OC 270004a_100000735609_100000752162 [0,0,0,1,0,0|1,0,0]=2 2123 B11R1.171 COC(CNCC1CC1)OC 34a_100000735609_100000211822 [0,0,0,1,0,0|1,0,0]=2 2124 B11R1.171 COC(COCC1CC1)OC 34a_100000211283_100000211822 [0,0,0,1,0,0|1,0,0]=2 2125 B11R1.171 COC(COCC1CC1)OC 34a_100011216393_100000742324 [0,0,0,1,0,0|1,0,0]=2 2126 B11R1.171 COC(COCC1CO1)OC 34a_100011216393_102125554688 [0,0,0,1,0,0|2,0,0]=3 2127 B11R1.171 COC(COC[C@@H]1CO1)OC 34a_100000757423_100000211822 [0,0,0,1,0,0|2,0,0]=3 2128 B11R1.171 COC(CSCC1CC1)OC 62a_100000751394_100000742324 [0,0,0,1,0,0|1,0,0]=2 2129 B11R1.171 COC(CSCC1CC1)OC 62a_100000756562_100000751394 [0,0,0,1,0,0|1,0,0]=2 2130 B11R1.171 COC(CSCC1CO1)OC 62a_100000751394_102125554688 [0,0,0,1,0,0|2,0,0]=3 2131 B11R1.171 COC(CSCC1CO1)OC 62a_102125554688_100000751394 [0,0,0,1,0,0|2,0,0]=3 2132 B11R1.171 COC(CSCC1CS1)OC 62a_100000031435_100000751394 [0,0,0,1,0,0|2,0,0]=3 2133 B11R1.171 COC(CSCC1CS1)OC 62a_100000751394_100000031435 [0,0,0,1,0,0|2,0,0]=3 2134 B11R1.171 COC(CSC[C@@H]1CO1)OC 62a_100000745022_100000751394 [0,0,0,1,0,0|2,0,0]=3 2135 B11R1.171 COC(CSC[C@@H]1CO1)OC 62a_100000751394_100000745022 [0,0,0,1,0,0|2,0,0]=3 2136 B11R1.190 CCCCCCN1CCC1C 269982a_100000755817_100000210757 [0,0,0,1,0,0|3,0,0]=4 2137 B11R1.190 CCCCCCN1CCC1C 34a_100000755817_100000210314 [0,0,0,1,0,0|3,0,0]=4 2138 B11R1.214 CCCCN1CC[C@H](C1)OC 2230a_100000766984_100000210211 [0,0,0,1,0,0|2,0,0]=3 2139 B11R1.214 CCCCN1CC[C@H](C1)OC 269982a_100000766984_100000210211 [0,0,0,1,0,0|2,0,0]=3 2140 B11R1.214 CCCNC1CCC(C1)CC 270004a_100020643023_100011218773 [0,0,0,1,0,0|3,0,0]=4 2141 B11R1.214 CCOCN1CC[C@H](C1)OC 269982a_100000766984_100000739092 [0,0,0,1,0,0|3,0,0]=4 2142 B11R1.214 COCCN1CC[C@H](C1)OC 2230a_100000766984_100011201679 [0,0,0,1,0,0|3,0,0]=4 2143 B11R1.214 COCCN1CC[C@H](C1)OC 269982a_100000766984_100000233755 [0,0,0,1,0,0|3,0,0]=4 2144 B11R1.214 CO[C@@H]1CCN(C1)CCCF 2230a_100000766984_100011934791 [0,0,0,1,0,0|3,0,0]=4 2145 B11R1.214 CO[C@@H]1CCN(C1)CCCF 269982a_100000766984_100011934791 [0,0,0,1,0,0|3,0,0]=4 2146 B11R1.214 CO[C@@H]1CCN(C1)CCCO 2230a_100000766984_100000230001 [0,0,0,1,0,0|3,0,0]=4 2147 B11R1.214 CO[C@@H]1CCN(C1)CCCO 269982a_100000766984_100011215043 [0,0,0,1,0,0|3,0,0]=4 2148 B11R1.214 CO[C@@H]1CCN(C1)CCSC 2230a_100000766984_100000751147 [0,0,0,1,0,0|3,0,0]=4 2149 B11R1.214 CO[C@@H]1CCN(C1)CCSC 269982a_100000766984_100000212216 [0,0,0,1,0,0|3,0,0]=4 2150 B11R1.248 CCN1CCCCCCCC1 2230a_100000039187_100000210202 [0,0,0,1,0,0|3,0,0]=4 2151 B11R1.248 CCN1CCCCCCCC1 269982a_100000039187_100000204670 [0,0,0,1,0,0|3,0,0]=4 2152 B11R1.248 CCN1CCCCCCCC1 34a_100000039187_100000210202 [0,0,0,1,0,0|3,0,0]=4 2153 B11R1.248 CNC1CCCCCCCC1 270004a_106832991635_100000038600 [0,0,0,1,0,0|2,0,0]=3 2154 B11R1.493 CCC(CC)OCC1CC1C 7a_100000744939_100000210505 [0,0,0,1,0,0|3,0,0]=4 2155 B11R1.493 COC(CN[C@@H]1C[C@@H]1F)OC 2230a_100015190264_100000751394 [0,0,0,1,0,0|2,0,0]=3 2156 B11R1.493 COC(CN[C@@H]1C[C@H]1F)OC 2230a_100025746932_100000751394 [0,0,0,1,0,0|2,0,0]=3 2157 B11R1.493 COC(CN[C@@H]1C[C@H]1F)OC 34a_100025746932_100000211822 [0,0,0,1,0,0|2,0,0]=3 2158 B11R1.542 CCC1(CO1)CNCCCF 34a_100015189416_200000139556 [0,0,0,1,0,0|3,0,0]=4 2159 B11R1.542 CCC1(CO1)COCCCBr 34a_100011217188_200000139556 [0,0,0,1,0,0|3,0,0]=4 2160 B11R1.542 CCC1(CO1)COCCCCl 34a_100000230001_200000139556 [0,0,0,1,0,0|3,0,0]=4 2161 B11R1.542 CCC1(CO1)COCCCF 34a_100000759539_200000139556 [0,0,0,1,0,0|3,0,0]=4 2162 B11R1.542 CCC1(CO1)COCCCN 34a_100000182051_200000139556 [0,0,0,1,0,0|3,0,0]=4 2163 B11R1.542 CCC1(CO1)COCCOC 34a_100000210237_200000139556 [0,0,0,1,0,0|3,0,0]=4 2164 B11R1.542 CCC1(CO1)COCCSC 34a_100000230434_200000139556 [0,0,0,1,0,0|3,0,0]=4 2165 B11R1.542 CCC1(CO1)COCCSC 7a_100000230434_200000139556 [0,0,0,1,0,0|3,0,0]=4 2166 B11R1.542 CCC1(CO1)CSCCCF 62a_100011934791_200000139556 [0,0,0,1,0,0|3,0,0]=4 2167 B11R1.542 CCC1(CO1)CSCCCF 62a_200000139556_100011934791 [0,0,0,1,0,0|3,0,0]=4 2168 B11R1.542 CCC1(CO1)CSCCCO 62a_100011215043_200000139556 [0,0,0,1,0,0|3,0,0]=4 2169 B11R1.542 CCC1(CO1)CSCCCO 62a_200000139556_100011215043 [0,0,0,1,0,0|3,0,0]=4 2170 B11R1.542 CCC1(CO1)CSCCOC 62a_100000233755_200000139556 [0,0,0,1,0,0|3,0,0]=4 2171 B11R1.542 CCC1(CO1)CSCCOC 62a_200000139556_100000233755 [0,0,0,1,0,0|3,0,0]=4 2172 B11R1.542 CCC1(CO1)CSCCSC 62a_100000212216_200000139556 [0,0,0,1,0,0|3,0,0]=4 2173 B11R1.542 CCC1(CO1)CSCCSC 62a_200000139556_100000751147 [0,0,0,1,0,0|3,0,0]=4 2174 B11R1.542 CCCCCNC1(CC1)CC 2230a_100000732774_100000210326 [0,0,0,1,0,0|3,0,0]=4 2175 B11R1.542 CCCCNCC1(CO1)CC 7a_106832991798_200000139556 [0,0,0,1,0,0|2,0,0]=3 2176 B11R1.542 CCCCOCC1(CO1)CC 34a_100000210227_200000139556 [0,0,0,1,0,0|2,0,0]=3 2177 B11R1.542 CCCCOCC1(CO1)CC 7a_100000210227_200000139556 [0,0,0,1,0,0|2,0,0]=3 2178 B11R1.542 CCCCSCC1(CO1)CC 62a_100000210211_200000139556 [0,0,0,1,0,0|2,0,0]=3 2179 B11R1.542 CCCCSCC1(CO1)CC 62a_200000139556_100000210210 [0,0,0,1,0,0|2,0,0]=3 2180 B11R1.542 CCOCSCC1(CO1)CC 62a_100000739092_200000139556 [0,0,0,1,0,0|3,0,0]=4 2181 B11R1.542 CCOCSCC1(CO1)CC 62a_200000139556_100000739092 [0,0,0,1,0,0|3,0,0]=4 2182 B11R1.807 CCC(CC)CN1CCC1C 269982a_100000755817_100011215472 [0,0,0,1,0,0|3,0,0]=4 2183 B11R1.807 CCC(CC)CN1CCC1C 34a_100000755817_100011215472 [0,0,0,1,0,0|3,0,0]=4 2184 B11R1.807 COC(CN1CCC1C)OC 34a_100000755817_100000211822 [0,0,0,1,0,0|1,0,0]=2 2185 B11R1.951 CCC1CCCN(CC1)CC 2230a_100000757272_100000210202 [0,0,0,1,0,0|3,0,0]=4 2186 B11R1.951 CCC1CCCN(CC1)CC 269982a_100000757272_100000204670 [0,0,0,1,0,0|3,0,0]=4 2187 B11R1.951 CCC1CCCN(CC1)CC 34a_100000757272_100000210202 [0,0,0,1,0,0|3,0,0]=4 2188 B11R1.951 CCN1CCCC(CC1)OC 2230a_100016993962_100000210202 [0,0,0,1,0,0|2,0,0]=3 2189 B11R1.951 CCN1CCCC(CC1)OC 269982a_100016993962_100000204670 [0,0,0,1,0,0|2,0,0]=3 2190 B11R1.951 CCN1CCCC(CC1)OC 34a_100016993962_100000210202 [0,0,0,1,0,0|2,0,0]=3 2191 B11R1.951 COC1CCCN(CC1)CF 269982a_100016993962_100015361967 [0,0,0,1,0,0|3,0,0]=4 2192 B11R1.951 COC1CCCN(CC1)CF 34a_100016993962_100015361967 [0,0,0,1,0,0|3,0,0]=4 2193 B8R0.4 C#CCCCCCOC 34a_100000766912_200000210301 [2,0,0,0,0,0|0,0,2]=4 2194 B8R0.4 C#CCCCCCOC 34a_100138415774_100012094781 [2,0,0,0,0,0|0,0,2]=4 2195 B8R0.4 C#CCCCCCOC 7a_100000766912_200000210301 [2,0,0,0,0,0|0,0,2]=4 2196 B8R0.4 C#CCCCCCO[13CH3] 34a_100000766912_200025704644 [2,0,0,0,0,0|0,0,2]=4 2197 B8R0.4 C#CCCCCCO[13CH3] 7a_100000766912_200025704644 [2,0,0,0,0,0|0,0,2]=4 2198 B8R0.4 C=CCCCCCOC 34a_100011216702_200000210301 [2,0,0,0,0,0|0,0,2]=4 2199 B8R0.4 C=CCCCCCOC 34a_100138415774_100000700193 [2,0,0,0,0,0|0,0,2]=4 2200 B8R0.4 C=CCCCCCOC 7a_100011216702_200000210301 [2,0,0,0,0,0|0,0,2]=4 2201 B8R0.4 C=CCCCCCO[13CH3] 34a_100011216702_200025704644 [2,0,0,0,0,0|0,0,2]=4 2202 B8R0.4 C=CCCCCCO[13CH3] 7a_100011216702_200025704644 [2,0,0,0,0,0|0,0,2]=4 2203 B8R0.4 CC/C=C/CCCOC 34a_100016287902_200000210301 [2,0,0,0,0,0|0,0,2]=4 2204 B8R0.4 CC/C=C/CCCOC 7a_100016287902_200000210301 [2,0,0,0,0,0|0,0,2]=4 2205 B8R0.4 CC/C=C/CCCO[13CH3] 34a_100016287902_200025704644 [2,0,0,0,0,0|0,0,2]=4 2206 B8R0.4 CC/C=C/CCCO[13CH3] 7a_100016287902_200025704644 [2,0,0,0,0,0|0,0,2]=4 2207 B8R0.4 CCCC#CCCOC 34a_100000042726_200000210301 [2,0,0,0,0,0|0,0,2]=4 2208 B8R0.4 CCCC#CCCOC 7a_100000042726_200000210301 [2,0,0,0,0,0|0,0,2]=4 2209 B8R0.4 CCCC#CCCO[13CH3] 34a_100000042726_200025704644 [2,0,0,0,0,0|0,0,2]=4 2210 B8R0.4 CCCC#CCCO[13CH3] 7a_100000042726_200025704644 [2,0,0,0,0,0|0,0,2]=4 2211 B8R0.4 CCCC/C=C/COC 34a_200016272032_200000210301 [2,0,0,0,0,0|0,0,2]=4 2212 B8R0.4 CCCC/C=C/COC 7a_200016272032_200000210301 [2,0,0,0,0,0|0,0,2]=4 2213 B8R0.4 CCCC/C=C/CO[13CH3] 34a_200016272032_200025704644 [2,0,0,0,0,0|0,0,2]=4 2214 B8R0.4 CCCC/C=C/CO[13CH3] 7a_200016272032_200025704644 [2,0,0,0,0,0|0,0,2]=4 2215 B8R0.4 CCCCC#CCOC 34a_200000034558_200000210301 [2,0,0,0,0,0|0,0,2]=4 2216 B8R0.4 CCCCC#CCOC 7a_200000034558_200000210301 [2,0,0,0,0,0|0,0,2]=4 2217 B8R0.4 CCCCC#CCO[13CH3] 34a_200000034558_200025704644 [2,0,0,0,0,0|0,0,2]=4 2218 B8R0.4 CCCCC#CCO[13CH3] 7a_200000034558_200025704644 [2,0,0,0,0,0|0,0,2]=4 2219 B8R0.4 CCCCCCCNC 2230a_100000229938_200000210301 [2,0,0,0,0,0|1,0,0]=3 2220 B8R0.4 CCCCCCCNC 2230a_106832991635_100000210681 [2,0,0,0,0,0|1,0,0]=3 2221 B8R0.4 CCCCCCCNC 34a_100102657272_100000210614 [2,0,0,0,0,0|1,0,0]=3 2222 B8R0.4 CCCCCCCNC 7a_106832991635_100000210614 [2,0,0,0,0,0|1,0,0]=3 2223 B8R0.4 CCCCCCCN[13CH3] 2230a_100000229938_200025704644 [2,0,0,0,0,0|1,0,0]=3 2224 B8R0.4 CCCCCCCOC 34a_100000210272_200000210301 [2,0,0,0,0,0|0,0,0]=2 2225 B8R0.4 CCCCCCCOC 34a_100138415774_100000210614 [2,0,0,0,0,0|0,0,0]=2 2226 B8R0.4 CCCCCCCOC 7a_100000210272_200000210301 [2,0,0,0,0,0|0,0,0]=2 2227 B8R0.4 CCCCCCCO[13CH3] 34a_100000210272_200025704644 [2,0,0,0,0,0|0,0,0]=2 2228 B8R0.4 CCCCCCCO[13CH3] 7a_100000210272_200025704644 [2,0,0,0,0,0|0,0,0]=2 2229 B8R0.4 CCCCCCCSC 62a_100000210614_200000210301 [2,0,0,0,0,0|0,1,0]=3 2230 B8R0.4 CCCCCCCSC 62a_200000210301_100000210316 [2,0,0,0,0,0|0,1,0]=3 2231 B8R0.4 CCCCCCCS[13CH3] 62a_100000210614_200025704644 [2,0,0,0,0,0|0,1,0]=3 2232 B8R0.4 CCCCCCCS[13CH3] 62a_200025704644_100000210316 [2,0,0,0,0,0|0,1,0]=3 2233 B8R0.4 CCCCCCNCC 2230a_100000210581_100000210202 [2,0,0,0,0,0|2,0,0]=4 2234 B8R0.4 CCCCCCNCC 2230a_100015525214_100000210314 [2,0,0,0,0,0|2,0,0]=4 2235 B8R0.4 CCCCCCOCC 34a_100000210259_100000210202 [2,0,0,0,0,0|2,0,0]=4 2236 B8R0.4 CCCCCCOCC 34a_100121572206_100000210314 [2,0,0,0,0,0|2,0,0]=4 2237 B8R0.4 CCCCCCOCC 7a_100000210259_100000210202 [2,0,0,0,0,0|2,0,0]=4 2238 B8R0.4 CCCCCCSCC 62a_100000210202_100000210757 [2,0,0,0,0,0|2,0,0]=4 2239 B8R0.4 CCCCCCSCC 62a_100000210314_100000210202 [2,0,0,0,0,0|2,0,0]=4 2240 B8R0.4 CCCCCNCCC 2230a_100000209983_100000210303 [2,0,0,0,0,0|2,0,0]=4 2241 B8R0.4 CCCCCNCOC 2230a_100000209983_100000766300 [2,0,0,0,0,0|1,0,0]=3 2242 B8R0.4 CCCCCNCSC 2230a_100000209983_100011218213 [2,0,0,0,0,0|1,1,0]=4 2243 B8R0.4 CCCCCOCCC 34a_100000210253_100000210303 [2,0,0,0,0,0|2,0,0]=4 2244 B8R0.4 CCCCCOCCC 34a_100000210258_100000718602 [2,0,0,0,0,0|2,0,0]=4 2245 B8R0.4 CCCCCOCCC 7a_100000210253_100000210303 [2,0,0,0,0,0|2,0,0]=4 2246 B8R0.4 CCCCCOCSC 34a_100000210253_100011218213 [2,0,0,0,0,0|1,1,0]=4 2247 B8R0.4 CCCCCSCCC 62a_100000210303_100000210326 [2,0,0,0,0,0|2,0,0]=4 2248 B8R0.4 CCCCCSCCC 62a_100000210326_100000210303 [2,0,0,0,0,0|2,0,0]=4 2249 B8R0.4 CCCCCSCOC 62a_100000210326_100000766300 [2,0,0,0,0,0|1,0,0]=3 2250 B8R0.4 CCCCCSCOC 62a_100000766300_100000210326 [2,0,0,0,0,0|1,0,0]=3 2251 B8R0.4 CCCCCSCSC 62a_100000210326_100011218213 [2,0,0,0,0,0|1,1,0]=4 2252 B8R0.4 CCCCCSCSC 62a_100011218213_100000210326 [2,0,0,0,0,0|1,1,0]=4 2253 B8R0.4 CCCCNCCCC 2230a_100000102301_100000210211 [2,0,0,0,0,0|2,0,0]=4 2254 B8R0.4 CCCCNCCCC 7a_106832991798_100000210211 [2,0,0,0,0,0|2,0,0]=4 2255 B8R0.4 CCCCNCCOC 2230a_100000102301_100011201679 [2,0,0,0,0,0|1,0,0]=3 2256 B8R0.4 CCCCNCCOC 2230a_100000209980_100000210211 [2,0,0,0,0,0|1,0,0]=3 2257 B8R0.4 CCCCNCCOC 7a_106832991798_100000233755 [2,0,0,0,0,0|1,0,0]=3 2258 B8R0.4 CCCCNCCSC 2230a_100000102301_100000751147 [2,0,0,0,0,0|1,1,0]=4 2259 B8R0.4 CCCCNCCSC 2230a_100020590264_100000210211 [2,0,0,0,0,0|1,1,0]=4 2260 B8R0.4 CCCCNCCSC 7a_106832991798_100000212216 [2,0,0,0,0,0|1,1,0]=4 2261 B8R0.4 CCCCOCCCC 34a_100000210227_100000210210 [2,0,0,0,0,0|2,0,0]=4 2262 B8R0.4 CCCCOCCCC 7a_100000210227_100000210211 [2,0,0,0,0,0|2,0,0]=4 2263 B8R0.4 CCCCOCCNC 2230a_106832991635_100000743108 [2,0,0,0,0,0|2,0,0]=4 2264 B8R0.4 CCCCOCCNC 34a_100102657272_100000743108 [2,0,0,0,0,0|2,0,0]=4 2265 B8R0.4 CCCCOCCNC 7a_106832991635_100000743108 [2,0,0,0,0,0|2,0,0]=4 2266 B8R0.4 CCCCOCCOC 34a_100000210227_100011201679 [2,0,0,0,0,0|1,0,0]=3 2267 B8R0.4 CCCCOCCOC 34a_100000210237_100000210210 [2,0,0,0,0,0|1,0,0]=3 2268 B8R0.4 CCCCOCCOC 34a_100000210238_200000210301 [2,0,0,0,0,0|1,0,0]=3 2269 B8R0.4 CCCCOCCOC 34a_100138415774_100000743108 [2,0,0,0,0,0|1,0,0]=3 2270 B8R0.4 CCCCOCCOC 7a_100000210227_100000233755 [2,0,0,0,0,0|1,0,0]=3 2271 B8R0.4 CCCCOCCOC 7a_100000210238_200000210301 [2,0,0,0,0,0|1,0,0]=3 2272 B8R0.4 CCCCOCCON 34a_100000700252_100000210210 [2,0,0,0,0,0|2,0,0]=4 2273 B8R0.4 CCCCOCCO[13CH3] 34a_100000210238_200025704644 [2,0,0,0,0,0|1,0,0]=3 2274 B8R0.4 CCCCOCCO[13CH3] 7a_100000210238_200025704644 [2,0,0,0,0,0|1,0,0]=3 2275 B8R0.4 CCCCOCCSC 34a_100000210227_100000212216 [2,0,0,0,0,0|1,1,0]=4 2276 B8R0.4 CCCCOCCSC 34a_100000230434_100000210210 [2,0,0,0,0,0|1,1,0]=4 2277 B8R0.4 CCCCOCCSC 62a_100000743108_200000210301 [2,0,0,0,0,0|1,1,0]=4 2278 B8R0.4 CCCCOCCSC 62a_200000210301_100000743108 [2,0,0,0,0,0|1,1,0]=4 2279 B8R0.4 CCCCOCCSC 7a_100000210227_100000212216 [2,0,0,0,0,0|1,1,0]=4 2280 B8R0.4 CCCCOCCSC 7a_100000230434_100000210211 [2,0,0,0,0,0|1,1,0]=4 2281 B8R0.4 CCCCOCCS[13CH3] 62a_100000743108_200025704644 [2,0,0,0,0,0|1,1,0]=4 2282 B8R0.4 CCCCOCCS[13CH3] 62a_200025704644_100000743108 [2,0,0,0,0,0|1,1,0]=4 2283 B8R0.4 CCCCSCCCC 62a_100000210211_100000210210 [2,0,0,0,0,0|2,0,0]=4 2284 B8R0.4 CCCCSCCNC 2230a_100025743550_200000210301 [2,0,0,0,0,0|2,0,0]=4 2285 B8R0.4 CCCCSCCN[13CH3] 2230a_100025743550_200025704644 [2,0,0,0,0,0|2,0,0]=4 2286 B8R0.4 CCCCSCCOC 34a_200000230436_200000210301 [2,0,0,0,0,0|1,0,0]=3 2287 B8R0.4 CCCCSCCOC 62a_100000210211_100000233755 [2,0,0,0,0,0|1,0,0]=3 2288 B8R0.4 CCCCSCCOC 62a_100000233755_100000210210 [2,0,0,0,0,0|1,0,0]=3 2289 B8R0.4 CCCCSCCOC 7a_200000230436_200000210301 [2,0,0,0,0,0|1,0,0]=3 2290 B8R0.4 CCCCSCCO[13CH3] 34a_200000230436_200025704644 [2,0,0,0,0,0|1,0,0]=3 2291 B8R0.4 CCCCSCCO[13CH3] 7a_200000230436_200025704644 [2,0,0,0,0,0|1,0,0]=3 2292 B8R0.4 CCCCSCCSC 62a_100000210211_100000751147 [2,0,0,0,0,0|1,1,0]=4 2293 B8R0.4 CCCCSCCSC 62a_100000212216_100000210210 [2,0,0,0,0,0|1,1,0]=4 2294 B8R0.4 CCCNCCCOC 34a_100150723488_100000210303 [2,0,0,0,0,0|1,0,0]=3 2295 B8R0.4 CCCNCCCSC 2230a_100000749238_100000210303 [2,0,0,0,0,0|1,1,0]=4 2296 B8R0.4 CCCOCCCNC 2230a_100011217757_200000210301 [2,0,0,0,0,0|2,0,0]=4 2297 B8R0.4 CCCOCCCNC 34a_100000213112_100000210303 [2,0,0,0,0,0|2,0,0]=4 2298 B8R0.4 CCCOCCCNC 34a_100011217757_200000210301 [2,0,0,0,0,0|2,0,0]=4 2299 B8R0.4 CCCOCCCN[13CH3] 2230a_100011217757_200025704644 [2,0,0,0,0,0|2,0,0]=4 2300 B8R0.4 CCCOCCCN[13CH3] 34a_100011217757_200025704644 [2,0,0,0,0,0|2,0,0]=4 2301 B8R0.4 CCCOCCCOC 34a_100000210258_100000740836 [2,0,0,0,0,0|1,0,0]=3 2302 B8R0.4 CCCOCCCOC 34a_100000740835_100000210303 [2,0,0,0,0,0|1,0,0]=3 2303 B8R0.4 CCCOCCCSC 34a_100000690336_100000210303 [2,0,0,0,0,0|1,1,0]=4 2304 B8R0.4 CCCOCCCSC 7a_100000690336_100000210303 [2,0,0,0,0,0|1,1,0]=4 2305 B8R0.4 CCCSCCCOC 62a_100000210303_100000709357 [2,0,0,0,0,0|1,0,0]=3 2306 B8R0.4 CCCSCCCOC 62a_100000709357_100000210303 [2,0,0,0,0,0|1,0,0]=3 2307 B8R0.4 CCNCCCCOC 2230a_100015525214_100000730899 [2,0,0,0,0,0|1,0,0]=3 2308 B8R0.4 CCNCOCCOC 2230a_100015525214_100000231047 [2,0,0,0,0,0|2,0,0]=4 2309 B8R0.4 CCOCCCCOC 34a_100000740925_100000210202 [2,0,0,0,0,0|1,0,0]=3 2310 B8R0.4 CCOCCCCOC 34a_100121572206_100000755781 [2,0,0,0,0,0|1,0,0]=3 2311 B8R0.4 CCOCCCCSC 34a_100011217163_100000210202 [2,0,0,0,0,0|1,1,0]=4 2312 B8R0.4 CCOCCCCSC 7a_100011217163_100000210202 [2,0,0,0,0,0|1,1,0]=4 2313 B8R0.4 CCOCCNCOC 2230a_102516460346_100000766300 [2,0,0,0,0,0|2,0,0]=4 2314 B8R0.4 CCOCCSCOC 62a_100000210147_100000766300 [2,0,0,0,0,0|2,0,0]=4 2315 B8R0.4 CCOCCSCOC 62a_100000766300_100011215890 [2,0,0,0,0,0|2,0,0]=4 2316 B8R0.4 CCOCSCCOC 62a_100000233755_100000739092 [2,0,0,0,0,0|2,0,0]=4 2317 B8R0.4 CCOCSCCOC 62a_100000739092_100000233755 [2,0,0,0,0,0|2,0,0]=4 2318 B8R0.4 CCSCCCCOC 62a_100000210202_100000730899 [2,0,0,0,0,0|1,0,0]=3 2319 B8R0.4 CCSCCCCOC 62a_100000730899_100000210202 [2,0,0,0,0,0|1,0,0]=3 2320 B8R0.4 CCSCCNCOC 2230a_100000106463_100000766300 [2,0,0,0,0,0|2,0,0]=4 2321 B8R0.4 CCSCCSCOC 62a_100000757381_100000766300 [2,0,0,0,0,0|2,0,0]=4 2322 B8R0.4 CCSCCSCOC 62a_100000766300_100000757381 [2,0,0,0,0,0|2,0,0]=4 2323 B8R0.4 CCSCOCCOC 62a_100000210202_100000231047 [2,0,0,0,0,0|2,0,0]=4 2324 B8R0.4 CCSCOCCOC 62a_100000231047_100000210202 [2,0,0,0,0,0|2,0,0]=4 2325 B8R0.4 CNCCCCCCF 2230a_106832991635_100015922095 [2,0,0,0,0,0|2,0,0]=4 2326 B8R0.4 CNCCCCCCF 34a_100102657272_100015922095 [2,0,0,0,0,0|2,0,0]=4 2327 B8R0.4 CNCCCCCCF 7a_106832991635_100015922095 [2,0,0,0,0,0|2,0,0]=4 2328 B8R0.4 CNCCCCCCO 2230a_100000686447_200000210301 [2,0,0,0,0,0|2,0,0]=4 2329 B8R0.4 CNCCCCCCO 2230a_106832991635_100000766143 [2,0,0,0,0,0|2,0,0]=4 2330 B8R0.4 CNCCCCCCO 34a_100000686447_200000210301 [2,0,0,0,0,0|2,0,0]=4 2331 B8R0.4 CNCCCCCCO 34a_100102657272_100000766143 [2,0,0,0,0,0|2,0,0]=4 2332 B8R0.4 CNCCCCCCO 7a_106832991635_100000766143 [2,0,0,0,0,0|2,0,0]=4 2333 B8R0.4 CNCCCCCOC 2230a_100000747528_200000210301 [2,0,0,0,0,0|1,0,0]=3 2334 B8R0.4 CNCCCCCOC 34a_100000722520_200000210301 [2,0,0,0,0,0|1,0,0]=3 2335 B8R0.4 CNCCCCCOC 34a_100000747528_200000210301 [2,0,0,0,0,0|1,0,0]=3 2336 B8R0.4 CNCCCCCO[13CH3] 34a_100000722520_200025704644 [2,0,0,0,0,0|1,0,0]=3 2337 B8R0.4 CNCCOCCOC 2230a_100000745349_200000210301 [2,0,0,0,0,0|2,0,0]=4 2338 B8R0.4 CNCCOCCOC 2230a_106832991635_100000695917 [2,0,0,0,0,0|2,0,0]=4 2339 B8R0.4 CNCCOCCOC 34a_100000228057_200000210301 [2,0,0,0,0,0|2,0,0]=4 2340 B8R0.4 CNCCOCCOC 34a_100000745349_200000210301 [2,0,0,0,0,0|2,0,0]=4 2341 B8R0.4 CNCCOCCOC 34a_100102657272_100000695917 [2,0,0,0,0,0|2,0,0]=4 2342 B8R0.4 CNCCOCCOC 7a_106832991635_100000695917 [2,0,0,0,0,0|2,0,0]=4 2343 B8R0.4 CNCCOCCO[13CH3] 34a_100000228057_200025704644 [2,0,0,0,0,0|2,0,0]=4 2344 B8R0.4 COCCCCCCBr 34a_100011215345_200000210301 [2,0,0,0,0,0|1,0,0]=3 2345 B8R0.4 COCCCCCCBr 7a_100011215345_200000210301 [2,0,0,0,0,0|1,0,0]=3 2346 B8R0.4 COCCCCCCCl 34a_100000766143_200000210301 [2,0,0,0,0,0|1,0,0]=3 2347 B8R0.4 COCCCCCCCl 7a_100000766143_200000210301 [2,0,0,0,0,0|1,0,0]=3 2348 B8R0.4 COCCCCCCF 34a_100000732779_200000210301 [2,0,0,0,0,0|1,0,0]=3 2349 B8R0.4 COCCCCCCF 34a_100138415774_100015922095 [2,0,0,0,0,0|1,0,0]=3 2350 B8R0.4 COCCCCCCF 7a_100000732779_200000210301 [2,0,0,0,0,0|1,0,0]=3 2351 B8R0.4 COCCCCCCN 34a_100000686447_200000210301 [2,0,0,0,0,0|1,0,0]=3 2352 B8R0.4 COCCCCCCO 34a_100138415774_100000766143 [2,0,0,0,0,0|1,0,0]=3 2353 B8R0.4 COCCCCCN[13CH3] 2230a_100000747528_200025704644 [2,0,0,0,0,0|1,0,0]=3 2354 B8R0.4 COCCCCCN[13CH3] 34a_100000747528_200025704644 [2,0,0,0,0,0|1,0,0]=3 2355 B8R0.4 COCCCCOCF 34a_100000740925_100015361967 [2,0,0,0,0,0|2,0,0]=4 2356 B8R0.4 COCCCCSCF 62a_100000730899_100015361967 [2,0,0,0,0,0|2,0,0]=4 2357 B8R0.4 COCCCCSCF 62a_100015361967_100000730899 [2,0,0,0,0,0|2,0,0]=4 2358 B8R0.4 COCCCNCCF 34a_100000724931_100000740836 [2,0,0,0,0,0|2,0,0]=4 2359 B8R0.4 COCCCNCCF 34a_100150723488_100011217306 [2,0,0,0,0,0|2,0,0]=4 2360 B8R0.4 COCCCNCCO 2230a_100016997473_100000740836 [2,0,0,0,0,0|2,0,0]=4 2361 B8R0.4 COCCCNCCO 34a_100016990907_100000740836 [2,0,0,0,0,0|2,0,0]=4 2362 B8R0.4 COCCCNCCO 34a_100150723488_100000211926 [2,0,0,0,0,0|2,0,0]=4 2363 B8R0.4 COCCCNCSC 34a_100150723488_100011218213 [2,0,0,0,0,0|2,0,0]=4 2364 B8R0.4 COCCCOCCBr 34a_100000211926_100000740836 [2,0,0,0,0,0|2,0,0]=4 2365 B8R0.4 COCCCOCCF 34a_100000740835_100011217306 [2,0,0,0,0,0|2,0,0]=4 2366 B8R0.4 COCCCOCCN 34a_100000210304_100000740836 [2,0,0,0,0,0|2,0,0]=4 2367 B8R0.4 COCCCOCCO 34a_100000740835_100000211926 [2,0,0,0,0,0|2,0,0]=4 2368 B8R0.4 COCCCOCSC 34a_100000740835_100011218213 [2,0,0,0,0,0|2,0,0]=4 2369 B8R0.4 COCCCSCCF 62a_100000709357_100011217306 [2,0,0,0,0,0|2,0,0]=4 2370 B8R0.4 COCCCSCCF 62a_100011217306_100000709357 [2,0,0,0,0,0|2,0,0]=4 2371 B8R0.4 COCCCSCCO 62a_100000211926_100000709357 [2,0,0,0,0,0|2,0,0]=4 2372 B8R0.4 COCCCSCCO 62a_100000709357_100000211926 [2,0,0,0,0,0|2,0,0]=4 2373 B8R0.4 COCCCSCOC 62a_100000709357_100000766300 [2,0,0,0,0,0|2,0,0]=4 2374 B8R0.4 COCCCSCOC 62a_100000766300_100000709357 [2,0,0,0,0,0|2,0,0]=4 2375 B8R0.4 COCCCSCSC 62a_100000709357_100011218213 [2,0,0,0,0,0|2,0,0]=4 2376 B8R0.4 COCCCSCSC 62a_100011218213_100000709357 [2,0,0,0,0,0|2,0,0]=4 2377 B8R0.4 COCCNCCCF 2230a_100000209980_100011934791 [2,0,0,0,0,0|2,0,0]=4 2378 B8R0.4 COCCNCCCF 2230a_100015189416_100011201679 [2,0,0,0,0,0|2,0,0]=4 2379 B8R0.4 COCCNCCCF 34a_100015189416_100011201679 [2,0,0,0,0,0|2,0,0]=4 2380 B8R0.4 COCCNCCCO 2230a_100000209980_100000230001 [2,0,0,0,0,0|2,0,0]=4 2381 B8R0.4 COCCNCCOC 2230a_100000209980_100011201679 [2,0,0,0,0,0|2,0,0]=4 2382 B8R0.4 COCCNCCSC 2230a_100000209980_100000751147 [2,0,0,0,0,0|2,0,0]=4 2383 B8R0.4 COCCNCCSC 2230a_100020590264_100011201679 [2,0,0,0,0,0|2,0,0]=4 2384 B8R0.4 COCCOCCCBr 34a_100011217188_100011201679 [2,0,0,0,0,0|2,0,0]=4 2385 B8R0.4 COCCOCCCCl 34a_100000230001_100011201679 [2,0,0,0,0,0|2,0,0]=4 2386 B8R0.4 COCCOCCCF 34a_100000210237_100011934791 [2,0,0,0,0,0|2,0,0]=4 2387 B8R0.4 COCCOCCCF 34a_100000759539_100011201679 [2,0,0,0,0,0|2,0,0]=4 2388 B8R0.4 COCCOCCCN 34a_100000182051_100011201679 [2,0,0,0,0,0|2,0,0]=4 2389 B8R0.4 COCCOCCCO 34a_100000210237_100000230001 [2,0,0,0,0,0|2,0,0]=4 2390 B8R0.4 COCCOCCN[13CH3] 2230a_100000745349_200025704644 [2,0,0,0,0,0|2,0,0]=4 2391 B8R0.4 COCCOCCN[13CH3] 34a_100000745349_200025704644 [2,0,0,0,0,0|2,0,0]=4 2392 B8R0.4 COCCOCCOC 34a_100000210237_100011201679 [2,0,0,0,0,0|2,0,0]=4 2393 B8R0.4 COCCOCCOC 34a_100011215163_200000210301 [2,0,0,0,0,0|2,0,0]=4 2394 B8R0.4 COCCOCCOC 34a_100138415774_100000695917 [2,0,0,0,0,0|2,0,0]=4 2395 B8R0.4 COCCOCCOC 7a_100011215163_200000210301 [2,0,0,0,0,0|2,0,0]=4 2396 B8R0.4 COCCOCCO[13CH3] 34a_100011215163_200025704644 [2,0,0,0,0,0|2,0,0]=4 2397 B8R0.4 COCCOCCO[13CH3] 7a_100011215163_200025704644 [2,0,0,0,0,0|2,0,0]=4 2398 B8R0.4 COCCOCCSC 34a_100000210237_100000212216 [2,0,0,0,0,0|2,0,0]=4 2399 B8R0.4 COCCOCCSC 34a_100000230434_100011201679 [2,0,0,0,0,0|2,0,0]=4 2400 B8R0.4 COCCOCCSC 62a_100000695917_200000210301 [2,0,0,0,0,0|2,0,0]=4 2401 B8R0.4 COCCOCCSC 62a_200000210301_100000695917 [2,0,0,0,0,0|2,0,0]=4 2402 B8R0.4 COCCOCCSC 7a_100000230434_100000233755 [2,0,0,0,0,0|2,0,0]=4 2403 B8R0.4 COCCOCCS[13CH3] 62a_100000695917_200025704644 [2,0,0,0,0,0|2,0,0]=4 2404 B8R0.4 COCCOCCS[13CH3] 62a_200025704644_100000695917 [2,0,0,0,0,0|2,0,0]=4 2405 B8R0.4 COCCSCCCF 62a_100000233755_100011934791 [2,0,0,0,0,0|2,0,0]=4 2406 B8R0.4 COCCSCCCF 62a_100011934791_100000233755 [2,0,0,0,0,0|2,0,0]=4 2407 B8R0.4 COCCSCCCO 62a_100000233755_100011215043 [2,0,0,0,0,0|2,0,0]=4 2408 B8R0.4 COCCSCCCO 62a_100011215043_100000233755 [2,0,0,0,0,0|2,0,0]=4 2409 B8R0.4 COCCSCCOC 62a_100000233755_100000233755 [2,0,0,0,0,0|2,0,0]=4 2410 B8R0.4 COCCSCCSC 62a_100000212216_100000233755 [2,0,0,0,0,0|2,0,0]=4 2411 B8R0.4 COCCSCCSC 62a_100000233755_100000751147 [2,0,0,0,0,0|2,0,0]=4 2412 B8R0.4 COCNCCCCO 2230a_100000750430_100000766300 [2,0,0,0,0,0|2,0,0]=4 2413 B8R0.4 COCNCCCSC 2230a_100000749238_100000766300 [2,0,0,0,0,0|2,0,0]=4 2414 B8R0.4 COCSCCCCF 62a_100000729493_100000766300 [2,0,0,0,0,0|2,0,0]=4 2415 B8R0.4 COCSCCCCF 62a_100000766300_100000729493 [2,0,0,0,0,0|2,0,0]=4 2416 B8R0.4 COCSCCCCO 62a_100000210776_100000766300 [2,0,0,0,0,0|2,0,0]=4 2417 B8R0.4 COCSCCCCO 62a_100000766300_100000210776 [2,0,0,0,0,0|2,0,0]=4 2418 B8R0.4 CSCCCCCCF 62a_100015922095_200000210301 [2,0,0,0,0,0|1,1,0]=4 2419 B8R0.4 CSCCCCCCF 62a_200000210301_100015922095 [2,0,0,0,0,0|1,1,0]=4 2420 B8R0.4 CSCCCCCCO 62a_100000766143_200000210301 [2,0,0,0,0,0|1,1,0]=4 2421 B8R0.4 CSCCCCCCO 62a_200000210301_100000766143 [2,0,0,0,0,0|1,1,0]=4 2422 B8R0.4 [13CH3]NCCCCCCO 2230a_100000686447_200025704644 [2,0,0,0,0,0|2,0,0]=4 2423 B8R0.4 [13CH3]NCCCCCCO 34a_100000686447_200025704644 [2,0,0,0,0,0|2,0,0]=4 2424 B8R0.4 [13CH3]OCCCCCCBr 34a_100011215345_200025704644 [2,0,0,0,0,0|1,0,0]=3 2425 B8R0.4 [13CH3]OCCCCCCBr 7a_100011215345_200025704644 [2,0,0,0,0,0|1,0,0]=3 2426 B8R0.4 [13CH3]OCCCCCCCl 34a_100000766143_200025704644 [2,0,0,0,0,0|1,0,0]=3 2427 B8R0.4 [13CH3]OCCCCCCCl 7a_100000766143_200025704644 [2,0,0,0,0,0|1,0,0]=3 2428 B8R0.4 [13CH3]OCCCCCCF 34a_100000732779_200025704644 [2,0,0,0,0,0|1,0,0]=3 2429 B8R0.4 [13CH3]OCCCCCCF 7a_100000732779_200025704644 [2,0,0,0,0,0|1,0,0]=3 2430 B8R0.4 [13CH3]OCCCCCCN 34a_100000686447_200025704644 [2,0,0,0,0,0|1,0,0]=3 2431 B8R0.4 [13CH3]SCCCCCCF 62a_100015922095_200025704644 [2,0,0,0,0,0|1,1,0]=4 2432 B8R0.4 [13CH3]SCCCCCCF 62a_200025704644_100015922095 [2,0,0,0,0,0|1,1,0]=4 2433 B8R0.4 [13CH3]SCCCCCCO 62a_100000766143_200025704644 [2,0,0,0,0,0|1,1,0]=4 2434 B8R0.4 [13CH3]SCCCCCCO 62a_200025704644_100000766143 [2,0,0,0,0,0|1,1,0]=4 2435 B8R0.6 CCC#CCC(C)OC 34a_200000035118_200000210301 [2,0,0,0,0,0|0,0,2]=4 2436 B8R0.6 CCC#CCC(C)OC 7a_200000035118_200000210301 [2,0,0,0,0,0|0,0,2]=4 2437 B8R0.6 CCC#CCC(C)O[13CH3] 34a_200000035118_200025704644 [2,0,0,0,0,0|0,0,2]=4 2438 B8R0.6 CCC#CCC(C)O[13CH3] 7a_200000035118_200025704644 [2,0,0,0,0,0|0,0,2]=4 2439 B8R0.6 CCC(C)CCCOC 7a_100011216074_200000210301 [2,0,0,0,0,0|2,0,0]=4 2440 B8R0.6 CCC(C)CCCO[13CH3] 7a_100011216074_200025704644 [2,0,0,0,0,0|2,0,0]=4 2441 B8R0.6 CCCCCC(C)NC 2230a_100000211957_200000210301 [2,0,0,0,0,0|1,0,0]=3 2442 B8R0.6 CCCCCC(C)NC 2230a_106832991635_200011218191 [2,0,0,0,0,0|1,0,0]=3 2443 B8R0.6 CCCCCC(C)NC 270004a_106832991635_100000211708 [2,0,0,0,0,0|1,0,0]=3 2444 B8R0.6 CCCCCC(C)NC 34a_100102657272_200011218191 [2,0,0,0,0,0|1,0,0]=3 2445 B8R0.6 CCCCCC(C)NC 7a_106832991635_200011218191 [2,0,0,0,0,0|1,0,0]=3 2446 B8R0.6 CCCCCC(C)N[13CH3] 2230a_100000211957_200025704644 [2,0,0,0,0,0|1,0,0]=3 2447 B8R0.6 CCCCCC(C)OC 34a_100011215632_200000210301 [2,0,0,0,0,0|0,0,0]=2 2448 B8R0.6 CCCCCC(C)OC 34a_100138415774_200011218191 [2,0,0,0,0,0|0,0,0]=2 2449 B8R0.6 CCCCCC(C)OC 7a_100011215632_200000210301 [2,0,0,0,0,0|0,0,0]=2 2450 B8R0.6 CCCCCC(C)O[13CH3] 34a_100011215632_200025704644 [2,0,0,0,0,0|0,0,0]=2 2451 B8R0.6 CCCCCC(C)O[13CH3] 7a_100011215632_200025704644 [2,0,0,0,0,0|0,0,0]=2 2452 B8R0.6 CCCCCC(C)SC 62a_200000210301_200011218191 [2,0,0,0,0,0|0,1,0]=3 2453 B8R0.6 CCCCCC(C)SC 62a_200011218191_200000210301 [2,0,0,0,0,0|0,1,0]=3 2454 B8R0.6 CCCCCC(C)S[13CH3] 62a_200011218191_200025704644 [2,0,0,0,0,0|0,1,0]=3 2455 B8R0.6 CCCCCC(C)S[13CH3] 62a_200025704644_200011218191 [2,0,0,0,0,0|0,1,0]=3 2456 B8R0.6 CCCCCN(C)CC 2230a_100000223495_100000210202 [2,0,0,0,0,0|2,0,0]=4 2457 B8R0.6 CCCCCN(C)CC 2230a_100000225621_100000210326 [2,0,0,0,0,0|2,0,0]=4 2458 B8R0.6 CCCCCN(C)CC 269982a_100000223495_100000204670 [2,0,0,0,0,0|2,0,0]=4 2459 B8R0.6 CCCCCN(C)CC 269982a_100000225621_100000210215 [2,0,0,0,0,0|2,0,0]=4 2460 B8R0.6 CCCCNC(C)CC 2230a_100000102301_100000758301 [2,0,0,0,0,0|2,0,0]=4 2461 B8R0.6 CCCCNC(C)CC 2230a_100000209981_100000210211 [2,0,0,0,0,0|2,0,0]=4 2462 B8R0.6 CCCCNC(C)CC 7a_106832991798_100000758301 [2,0,0,0,0,0|2,0,0]=4 2463 B8R0.6 CCCCOC(C)CC 34a_100000210227_100011215416 [2,0,0,0,0,0|2,0,0]=4 2464 B8R0.6 CCCCOC(C)CC 7a_100000210227_100000758301 [2,0,0,0,0,0|2,0,0]=4 2465 B8R0.6 CCCCOC(C)CC 7a_100000210228_100000210211 [2,0,0,0,0,0|2,0,0]=4 2466 B8R0.6 CCCCSC(C)CC 62a_100000210211_100000758301 [2,0,0,0,0,0|2,0,0]=4 2467 B8R0.6 CCCCSC(C)CC 62a_100000758301_100000210210 [2,0,0,0,0,0|2,0,0]=4 2468 B8R0.6 CCCCSC(C)OC 62a_100000210211_100009879195 [2,0,0,0,0,0|1,0,0]=3 2469 B8R0.6 CCCCSC(C)OC 62a_100009879195_100000210210 [2,0,0,0,0,0|1,0,0]=3 2470 B8R0.6 CCCNCC(C)CC 2230a_100020588543_100000210303 [2,0,0,0,0,0|2,0,0]=4 2471 B8R0.6 CCCNCC(C)CC 270004a_100020643023_100000243153 [2,0,0,0,0,0|2,0,0]=4 2472 B8R0.6 CCCNCC(O)CC 2230a_100011218483_100000210303 [2,0,0,0,0,0|2,0,0]=4 2473 B8R0.6 CCCNC[C@@H](C)OC 2230a_100020591295_100000210303 [2,0,0,0,0,0|1,0,0]=3 2474 B8R0.6 CCCOCC(C)CC 34a_100000210258_100000748023 [2,0,0,0,0,0|2,0,0]=4 2475 B8R0.6 CCCOCC(C)OC 34a_100000690652_100000210303 [2,0,0,0,0,0|1,0,0]=3 2476 B8R0.6 CCCOCC(O)CC 34a_100000210258_100011218378 [2,0,0,0,0,0|2,0,0]=4 2477 B8R0.6 CCCOC[C@@H](C)CC 34a_100000210258_100009816398 [2,0,0,0,0,0|2,0,0]=4 2478 B8R0.6 CCCOC[C@@H](C)CC 7a_100009816381_100000210303 [2,0,0,0,0,0|2,0,0]=4 2479 B8R0.6 CCCSCC(C)CC 62a_100000210303_100000748023 [2,0,0,0,0,0|2,0,0]=4 2480 B8R0.6 CCCSCC(C)CC 62a_100000748023_100000210303 [2,0,0,0,0,0|2,0,0]=4 2481 B8R0.6 CCCSCC(C)NC 270004a_106832991635_100011343953 [2,0,0,0,0,0|2,0,0]=4 2482 B8R0.6 CCCSCC(O)CC 62a_100000210303_100011218378 [2,0,0,0,0,0|2,0,0]=4 2483 B8R0.6 CCCSCC(O)CC 62a_100011218378_100000210303 [2,0,0,0,0,0|2,0,0]=4 2484 B8R0.6 CCCSC[C@@H](C)CC 62a_100000210303_100009816398 [2,0,0,0,0,0|2,0,0]=4 2485 B8R0.6 CCCSC[C@@H](C)CC 62a_100009816398_100000210303 [2,0,0,0,0,0|2,0,0]=4 2486 B8R0.6 CCNCCC(C)CC 2230a_100020591266_100000210202 [2,0,0,0,0,0|2,0,0]=4 2487 B8R0.6 CCOCCC(C)CC 7a_100011215188_100000210202 [2,0,0,0,0,0|2,0,0]=4 2488 B8R0.6 CCOCCC(C)NC 270004a_106832991635_200011216536 [2,0,0,0,0,0|2,0,0]=4 2489 B8R0.6 CCOCCC(C)OC 7a_100000764861_100000210202 [2,0,0,0,0,0|1,0,0]=3 2490 B8R0.6 CCOCSC(C)OC 62a_100000739092_100009879195 [2,0,0,0,0,0|2,0,0]=4 2491 B8R0.6 CCOCSC(C)OC 62a_100009879195_100000739092 [2,0,0,0,0,0|2,0,0]=4 2492 B8R0.6 CNC(C)CCCSC 270004a_106832991635_100011399439 [2,0,0,0,0,0|2,0,0]=4 2493 B8R0.6 COC(C)CCOCF 7a_100000764861_100015361967 [2,0,0,0,0,0|2,0,0]=4 2494 B8R0.6 COC(C)COCCF 34a_100000690652_100011217306 [2,0,0,0,0,0|2,0,0]=4 2495 B8R0.6 COC(C)COCCO 34a_100000690652_100000211926 [2,0,0,0,0,0|2,0,0]=4 2496 B8R0.6 COC(C)COCSC 34a_100000690652_100011218213 [2,0,0,0,0,0|2,0,0]=4 2497 B8R0.6 COC(C)SCCCF 62a_100009879195_100011934791 [2,0,0,0,0,0|2,0,0]=4 2498 B8R0.6 COC(C)SCCCF 62a_100011934791_100009879195 [2,0,0,0,0,0|2,0,0]=4 2499 B8R0.6 COC(C)SCCCO 62a_100009879195_100011215043 [2,0,0,0,0,0|2,0,0]=4 2500 B8R0.6 COC(C)SCCCO 62a_100011215043_100009879195 [2,0,0,0,0,0|2,0,0]=4 2501 B8R0.6 COC(C)SCCSC 62a_100000212216_100009879195 [2,0,0,0,0,0|2,0,0]=4 2502 B8R0.6 COC(C)SCCSC 62a_100009879195_100000751147 [2,0,0,0,0,0|2,0,0]=4 2503 B8R0.6 COCCCC(C)OC 34a_200011539412_200000210301 [2,0,0,0,0,0|1,0,0]=3 2504 B8R0.6 COCCCC(C)OC 7a_200011539412_200000210301 [2,0,0,0,0,0|1,0,0]=3 2505 B8R0.6 COCCCC(C)O[13CH3] 34a_200011539412_200025704644 [2,0,0,0,0,0|1,0,0]=3 2506 B8R0.6 COCCCC(C)O[13CH3] 7a_200011539412_200025704644 [2,0,0,0,0,0|1,0,0]=3 2507 B8R0.6 COCCSC(C)OC 62a_100000233755_100009879195 [2,0,0,0,0,0|2,0,0]=4 2508 B8R0.6 COCCSC(C)OC 62a_100009879195_100000233755 [2,0,0,0,0,0|2,0,0]=4 2509 B8R0.6 COCNC[C@@H](C)OC 2230a_100020591295_100000766300 [2,0,0,0,0,0|2,0,0]=4 2510 B8R0.6 CO[C@H](C)CNCCF 2230a_100020591295_100011217306 [2,0,0,0,0,0|2,0,0]=4 2511 B8R0.6 CO[C@H](C)CNCCO 2230a_100020591295_100000211926 [2,0,0,0,0,0|2,0,0]=4 2512 B8R0.6 CO[C@H](C)CNCSC 2230a_100020591295_100011218213 [2,0,0,0,0,0|2,0,0]=4 2513 B8R0.7 CC(C)CCCCO[13CH3] 34a_100011214890_200025704644 [2,0,0,0,0,0|1,0,0]=3 2514 B8R0.7 CC(C)CCCCO[13CH3] 7a_100011214890_200025704644 [2,0,0,0,0,0|1,0,0]=3 2515 B8R0.7 CC(C)CCCCS[13CH3] 62a_100011216152_200025704644 [2,0,0,0,0,0|1,0,0]=3 2516 B8R0.7 CC(C)CCCCS[13CH3] 62a_200025704644_100011216152 [2,0,0,0,0,0|1,0,0]=3 2517 B8R0.7 CC(C)CCCNCF 34a_200000737386_100015361967 [2,0,0,0,0,0|2,0,0]=4 2518 B8R0.7 CC(C)CCCOCF 34a_100000210774_100015361967 [2,0,0,0,0,0|2,0,0]=4 2519 B8R0.7 CC(C)CCCOCF 7a_100000210774_100015361967 [2,0,0,0,0,0|2,0,0]=4 2520 B8R0.7 CC(C)CCCSCF 62a_100011214892_100015361967 [2,0,0,0,0,0|2,0,0]=4 2521 B8R0.7 CC(C)CCCSCF 62a_100015361967_100011214892 [2,0,0,0,0,0|2,0,0]=4 2522 B8R0.7 CC(C)CCNCCF 269862a_100000724931_100000185833 [2,0,0,0,0,0|2,0,0]=4 2523 B8R0.7 CC(C)CCNCCF 34a_100000724931_100000210312 [2,0,0,0,0,0|2,0,0]=4 2524 B8R0.7 CC(C)CCNCCO 2230a_100016997473_100000210312 [2,0,0,0,0,0|2,0,0]=4 2525 B8R0.7 CC(C)CCNCCO 269862a_100000210304_100000185833 [2,0,0,0,0,0|2,0,0]=4 2526 B8R0.7 CC(C)CCNCCO 34a_100016990907_100000210312 [2,0,0,0,0,0|2,0,0]=4 2527 B8R0.7 CC(C)CCOCCBr 34a_100000211926_100000210312 [2,0,0,0,0,0|2,0,0]=4 2528 B8R0.7 CC(C)CCOCCF 34a_100000210254_100011217306 [2,0,0,0,0,0|2,0,0]=4 2529 B8R0.7 CC(C)CCOCCF 7a_100000210254_100011217306 [2,0,0,0,0,0|2,0,0]=4 2530 B8R0.7 CC(C)CCOCCN 34a_100000210304_100000210312 [2,0,0,0,0,0|2,0,0]=4 2531 B8R0.7 CC(C)CCOCCO 34a_100000210254_100000211926 [2,0,0,0,0,0|2,0,0]=4 2532 B8R0.7 CC(C)CCOCCO 7a_100000210254_100000211926 [2,0,0,0,0,0|2,0,0]=4 2533 B8R0.7 CC(C)CCSCCF 62a_100000210312_100011217306 [2,0,0,0,0,0|2,0,0]=4 2534 B8R0.7 CC(C)CCSCCF 62a_100011217306_100000210312 [2,0,0,0,0,0|2,0,0]=4 2535 B8R0.7 CC(C)CCSCCO 62a_100000210312_100000211926 [2,0,0,0,0,0|2,0,0]=4 2536 B8R0.7 CC(C)CCSCCO 62a_100000211926_100000210312 [2,0,0,0,0,0|2,0,0]=4 2537 B8R0.7 CC(C)CNCCCF 2230a_100000210953_100011934791 [2,0,0,0,0,0|2,0,0]=4 2538 B8R0.7 CC(C)CNCCCF 2230a_100015189416_100000210760 [2,0,0,0,0,0|2,0,0]=4 2539 B8R0.7 CC(C)CNCCCF 270004a_100015189416_100000210432 [2,0,0,0,0,0|2,0,0]=4 2540 B8R0.7 CC(C)CNCCCF 34a_100000210953_100011934791 [2,0,0,0,0,0|2,0,0]=4 2541 B8R0.7 CC(C)CNCCCF 34a_100015189416_100000210624 [2,0,0,0,0,0|2,0,0]=4 2542 B8R0.7 CC(C)CNCCCO 2230a_100000210953_100000230001 [2,0,0,0,0,0|2,0,0]=4 2543 B8R0.7 CC(C)CNCCCO 270004a_100000182051_100000210432 [2,0,0,0,0,0|2,0,0]=4 2544 B8R0.7 CC(C)CNCCCO 34a_100000210953_100000230001 [2,0,0,0,0,0|2,0,0]=4 2545 B8R0.7 CC(C)CNCCO[13CH3] 34a_100015185251_200025704644 [2,0,0,0,0,0|2,0,0]=4 2546 B8R0.7 CC(C)COCCCBr 34a_100011217188_100000210624 [2,0,0,0,0,0|2,0,0]=4 2547 B8R0.7 CC(C)COCCCCl 34a_100000230001_100000210624 [2,0,0,0,0,0|2,0,0]=4 2548 B8R0.7 CC(C)COCCCF 34a_100000210257_100011934791 [2,0,0,0,0,0|2,0,0]=4 2549 B8R0.7 CC(C)COCCCF 34a_100000759539_100000210624 [2,0,0,0,0,0|2,0,0]=4 2550 B8R0.7 CC(C)COCCCN 34a_100000182051_100000210624 [2,0,0,0,0,0|2,0,0]=4 2551 B8R0.7 CC(C)COCCCO 34a_100000210257_100000230001 [2,0,0,0,0,0|2,0,0]=4 2552 B8R0.7 CC(C)COCCO[13CH3] 34a_100000703358_200025704644 [2,0,0,0,0,0|2,0,0]=4 2553 B8R0.7 CC(C)COCCO[13CH3] 7a_100000703358_200025704644 [2,0,0,0,0,0|2,0,0]=4 2554 B8R0.7 CC(C)CSCCCF 62a_100000210624_100011934791 [2,0,0,0,0,0|2,0,0]=4 2555 B8R0.7 CC(C)CSCCCF 62a_100011934791_100000210760 [2,0,0,0,0,0|2,0,0]=4 2556 B8R0.7 CC(C)CSCCCO 62a_100000210624_100011215043 [2,0,0,0,0,0|2,0,0]=4 2557 B8R0.7 CC(C)CSCCCO 62a_100011215043_100000210760 [2,0,0,0,0,0|2,0,0]=4 2558 B8R0.7 CC(C)CSCCO[13CH3] 34a_200000230437_200025704644 [2,0,0,0,0,0|2,0,0]=4 2559 B8R0.7 CC(C)CSCCO[13CH3] 7a_200000230437_200025704644 [2,0,0,0,0,0|2,0,0]=4 2560 B8R0.7 CC(C)NCCCCF 2230a_100138425928_100000729493 [2,0,0,0,0,0|2,0,0]=4 2561 B8R0.7 CC(C)NCCCCF 34a_100138425928_100000729493 [2,0,0,0,0,0|2,0,0]=4 2562 B8R0.7 CC(C)NCCCCO 2230a_100000750430_100000210206 [2,0,0,0,0,0|2,0,0]=4 2563 B8R0.7 CC(C)NCCCCO 2230a_100138425928_100000210776 [2,0,0,0,0,0|2,0,0]=4 2564 B8R0.7 CC(C)NCCCCO 34a_100000750430_100000210206 [2,0,0,0,0,0|2,0,0]=4 2565 B8R0.7 CC(C)NCCCCO 34a_100138425928_100011216708 [2,0,0,0,0,0|2,0,0]=4 2566 B8R0.7 CC(C)NCCCO[13CH3] 34a_100000182298_200025704644 [2,0,0,0,0,0|2,0,0]=4 2567 B8R0.7 CC(C)OCCCCBr 34a_100011216708_100000210206 [2,0,0,0,0,0|2,0,0]=4 2568 B8R0.7 CC(C)OCCCCCl 34a_100000210776_100000210206 [2,0,0,0,0,0|2,0,0]=4 2569 B8R0.7 CC(C)OCCCCCl 7a_100000210776_100000210206 [2,0,0,0,0,0|2,0,0]=4 2570 B8R0.7 CC(C)OCCCCF 34a_100000212225_100000729493 [2,0,0,0,0,0|2,0,0]=4 2571 B8R0.7 CC(C)OCCCCF 34a_100011995726_100000210206 [2,0,0,0,0,0|2,0,0]=4 2572 B8R0.7 CC(C)OCCCCF 7a_100011995726_100000210206 [2,0,0,0,0,0|2,0,0]=4 2573 B8R0.7 CC(C)OCCCCI 34a_200012148704_100000210206 [2,0,0,0,0,0|2,0,0]=4 2574 B8R0.7 CC(C)OCCCCN 34a_100000750430_100000210206 [2,0,0,0,0,0|2,0,0]=4 2575 B8R0.7 CC(C)OCCCCO 34a_100000212225_100011216708 [2,0,0,0,0,0|2,0,0]=4 2576 B8R0.7 CC(C)OCCCN[13CH3] 2230a_100000737246_200025704644 [2,0,0,0,0,0|2,0,0]=4 2577 B8R0.7 CC(C)OCCCN[13CH3] 34a_100000737246_200025704644 [2,0,0,0,0,0|2,0,0]=4 2578 B8R0.7 CC(C)SCCCCF 62a_100000210206_100000729493 [2,0,0,0,0,0|2,0,0]=4 2579 B8R0.7 CC(C)SCCCCF 62a_100000729493_100000210206 [2,0,0,0,0,0|2,0,0]=4 2580 B8R0.7 CC(C)SCCCCO 62a_100000210206_100000210776 [2,0,0,0,0,0|2,0,0]=4 2581 B8R0.7 CC(C)SCCCCO 62a_100000210776_100000210206 [2,0,0,0,0,0|2,0,0]=4 2582 B8R0.7 CC(O)CCCSCF 62a_100015361967_200000718107 [2,0,0,0,0,0|2,0,0]=4 2583 B8R0.7 CC(O)CCCSCF 62a_200000718107_100015361967 [2,0,0,0,0,0|2,0,0]=4 2584 B8R0.7 CC(O)CCNCCF 2230a_200000755665_100011217306 [2,0,0,0,0,0|2,0,0]=4 2585 B8R0.7 CC(O)CCNCCF 34a_100000724931_100012276601 [2,0,0,0,0,0|2,0,0]=4 2586 B8R0.7 CC(O)CCNCCO 2230a_100016997473_100012276601 [2,0,0,0,0,0|2,0,0]=4 2587 B8R0.7 CC(O)CCNCCO 2230a_200000755665_100000211926 [2,0,0,0,0,0|2,0,0]=4 2588 B8R0.7 CC(O)CCNCCO 34a_100016990907_100012276601 [2,0,0,0,0,0|2,0,0]=4 2589 B8R0.7 CC(O)CCOCCBr 34a_100000211926_100012276601 [2,0,0,0,0,0|2,0,0]=4 2590 B8R0.7 CC(O)CCOCCN 34a_100000210304_100012276601 [2,0,0,0,0,0|2,0,0]=4 2591 B8R0.7 CC(O)CCSCCF 62a_100011217306_100012276601 [2,0,0,0,0,0|2,0,0]=4 2592 B8R0.7 CC(O)CCSCCF 62a_100012276601_100011217306 [2,0,0,0,0,0|2,0,0]=4 2593 B8R0.7 CC(O)CCSCCO 62a_100000211926_100012276601 [2,0,0,0,0,0|2,0,0]=4 2594 B8R0.7 CC(O)CCSCCO 62a_100012276601_100000211926 [2,0,0,0,0,0|2,0,0]=4 2595 B8R0.7 CC(O)CNCCCF 2230a_100000210904_100011934791 [2,0,0,0,0,0|2,0,0]=4 2596 B8R0.7 CC(O)CNCCCF 2230a_100015189416_100011218427 [2,0,0,0,0,0|2,0,0]=4 2597 B8R0.7 CC(O)CNCCCF 34a_100000210904_100011934791 [2,0,0,0,0,0|2,0,0]=4 2598 B8R0.7 CC(O)CNCCCF 34a_100015189416_100011218427 [2,0,0,0,0,0|2,0,0]=4 2599 B8R0.7 CC(O)CNCCCO 2230a_100000210904_100000230001 [2,0,0,0,0,0|2,0,0]=4 2600 B8R0.7 CC(O)CNCCCO 34a_100000210904_100000230001 [2,0,0,0,0,0|2,0,0]=4 2601 B8R0.7 CC(O)COCCCBr 34a_100011217188_100011218427 [2,0,0,0,0,0|2,0,0]=4 2602 B8R0.7 CC(O)COCCCCl 34a_100000230001_100011218427 [2,0,0,0,0,0|2,0,0]=4 2603 B8R0.7 CC(O)COCCCF 34a_100000759539_100011218427 [2,0,0,0,0,0|2,0,0]=4 2604 B8R0.7 CC(O)COCCCN 34a_100000182051_100011218427 [2,0,0,0,0,0|2,0,0]=4 2605 B8R0.7 CC(O)CSCCCF 62a_100011218427_100011934791 [2,0,0,0,0,0|2,0,0]=4 2606 B8R0.7 CC(O)CSCCCF 62a_100011934791_100011218427 [2,0,0,0,0,0|2,0,0]=4 2607 B8R0.7 CC(O)CSCCCO 62a_100011215043_100011218427 [2,0,0,0,0,0|2,0,0]=4 2608 B8R0.7 CC(O)CSCCCO 62a_100011218427_100011215043 [2,0,0,0,0,0|2,0,0]=4 2609 B8R0.7 CCCCCCC(=O)C 1458a_100000070787_100000210757 [2,0,0,0,0,0|0,0,2]=4 2610 B8R0.7 CCCCCCC(=O)C 1458a_100102632555_200000210301 [2,0,0,0,0,0|0,0,2]=4 2611 B8R0.7 CCCCCCC(=O)[13CH3] 1458a_100102632555_200025704644 [2,0,0,0,0,0|0,0,2]=4 2612 B8R0.7 CCCCCCN(C)C 2230a_100102631434_100000210314 [2,0,0,0,0,0|1,0,0]=3 2613 B8R0.7 CCCCCCN(C)C 2230a_106256046315_200000210301 [2,0,0,0,0,0|1,0,0]=3 2614 B8R0.7 CCCCCCN(C)C 269982a_100102631434_100000210757 [2,0,0,0,0,0|1,0,0]=3 2615 B8R0.7 CCCCCCN(C)C 269982a_106256046315_200000210301 [2,0,0,0,0,0|1,0,0]=3 2616 B8R0.7 CCCCCCN(C)[13CH3] 2230a_106256046315_200025704644 [2,0,0,0,0,0|1,0,0]=3 2617 B8R0.7 CCCCCCN(C)[13CH3] 269982a_106256046315_200025704644 [2,0,0,0,0,0|1,0,0]=3 2618 B8R0.7 CCCCCNC(C)C 2230a_100000209983_100000210206 [2,0,0,0,0,0|1,0,0]=3 2619 B8R0.7 CCCCCNC(C)C 2230a_100138425928_100000210326 [2,0,0,0,0,0|1,0,0]=3 2620 B8R0.7 CCCCCNC(C)C 34a_100138425928_100000718602 [2,0,0,0,0,0|1,0,0]=3 2621 B8R0.7 CCCCCOC(C)C 34a_100000210253_100000210206 [2,0,0,0,0,0|1,0,0]=3 2622 B8R0.7 CCCCCOC(C)C 34a_100000212225_100000718602 [2,0,0,0,0,0|1,0,0]=3 2623 B8R0.7 CCCCCOC(C)C 7a_100000210253_100000210206 [2,0,0,0,0,0|1,0,0]=3 2624 B8R0.7 CCCCCSC(C)C 62a_100000210206_100000210326 [2,0,0,0,0,0|1,0,0]=3 2625 B8R0.7 CCCCCSC(C)C 62a_100000210326_100000210206 [2,0,0,0,0,0|1,0,0]=3 2626 B8R0.7 CCCCNCC(C)C 2230a_100000102301_100000210760 [2,0,0,0,0,0|1,0,0]=3 2627 B8R0.7 CCCCNCC(C)C 2230a_100000210953_100000210211 [2,0,0,0,0,0|1,0,0]=3 2628 B8R0.7 CCCCNCC(C)C 270004a_100000102301_100000210432 [2,0,0,0,0,0|1,0,0]=3 2629 B8R0.7 CCCCNCC(C)C 34a_100000210953_100000210210 [2,0,0,0,0,0|1,0,0]=3 2630 B8R0.7 CCCCNCC(C)C 7a_106832991798_100000210760 [2,0,0,0,0,0|1,0,0]=3 2631 B8R0.7 CCCCNCC(C)O 2230a_100000102301_100011218427 [2,0,0,0,0,0|1,0,0]=3 2632 B8R0.7 CCCCNCC(C)O 2230a_100000210904_100000210211 [2,0,0,0,0,0|1,0,0]=3 2633 B8R0.7 CCCCNCC(C)O 34a_100000210904_100000210210 [2,0,0,0,0,0|1,0,0]=3 2634 B8R0.7 CCCCNCC(C)O 7a_106832991798_100011218427 [2,0,0,0,0,0|1,0,0]=3 2635 B8R0.7 CCCCNC[C@@H](C)O 2230a_100000102301_100009817552 [2,0,0,0,0,0|1,0,0]=3 2636 B8R0.7 CCCCNC[C@@H](C)O 7a_106832991798_100009817552 [2,0,0,0,0,0|1,0,0]=3 2637 B8R0.7 CCCCOCC(C)Br 34a_100012180447_100000210210 [2,0,0,0,0,0|2,0,0]=4 2638 B8R0.7 CCCCOCC(C)C 34a_100000210227_100000210624 [2,0,0,0,0,0|1,0,0]=3 2639 B8R0.7 CCCCOCC(C)C 34a_100000210257_100000210210 [2,0,0,0,0,0|1,0,0]=3 2640 B8R0.7 CCCCOCC(C)C 7a_100000210227_100000210760 [2,0,0,0,0,0|1,0,0]=3 2641 B8R0.7 CCCCOCC(C)F 34a_100015925927_100000210210 [2,0,0,0,0,0|2,0,0]=4 2642 B8R0.7 CCCCOCC(C)O 34a_100000210227_100011218427 [2,0,0,0,0,0|1,0,0]=3 2643 B8R0.7 CCCCOCC(C)O 7a_100000210227_100011218427 [2,0,0,0,0,0|1,0,0]=3 2644 B8R0.7 CCCCOCN(C)C 2230a_100102631434_100011995733 [2,0,0,0,0,0|2,0,0]=4 2645 B8R0.7 CCCCOCN(C)C 269982a_100102631434_100011995733 [2,0,0,0,0,0|2,0,0]=4 2646 B8R0.7 CCCCOC[C@@H](C)Cl 34a_100016084084_100000210210 [2,0,0,0,0,0|2,0,0]=4 2647 B8R0.7 CCCCOC[C@@H](C)N 34a_100000737577_100000210210 [2,0,0,0,0,0|2,0,0]=4 2648 B8R0.7 CCCCOC[C@@H](C)O 34a_100000210227_100009817552 [2,0,0,0,0,0|1,0,0]=3 2649 B8R0.7 CCCCOC[C@@H](C)O 7a_100000210227_100009817552 [2,0,0,0,0,0|1,0,0]=3 2650 B8R0.7 CCCCSCC(C)C 62a_100000210211_100000210760 [2,0,0,0,0,0|1,0,0]=3 2651 B8R0.7 CCCCSCC(C)C 62a_100000210624_100000210210 [2,0,0,0,0,0|1,0,0]=3 2652 B8R0.7 CCCCSCC(C)O 62a_100000210211_100011218427 [2,0,0,0,0,0|1,0,0]=3 2653 B8R0.7 CCCCSCC(C)O 62a_100011218427_100000210210 [2,0,0,0,0,0|1,0,0]=3 2654 B8R0.7 CCCCSC[C@@H](C)O 62a_100000210211_100009817552 [2,0,0,0,0,0|1,0,0]=3 2655 B8R0.7 CCCCSC[C@@H](C)O 62a_100009817552_100000210210 [2,0,0,0,0,0|1,0,0]=3 2656 B8R0.7 CCCNCCC(C)C 269862a_100020643023_100000185833 [2,0,0,0,0,0|1,0,0]=3 2657 B8R0.7 CCCNCCC(C)O 2230a_200000755665_100000210303 [2,0,0,0,0,0|1,0,0]=3 2658 B8R0.7 CCCOCCC(C)Br 34a_100009893172_100000210303 [2,0,0,0,0,0|2,0,0]=4 2659 B8R0.7 CCCOCCC(C)C 34a_100000210254_100000210303 [2,0,0,0,0,0|1,0,0]=3 2660 B8R0.7 CCCOCCC(C)C 34a_100000210258_100000210312 [2,0,0,0,0,0|1,0,0]=3 2661 B8R0.7 CCCOCCC(C)C 7a_100000210254_100000210303 [2,0,0,0,0,0|1,0,0]=3 2662 B8R0.7 CCCOCCC(C)O 34a_100000210258_100012276601 [2,0,0,0,0,0|1,0,0]=3 2663 B8R0.7 CCCOCCN(C)C 2230a_100102631434_100011215938 [2,0,0,0,0,0|2,0,0]=4 2664 B8R0.7 CCCOCCN(C)C 269982a_100102631434_100011215938 [2,0,0,0,0,0|2,0,0]=4 2665 B8R0.7 CCCOCC[C@@H](C)N 34a_100000706166_100000210303 [2,0,0,0,0,0|2,0,0]=4 2666 B8R0.7 CCCOCOC(C)C 34a_100000210258_100000709892 [2,0,0,0,0,0|2,0,0]=4 2667 B8R0.7 CCCSCCC(C)C 62a_100000210303_100000210312 [2,0,0,0,0,0|1,0,0]=3 2668 B8R0.7 CCCSCCC(C)C 62a_100000210312_100000210303 [2,0,0,0,0,0|1,0,0]=3 2669 B8R0.7 CCCSCCC(C)O 62a_100000210303_100012276601 [2,0,0,0,0,0|1,0,0]=3 2670 B8R0.7 CCCSCCC(C)O 62a_100012276601_100000210303 [2,0,0,0,0,0|1,0,0]=3 2671 B8R0.7 CCCSCCN(C)C 62a_100000210303_100000755713 [2,0,0,0,0,0|2,0,0]=4 2672 B8R0.7 CCCSCOC(C)C 62a_100000210303_100000709892 [2,0,0,0,0,0|2,0,0]=4 2673 B8R0.7 CCCSCOC(C)C 62a_100000709892_100000210303 [2,0,0,0,0,0|2,0,0]=4 2674 B8R0.7 CCNCCCC(C)C 2230a_100015525214_100011214892 [2,0,0,0,0,0|1,0,0]=3 2675 B8R0.7 CCNCCCC(C)C 2230a_200000737386_100000210202 [2,0,0,0,0,0|1,0,0]=3 2676 B8R0.7 CCNCCCC(C)C 34a_200000737386_100000210202 [2,0,0,0,0,0|1,0,0]=3 2677 B8R0.7 CCNCCCC(C)O 2230a_100015525214_200000718107 [2,0,0,0,0,0|1,0,0]=3 2678 B8R0.7 CCNCCOC(C)C 2230a_100000701111_100000210202 [2,0,0,0,0,0|2,0,0]=4 2679 B8R0.7 CCNCCOC(C)C 2230a_100015525214_100000211751 [2,0,0,0,0,0|2,0,0]=4 2680 B8R0.7 CCNCCOC(C)C 34a_100000701111_100000210202 [2,0,0,0,0,0|2,0,0]=4 2681 B8R0.7 CCNCCSC(C)C 2230a_100000731138_100000210202 [2,0,0,0,0,0|2,0,0]=4 2682 B8R0.7 CCNCCSC(C)C 2230a_100015525214_100000730970 [2,0,0,0,0,0|2,0,0]=4 2683 B8R0.7 CCNCCSC(C)C 34a_100000731138_100000210202 [2,0,0,0,0,0|2,0,0]=4 2684 B8R0.7 CCOCCCC(C)C 34a_100000210774_100000210202 [2,0,0,0,0,0|1,0,0]=3 2685 B8R0.7 CCOCCCC(C)C 34a_100121572206_100011214892 [2,0,0,0,0,0|1,0,0]=3 2686 B8R0.7 CCOCCCC(C)C 7a_100000210774_100000210202 [2,0,0,0,0,0|1,0,0]=3 2687 B8R0.7 CCOCCCC(C)O 34a_100121572206_200000718107 [2,0,0,0,0,0|1,0,0]=3 2688 B8R0.7 CCOCCCN(C)C 2230a_100102631434_100012232248 [2,0,0,0,0,0|2,0,0]=4 2689 B8R0.7 CCOCCCN(C)C 269982a_100102631434_100012232248 [2,0,0,0,0,0|2,0,0]=4 2690 B8R0.7 CCOCCNC(C)C 2230a_100138425928_100011215890 [2,0,0,0,0,0|2,0,0]=4 2691 B8R0.7 CCOCCNC(C)C 2230a_102516460346_100000210206 [2,0,0,0,0,0|2,0,0]=4 2692 B8R0.7 CCOCCNC(C)C 34a_100000224655_100000210202 [2,0,0,0,0,0|2,0,0]=4 2693 B8R0.7 CCOCCNC(C)C 34a_100138425928_100000210147 [2,0,0,0,0,0|2,0,0]=4 2694 B8R0.7 CCOCCNC(C)C 34a_102516460346_100000210206 [2,0,0,0,0,0|2,0,0]=4 2695 B8R0.7 CCOCCOC(C)C 34a_100000210136_100000210206 [2,0,0,0,0,0|2,0,0]=4 2696 B8R0.7 CCOCCOC(C)C 34a_100000211219_100000210202 [2,0,0,0,0,0|2,0,0]=4 2697 B8R0.7 CCOCCOC(C)C 34a_100000212225_100000210147 [2,0,0,0,0,0|2,0,0]=4 2698 B8R0.7 CCOCCOC(C)C 34a_100121572206_100000211751 [2,0,0,0,0,0|2,0,0]=4 2699 B8R0.7 CCOCCOC(C)C 7a_100000210136_100000210206 [2,0,0,0,0,0|2,0,0]=4 2700 B8R0.7 CCOCCOC(C)C 7a_100000211219_100000210202 [2,0,0,0,0,0|2,0,0]=4 2701 B8R0.7 CCOCCSC(C)C 34a_100121572206_100000730970 [2,0,0,0,0,0|2,0,0]=4 2702 B8R0.7 CCOCCSC(C)C 34a_200011212901_100000210202 [2,0,0,0,0,0|2,0,0]=4 2703 B8R0.7 CCOCCSC(C)C 62a_100000210147_100000210206 [2,0,0,0,0,0|2,0,0]=4 2704 B8R0.7 CCOCCSC(C)C 62a_100000210206_100011215890 [2,0,0,0,0,0|2,0,0]=4 2705 B8R0.7 CCOCCSC(C)C 7a_200011212901_100000210202 [2,0,0,0,0,0|2,0,0]=4 2706 B8R0.7 CCOCSCC(C)C 62a_100000210624_100000739092 [2,0,0,0,0,0|2,0,0]=4 2707 B8R0.7 CCOCSCC(C)C 62a_100000739092_100000210760 [2,0,0,0,0,0|2,0,0]=4 2708 B8R0.7 CCOCSCC(C)O 62a_100000739092_100011218427 [2,0,0,0,0,0|2,0,0]=4 2709 B8R0.7 CCOCSCC(C)O 62a_100011218427_100000739092 [2,0,0,0,0,0|2,0,0]=4 2710 B8R0.7 CCOCSC[C@@H](C)O 62a_100000739092_100009817552 [2,0,0,0,0,0|2,0,0]=4 2711 B8R0.7 CCOCSC[C@@H](C)O 62a_100009817552_100000739092 [2,0,0,0,0,0|2,0,0]=4 2712 B8R0.7 CCSCCCC(C)C 62a_100000210202_100011214892 [2,0,0,0,0,0|1,0,0]=3 2713 B8R0.7 CCSCCCC(C)C 62a_100011214892_100000210202 [2,0,0,0,0,0|1,0,0]=3 2714 B8R0.7 CCSCCCC(C)O 62a_100000210202_200000718107 [2,0,0,0,0,0|1,0,0]=3 2715 B8R0.7 CCSCCCC(C)O 62a_200000718107_100000210202 [2,0,0,0,0,0|1,0,0]=3 2716 B8R0.7 CCSCCCN(C)C 62a_100000210202_100000757444 [2,0,0,0,0,0|2,0,0]=4 2717 B8R0.7 CCSCCNC(C)C 2230a_100000106463_100000210206 [2,0,0,0,0,0|2,0,0]=4 2718 B8R0.7 CCSCCNC(C)C 2230a_100138425928_100000757381 [2,0,0,0,0,0|2,0,0]=4 2719 B8R0.7 CCSCCNC(C)C 34a_100138425928_100000757381 [2,0,0,0,0,0|2,0,0]=4 2720 B8R0.7 CCSCCOC(C)C 34a_100000212035_100000210206 [2,0,0,0,0,0|2,0,0]=4 2721 B8R0.7 CCSCCOC(C)C 34a_100000212225_100000757381 [2,0,0,0,0,0|2,0,0]=4 2722 B8R0.7 CCSCCOC(C)C 62a_100000210202_100000211751 [2,0,0,0,0,0|2,0,0]=4 2723 B8R0.7 CCSCCOC(C)C 62a_100000211751_100000210202 [2,0,0,0,0,0|2,0,0]=4 2724 B8R0.7 CCSCCOC(C)C 7a_100000212035_100000210206 [2,0,0,0,0,0|2,0,0]=4 2725 B8R0.7 CCSCCSC(C)C 62a_100000210202_100000730970 [2,0,0,0,0,0|2,0,0]=4 2726 B8R0.7 CCSCCSC(C)C 62a_100000210206_100000757381 [2,0,0,0,0,0|2,0,0]=4 2727 B8R0.7 CCSCCSC(C)C 62a_100000730970_100000210202 [2,0,0,0,0,0|2,0,0]=4 2728 B8R0.7 CCSCCSC(C)C 62a_100000757381_100000210206 [2,0,0,0,0,0|2,0,0]=4 2729 B8R0.7 CN(C)CCCCCF 2230a_100102631434_100000729378 [2,0,0,0,0,0|2,0,0]=4 2730 B8R0.7 CN(C)CCCCCF 269982a_100102631434_100000729378 [2,0,0,0,0,0|2,0,0]=4 2731 B8R0.7 CN(C)CCCCCO 2230a_100000722520_200000210301 [2,0,0,0,0,0|2,0,0]=4 2732 B8R0.7 CN(C)CCCCCO 2230a_100102631434_100000746330 [2,0,0,0,0,0|2,0,0]=4 2733 B8R0.7 CN(C)CCCCCO 269982a_100000722520_200000210301 [2,0,0,0,0,0|2,0,0]=4 2734 B8R0.7 CN(C)CCCCCO 269982a_100102631434_100000746330 [2,0,0,0,0,0|2,0,0]=4 2735 B8R0.7 CN(C)CCCCS[13CH3] 62a_200025704644_100000690147 [2,0,0,0,0,0|2,0,0]=4 2736 B8R0.7 CN([13CH3])CCCCCO 2230a_100000722520_200025704644 [2,0,0,0,0,0|2,0,0]=4 2737 B8R0.7 CN([13CH3])CCCCCO 269982a_100000722520_200025704644 [2,0,0,0,0,0|2,0,0]=4 2738 B8R0.7 CNCCCCB(O)O 2230a_106832991635_200009817182 [2,0,0,0,0,0|2,0,0]=4 2739 B8R0.7 CNCCCCB(O)O 34a_100102657272_200009817182 [2,0,0,0,0,0|2,0,0]=4 2740 B8R0.7 CNCCCCB(O)O 7a_106832991635_200009817182 [2,0,0,0,0,0|2,0,0]=4 2741 B8R0.7 CNCCCCC(C)C 2230a_106832991635_100011216152 [2,0,0,0,0,0|1,0,0]=3 2742 B8R0.7 CNCCCCC(C)C 34a_100102657272_100011216152 [2,0,0,0,0,0|1,0,0]=3 2743 B8R0.7 CNCCCCC(C)C 7a_106832991635_100011216152 [2,0,0,0,0,0|1,0,0]=3 2744 B8R0.7 CNCCCOC(C)C 2230a_100000737246_200000210301 [2,0,0,0,0,0|2,0,0]=4 2745 B8R0.7 CNCCCOC(C)C 34a_100000213112_100000210206 [2,0,0,0,0,0|2,0,0]=4 2746 B8R0.7 CNCCCOC(C)C 34a_100000737246_200000210301 [2,0,0,0,0,0|2,0,0]=4 2747 B8R0.7 COCCCCB(O)O 34a_100138415774_200009817182 [2,0,0,0,0,0|2,0,0]=4 2748 B8R0.7 COCCCCC(C)C 34a_100011214890_200000210301 [2,0,0,0,0,0|1,0,0]=3 2749 B8R0.7 COCCCCC(C)C 34a_100138415774_100011216152 [2,0,0,0,0,0|1,0,0]=3 2750 B8R0.7 COCCCCC(C)C 7a_100011214890_200000210301 [2,0,0,0,0,0|1,0,0]=3 2751 B8R0.7 COCCCCN(C)C 2230a_100102631434_100000730899 [2,0,0,0,0,0|2,0,0]=4 2752 B8R0.7 COCCCCN(C)C 269982a_100102631434_100000730899 [2,0,0,0,0,0|2,0,0]=4 2753 B8R0.7 COCCCNC(C)C 2230a_100138425928_100000740836 [2,0,0,0,0,0|2,0,0]=4 2754 B8R0.7 COCCCNC(C)C 34a_100000182298_200000210301 [2,0,0,0,0,0|2,0,0]=4 2755 B8R0.7 COCCCNC(C)C 34a_100138425928_100000740836 [2,0,0,0,0,0|2,0,0]=4 2756 B8R0.7 COCCCNC(C)C 34a_100150723488_100000210206 [2,0,0,0,0,0|2,0,0]=4 2757 B8R0.7 COCCCOC(C)C 34a_100000212225_100000740836 [2,0,0,0,0,0|2,0,0]=4 2758 B8R0.7 COCCCOC(C)C 34a_100000740835_100000210206 [2,0,0,0,0,0|2,0,0]=4 2759 B8R0.7 COCCCSC(C)C 62a_100000210206_100000709357 [2,0,0,0,0,0|2,0,0]=4 2760 B8R0.7 COCCCSC(C)C 62a_100000709357_100000210206 [2,0,0,0,0,0|2,0,0]=4 2761 B8R0.7 COCCNCC(C)C 2230a_100000209980_100000210760 [2,0,0,0,0,0|2,0,0]=4 2762 B8R0.7 COCCNCC(C)C 2230a_100000210953_100011201679 [2,0,0,0,0,0|2,0,0]=4 2763 B8R0.7 COCCNCC(C)C 270004a_100000209980_100000210432 [2,0,0,0,0,0|2,0,0]=4 2764 B8R0.7 COCCNCC(C)C 34a_100000210953_100011201679 [2,0,0,0,0,0|2,0,0]=4 2765 B8R0.7 COCCNCC(C)C 34a_100015185251_200000210301 [2,0,0,0,0,0|2,0,0]=4 2766 B8R0.7 COCCNCC(C)O 2230a_100000209980_100011218427 [2,0,0,0,0,0|2,0,0]=4 2767 B8R0.7 COCCNCC(C)O 2230a_100000210904_100011201679 [2,0,0,0,0,0|2,0,0]=4 2768 B8R0.7 COCCNCC(C)O 34a_100000210904_100011201679 [2,0,0,0,0,0|2,0,0]=4 2769 B8R0.7 COCCNC[C@@H](C)O 2230a_100000209980_100009817552 [2,0,0,0,0,0|2,0,0]=4 2770 B8R0.7 COCCOCC(C)C 34a_100000210237_100000210624 [2,0,0,0,0,0|2,0,0]=4 2771 B8R0.7 COCCOCC(C)C 34a_100000210257_100011201679 [2,0,0,0,0,0|2,0,0]=4 2772 B8R0.7 COCCOCC(C)C 34a_100000703358_200000210301 [2,0,0,0,0,0|2,0,0]=4 2773 B8R0.7 COCCOCC(C)C 7a_100000703358_200000210301 [2,0,0,0,0,0|2,0,0]=4 2774 B8R0.7 COCCOCC(C)O 34a_100000210237_100011218427 [2,0,0,0,0,0|2,0,0]=4 2775 B8R0.7 COCCOC[C@@H](C)O 34a_100000210237_100009817552 [2,0,0,0,0,0|2,0,0]=4 2776 B8R0.7 COCCSCC(C)C 34a_200000230437_200000210301 [2,0,0,0,0,0|2,0,0]=4 2777 B8R0.7 COCCSCC(C)C 62a_100000210624_100000233755 [2,0,0,0,0,0|2,0,0]=4 2778 B8R0.7 COCCSCC(C)C 62a_100000233755_100000210760 [2,0,0,0,0,0|2,0,0]=4 2779 B8R0.7 COCCSCC(C)C 7a_200000230437_200000210301 [2,0,0,0,0,0|2,0,0]=4 2780 B8R0.7 COCCSCC(C)O 62a_100000233755_100011218427 [2,0,0,0,0,0|2,0,0]=4 2781 B8R0.7 COCCSCC(C)O 62a_100011218427_100000233755 [2,0,0,0,0,0|2,0,0]=4 2782 B8R0.7 COCCSC[C@@H](C)O 62a_100000233755_100009817552 [2,0,0,0,0,0|2,0,0]=4 2783 B8R0.7 COCCSC[C@@H](C)O 62a_100009817552_100000233755 [2,0,0,0,0,0|2,0,0]=4 2784 B8R0.7 COCNCCC(C)O 2230a_200000755665_100000766300 [2,0,0,0,0,0|2,0,0]=4 2785 B8R0.7 COCSCCC(C)C 62a_100000210312_100000766300 [2,0,0,0,0,0|2,0,0]=4 2786 B8R0.7 COCSCCC(C)C 62a_100000766300_100000210312 [2,0,0,0,0,0|2,0,0]=4 2787 B8R0.7 COCSCCC(C)O 62a_100000766300_100012276601 [2,0,0,0,0,0|2,0,0]=4 2788 B8R0.7 COCSCCC(C)O 62a_100012276601_100000766300 [2,0,0,0,0,0|2,0,0]=4 2789 B8R0.7 CSCCCCB(O)O 62a_200000210301_200009817182 [2,0,0,0,0,0|2,0,0]=4 2790 B8R0.7 CSCCCCB(O)O 62a_200009817182_200000210301 [2,0,0,0,0,0|2,0,0]=4 2791 B8R0.7 CSCCCCC(C)C 62a_100011216152_200000210301 [2,0,0,0,0,0|1,0,0]=3 2792 B8R0.7 CSCCCCC(C)C 62a_200000210301_100011216152 [2,0,0,0,0,0|1,0,0]=3 2793 B8R0.7 CSCCCCN(C)C 62a_200000210301_100000690147 [2,0,0,0,0,0|2,0,0]=4 2794 B8R0.7 CSCCCNC(C)C 2230a_100000749238_100000210206 [2,0,0,0,0,0|2,0,0]=4 2795 B8R0.7 CSCCCOC(C)C 34a_100000690336_100000210206 [2,0,0,0,0,0|2,0,0]=4 2796 B8R0.7 CSCCCOC(C)C 7a_100000690336_100000210206 [2,0,0,0,0,0|2,0,0]=4 2797 B8R0.7 CSCCNCC(C)C 2230a_100000210953_100000751147 [2,0,0,0,0,0|2,0,0]=4 2798 B8R0.7 CSCCNCC(C)C 2230a_100020590264_100000210760 [2,0,0,0,0,0|2,0,0]=4 2799 B8R0.7 CSCCNCC(C)C 270004a_100020590264_100000210432 [2,0,0,0,0,0|2,0,0]=4 2800 B8R0.7 CSCCNCC(C)C 34a_100000210953_100000212216 [2,0,0,0,0,0|2,0,0]=4 2801 B8R0.7 CSCCNCC(C)O 2230a_100000210904_100000751147 [2,0,0,0,0,0|2,0,0]=4 2802 B8R0.7 CSCCNCC(C)O 2230a_100020590264_100011218427 [2,0,0,0,0,0|2,0,0]=4 2803 B8R0.7 CSCCNCC(C)O 34a_100000210904_100000212216 [2,0,0,0,0,0|2,0,0]=4 2804 B8R0.7 CSCCNC[C@@H](C)O 2230a_100020590264_100009817552 [2,0,0,0,0,0|2,0,0]=4 2805 B8R0.7 CSCCOCC(C)C 34a_100000210257_100000212216 [2,0,0,0,0,0|2,0,0]=4 2806 B8R0.7 CSCCOCC(C)C 34a_100000230434_100000210624 [2,0,0,0,0,0|2,0,0]=4 2807 B8R0.7 CSCCOCC(C)C 7a_100000230434_100000210760 [2,0,0,0,0,0|2,0,0]=4 2808 B8R0.7 CSCCOCC(C)O 34a_100000230434_100011218427 [2,0,0,0,0,0|2,0,0]=4 2809 B8R0.7 CSCCOCC(C)O 7a_100000230434_100011218427 [2,0,0,0,0,0|2,0,0]=4 2810 B8R0.7 CSCCOC[C@@H](C)O 34a_100000230434_100009817552 [2,0,0,0,0,0|2,0,0]=4 2811 B8R0.7 CSCCOC[C@@H](C)O 7a_100000230434_100009817552 [2,0,0,0,0,0|2,0,0]=4 2812 B8R0.7 CSCCSCC(C)C 62a_100000210624_100000751147 [2,0,0,0,0,0|2,0,0]=4 2813 B8R0.7 CSCCSCC(C)C 62a_100000212216_100000210760 [2,0,0,0,0,0|2,0,0]=4 2814 B8R0.7 CSCCSCC(C)O 62a_100000212216_100011218427 [2,0,0,0,0,0|2,0,0]=4 2815 B8R0.7 CSCCSCC(C)O 62a_100011218427_100000751147 [2,0,0,0,0,0|2,0,0]=4 2816 B8R0.7 CSCCSC[C@@H](C)O 62a_100000212216_100009817552 [2,0,0,0,0,0|2,0,0]=4 2817 B8R0.7 CSCCSC[C@@H](C)O 62a_100009817552_100000751147 [2,0,0,0,0,0|2,0,0]=4 2818 B8R0.7 CSCNCCC(C)O 2230a_200000755665_100011218213 [2,0,0,0,0,0|2,0,0]=4 2819 B8R0.7 CSCOCCC(C)C 34a_100000210254_100011218213 [2,0,0,0,0,0|2,0,0]=4 2820 B8R0.7 CSCSCCC(C)C 62a_100000210312_100011218213 [2,0,0,0,0,0|2,0,0]=4 2821 B8R0.7 CSCSCCC(C)C 62a_100011218213_100000210312 [2,0,0,0,0,0|2,0,0]=4 2822 B8R0.7 CSCSCCC(C)O 62a_100011218213_100012276601 [2,0,0,0,0,0|2,0,0]=4 2823 B8R0.7 CSCSCCC(C)O 62a_100012276601_100011218213 [2,0,0,0,0,0|2,0,0]=4 2824 B8R0.7 C[C@@H](O)CNCCCF 2230a_100015189416_100009817552 [2,0,0,0,0,0|2,0,0]=4 2825 B8R0.7 C[C@@H](O)CNCCCF 34a_100015189416_100009817552 [2,0,0,0,0,0|2,0,0]=4 2826 B8R0.7 C[C@@H](O)COCCCBr 34a_100011217188_100009817552 [2,0,0,0,0,0|2,0,0]=4 2827 B8R0.7 C[C@@H](O)COCCCCl 34a_100000230001_100009817552 [2,0,0,0,0,0|2,0,0]=4 2828 B8R0.7 C[C@@H](O)COCCCF 34a_100000759539_100009817552 [2,0,0,0,0,0|2,0,0]=4 2829 B8R0.7 C[C@@H](O)COCCCN 34a_100000182051_100009817552 [2,0,0,0,0,0|2,0,0]=4 2830 B8R0.7 C[C@@H](O)CSCCCF 62a_100009817552_100011934791 [2,0,0,0,0,0|2,0,0]=4 2831 B8R0.7 C[C@@H](O)CSCCCF 62a_100011934791_100009817552 [2,0,0,0,0,0|2,0,0]=4 2832 B8R0.7 C[C@@H](O)CSCCCO 62a_100009817552_100011215043 [2,0,0,0,0,0|2,0,0]=4 2833 B8R0.7 C[C@@H](O)CSCCCO 62a_100011215043_100009817552 [2,0,0,0,0,0|2,0,0]=4 2834 B8R0.7 [13CH3]SCCCCB(O)O 62a_200009817182_200025704644 [2,0,0,0,0,0|2,0,0]=4 2835 B8R0.7 [13CH3]SCCCCB(O)O 62a_200025704644_200009817182 [2,0,0,0,0,0|2,0,0]=4 2836 B8R0.11 C#CC(CCCC)OC 34a_200011217967_200000210301 [2,0,0,0,0,0|1,0,1]=4 2837 B8R0.11 C#CC(CCCC)OC 7a_200011217967_200000210301 [2,0,0,0,0,0|1,0,1]=4 2838 B8R0.11 C#CC(CCCC)O[13CH3] 34a_200011217967_200025704644 [2,0,0,0,0,0|1,0,1]=4 2839 B8R0.11 C#CC(CCCC)O[13CH3] 7a_200011217967_200025704644 [2,0,0,0,0,0|1,0,1]=4 2840 B8R0.11 C=CC(CCCC)OC 34a_200011215037_200000210301 [2,0,0,0,0,0|1,0,1]=4 2841 B8R0.11 C=CC(CCCC)OC 7a_200011215037_200000210301 [2,0,0,0,0,0|1,0,1]=4 2842 B8R0.11 C=CC(CCCC)O[13CH3] 34a_200011215037_200025704644 [2,0,0,0,0,0|1,0,1]=4 2843 B8R0.11 C=CC(CCCC)O[13CH3] 7a_200011215037_200025704644 [2,0,0,0,0,0|1,0,1]=4 2844 B8R0.11 CCCCC(CC)NC 270004a_106832991635_100000753412 [2,0,0,0,0,0|2,0,0]=4 2845 B8R0.11 CCCCC(CC)NC 34a_100102657272_200011216223 [2,0,0,0,0,0|2,0,0]=4 2846 B8R0.11 CCCCC(CC)NC 7a_106832991635_200011216223 [2,0,0,0,0,0|2,0,0]=4 2847 B8R0.11 CCCCC(CC)OC 34a_100011215227_200000210301 [2,0,0,0,0,0|1,0,0]=3 2848 B8R0.11 CCCCC(CC)OC 34a_100138415774_200011216223 [2,0,0,0,0,0|1,0,0]=3 2849 B8R0.11 CCCCC(CC)OC 7a_100011215227_200000210301 [2,0,0,0,0,0|1,0,0]=3 2850 B8R0.11 CCCCC(CC)O[13CH3] 34a_100011215227_200025704644 [2,0,0,0,0,0|1,0,0]=3 2851 B8R0.11 CCCCC(CC)O[13CH3] 7a_100011215227_200025704644 [2,0,0,0,0,0|1,0,0]=3 2852 B8R0.11 CCCCC(CC)SC 62a_200000210301_200011216223 [2,0,0,0,0,0|1,1,0]=4 2853 B8R0.11 CCCCC(CC)SC 62a_200011216223_200000210301 [2,0,0,0,0,0|1,1,0]=4 2854 B8R0.11 CCCCC(CC)S[13CH3] 62a_200011216223_200025704644 [2,0,0,0,0,0|1,1,0]=4 2855 B8R0.11 CCCCC(CC)S[13CH3] 62a_200025704644_200011216223 [2,0,0,0,0,0|1,1,0]=4 2856 B8R0.11 CCNCC(OC)OC 2230a_100015525214_100000751394 [2,0,0,0,0,0|1,0,0]=3 2857 B8R0.11 CCNCC(OC)OC 270004a_100015525214_100000752162 [2,0,0,0,0,0|1,0,0]=3 2858 B8R0.11 CCOCC(CC)OC 34a_100011934954_100000210202 [2,0,0,0,0,0|2,0,0]=4 2859 B8R0.11 CCOCC(CC)OC 7a_100011934954_100000210202 [2,0,0,0,0,0|2,0,0]=4 2860 B8R0.11 CCOCC(OC)OC 34a_100011216393_100000210202 [2,0,0,0,0,0|1,0,0]=3 2861 B8R0.11 CCOCC(OC)OC 34a_100121572206_100000211822 [2,0,0,0,0,0|1,0,0]=3 2862 B8R0.11 CCSCC(OC)OC 62a_100000210202_100000751394 [2,0,0,0,0,0|1,0,0]=3 2863 B8R0.11 CCSCC(OC)OC 62a_100000751394_100000210202 [2,0,0,0,0,0|1,0,0]=3 2864 B8R0.11 CNCCC(OC)OC 2230a_106832991635_100009813347 [2,0,0,0,0,0|1,0,0]=3 2865 B8R0.11 CNCCC(OC)OC 34a_100102657272_100000139399 [2,0,0,0,0,0|1,0,0]=3 2866 B8R0.11 CNCCC(OC)OC 7a_106832991635_100009813347 [2,0,0,0,0,0|1,0,0]=3 2867 B8R0.11 COC(CCSC)OC 62a_100000139399_200000210301 [2,0,0,0,0,0|1,0,0]=3 2868 B8R0.11 COC(CCSC)OC 62a_200000210301_100000139399 [2,0,0,0,0,0|1,0,0]=3 2869 B8R0.11 COC(CCS[13CH3])OC 62a_100000139399_200025704644 [2,0,0,0,0,0|1,0,0]=3 2870 B8R0.11 COC(CCS[13CH3])OC 62a_200025704644_100000139399 [2,0,0,0,0,0|1,0,0]=3 2871 B8R0.11 COC(COCF)OC 34a_100011216393_100015361967 [2,0,0,0,0,0|2,0,0]=4 2872 B8R0.11 COC(CSCF)OC 62a_100000751394_100015361967 [2,0,0,0,0,0|2,0,0]=4 2873 B8R0.11 COC(CSCF)OC 62a_100015361967_100000751394 [2,0,0,0,0,0|2,0,0]=4 2874 B8R0.11 COCCC(OC)OC 34a_100138415774_100000139399 [2,0,0,0,0,0|1,0,0]=3 2875 B10R0.1 C/C=C/C(C)OCCCCC 34a_200102604097_100000718602 [1,1,0,0,0,0|2,0,0]=4 2876 B10R0.1 CC#CC(C)OCCCCC 34a_100011216543_100000718602 [1,1,0,0,0,0|2,0,0]=4 2877 B10R0.1 CCCC(C)CCCOCC 34a_100011713154_100000210202 [1,1,0,0,0,0|2,0,0]=4 2878 B10R0.1 CCCC(C)CCCOCC 7a_100011713154_100000210202 [1,1,0,0,0,0|2,0,0]=4 2879 B10R0.1 CCCCCCC(=O)COC 1458a_100000210968_100000210757 [1,1,0,0,0,0|0,0,2]=4 2880 B10R0.1 CCCCCCC(C)NCC 2230a_100000210919_100000210202 [1,1,0,0,0,0|1,0,0]=3 2881 B10R0.1 CCCCCCC(C)NCC 2230a_100015525214_100011215978 [1,1,0,0,0,0|1,0,0]=3 2882 B10R0.1 CCCCCCC(C)NCC 270004a_100015525214_100000210826 [1,1,0,0,0,0|1,0,0]=3 2883 B10R0.1 CCCCCCC(C)NCC 34a_100000210919_100000210202 [1,1,0,0,0,0|1,0,0]=3 2884 B10R0.1 CCCCCCC(C)NCF 34a_100000210919_100015361967 [1,1,0,0,0,0|1,0,0]=3 2885 B10R0.1 CCCCCCC(C)OCC 34a_100000210265_100000210202 [1,1,0,0,0,0|0,0,0]=2 2886 B10R0.1 CCCCCCC(C)OCC 34a_100121572206_100011215978 [1,1,0,0,0,0|0,0,0]=2 2887 B10R0.1 CCCCCCC(C)OCC 7a_100000210265_100000210202 [1,1,0,0,0,0|0,0,0]=2 2888 B10R0.1 CCCCCCC(C)OCF 34a_100000210265_100015361967 [1,1,0,0,0,0|0,0,0]=2 2889 B10R0.1 CCCCCCC(C)OCF 7a_100000210265_100015361967 [1,1,0,0,0,0|0,0,0]=2 2890 B10R0.1 CCCCCCC(C)SCC 62a_100000210202_100011215978 [1,1,0,0,0,0|0,1,0]=3 2891 B10R0.1 CCCCCCC(C)SCC 62a_100011215978_100000210202 [1,1,0,0,0,0|0,1,0]=3 2892 B10R0.1 CCCCCCC(C)SCF 62a_100011215978_100015361967 [1,1,0,0,0,0|0,1,0]=3 2893 B10R0.1 CCCCCCC(C)SCF 62a_100015361967_100011215978 [1,1,0,0,0,0|0,1,0]=3 2894 B10R0.1 CCCCCCN(C)CCC 2230a_100000747261_100000210314 [1,1,0,0,0,0|2,0,0]=4 2895 B10R0.1 CCCCCCN(C)CCC 2230a_106256046315_100000210303 [1,1,0,0,0,0|2,0,0]=4 2896 B10R0.1 CCCCCCN(C)CCC 269982a_100000747261_100000210757 [1,1,0,0,0,0|2,0,0]=4 2897 B10R0.1 CCCCCCN(C)CCC 269982a_106256046315_100000210303 [1,1,0,0,0,0|2,0,0]=4 2898 B10R0.1 CCCCCCN(C)CCF 2230a_106256046315_100011217306 [1,1,0,0,0,0|2,0,0]=4 2899 B10R0.1 CCCCCCN(C)CCF 269982a_106256046315_100011217306 [1,1,0,0,0,0|2,0,0]=4 2900 B10R0.1 CCCCCCN(C)CCO 2230a_100000210263_100000210314 [1,1,0,0,0,0|2,0,0]=4 2901 B10R0.1 CCCCCCN(C)CCO 2230a_106256046315_100000211926 [1,1,0,0,0,0|2,0,0]=4 2902 B10R0.1 CCCCCCN(C)CCO 269982a_100000210263_100000210757 [1,1,0,0,0,0|2,0,0]=4 2903 B10R0.1 CCCCCCN(C)CCO 269982a_106256046315_100000211926 [1,1,0,0,0,0|2,0,0]=4 2904 B10R0.1 CCCCCCN(C)COC 2230a_106256046315_100000766300 [1,1,0,0,0,0|1,0,0]=3 2905 B10R0.1 CCCCCCN(C)COC 269982a_106256046315_100000766300 [1,1,0,0,0,0|1,0,0]=3 2906 B10R0.1 CCCCCCN(C)CSC 2230a_106256046315_100011218213 [1,1,0,0,0,0|1,1,0]=4 2907 B10R0.1 CCCCCCN(C)CSC 269982a_106256046315_100011218213 [1,1,0,0,0,0|1,1,0]=4 2908 B10R0.1 CCCCCNC(C)CCC 2230a_100000209983_100000766640 [1,1,0,0,0,0|2,0,0]=4 2909 B10R0.1 CCCCCNC(C)CCC 2230a_100000741246_100000210326 [1,1,0,0,0,0|2,0,0]=4 2910 B10R0.1 CCCCCNC(C)CCC 270004a_100000209983_100000211909 [1,1,0,0,0,0|2,0,0]=4 2911 B10R0.1 CCCCCNC(C)CCO 2230a_100000209983_100009893172 [1,1,0,0,0,0|2,0,0]=4 2912 B10R0.1 CCCCCNC(C)COC 2230a_100000209983_100000765312 [1,1,0,0,0,0|1,0,0]=3 2913 B10R0.1 CCCCCNC(C)COC 270004a_100000209983_100000749346 [1,1,0,0,0,0|1,0,0]=3 2914 B10R0.1 CCCCCNC(C)CSC 270004a_100000209983_100011216314 [1,1,0,0,0,0|1,1,0]=4 2915 B10R0.1 CCCCCN[C@H](C)CCO 2230a_100000706166_100000210326 [1,1,0,0,0,0|2,0,0]=4 2916 B10R0.1 CCCCCN[C@H](C)CCO 34a_100000706166_100000718602 [1,1,0,0,0,0|2,0,0]=4 2917 B10R0.1 CCCCCN[C@H](C)COC 2230a_100000764878_100000210326 [1,1,0,0,0,0|1,0,0]=3 2918 B10R0.1 CCCCCOC(C)CCBr 34a_100012276601_100000718602 [1,1,0,0,0,0|2,0,0]=4 2919 B10R0.1 CCCCCOC(C)CCC 34a_100000210253_100000766640 [1,1,0,0,0,0|2,0,0]=4 2920 B10R0.1 CCCCCOC(C)CCC 34a_100000764384_100000718602 [1,1,0,0,0,0|2,0,0]=4 2921 B10R0.1 CCCCCOC(C)CCC 7a_100000210253_100000766640 [1,1,0,0,0,0|2,0,0]=4 2922 B10R0.1 CCCCCOC(C)CCC 7a_100000764384_100000210326 [1,1,0,0,0,0|2,0,0]=4 2923 B10R0.1 CCCCCOC(C)CCO 34a_100000210253_100009893172 [1,1,0,0,0,0|2,0,0]=4 2924 B10R0.1 CCCCCOC(C)CCO 7a_100000210253_100009893172 [1,1,0,0,0,0|2,0,0]=4 2925 B10R0.1 CCCCCOC(C)COC 34a_100000210253_100000765312 [1,1,0,0,0,0|1,0,0]=3 2926 B10R0.1 CCCCCOC(C)COC 7a_100000210253_100000765312 [1,1,0,0,0,0|1,0,0]=3 2927 B10R0.1 CCCCCO[C@H](C)COC 34a_100011934205_100000718602 [1,1,0,0,0,0|1,0,0]=3 2928 B10R0.1 CCCCCSC(C)CCC 62a_100000210326_100000766640 [1,1,0,0,0,0|2,0,0]=4 2929 B10R0.1 CCCCCSC(C)CCC 62a_100000766640_100000210326 [1,1,0,0,0,0|2,0,0]=4 2930 B10R0.1 CCCCCSC(C)CCO 62a_100000210326_100009893172 [1,1,0,0,0,0|2,0,0]=4 2931 B10R0.1 CCCCCSC(C)CCO 62a_100009893172_100000210326 [1,1,0,0,0,0|2,0,0]=4 2932 B10R0.1 CCCCCSC(C)COC 62a_100000210326_100000765312 [1,1,0,0,0,0|1,0,0]=3 2933 B10R0.1 CCCCCSC(C)COC 62a_100000765312_100000210326 [1,1,0,0,0,0|1,0,0]=3 2934 B10R0.1 CCCCNCC(C)CCC 2230a_100000102301_100011216630 [1,1,0,0,0,0|2,0,0]=4 2935 B10R0.1 CCCCNCC(C)CCC 270004a_100000102301_100000243154 [1,1,0,0,0,0|2,0,0]=4 2936 B10R0.1 CCCCNCC(C)CCC 7a_106832991798_100011216630 [1,1,0,0,0,0|2,0,0]=4 2937 B10R0.1 CCCCNCC(O)COC 2230a_100000756049_100000210211 [1,1,0,0,0,0|1,0,0]=3 2938 B10R0.1 CCCCNCC(O)COC 34a_100000756049_100000210210 [1,1,0,0,0,0|1,0,0]=3 2939 B10R0.1 CCCCNCC(O)COC 7a_106832991798_100011215053 [1,1,0,0,0,0|1,0,0]=3 2940 B10R0.1 CCCCOCC(C)CCC 34a_100000210227_100011216630 [1,1,0,0,0,0|2,0,0]=4 2941 B10R0.1 CCCCOCC(C)CCC 34a_100000688023_100000210210 [1,1,0,0,0,0|2,0,0]=4 2942 B10R0.1 CCCCOCC(C)CCC 7a_100000210227_100011216630 [1,1,0,0,0,0|2,0,0]=4 2943 B10R0.1 CCCCOCC(C)CCC 7a_100000688023_100000210211 [1,1,0,0,0,0|2,0,0]=4 2944 B10R0.1 CCCCOCC(C)CCN 34a_106354213184_100000210210 [1,1,0,0,0,0|2,0,0]=4 2945 B10R0.1 CCCCOCC(C)OCC 34a_100011217071_100000210202 [1,1,0,0,0,0|1,0,0]=3 2946 B10R0.1 CCCCOCC(C)OCC 7a_100011217071_100000210202 [1,1,0,0,0,0|1,0,0]=3 2947 B10R0.1 CCCCOCC(C)OCF 34a_100011217071_100015361967 [1,1,0,0,0,0|1,0,0]=3 2948 B10R0.1 CCCCOCC(C)OCF 7a_100011217071_100015361967 [1,1,0,0,0,0|1,0,0]=3 2949 B10R0.1 CCCCOCC(N)COC 34a_100000724102_100000210210 [1,1,0,0,0,0|2,0,0]=4 2950 B10R0.1 CCCCOCC(O)COC 34a_100000210227_100011215053 [1,1,0,0,0,0|1,0,0]=3 2951 B10R0.1 CCCCOCC(O)COC 7a_100000210227_100011215053 [1,1,0,0,0,0|1,0,0]=3 2952 B10R0.1 CCCCSCC(C)CCC 62a_100000210211_100011216630 [1,1,0,0,0,0|2,0,0]=4 2953 B10R0.1 CCCCSCC(C)CCC 62a_100011216630_100000210210 [1,1,0,0,0,0|2,0,0]=4 2954 B10R0.1 CCCCSCC(O)COC 62a_100000210211_100011215053 [1,1,0,0,0,0|1,0,0]=3 2955 B10R0.1 CCCCSCC(O)COC 62a_100011215053_100000210210 [1,1,0,0,0,0|1,0,0]=3 2956 B10R0.1 CCCOCCC(C)CCC 34a_100011217855_100000210303 [1,1,0,0,0,0|2,0,0]=4 2957 B10R0.1 CCCOCCC(C)CCC 7a_100011217855_100000210303 [1,1,0,0,0,0|2,0,0]=4 2958 B10R0.1 CCOCCNC(C)COC 2230a_102516460346_100000765312 [1,1,0,0,0,0|2,0,0]=4 2959 B10R0.1 CCOCCNC(C)COC 270004a_102516460346_100000749346 [1,1,0,0,0,0|2,0,0]=4 2960 B10R0.1 CCOCCNC(C)COC 34a_102516460346_100000765312 [1,1,0,0,0,0|2,0,0]=4 2961 B10R0.1 CCOCCN[C@H](C)COC 2230a_100000764878_100011215890 [1,1,0,0,0,0|2,0,0]=4 2962 B10R0.1 CCOCCOC(C)COC 34a_100000210136_100000765312 [1,1,0,0,0,0|2,0,0]=4 2963 B10R0.1 CCOCCOC(C)COC 7a_100000210136_100000765312 [1,1,0,0,0,0|2,0,0]=4 2964 B10R0.1 CCOCCO[C@H](C)COC 34a_100011934205_100000210147 [1,1,0,0,0,0|2,0,0]=4 2965 B10R0.1 CCOCCSC(C)COC 62a_100000210147_100000765312 [1,1,0,0,0,0|2,0,0]=4 2966 B10R0.1 CCOCCSC(C)COC 62a_100000765312_100011215890 [1,1,0,0,0,0|2,0,0]=4 2967 B10R0.1 CCOCSCC(O)COC 62a_100000739092_100011215053 [1,1,0,0,0,0|2,0,0]=4 2968 B10R0.1 CCOCSCC(O)COC 62a_100011215053_100000739092 [1,1,0,0,0,0|2,0,0]=4 2969 B10R0.1 CCSCCNC(C)COC 2230a_100000106463_100000765312 [1,1,0,0,0,0|2,0,0]=4 2970 B10R0.1 CCSCCNC(C)COC 270004a_100000106463_100000749346 [1,1,0,0,0,0|2,0,0]=4 2971 B10R0.1 CCSCCN[C@H](C)COC 2230a_100000764878_100000757381 [1,1,0,0,0,0|2,0,0]=4 2972 B10R0.1 CCSCCOC(C)COC 34a_100000212035_100000765312 [1,1,0,0,0,0|2,0,0]=4 2973 B10R0.1 CCSCCOC(C)COC 7a_100000212035_100000765312 [1,1,0,0,0,0|2,0,0]=4 2974 B10R0.1 CCSCCO[C@H](C)COC 34a_100011934205_100000757381 [1,1,0,0,0,0|2,0,0]=4 2975 B10R0.1 CCSCCSC(C)COC 62a_100000757381_100000765312 [1,1,0,0,0,0|2,0,0]=4 2976 B10R0.1 CCSCCSC(C)COC 62a_100000765312_100000757381 [1,1,0,0,0,0|2,0,0]=4 2977 B10R0.1 CNCCCOC(C)COC 34a_100000213112_100000765312 [1,1,0,0,0,0|2,0,0]=4 2978 B10R0.1 COCC(C)NCCCCO 2230a_100000750430_100000765312 [1,1,0,0,0,0|2,0,0]=4 2979 B10R0.1 COCC(C)NCCCCO 270004a_100000750430_100000749346 [1,1,0,0,0,0|2,0,0]=4 2980 B10R0.1 COCC(C)NCCCCO 34a_100000750430_100000765312 [1,1,0,0,0,0|2,0,0]=4 2981 B10R0.1 COCC(C)NCCCSC 2230a_100000749238_100000765312 [1,1,0,0,0,0|2,0,0]=4 2982 B10R0.1 COCC(C)NCCCSC 270004a_100000749238_100000749346 [1,1,0,0,0,0|2,0,0]=4 2983 B10R0.1 COCC(C)OCCCCBr 34a_100011216708_100000765312 [1,1,0,0,0,0|2,0,0]=4 2984 B10R0.1 COCC(C)OCCCCCl 34a_100000210776_100000765312 [1,1,0,0,0,0|2,0,0]=4 2985 B10R0.1 COCC(C)OCCCCCl 7a_100000210776_100000765312 [1,1,0,0,0,0|2,0,0]=4 2986 B10R0.1 COCC(C)OCCCCF 34a_100011995726_100000765312 [1,1,0,0,0,0|2,0,0]=4 2987 B10R0.1 COCC(C)OCCCCF 7a_100011995726_100000765312 [1,1,0,0,0,0|2,0,0]=4 2988 B10R0.1 COCC(C)OCCCCI 34a_200012148704_100000765312 [1,1,0,0,0,0|2,0,0]=4 2989 B10R0.1 COCC(C)OCCCCN 34a_100000750430_100000765312 [1,1,0,0,0,0|2,0,0]=4 2990 B10R0.1 COCC(C)OCCCSC 34a_100000690336_100000765312 [1,1,0,0,0,0|2,0,0]=4 2991 B10R0.1 COCC(C)OCCCSC 7a_100000690336_100000765312 [1,1,0,0,0,0|2,0,0]=4 2992 B10R0.1 COCC(C)SCCCCF 62a_100000729493_100000765312 [1,1,0,0,0,0|2,0,0]=4 2993 B10R0.1 COCC(C)SCCCCF 62a_100000765312_100000729493 [1,1,0,0,0,0|2,0,0]=4 2994 B10R0.1 COCC(C)SCCCCO 62a_100000210776_100000765312 [1,1,0,0,0,0|2,0,0]=4 2995 B10R0.1 COCC(C)SCCCCO 62a_100000765312_100000210776 [1,1,0,0,0,0|2,0,0]=4 2996 B10R0.1 COCC(O)CNCCCF 2230a_100000756049_100011934791 [1,1,0,0,0,0|2,0,0]=4 2997 B10R0.1 COCC(O)CNCCCF 34a_100000756049_100011934791 [1,1,0,0,0,0|2,0,0]=4 2998 B10R0.1 COCC(O)CNCCCF 34a_100015189416_100011215053 [1,1,0,0,0,0|2,0,0]=4 2999 B10R0.1 COCC(O)CNCCCO 2230a_100000756049_100000230001 [1,1,0,0,0,0|2,0,0]=4 3000 B10R0.1 COCC(O)CNCCCO 34a_100000756049_100000230001 [1,1,0,0,0,0|2,0,0]=4 3001 B10R0.1 COCC(O)CNCCSC 2230a_100000756049_100000751147 [1,1,0,0,0,0|2,0,0]=4 3002 B10R0.1 COCC(O)CNCCSC 34a_100000756049_100000212216 [1,1,0,0,0,0|2,0,0]=4 3003 B10R0.1 COCC(O)COCCCBr 34a_100011217188_100011215053 [1,1,0,0,0,0|2,0,0]=4 3004 B10R0.1 COCC(O)COCCCCl 34a_100000230001_100011215053 [1,1,0,0,0,0|2,0,0]=4 3005 B10R0.1 COCC(O)COCCCF 34a_100000759539_100011215053 [1,1,0,0,0,0|2,0,0]=4 3006 B10R0.1 COCC(O)COCCCN 34a_100000182051_100011215053 [1,1,0,0,0,0|2,0,0]=4 3007 B10R0.1 COCC(O)COCCSC 34a_100000230434_100011215053 [1,1,0,0,0,0|2,0,0]=4 3008 B10R0.1 COCC(O)COCCSC 7a_100000230434_100011215053 [1,1,0,0,0,0|2,0,0]=4 3009 B10R0.1 COCC(O)CSCCCF 62a_100011215053_100011934791 [1,1,0,0,0,0|2,0,0]=4 3010 B10R0.1 COCC(O)CSCCCF 62a_100011934791_100011215053 [1,1,0,0,0,0|2,0,0]=4 3011 B10R0.1 COCC(O)CSCCCO 62a_100011215043_100011215053 [1,1,0,0,0,0|2,0,0]=4 3012 B10R0.1 COCC(O)CSCCCO 62a_100011215053_100011215043 [1,1,0,0,0,0|2,0,0]=4 3013 B10R0.1 COCC(O)CSCCSC 62a_100000212216_100011215053 [1,1,0,0,0,0|2,0,0]=4 3014 B10R0.1 COCC(O)CSCCSC 62a_100011215053_100000751147 [1,1,0,0,0,0|2,0,0]=4 3015 B10R0.1 COCCCNC(C)COC 270004a_100150723488_100000749346 [1,1,0,0,0,0|2,0,0]=4 3016 B10R0.1 COCCCNC(C)COC 34a_100150723488_100000765312 [1,1,0,0,0,0|2,0,0]=4 3017 B10R0.1 COCCCN[C@H](C)COC 2230a_100000764878_100000740836 [1,1,0,0,0,0|2,0,0]=4 3018 B10R0.1 COCCCOC(C)COC 34a_100000740835_100000765312 [1,1,0,0,0,0|2,0,0]=4 3019 B10R0.1 COCCCO[C@H](C)COC 34a_100011934205_100000740836 [1,1,0,0,0,0|2,0,0]=4 3020 B10R0.1 COCCCSC(C)COC 62a_100000709357_100000765312 [1,1,0,0,0,0|2,0,0]=4 3021 B10R0.1 COCCCSC(C)COC 62a_100000765312_100000709357 [1,1,0,0,0,0|2,0,0]=4 3022 B10R0.1 COCCNCC(O)COC 2230a_100000756049_100011201679 [1,1,0,0,0,0|2,0,0]=4 3023 B10R0.1 COCCNCC(O)COC 34a_100000756049_100011201679 [1,1,0,0,0,0|2,0,0]=4 3024 B10R0.1 COCCOCC(O)COC 34a_100000210237_100011215053 [1,1,0,0,0,0|2,0,0]=4 3025 B10R0.1 COCCSCC(O)COC 62a_100000233755_100011215053 [1,1,0,0,0,0|2,0,0]=4 3026 B10R0.1 COCCSCC(O)COC 62a_100011215053_100000233755 [1,1,0,0,0,0|2,0,0]=4 3027 B10R0.1 COCN(C)CCCCCO 2230a_100000722520_100000766300 [1,1,0,0,0,0|2,0,0]=4 3028 B10R0.1 COCN(C)CCCCCO 269982a_100000722520_100000766300 [1,1,0,0,0,0|2,0,0]=4 3029 B10R0.1 COC[C@@H](C)NCCCCF 2230a_100000764878_100000729493 [1,1,0,0,0,0|2,0,0]=4 3030 B10R0.1 COC[C@@H](C)NCCCCO 2230a_100000764878_100000210776 [1,1,0,0,0,0|2,0,0]=4 3031 B10R0.1 COC[C@@H](C)OCCCCF 34a_100011934205_100000729493 [1,1,0,0,0,0|2,0,0]=4 3032 B10R0.1 COC[C@@H](C)OCCCCO 34a_100011934205_100011216708 [1,1,0,0,0,0|2,0,0]=4 3033 B10R0.18 CCCCC(=O)CC(C)CC 1458a_100000210183_100000748023 [1,1,0,0,0,0|1,0,1]=4 3034 B10R0.18 CCCCC(=O)CC(C)CC 1458a_100000708755_100000210211 [1,1,0,0,0,0|1,0,1]=4 3035 B10R0.18 CCCCC(=O)CC(O)CC 1458a_100000210183_100011218378 [1,1,0,0,0,0|1,0,1]=4 3036 B10R0.18 CCCCC(=O)CC(O)CC 1458a_100011667805_100000210211 [1,1,0,0,0,0|1,0,1]=4 3037 B10R0.18 CCCCC(=O)C[C@@H](C)CC 1458a_100000210183_100009816398 [1,1,0,0,0,0|1,0,1]=4 3038 B10R0.18 CCCCC(C)NC(C)CC 2230a_100000126638_100000758301 [1,1,0,0,0,0|2,0,0]=4 3039 B10R0.18 CCCCC(C)NC(C)CC 2230a_100000209981_200011215066 [1,1,0,0,0,0|2,0,0]=4 3040 B10R0.18 CCCCC(C)NC(C)CC 270004a_100000209981_100000210087 [1,1,0,0,0,0|2,0,0]=4 3041 B10R0.18 CCCCC(C)OC(C)CC 34a_100000687866_100011215416 [1,1,0,0,0,0|2,0,0]=4 3042 B10R0.18 CCCCC(C)OC(C)CC 7a_100000210228_200011215066 [1,1,0,0,0,0|2,0,0]=4 3043 B10R0.18 CCCCC(C)OC(C)CC 7a_100000687866_100000758301 [1,1,0,0,0,0|2,0,0]=4 3044 B10R0.18 CCCCC(C)SC(C)CC 62a_100000758301_200011215066 [1,1,0,0,0,0|2,0,0]=4 3045 B10R0.18 CCCCC(C)SC(C)CC 62a_200011215066_100000758301 [1,1,0,0,0,0|2,0,0]=4 3046 B10R0.18 CCCCC(C)SC(C)OC 62a_100009879195_200011215066 [1,1,0,0,0,0|1,0,0]=3 3047 B10R0.18 CCCCC(C)SC(C)OC 62a_200011215066_100009879195 [1,1,0,0,0,0|1,0,0]=3 3048 B10R0.18 CCCCN(C)CC(C)CC 2230a_100000207549_100000748023 [1,1,0,0,0,0|2,0,0]=4 3049 B10R0.18 CCCCN(C)CC(C)CC 2230a_100000753921_100000210211 [1,1,0,0,0,0|2,0,0]=4 3050 B10R0.18 CCCCN(C)CC(C)CC 269982a_100000207549_100000748023 [1,1,0,0,0,0|2,0,0]=4 3051 B10R0.18 CCCCN(C)CC(C)CC 269982a_100000753921_100000210211 [1,1,0,0,0,0|2,0,0]=4 3052 B10R0.18 CCCCN(C)CC(C)CC 270004a_100000207549_100000243153 [1,1,0,0,0,0|2,0,0]=4 3053 B10R0.18 CCCCN(C)CC(O)CC 2230a_100000207549_100011218378 [1,1,0,0,0,0|2,0,0]=4 3054 B10R0.18 CCCCN(C)CC(O)CC 269982a_100000207549_100011218378 [1,1,0,0,0,0|2,0,0]=4 3055 B10R0.18 CCCCN(C)C[C@@H](C)CC 2230a_100000207549_100009816398 [1,1,0,0,0,0|2,0,0]=4 3056 B10R0.18 CCCCN(C)C[C@@H](C)CC 269982a_100000207549_100009816398 [1,1,0,0,0,0|2,0,0]=4 3057 B10R0.18 CCCNC(C)CC(C)CC 2230a_100000763565_100000210303 [1,1,0,0,0,0|2,0,0]=4 3058 B10R0.18 CCCNC(C)CC(C)CC 270004a_100020643023_100011710205 [1,1,0,0,0,0|2,0,0]=4 3059 B10R0.55 C=C(C)CCNC[C@@H](C)OC 2230a_100020591295_100000730704 [1,1,0,0,0,0|1,0,1]=4 3060 B10R0.55 C=C(C)CCOCC(C)OC 34a_100000690652_100000730704 [1,1,0,0,0,0|1,0,1]=4 3061 B10R0.55 C=C(C)COCCC(C)OC 7a_100000764861_100000748629 [1,1,0,0,0,0|1,0,1]=4 3062 B10R0.55 CCC(C)CCCOC(C)C 7a_100011216074_100000210206 [1,1,0,0,0,0|2,0,0]=4 3063 B10R0.55 CCC(C)CCNCC(C)C 2230a_100020591266_100000210760 [1,1,0,0,0,0|2,0,0]=4 3064 B10R0.55 CCC(C)CCNCC(C)C 270004a_100020591266_100000210432 [1,1,0,0,0,0|2,0,0]=4 3065 B10R0.55 CCC(C)CCNCC(C)O 2230a_100020591266_100011218427 [1,1,0,0,0,0|2,0,0]=4 3066 B10R0.55 CCC(C)CCNC[C@@H](C)O 2230a_100020591266_100009817552 [1,1,0,0,0,0|2,0,0]=4 3067 B10R0.55 CCC(C)CCOCC(C)C 7a_100011215188_100000210760 [1,1,0,0,0,0|2,0,0]=4 3068 B10R0.55 CCC(C)CCOCC(C)O 7a_100011215188_100011218427 [1,1,0,0,0,0|2,0,0]=4 3069 B10R0.55 CCC(C)CCOC[C@@H](C)O 7a_100011215188_100009817552 [1,1,0,0,0,0|2,0,0]=4 3070 B10R0.55 CCC(C)CNCCC(C)C 2230a_100020588543_100000210312 [1,1,0,0,0,0|2,0,0]=4 3071 B10R0.55 CCC(C)CNCCC(C)C 269862a_100020588543_100000185833 [1,1,0,0,0,0|2,0,0]=4 3072 B10R0.55 CCC(C)CNCCC(C)C 270004a_100000210545_100000243153 [1,1,0,0,0,0|2,0,0]=4 3073 B10R0.55 CCC(C)CNCCC(C)O 2230a_100020588543_100012276601 [1,1,0,0,0,0|2,0,0]=4 3074 B10R0.55 CCC(C)CNCCC(C)O 2230a_200000755665_100000748023 [1,1,0,0,0,0|2,0,0]=4 3075 B10R0.55 CCC(C)CNCCC(C)O 270004a_200000755665_100000243153 [1,1,0,0,0,0|2,0,0]=4 3076 B10R0.55 CCC(C)COCCC(C)Br 34a_100009893172_100000748023 [1,1,0,0,0,0|2,0,0]=4 3077 B10R0.55 CCC(C)COCCC(C)C 34a_100000210254_100000748023 [1,1,0,0,0,0|2,0,0]=4 3078 B10R0.55 CCC(C)COCCC(C)C 7a_100000210254_100000748023 [1,1,0,0,0,0|2,0,0]=4 3079 B10R0.55 CCC(C)COCC[C@@H](C)N 34a_100000706166_100000748023 [1,1,0,0,0,0|2,0,0]=4 3080 B10R0.55 CCC(C)CSCCC(C)C 62a_100000210312_100000748023 [1,1,0,0,0,0|2,0,0]=4 3081 B10R0.55 CCC(C)CSCCC(C)C 62a_100000748023_100000210312 [1,1,0,0,0,0|2,0,0]=4 3082 B10R0.55 CCC(C)CSCCC(C)O 62a_100000748023_100012276601 [1,1,0,0,0,0|2,0,0]=4 3083 B10R0.55 CCC(C)CSCCC(C)O 62a_100012276601_100000748023 [1,1,0,0,0,0|2,0,0]=4 3084 B10R0.55 CCC(C)NCCCC(C)C 2230a_100000209981_100011214892 [1,1,0,0,0,0|2,0,0]=4 3085 B10R0.55 CCC(C)NCCCC(C)C 2230a_200000737386_100000758301 [1,1,0,0,0,0|2,0,0]=4 3086 B10R0.55 CCC(C)NCCCC(C)C 34a_200000737386_100011215416 [1,1,0,0,0,0|2,0,0]=4 3087 B10R0.55 CCC(C)NCCCC(C)O 2230a_100000209981_200000718107 [1,1,0,0,0,0|2,0,0]=4 3088 B10R0.55 CCC(C)OCCCC(C)C 34a_100000210774_100011215416 [1,1,0,0,0,0|2,0,0]=4 3089 B10R0.55 CCC(C)OCCCC(C)C 7a_100000210228_100011214892 [1,1,0,0,0,0|2,0,0]=4 3090 B10R0.55 CCC(C)OCCCC(C)C 7a_100000210774_100000758301 [1,1,0,0,0,0|2,0,0]=4 3091 B10R0.55 CCC(C)OCCCC(C)O 7a_100000210228_200000718107 [1,1,0,0,0,0|2,0,0]=4 3092 B10R0.55 CCC(C)SCCCC(C)C 62a_100000758301_100011214892 [1,1,0,0,0,0|2,0,0]=4 3093 B10R0.55 CCC(C)SCCCC(C)C 62a_100011214892_100000758301 [1,1,0,0,0,0|2,0,0]=4 3094 B10R0.55 CCC(C)SCCCC(C)O 62a_100000758301_200000718107 [1,1,0,0,0,0|2,0,0]=4 3095 B10R0.55 CCC(C)SCCCC(C)O 62a_200000718107_100000758301 [1,1,0,0,0,0|2,0,0]=4 3096 B10R0.55 CCC(O)CNCCC(C)C 2230a_100011218483_100000210312 [1,1,0,0,0,0|2,0,0]=4 3097 B10R0.55 CCC(O)CNCCC(C)C 269862a_100011218483_100000185833 [1,1,0,0,0,0|2,0,0]=4 3098 B10R0.55 CCC(O)CNCCC(C)O 2230a_100011218483_100012276601 [1,1,0,0,0,0|2,0,0]=4 3099 B10R0.55 CCC(O)CNCCC(C)O 2230a_200000755665_100011218378 [1,1,0,0,0,0|2,0,0]=4 3100 B10R0.55 CCC(O)COCCC(C)Br 34a_100009893172_100011218378 [1,1,0,0,0,0|2,0,0]=4 3101 B10R0.55 CCC(O)COCCC(C)C 34a_100000210254_100011218378 [1,1,0,0,0,0|2,0,0]=4 3102 B10R0.55 CCC(O)COCCC(C)C 7a_100000210254_100011218378 [1,1,0,0,0,0|2,0,0]=4 3103 B10R0.55 CCC(O)COCC[C@@H](C)N 34a_100000706166_100011218378 [1,1,0,0,0,0|2,0,0]=4 3104 B10R0.55 CCC(O)CSCCC(C)C 62a_100000210312_100011218378 [1,1,0,0,0,0|2,0,0]=4 3105 B10R0.55 CCC(O)CSCCC(C)C 62a_100011218378_100000210312 [1,1,0,0,0,0|2,0,0]=4 3106 B10R0.55 CCC(O)CSCCC(C)O 62a_100011218378_100012276601 [1,1,0,0,0,0|2,0,0]=4 3107 B10R0.55 CCC(O)CSCCC(C)O 62a_100012276601_100011218378 [1,1,0,0,0,0|2,0,0]=4 3108 B10R0.55 CCN(C)CCCCC(C)C 2230a_100000225621_100011216152 [1,1,0,0,0,0|2,0,0]=4 3109 B10R0.55 CCN(C)CCCCC(C)C 269982a_100000225621_100011216152 [1,1,0,0,0,0|2,0,0]=4 3110 B10R0.55 CC[C@H](C)CNCCC(C)O 2230a_200000755665_100009816398 [1,1,0,0,0,0|2,0,0]=4 3111 B10R0.55 CC[C@H](C)COCCC(C)Br 34a_100009893172_100009816398 [1,1,0,0,0,0|2,0,0]=4 3112 B10R0.55 CC[C@H](C)COCCC(C)C 34a_100000210254_100009816398 [1,1,0,0,0,0|2,0,0]=4 3113 B10R0.55 CC[C@H](C)COCCC(C)C 7a_100000210254_100009816398 [1,1,0,0,0,0|2,0,0]=4 3114 B10R0.55 CC[C@H](C)COCCC(C)C 7a_100009816381_100000210626 [1,1,0,0,0,0|2,0,0]=4 3115 B10R0.55 CC[C@H](C)COCCC(C)O 7a_100009816381_100012276601 [1,1,0,0,0,0|2,0,0]=4 3116 B10R0.55 CC[C@H](C)COCC[C@@H](C)N 34a_100000706166_100009816398 [1,1,0,0,0,0|2,0,0]=4 3117 B10R0.55 CC[C@H](C)CSCCC(C)C 62a_100000210312_100009816398 [1,1,0,0,0,0|2,0,0]=4 3118 B10R0.55 CC[C@H](C)CSCCC(C)C 62a_100009816398_100000210312 [1,1,0,0,0,0|2,0,0]=4 3119 B10R0.55 CC[C@H](C)CSCCC(C)O 62a_100009816398_100012276601 [1,1,0,0,0,0|2,0,0]=4 3120 B10R0.55 CC[C@H](C)CSCCC(C)O 62a_100012276601_100009816398 [1,1,0,0,0,0|2,0,0]=4 3121 B10R0.55 CNC(C)CCOCC(C)C 270004a_106832991635_200011216429 [1,1,0,0,0,0|2,0,0]=4 3122 B10R0.55 COC(C)CCOCC(C)C 7a_100000764861_100000210760 [1,1,0,0,0,0|1,0,0]=3 3123 B10R0.55 COC(C)CCOCC(C)O 7a_100000764861_100011218427 [1,1,0,0,0,0|1,0,0]=3 3124 B10R0.55 COC(C)CCOCC(F)F 7a_100000764861_100011934356 [1,1,0,0,0,0|2,0,0]=4 3125 B10R0.55 COC(C)CCOC[C@@H](C)O 7a_100000764861_100009817552 [1,1,0,0,0,0|1,0,0]=3 3126 B10R0.55 COC(C)COCCC(C)C 34a_100000690652_100000210312 [1,1,0,0,0,0|1,0,0]=3 3127 B10R0.55 COC(C)COCCC(C)O 34a_100000690652_100012276601 [1,1,0,0,0,0|1,0,0]=3 3128 B10R0.55 COC(C)COCOC(C)C 34a_100000690652_100000709892 [1,1,0,0,0,0|2,0,0]=4 3129 B10R0.55 COC(C)SCCCC(=O)C 62a_100009879195_100011215641 [1,1,0,0,0,0|1,0,1]=4 3130 B10R0.55 COC(C)SCCCC(=O)C 62a_100011215641_100009879195 [1,1,0,0,0,0|1,0,1]=4 3131 B10R0.55 COC(C)SCCCC(C)C 62a_100009879195_100011214892 [1,1,0,0,0,0|1,0,0]=3 3132 B10R0.55 COC(C)SCCCC(C)C 62a_100011214892_100009879195 [1,1,0,0,0,0|1,0,0]=3 3133 B10R0.55 COC(C)SCCCC(C)O 62a_100009879195_200000718107 [1,1,0,0,0,0|1,0,0]=3 3134 B10R0.55 COC(C)SCCCC(C)O 62a_200000718107_100009879195 [1,1,0,0,0,0|1,0,0]=3 3135 B10R0.55 COC(C)SCCCN(C)C 62a_100009879195_100000757444 [1,1,0,0,0,0|2,0,0]=4 3136 B10R0.55 COC(C)SCCOC(C)C 62a_100000211751_100009879195 [1,1,0,0,0,0|2,0,0]=4 3137 B10R0.55 COC(C)SCCOC(C)C 62a_100009879195_100000211751 [1,1,0,0,0,0|2,0,0]=4 3138 B10R0.55 COC(C)SCCSC(C)C 62a_100000730970_100009879195 [1,1,0,0,0,0|2,0,0]=4 3139 B10R0.55 COC(C)SCCSC(C)C 62a_100009879195_100000730970 [1,1,0,0,0,0|2,0,0]=4 3140 B10R0.55 CO[C@H](C)CNCCC(C)C 2230a_100020591295_100000210312 [1,1,0,0,0,0|1,0,0]=3 3141 B10R0.55 CO[C@H](C)CNCCC(C)C 269862a_100020591295_100000185833 [1,1,0,0,0,0|1,0,0]=3 3142 B10R0.55 CO[C@H](C)CNCCC(C)O 2230a_100020591295_100012276601 [1,1,0,0,0,0|1,0,0]=3 3143 B10R0.55 CO[C@H](C)CNCOC(C)C 2230a_100020591295_100000709892 [1,1,0,0,0,0|2,0,0]=4 3144 B10R0.59 CCC(C)CCNC(C)CC 2230a_100020591266_100000758301 [1,1,0,0,0,0|2,0,0]=4 3145 B10R0.59 CCC(C)CCOC(C)CC 7a_100011215188_100000758301 [1,1,0,0,0,0|2,0,0]=4 3146 B10R0.59 CCC(C)CNCC(C)CC 2230a_100020588543_100000748023 [1,1,0,0,0,0|2,0,0]=4 3147 B10R0.59 CCC(C)CNCC(C)CC 270004a_100020588543_100000243153 [1,1,0,0,0,0|2,0,0]=4 3148 B10R0.59 CCC(C)CNCC(O)CC 2230a_100011218483_100000748023 [1,1,0,0,0,0|2,0,0]=4 3149 B10R0.59 CCC(C)CNCC(O)CC 2230a_100020588543_100011218378 [1,1,0,0,0,0|2,0,0]=4 3150 B10R0.59 CCC(C)CNCC(O)CC 270004a_100011218483_100000243153 [1,1,0,0,0,0|2,0,0]=4 3151 B10R0.59 CCC(C)CNC[C@@H](C)CC 2230a_100020588543_100009816398 [1,1,0,0,0,0|2,0,0]=4 3152 B10R0.59 CCC(C)CNC[C@@H](C)OC 2230a_100020591295_100000748023 [1,1,0,0,0,0|1,0,0]=3 3153 B10R0.59 CCC(C)CNC[C@@H](C)OC 270004a_100020591295_100000243153 [1,1,0,0,0,0|1,0,0]=3 3154 B10R0.59 CCC(C)COCC(C)OC 34a_100000690652_100000748023 [1,1,0,0,0,0|1,0,0]=3 3155 B10R0.59 CCC(C)COC[C@@H](C)CC 7a_100009816381_100000748023 [1,1,0,0,0,0|2,0,0]=4 3156 B10R0.59 CCC(C)CSCC(C)CC 62a_100000748023_100000748023 [1,1,0,0,0,0|2,0,0]=4 3157 B10R0.59 CCC(C)CSCC(O)CC 62a_100000748023_100011218378 [1,1,0,0,0,0|2,0,0]=4 3158 B10R0.59 CCC(C)CSCC(O)CC 62a_100011218378_100000748023 [1,1,0,0,0,0|2,0,0]=4 3159 B10R0.59 CCC(C)CSC[C@@H](C)CC 62a_100000748023_100009816398 [1,1,0,0,0,0|2,0,0]=4 3160 B10R0.59 CCC(C)CSC[C@@H](C)CC 62a_100009816398_100000748023 [1,1,0,0,0,0|2,0,0]=4 3161 B10R0.59 CCC(C)OCCC(C)OC 7a_100000764861_100000758301 [1,1,0,0,0,0|1,0,0]=3 3162 B10R0.59 CCC(O)CNCC(O)CC 2230a_100011218483_100011218378 [1,1,0,0,0,0|2,0,0]=4 3163 B10R0.59 CCC(O)CNC[C@@H](C)CC 2230a_100011218483_100009816398 [1,1,0,0,0,0|2,0,0]=4 3164 B10R0.59 CCC(O)CNC[C@@H](C)OC 2230a_100020591295_100011218378 [1,1,0,0,0,0|1,0,0]=3 3165 B10R0.59 CCC(O)COCC(C)OC 34a_100000690652_100011218378 [1,1,0,0,0,0|1,0,0]=3 3166 B10R0.59 CCC(O)COC[C@@H](C)CC 7a_100009816381_100011218378 [1,1,0,0,0,0|2,0,0]=4 3167 B10R0.59 CCC(O)CSCC(O)CC 62a_100011218378_100011218378 [1,1,0,0,0,0|2,0,0]=4 3168 B10R0.59 CCC(O)CSC[C@@H](C)CC 62a_100009816398_100011218378 [1,1,0,0,0,0|2,0,0]=4 3169 B10R0.59 CCC(O)CSC[C@@H](C)CC 62a_100011218378_100009816398 [1,1,0,0,0,0|2,0,0]=4 3170 B10R0.59 CC[C@H](C)CNC[C@@H](C)OC 2230a_100020591295_100009816398 [1,1,0,0,0,0|1,0,0]=3 3171 B10R0.59 CC[C@H](C)COCC(C)OC 34a_100000690652_100009816398 [1,1,0,0,0,0|1,0,0]=3 3172 B10R0.59 CC[C@H](C)COC[C@@H](C)CC 7a_100009816381_100009816398 [1,1,0,0,0,0|2,0,0]=4 3173 B10R0.59 CC[C@H](C)CSC[C@@H](C)CC 62a_100009816398_100009816398 [1,1,0,0,0,0|2,0,0]=4 3174 B10R0.59 COC(C)CCOC(C)CO 7a_100000764861_100012180447 [1,1,0,0,0,0|2,0,0]=4 3175 B10R0.59 COC(C)COCC(O)CO 34a_100000690652_100011219619 [1,1,0,0,0,0|2,0,0]=4 3176 B10R0.59 COC(C)COC[C@@H](C)CO 34a_100000690652_100000059175 [1,1,0,0,0,0|2,0,0]=4 3177 B10R0.59 COC(C)COC[C@@H](O)CF 34a_100000690652_100015614560 [1,1,0,0,0,0|2,0,0]=4 3178 B10R0.59 COC(C)COC[C@@H](O)CO 34a_100000690652_100009815848 [1,1,0,0,0,0|2,0,0]=4 3179 B10R0.59 CO[C@H](C)CNCC(O)CO 2230a_100020591295_100011219619 [1,1,0,0,0,0|2,0,0]=4 3180 B10R0.59 CO[C@H](C)CNC[C@@H](C)CO 2230a_100020591295_100000059175 [1,1,0,0,0,0|2,0,0]=4 3181 B10R0.59 CO[C@H](C)CNC[C@@H](O)CF 2230a_100020591295_100015614560 [1,1,0,0,0,0|2,0,0]=4 3182 B10R0.59 CO[C@H](C)CNC[C@@H](O)CO 2230a_100020591295_100009815848 [1,1,0,0,0,0|2,0,0]=4 3183 B10R0.62 CC(C)(CCCCCBr)O[13CH3] 7a_100010402123_200025704644 [1,1,0,0,0,0|1,0,0]=3 3184 B10R0.62 CCCCCCC(C)(C)OC 7a_200011995690_200000210301 [1,1,0,0,0,0|0,0,0]=2 3185 B10R0.62 CCCCCCC(C)(C)O[13CH3] 7a_200011995690_200025704644 [1,1,0,0,0,0|0,0,0]=2 3186 B10R0.62 CCCCCNC(C)(C)CC 2230a_100000211385_100000210326 [1,1,0,0,0,0|2,0,0]=4 3187 B10R0.62 CCCCCOC(C)(C)CC 7a_100000210230_100000210326 [1,1,0,0,0,0|2,0,0]=4 3188 B10R0.62 CCCCCOC(C)(C)CC 7a_100000210253_100000210677 [1,1,0,0,0,0|2,0,0]=4 3189 B10R0.62 CCCCCSC(C)(C)CC 62a_100000032637_100000210326 [1,1,0,0,0,0|2,0,0]=4 3190 B10R0.62 CCCCCSC(C)(C)CC 62a_100000210326_100000032637 [1,1,0,0,0,0|2,0,0]=4 3191 B10R0.62 CCCCNCC(C)(C)OC 2230a_100000763424_100000210211 [1,1,0,0,0,0|1,0,0]=3 3192 B10R0.62 CCCCNCC(C)(C)SC 270004a_100000102301_100009845794 [1,1,0,0,0,0|1,1,0]=4 3193 B10R0.62 CCCCOCC(C)(C)CC 7a_100000765029_100000210211 [1,1,0,0,0,0|2,0,0]=4 3194 B10R0.62 CCCCOCC(C)(C)OC 34a_100000210227_100000701081 [1,1,0,0,0,0|1,0,0]=3 3195 B10R0.62 CCCCSCC(C)(C)OC 62a_100000210211_100000701081 [1,1,0,0,0,0|1,0,0]=3 3196 B10R0.62 CCCCSCC(C)(C)OC 62a_100000701081_100000210210 [1,1,0,0,0,0|1,0,0]=3 3197 B10R0.62 CCCOCCC(C)(C)OC 7a_100000699976_100000210303 [1,1,0,0,0,0|1,0,0]=3 3198 B10R0.62 CCOCSCC(C)(C)OC 62a_100000701081_100000739092 [1,1,0,0,0,0|2,0,0]=4 3199 B10R0.62 CCOCSCC(C)(C)OC 62a_100000739092_100000701081 [1,1,0,0,0,0|2,0,0]=4 3200 B10R0.62 COC(C)(C)CCCCCBr 7a_100010402123_200000210301 [1,1,0,0,0,0|1,0,0]=3 3201 B10R0.62 COC(C)(C)CCOCCF 7a_100000699976_100011217306 [1,1,0,0,0,0|2,0,0]=4 3202 B10R0.62 COC(C)(C)CCOCCO 7a_100000699976_100000211926 [1,1,0,0,0,0|2,0,0]=4 3203 B10R0.62 COC(C)(C)CNCCCF 2230a_100000763424_100011934791 [1,1,0,0,0,0|2,0,0]=4 3204 B10R0.62 COC(C)(C)CNCCCF 34a_100015189416_100000701081 [1,1,0,0,0,0|2,0,0]=4 3205 B10R0.62 COC(C)(C)CNCCCO 2230a_100000763424_100000230001 [1,1,0,0,0,0|2,0,0]=4 3206 B10R0.62 COC(C)(C)CNCCSC 2230a_100000763424_100000751147 [1,1,0,0,0,0|2,0,0]=4 3207 B10R0.62 COC(C)(C)COCCCBr 34a_100011217188_100000701081 [1,1,0,0,0,0|2,0,0]=4 3208 B10R0.62 COC(C)(C)COCCCCl 34a_100000230001_100000701081 [1,1,0,0,0,0|2,0,0]=4 3209 B10R0.62 COC(C)(C)COCCCF 34a_100000759539_100000701081 [1,1,0,0,0,0|2,0,0]=4 3210 B10R0.62 COC(C)(C)COCCCN 34a_100000182051_100000701081 [1,1,0,0,0,0|2,0,0]=4 3211 B10R0.62 COC(C)(C)COCCSC 34a_100000230434_100000701081 [1,1,0,0,0,0|2,0,0]=4 3212 B10R0.62 COC(C)(C)CSCCCF 62a_100000701081_100011934791 [1,1,0,0,0,0|2,0,0]=4 3213 B10R0.62 COC(C)(C)CSCCCF 62a_100011934791_100000701081 [1,1,0,0,0,0|2,0,0]=4 3214 B10R0.62 COC(C)(C)CSCCCO 62a_100000701081_100011215043 [1,1,0,0,0,0|2,0,0]=4 3215 B10R0.62 COC(C)(C)CSCCCO 62a_100011215043_100000701081 [1,1,0,0,0,0|2,0,0]=4 3216 B10R0.62 COC(C)(C)CSCCSC 62a_100000212216_100000701081 [1,1,0,0,0,0|2,0,0]=4 3217 B10R0.62 COC(C)(C)CSCCSC 62a_100000701081_100000751147 [1,1,0,0,0,0|2,0,0]=4 3218 B10R0.62 COCCNCC(C)(C)OC 2230a_100000763424_100011201679 [1,1,0,0,0,0|2,0,0]=4 3219 B10R0.62 COCCOCC(C)(C)OC 34a_100000210237_100000701081 [1,1,0,0,0,0|2,0,0]=4 3220 B10R0.62 COCCOCC(C)(C)OC 7a_100000067319_200000210301 [1,1,0,0,0,0|2,0,0]=4 3221 B10R0.62 COCCOCC(C)(C)O[13CH3] 7a_100000067319_200025704644 [1,1,0,0,0,0|2,0,0]=4 3222 B10R0.62 COCCSCC(C)(C)OC 62a_100000233755_100000701081 [1,1,0,0,0,0|2,0,0]=4 3223 B10R0.62 COCCSCC(C)(C)OC 62a_100000701081_100000233755 [1,1,0,0,0,0|2,0,0]=4 3224 B10R0.74 C#CC(C)NCCCCCC 2230a_100000707721_100000210314 [1,1,0,0,0,0|1,0,1]=4 3225 B10R0.74 C#CC(C)NCCCCCC 34a_100000707721_100000210314 [1,1,0,0,0,0|1,0,1]=4 3226 B10R0.74 C#CC(C)OCCCCCC 34a_100000210259_200000035995 [1,1,0,0,0,0|1,0,1]=4 3227 B10R0.74 C#CC(C)SCCCCCC 62a_200000035995_100000210757 [1,1,0,0,0,0|1,0,1]=4 3228 B10R0.74 C#CC(O)CCCCCNC 2230a_106832991635_200010408556 [1,1,0,0,0,0|1,0,1]=4 3229 B10R0.74 C#CC(O)CCCCCNC 34a_100102657272_200010408556 [1,1,0,0,0,0|1,0,1]=4 3230 B10R0.74 C#CC(O)CCCCCNC 7a_106832991635_200010408556 [1,1,0,0,0,0|1,0,1]=4 3231 B10R0.74 C#CC(O)CCCCCOC 34a_100138415774_200010408556 [1,1,0,0,0,0|1,0,1]=4 3232 B10R0.74 C#CC(O)CCCCCSC 62a_200000210301_200010408556 [1,1,0,0,0,0|1,0,1]=4 3233 B10R0.74 C#CC(O)CCCCCSC 62a_200010408556_200000210301 [1,1,0,0,0,0|1,0,1]=4 3234 B10R0.74 C#CC(O)CCCCCS[13CH3] 62a_200010408556_200025704644 [1,1,0,0,0,0|1,0,1]=4 3235 B10R0.74 C#CC(O)CCCCCS[13CH3] 62a_200025704644_200010408556 [1,1,0,0,0,0|1,0,1]=4 3236 B10R0.74 C#CCCCCSC(C)OC 62a_100009879195_100010269958 [1,1,0,0,0,0|0,0,2]=4 3237 B10R0.74 C#CCCCCSC(C)OC 62a_100010269958_100009879195 [1,1,0,0,0,0|0,0,2]=4 3238 B10R0.74 C#CCCCNC[C@@H](C)OC 2230a_100020591295_100000731252 [1,1,0,0,0,0|0,0,2]=4 3239 B10R0.74 C#CCCCOCC(C)OC 34a_100000690652_100000695029 [1,1,0,0,0,0|0,0,2]=4 3240 B10R0.74 C#CCCOCCC(C)OC 7a_100000764861_100000688953 [1,1,0,0,0,0|0,0,2]=4 3241 B10R0.74 C#C[C@@H](C)OCCCCCC 34a_100009815206_100000210314 [1,1,0,0,0,0|1,0,1]=4 3242 B10R0.74 C#C[C@@H](C)OCCCCCC 7a_100009815206_100000210314 [1,1,0,0,0,0|1,0,1]=4 3243 B10R0.74 C/C=C/COCCC(C)OC 7a_100000764861_100102629194 [1,1,0,0,0,0|0,0,2]=4 3244 B10R0.74 C=CC(C)COCCCCC 34a_100011215527_100000718602 [1,1,0,0,0,0|1,0,1]=4 3245 B10R0.74 C=CC(C)COCCCCC 7a_100011215527_100000210326 [1,1,0,0,0,0|1,0,1]=4 3246 B10R0.74 C=CC(C)OCCCCCC 34a_100000695699_100000210314 [1,1,0,0,0,0|1,0,1]=4 3247 B10R0.74 C=CC(C)SCCCCCC 62a_100011215867_100000210757 [1,1,0,0,0,0|1,0,1]=4 3248 B10R0.74 C=CC(O)CNCCCCC 2230a_100000209983_100000730141 [1,1,0,0,0,0|1,0,1]=4 3249 B10R0.74 C=CC(O)COCCCCC 34a_100000210253_100000730141 [1,1,0,0,0,0|1,0,1]=4 3250 B10R0.74 C=CC(O)COCCCCC 7a_100000210253_100000730141 [1,1,0,0,0,0|1,0,1]=4 3251 B10R0.74 C=CC(O)CSCCCCC 62a_100000210326_100000730141 [1,1,0,0,0,0|1,0,1]=4 3252 B10R0.74 C=CC(O)CSCCCCC 62a_100000730141_100000210326 [1,1,0,0,0,0|1,0,1]=4 3253 B10R0.74 C=CCCCCSC(C)OC 62a_100009879195_100011215482 [1,1,0,0,0,0|0,0,2]=4 3254 B10R0.74 C=CCCCCSC(C)OC 62a_100011215482_100009879195 [1,1,0,0,0,0|0,0,2]=4 3255 B10R0.74 C=CCCCNC[C@@H](C)OC 2230a_100020591295_100011713584 [1,1,0,0,0,0|0,0,2]=4 3256 B10R0.74 C=CCCCOCC(C)OC 34a_100000690652_100000757094 [1,1,0,0,0,0|0,0,2]=4 3257 B10R0.74 C=CCCOCCC(C)OC 7a_100000764861_100000754431 [1,1,0,0,0,0|0,0,2]=4 3258 B10R0.74 CC#CCOCCC(C)OC 7a_100000764861_100000748600 [1,1,0,0,0,0|0,0,2]=4 3259 B10R0.74 CC/C=C\CCSC(C)OC 62a_100009879195_100015370543 [1,1,0,0,0,0|0,0,2]=4 3260 B10R0.74 CC/C=C\CCSC(C)OC 62a_100015370543_100009879195 [1,1,0,0,0,0|0,0,2]=4 3261 B10R0.74 CC/C=C\CNC[C@@H](C)OC 2230a_100020591295_100103147603 [1,1,0,0,0,0|0,0,2]=4 3262 B10R0.74 CC/C=C\COCC(C)OC 34a_100000690652_100103147603 [1,1,0,0,0,0|0,0,2]=4 3263 B10R0.74 CC=CCOCCC(C)OC 7a_100000764861_100000070051 [1,1,0,0,0,0|0,0,2]=4 3264 B10R0.74 CCC#CCNC[C@@H](C)OC 2230a_100020591295_100009813939 [1,1,0,0,0,0|0,0,2]=4 3265 B10R0.74 CCC#CCOCC(C)OC 34a_100000690652_100009813939 [1,1,0,0,0,0|0,0,2]=4 3266 B10R0.74 CCC(C)CCCCCOC 7a_200000035636_200000210301 [1,1,0,0,0,0|1,0,0]=3 3267 B10R0.74 CCC(C)CCCCCO[13CH3] 7a_200000035636_200025704644 [1,1,0,0,0,0|1,0,0]=3 3268 B10R0.74 CCC(C)CCCOCCF 7a_100011216074_100011217306 [1,1,0,0,0,0|2,0,0]=4 3269 B10R0.74 CCC(C)CCCOCCO 7a_100011216074_100000211926 [1,1,0,0,0,0|2,0,0]=4 3270 B10R0.74 CCC(C)CCNCCCF 2230a_100020591266_100011934791 [1,1,0,0,0,0|2,0,0]=4 3271 B10R0.74 CCC(C)CCNCCCO 2230a_100020591266_100000230001 [1,1,0,0,0,0|2,0,0]=4 3272 B10R0.74 CCC(C)CCNCCOC 2230a_100020591266_100011201679 [1,1,0,0,0,0|2,0,0]=4 3273 B10R0.74 CCC(C)CCNCCSC 2230a_100020591266_100000751147 [1,1,0,0,0,0|2,0,0]=4 3274 B10R0.74 CCC(C)CCOCCCF 7a_100011215188_100011934791 [1,1,0,0,0,0|2,0,0]=4 3275 B10R0.74 CCC(C)CCOCCCO 7a_100011215188_100011215043 [1,1,0,0,0,0|2,0,0]=4 3276 B10R0.74 CCC(C)CCOCCOC 7a_100011215188_100000233755 [1,1,0,0,0,0|2,0,0]=4 3277 B10R0.74 CCC(C)CCOCCSC 7a_100011215188_100000212216 [1,1,0,0,0,0|2,0,0]=4 3278 B10R0.74 CCC(C)CNCCCCF 2230a_100020588543_100000729493 [1,1,0,0,0,0|2,0,0]=4 3279 B10R0.74 CCC(C)CNCCCCO 2230a_100000750430_100000748023 [1,1,0,0,0,0|2,0,0]=4 3280 B10R0.74 CCC(C)CNCCCCO 2230a_100020588543_100000210776 [1,1,0,0,0,0|2,0,0]=4 3281 B10R0.74 CCC(C)CNCCCCO 270004a_100000750430_100000243153 [1,1,0,0,0,0|2,0,0]=4 3282 B10R0.74 CCC(C)CNCCCCO 34a_100000750430_100000748023 [1,1,0,0,0,0|2,0,0]=4 3283 B10R0.74 CCC(C)CNCCCOC 2230a_100020588543_100000740836 [1,1,0,0,0,0|2,0,0]=4 3284 B10R0.74 CCC(C)CNCCCOC 270004a_100150723488_100000243153 [1,1,0,0,0,0|2,0,0]=4 3285 B10R0.74 CCC(C)CNCCCOC 34a_100150723488_100000748023 [1,1,0,0,0,0|2,0,0]=4 3286 B10R0.74 CCC(C)CNCCCSC 2230a_100000749238_100000748023 [1,1,0,0,0,0|2,0,0]=4 3287 B10R0.74 CCC(C)CNCCCSC 270004a_100000749238_100000243153 [1,1,0,0,0,0|2,0,0]=4 3288 B10R0.74 CCC(C)COCCCCBr 34a_100011216708_100000748023 [1,1,0,0,0,0|2,0,0]=4 3289 B10R0.74 CCC(C)COCCCCCl 34a_100000210776_100000748023 [1,1,0,0,0,0|2,0,0]=4 3290 B10R0.74 CCC(C)COCCCCCl 7a_100000210776_100000748023 [1,1,0,0,0,0|2,0,0]=4 3291 B10R0.74 CCC(C)COCCCCF 34a_100011995726_100000748023 [1,1,0,0,0,0|2,0,0]=4 3292 B10R0.74 CCC(C)COCCCCF 7a_100011995726_100000748023 [1,1,0,0,0,0|2,0,0]=4 3293 B10R0.74 CCC(C)COCCCCI 34a_200012148704_100000748023 [1,1,0,0,0,0|2,0,0]=4 3294 B10R0.74 CCC(C)COCCCCN 34a_100000750430_100000748023 [1,1,0,0,0,0|2,0,0]=4 3295 B10R0.74 CCC(C)COCCCNC 34a_100000213112_100000748023 [1,1,0,0,0,0|2,0,0]=4 3296 B10R0.74 CCC(C)COCCCOC 34a_100000740835_100000748023 [1,1,0,0,0,0|2,0,0]=4 3297 B10R0.74 CCC(C)COCCCSC 34a_100000690336_100000748023 [1,1,0,0,0,0|2,0,0]=4 3298 B10R0.74 CCC(C)COCCCSC 7a_100000690336_100000748023 [1,1,0,0,0,0|2,0,0]=4 3299 B10R0.74 CCC(C)CSCCCCF 62a_100000729493_100000748023 [1,1,0,0,0,0|2,0,0]=4 3300 B10R0.74 CCC(C)CSCCCCF 62a_100000748023_100000729493 [1,1,0,0,0,0|2,0,0]=4 3301 B10R0.74 CCC(C)CSCCCCO 62a_100000210776_100000748023 [1,1,0,0,0,0|2,0,0]=4 3302 B10R0.74 CCC(C)CSCCCCO 62a_100000748023_100000210776 [1,1,0,0,0,0|2,0,0]=4 3303 B10R0.74 CCC(C)CSCCCOC 62a_100000709357_100000748023 [1,1,0,0,0,0|2,0,0]=4 3304 B10R0.74 CCC(C)CSCCCOC 62a_100000748023_100000709357 [1,1,0,0,0,0|2,0,0]=4 3305 B10R0.74 CCC(C)NCCCCCF 2230a_100000209981_100000729378 [1,1,0,0,0,0|2,0,0]=4 3306 B10R0.74 CCC(C)NCCCCCO 2230a_100000209981_100000746330 [1,1,0,0,0,0|2,0,0]=4 3307 B10R0.74 CCC(C)NCCCCCO 2230a_100000762737_100000758301 [1,1,0,0,0,0|2,0,0]=4 3308 B10R0.74 CCC(C)NCCCCCO 34a_100000762737_100011215416 [1,1,0,0,0,0|2,0,0]=4 3309 B10R0.74 CCC(C)NCCCCOC 2230a_100000209981_100000730899 [1,1,0,0,0,0|2,0,0]=4 3310 B10R0.74 CCC(C)OCCCCCBr 34a_100000746331_100011215416 [1,1,0,0,0,0|2,0,0]=4 3311 B10R0.74 CCC(C)OCCCCCBr 7a_100000746331_100000758301 [1,1,0,0,0,0|2,0,0]=4 3312 B10R0.74 CCC(C)OCCCCCCl 34a_100000746330_100011215416 [1,1,0,0,0,0|2,0,0]=4 3313 B10R0.74 CCC(C)OCCCCCCl 7a_100000746330_100000758301 [1,1,0,0,0,0|2,0,0]=4 3314 B10R0.74 CCC(C)OCCCCCF 7a_100000210228_100000729378 [1,1,0,0,0,0|2,0,0]=4 3315 B10R0.74 CCC(C)OCCCCCI 34a_200012148887_100011215416 [1,1,0,0,0,0|2,0,0]=4 3316 B10R0.74 CCC(C)OCCCCCI 7a_200012148887_100000758301 [1,1,0,0,0,0|2,0,0]=4 3317 B10R0.74 CCC(C)OCCCCCN 34a_100000762737_100011215416 [1,1,0,0,0,0|2,0,0]=4 3318 B10R0.74 CCC(C)OCCCCCO 7a_100000210228_100000746330 [1,1,0,0,0,0|2,0,0]=4 3319 B10R0.74 CCC(C)OCCCCOC 34a_100000740925_100011215416 [1,1,0,0,0,0|2,0,0]=4 3320 B10R0.74 CCC(C)OCCCCOC 7a_100000210228_100000730899 [1,1,0,0,0,0|2,0,0]=4 3321 B10R0.74 CCC(C)OCCCCSC 34a_100011217163_100011215416 [1,1,0,0,0,0|2,0,0]=4 3322 B10R0.74 CCC(C)OCCCCSC 7a_100011217163_100000758301 [1,1,0,0,0,0|2,0,0]=4 3323 B10R0.74 CCC(C)SCCCCCF 62a_100000729378_100000758301 [1,1,0,0,0,0|2,0,0]=4 3324 B10R0.74 CCC(C)SCCCCCF 62a_100000758301_100000729378 [1,1,0,0,0,0|2,0,0]=4 3325 B10R0.74 CCC(C)SCCCCCO 62a_100000746330_100000758301 [1,1,0,0,0,0|2,0,0]=4 3326 B10R0.74 CCC(C)SCCCCCO 62a_100000758301_100000746330 [1,1,0,0,0,0|2,0,0]=4 3327 B10R0.74 CCC(C)SCCCCOC 62a_100000730899_100000758301 [1,1,0,0,0,0|2,0,0]=4 3328 B10R0.74 CCC(C)SCCCCOC 62a_100000758301_100000730899 [1,1,0,0,0,0|2,0,0]=4 3329 B10R0.74 CCC(O)CNCCCCF 2230a_100011218483_100000729493 [1,1,0,0,0,0|2,0,0]=4 3330 B10R0.74 CCC(O)CNCCCCO 2230a_100000750430_100011218378 [1,1,0,0,0,0|2,0,0]=4 3331 B10R0.74 CCC(O)CNCCCCO 2230a_100011218483_100000210776 [1,1,0,0,0,0|2,0,0]=4 3332 B10R0.74 CCC(O)CNCCCCO 34a_100000750430_100011218378 [1,1,0,0,0,0|2,0,0]=4 3333 B10R0.74 CCC(O)CNCCCOC 2230a_100011218483_100000740836 [1,1,0,0,0,0|2,0,0]=4 3334 B10R0.74 CCC(O)CNCCCOC 34a_100150723488_100011218378 [1,1,0,0,0,0|2,0,0]=4 3335 B10R0.74 CCC(O)CNCCCSC 2230a_100000749238_100011218378 [1,1,0,0,0,0|2,0,0]=4 3336 B10R0.74 CCC(O)COCCCCBr 34a_100011216708_100011218378 [1,1,0,0,0,0|2,0,0]=4 3337 B10R0.74 CCC(O)COCCCCCl 34a_100000210776_100011218378 [1,1,0,0,0,0|2,0,0]=4 3338 B10R0.74 CCC(O)COCCCCCl 7a_100000210776_100011218378 [1,1,0,0,0,0|2,0,0]=4 3339 B10R0.74 CCC(O)COCCCCF 34a_100011995726_100011218378 [1,1,0,0,0,0|2,0,0]=4 3340 B10R0.74 CCC(O)COCCCCF 7a_100011995726_100011218378 [1,1,0,0,0,0|2,0,0]=4 3341 B10R0.74 CCC(O)COCCCCI 34a_200012148704_100011218378 [1,1,0,0,0,0|2,0,0]=4 3342 B10R0.74 CCC(O)COCCCCN 34a_100000750430_100011218378 [1,1,0,0,0,0|2,0,0]=4 3343 B10R0.74 CCC(O)COCCCNC 34a_100000213112_100011218378 [1,1,0,0,0,0|2,0,0]=4 3344 B10R0.74 CCC(O)COCCCOC 34a_100000740835_100011218378 [1,1,0,0,0,0|2,0,0]=4 3345 B10R0.74 CCC(O)COCCCSC 34a_100000690336_100011218378 [1,1,0,0,0,0|2,0,0]=4 3346 B10R0.74 CCC(O)COCCCSC 7a_100000690336_100011218378 [1,1,0,0,0,0|2,0,0]=4 3347 B10R0.74 CCC(O)CSCCCCF 62a_100000729493_100011218378 [1,1,0,0,0,0|2,0,0]=4 3348 B10R0.74 CCC(O)CSCCCCF 62a_100011218378_100000729493 [1,1,0,0,0,0|2,0,0]=4 3349 B10R0.74 CCC(O)CSCCCCO 62a_100000210776_100011218378 [1,1,0,0,0,0|2,0,0]=4 3350 B10R0.74 CCC(O)CSCCCCO 62a_100011218378_100000210776 [1,1,0,0,0,0|2,0,0]=4 3351 B10R0.74 CCC(O)CSCCCOC 62a_100000709357_100011218378 [1,1,0,0,0,0|2,0,0]=4 3352 B10R0.74 CCC(O)CSCCCOC 62a_100011218378_100000709357 [1,1,0,0,0,0|2,0,0]=4 3353 B10R0.74 CCCCCCCC(C)NC 2230a_106832991635_200011218727 [1,1,0,0,0,0|1,0,0]=3 3354 B10R0.74 CCCCCCCC(C)NC 270004a_106832991635_100000210596 [1,1,0,0,0,0|1,0,0]=3 3355 B10R0.74 CCCCCCCC(C)NC 34a_100102657272_200011218727 [1,1,0,0,0,0|1,0,0]=3 3356 B10R0.74 CCCCCCCC(C)NC 7a_106832991635_200011218727 [1,1,0,0,0,0|1,0,0]=3 3357 B10R0.74 CCCCCCCC(C)OC 34a_100138415774_200011218727 [1,1,0,0,0,0|0,0,0]=2 3358 B10R0.74 CCCCCCCC(C)OC 34a_200011215852_200000210301 [1,1,0,0,0,0|0,0,0]=2 3359 B10R0.74 CCCCCCCC(C)OC 7a_200011215852_200000210301 [1,1,0,0,0,0|0,0,0]=2 3360 B10R0.74 CCCCCCCC(C)O[13CH3] 34a_200011215852_200025704644 [1,1,0,0,0,0|0,0,0]=2 3361 B10R0.74 CCCCCCCC(C)O[13CH3] 7a_200011215852_200025704644 [1,1,0,0,0,0|0,0,0]=2 3362 B10R0.74 CCCCCCCC(C)SC 62a_200000210301_200011218727 [1,1,0,0,0,0|0,1,0]=3 3363 B10R0.74 CCCCCCCC(C)SC 62a_200011218727_200000210301 [1,1,0,0,0,0|0,1,0]=3 3364 B10R0.74 CCCCCCCC(C)S[13CH3] 62a_200011218727_200025704644 [1,1,0,0,0,0|0,1,0]=3 3365 B10R0.74 CCCCCCCC(C)S[13CH3] 62a_200025704644_200011218727 [1,1,0,0,0,0|0,1,0]=3 3366 B10R0.74 CCCCCCCN(C)CC 2230a_100000225621_100000210681 [1,1,0,0,0,0|2,0,0]=4 3367 B10R0.74 CCCCCCCN(C)CC 2230a_100000228206_100000210202 [1,1,0,0,0,0|2,0,0]=4 3368 B10R0.74 CCCCCCCN(C)CC 2230a_100000228213_200000210301 [1,1,0,0,0,0|2,0,0]=4 3369 B10R0.74 CCCCCCCN(C)CC 269982a_100000225621_100000210681 [1,1,0,0,0,0|2,0,0]=4 3370 B10R0.74 CCCCCCCN(C)CC 269982a_100000228206_100000204670 [1,1,0,0,0,0|2,0,0]=4 3371 B10R0.74 CCCCCCCN(C)CC 269982a_100000228213_200000210301 [1,1,0,0,0,0|2,0,0]=4 3372 B10R0.74 CCCCCCCN([13CH3])CC 2230a_100000228213_200025704644 [1,1,0,0,0,0|2,0,0]=4 3373 B10R0.74 CCCCCCCN([13CH3])CC 269982a_100000228213_200025704644 [1,1,0,0,0,0|2,0,0]=4 3374 B10R0.74 CCCCCCNC(C)C#N 2230a_100000210581_100000184139 [1,1,0,0,0,0|2,0,0]=4 3375 B10R0.74 CCCCCCNC(C)C#N 2230a_100000737613_100000210314 [1,1,0,0,0,0|2,0,0]=4 3376 B10R0.74 CCCCCCNC(C)CC 2230a_100000209981_100000210314 [1,1,0,0,0,0|1,0,0]=3 3377 B10R0.74 CCCCCCNC(C)CC 2230a_100000210581_100000758301 [1,1,0,0,0,0|1,0,0]=3 3378 B10R0.74 CCCCCCNC(C)CO 2230a_100000210581_100012180447 [1,1,0,0,0,0|2,0,0]=4 3379 B10R0.74 CCCCCCN[C@H](C)CO 2230a_100000737577_100000210314 [1,1,0,0,0,0|2,0,0]=4 3380 B10R0.74 CCCCCCOC(C)C#N 34a_100011218135_100000210314 [1,1,0,0,0,0|2,0,0]=4 3381 B10R0.74 CCCCCCOC(C)C#N 7a_100000210259_100000703298 [1,1,0,0,0,0|2,0,0]=4 3382 B10R0.74 CCCCCCOC(C)CC 34a_100000210259_100011215416 [1,1,0,0,0,0|1,0,0]=3 3383 B10R0.74 CCCCCCOC(C)CC 7a_100000210228_100000210314 [1,1,0,0,0,0|1,0,0]=3 3384 B10R0.74 CCCCCCOC(C)CC 7a_100000210259_100000758301 [1,1,0,0,0,0|1,0,0]=3 3385 B10R0.74 CCCCCCOC(C)CF 34a_100016041109_100000210314 [1,1,0,0,0,0|2,0,0]=4 3386 B10R0.74 CCCCCCOC(C)CF 7a_100016041109_100000210314 [1,1,0,0,0,0|2,0,0]=4 3387 B10R0.74 CCCCCCOC(C)CN 34a_100000210904_100000210314 [1,1,0,0,0,0|2,0,0]=4 3388 B10R0.74 CCCCCCOC(C)CO 34a_100000210259_100012180447 [1,1,0,0,0,0|2,0,0]=4 3389 B10R0.74 CCCCCCOC(C)CO 7a_100000210259_100012180447 [1,1,0,0,0,0|2,0,0]=4 3390 B10R0.74 CCCCCCSC(C)C#N 62a_100000210314_100000703298 [1,1,0,0,0,0|2,0,0]=4 3391 B10R0.74 CCCCCCSC(C)C#N 62a_100000703298_100000210757 [1,1,0,0,0,0|2,0,0]=4 3392 B10R0.74 CCCCCCSC(C)CC 62a_100000210314_100000758301 [1,1,0,0,0,0|1,0,0]=3 3393 B10R0.74 CCCCCCSC(C)CC 62a_100000758301_100000210757 [1,1,0,0,0,0|1,0,0]=3 3394 B10R0.74 CCCCCCSC(C)CO 62a_100012180447_100000210757 [1,1,0,0,0,0|2,0,0]=4 3395 B10R0.74 CCCCCCSC(C)OC 62a_100000210314_100009879195 [1,1,0,0,0,0|0,0,0]=2 3396 B10R0.74 CCCCCCSC(C)OC 62a_100009879195_100000210757 [1,1,0,0,0,0|0,0,0]=2 3397 B10R0.74 CCCCCCS[C@H](C)CO 62a_100000210314_100016084084 [1,1,0,0,0,0|2,0,0]=4 3398 B10R0.74 CCCCCCS[C@H](C)CO 62a_100016084084_100000210757 [1,1,0,0,0,0|2,0,0]=4 3399 B10R0.74 CCCCCNCC(=O)OC 2230a_100000209983_100000747449 [1,1,0,0,0,0|0,0,2]=4 3400 B10R0.74 CCCCCNCC(C)CC 2230a_100000209983_100000748023 [1,1,0,0,0,0|1,0,0]=3 3401 B10R0.74 CCCCCNCC(C)CC 2230a_100020588543_100000210326 [1,1,0,0,0,0|1,0,0]=3 3402 B10R0.74 CCCCCNCC(C)CC 270004a_100000209983_100000243153 [1,1,0,0,0,0|1,0,0]=3 3403 B10R0.74 CCCCCNCC(C)CO 34a_100000744482_100000718602 [1,1,0,0,0,0|2,0,0]=4 3404 B10R0.74 CCCCCNCC(O)CC 2230a_100000209983_100011218378 [1,1,0,0,0,0|1,0,0]=3 3405 B10R0.74 CCCCCNCC(O)CC 2230a_100011218483_100000210326 [1,1,0,0,0,0|1,0,0]=3 3406 B10R0.74 CCCCCNCC(O)CO 2230a_100000209983_100011219619 [1,1,0,0,0,0|2,0,0]=4 3407 B10R0.74 CCCCCNC[C@@H](C)CC 2230a_100000209983_100009816398 [1,1,0,0,0,0|1,0,0]=3 3408 B10R0.74 CCCCCNC[C@@H](C)CO 2230a_100000209983_100000059175 [1,1,0,0,0,0|2,0,0]=4 3409 B10R0.74 CCCCCNC[C@@H](C)OC 2230a_100020591295_100000210326 [1,1,0,0,0,0|0,0,0]=2 3410 B10R0.74 CCCCCNC[C@@H](O)CF 2230a_100000209983_100015614560 [1,1,0,0,0,0|2,0,0]=4 3411 B10R0.74 CCCCCNC[C@@H](O)CO 2230a_100000209983_100009815848 [1,1,0,0,0,0|2,0,0]=4 3412 B10R0.74 CCCCCNC[C@H](O)CO 2230a_100020644852_100000210326 [1,1,0,0,0,0|2,0,0]=4 3413 B10R0.74 CCCCCOCC(=O)OC 34a_100000210253_100000747449 [1,1,0,0,0,0|0,0,2]=4 3414 B10R0.74 CCCCCOCC(=O)OC 7a_100000210253_100000747449 [1,1,0,0,0,0|0,0,2]=4 3415 B10R0.74 CCCCCOCC(C)CC 34a_100000210253_100000748023 [1,1,0,0,0,0|1,0,0]=3 3416 B10R0.74 CCCCCOCC(C)CC 7a_100000210253_100000748023 [1,1,0,0,0,0|1,0,0]=3 3417 B10R0.74 CCCCCOCC(C)CN 34a_100000744482_100000718602 [1,1,0,0,0,0|2,0,0]=4 3418 B10R0.74 CCCCCOCC(C)OC 34a_100000690652_100000718602 [1,1,0,0,0,0|0,0,0]=2 3419 B10R0.74 CCCCCOCC(O)CC 34a_100000210253_100011218378 [1,1,0,0,0,0|1,0,0]=3 3420 B10R0.74 CCCCCOCC(O)CC 7a_100000210253_100011218378 [1,1,0,0,0,0|1,0,0]=3 3421 B10R0.74 CCCCCOCC(O)CO 34a_100000210253_100011219619 [1,1,0,0,0,0|2,0,0]=4 3422 B10R0.74 CCCCCOCC(O)CO 7a_100000210253_100011219619 [1,1,0,0,0,0|2,0,0]=4 3423 B10R0.74 CCCCCOC[C@@H](C)CC 34a_100000210253_100009816398 [1,1,0,0,0,0|1,0,0]=3 3424 B10R0.74 CCCCCOC[C@@H](C)CC 7a_100000210253_100009816398 [1,1,0,0,0,0|1,0,0]=3 3425 B10R0.74 CCCCCOC[C@@H](C)CC 7a_100009816381_100000210326 [1,1,0,0,0,0|1,0,0]=3 3426 B10R0.74 CCCCCOC[C@@H](C)CO 34a_100000210253_100000059175 [1,1,0,0,0,0|2,0,0]=4 3427 B10R0.74 CCCCCOC[C@@H](C)CO 7a_100000210253_100000059175 [1,1,0,0,0,0|2,0,0]=4 3428 B10R0.74 CCCCCOC[C@@H](O)CF 34a_100000210253_100015614560 [1,1,0,0,0,0|2,0,0]=4 3429 B10R0.74 CCCCCOC[C@@H](O)CF 7a_100000210253_100015614560 [1,1,0,0,0,0|2,0,0]=4 3430 B10R0.74 CCCCCOC[C@@H](O)CO 34a_100000210253_100009815848 [1,1,0,0,0,0|2,0,0]=4 3431 B10R0.74 CCCCCOC[C@@H](O)CO 7a_100000210253_100009815848 [1,1,0,0,0,0|2,0,0]=4 3432 B10R0.74 CCCCCSCC(=O)OC 62a_100000210326_100000747449 [1,1,0,0,0,0|0,0,2]=4 3433 B10R0.74 CCCCCSCC(=O)OC 62a_100000747449_100000210326 [1,1,0,0,0,0|0,0,2]=4 3434 B10R0.74 CCCCCSCC(C)CC 62a_100000210326_100000748023 [1,1,0,0,0,0|1,0,0]=3 3435 B10R0.74 CCCCCSCC(C)CC 62a_100000748023_100000210326 [1,1,0,0,0,0|1,0,0]=3 3436 B10R0.74 CCCCCSCC(O)CC 62a_100000210326_100011218378 [1,1,0,0,0,0|1,0,0]=3 3437 B10R0.74 CCCCCSCC(O)CC 62a_100011218378_100000210326 [1,1,0,0,0,0|1,0,0]=3 3438 B10R0.74 CCCCCSCC(O)CO 62a_100000210326_100011219619 [1,1,0,0,0,0|2,0,0]=4 3439 B10R0.74 CCCCCSCC(O)CO 62a_100011219619_100000210326 [1,1,0,0,0,0|2,0,0]=4 3440 B10R0.74 CCCCCSC[C@@H](C)CC 62a_100000210326_100009816398 [1,1,0,0,0,0|1,0,0]=3 3441 B10R0.74 CCCCCSC[C@@H](C)CC 62a_100009816398_100000210326 [1,1,0,0,0,0|1,0,0]=3 3442 B10R0.74 CCCCCSC[C@@H](C)CO 62a_100000059175_100000210326 [1,1,0,0,0,0|2,0,0]=4 3443 B10R0.74 CCCCCSC[C@@H](C)CO 62a_100000210326_100000059175 [1,1,0,0,0,0|2,0,0]=4 3444 B10R0.74 CCCCCSC[C@@H](O)CF 62a_100000210326_100015614560 [1,1,0,0,0,0|2,0,0]=4 3445 B10R0.74 CCCCCSC[C@@H](O)CF 62a_100015614560_100000210326 [1,1,0,0,0,0|2,0,0]=4 3446 B10R0.74 CCCCCSC[C@@H](O)CO 62a_100000210326_100009815848 [1,1,0,0,0,0|2,0,0]=4 3447 B10R0.74 CCCCCSC[C@@H](O)CO 62a_100009815848_100000210326 [1,1,0,0,0,0|2,0,0]=4 3448 B10R0.74 CCCCNCCC(=O)OC 2230a_100000102301_100000204255 [1,1,0,0,0,0|0,0,2]=4 3449 B10R0.74 CCCCNCCC(=O)OC 7a_106832991798_100000204255 [1,1,0,0,0,0|0,0,2]=4 3450 B10R0.74 CCCCNCCC(C)CC 2230a_100020591266_100000210211 [1,1,0,0,0,0|1,0,0]=3 3451 B10R0.74 CCCCNCCC(C)CO 2230a_106354213184_100000210211 [1,1,0,0,0,0|2,0,0]=4 3452 B10R0.74 CCCCNCCC(C)CO 34a_106354213184_100000210210 [1,1,0,0,0,0|2,0,0]=4 3453 B10R0.74 CCCCOCCC(=O)OC 34a_100000210227_100000742370 [1,1,0,0,0,0|0,0,2]=4 3454 B10R0.74 CCCCOCCC(=O)OC 7a_100000210227_100000204255 [1,1,0,0,0,0|0,0,2]=4 3455 B10R0.74 CCCCOCCC(C)CC 7a_100011215188_100000210211 [1,1,0,0,0,0|1,0,0]=3 3456 B10R0.74 CCCCOCCC(C)OC 7a_100000764861_100000210211 [1,1,0,0,0,0|0,0,0]=2 3457 B10R0.74 CCCCOCCN(C)CC 2230a_100000225621_100000743108 [1,1,0,0,0,0|2,0,0]=4 3458 B10R0.74 CCCCOCCN(C)CC 269982a_100000225621_100000743108 [1,1,0,0,0,0|2,0,0]=4 3459 B10R0.74 CCCCOCNC(C)CC 2230a_100000209981_100011995733 [1,1,0,0,0,0|2,0,0]=4 3460 B10R0.74 CCCCOCSC(C)CC 62a_100000758301_100011995733 [1,1,0,0,0,0|2,0,0]=4 3461 B10R0.74 CCCCOCSC(C)CC 62a_100011995733_100000758301 [1,1,0,0,0,0|2,0,0]=4 3462 B10R0.74 CCCCOCSC(C)OC 62a_100009879195_100011995733 [1,1,0,0,0,0|1,0,0]=3 3463 B10R0.74 CCCCOCSC(C)OC 62a_100011995733_100009879195 [1,1,0,0,0,0|1,0,0]=3 3464 B10R0.74 CCCCSCCC(=O)OC 62a_100000204255_100000210210 [1,1,0,0,0,0|0,0,2]=4 3465 B10R0.74 CCCCSCCC(=O)OC 62a_100000210211_100000204255 [1,1,0,0,0,0|0,0,2]=4 3466 B10R0.74 CCCOCCCC(=O)OC 34a_100000210258_100000742333 [1,1,0,0,0,0|0,0,2]=4 3467 B10R0.74 CCCOCCCC(C)CC 7a_100011216074_100000210303 [1,1,0,0,0,0|1,0,0]=3 3468 B10R0.74 CCCOCCC[C@@H](C)CN 34a_100160569302_100000210303 [1,1,0,0,0,0|2,0,0]=4 3469 B10R0.74 CCCOCCNC(C)CC 2230a_100000209981_100011215938 [1,1,0,0,0,0|2,0,0]=4 3470 B10R0.74 CCCOCCNC(C)CC 2230a_100161115042_100000758301 [1,1,0,0,0,0|2,0,0]=4 3471 B10R0.74 CCCOCCNC(C)CC 34a_100161115042_100011215416 [1,1,0,0,0,0|2,0,0]=4 3472 B10R0.74 CCCOCCOC(C)CC 34a_100000752267_100011215416 [1,1,0,0,0,0|2,0,0]=4 3473 B10R0.74 CCCOCCOC(C)CC 7a_100000210228_100011215938 [1,1,0,0,0,0|2,0,0]=4 3474 B10R0.74 CCCOCCOC(C)CC 7a_100000752267_100000758301 [1,1,0,0,0,0|2,0,0]=4 3475 B10R0.74 CCCOCCSC(C)CC 62a_100000758301_100011215938 [1,1,0,0,0,0|2,0,0]=4 3476 B10R0.74 CCCOCCSC(C)CC 62a_100011215938_100000758301 [1,1,0,0,0,0|2,0,0]=4 3477 B10R0.74 CCCOCCSC(C)OC 62a_100009879195_100011215938 [1,1,0,0,0,0|1,0,0]=3 3478 B10R0.74 CCCOCCSC(C)OC 62a_100011215938_100009879195 [1,1,0,0,0,0|1,0,0]=3 3479 B10R0.74 CCCSCCCC(=O)OC 62a_100000210303_100011218270 [1,1,0,0,0,0|0,0,2]=4 3480 B10R0.74 CCCSCCCC(=O)OC 62a_100011218270_100000210303 [1,1,0,0,0,0|0,0,2]=4 3481 B10R0.74 CCCSCCCN(C)CC 62a_100000210303_100015186262 [1,1,0,0,0,0|2,0,0]=4 3482 B10R0.74 CCCSCCNC(C)CC 2230a_100020603323_100000758301 [1,1,0,0,0,0|2,0,0]=4 3483 B10R0.74 CCCSCCOC(C)CC 34a_200000230433_100011215416 [1,1,0,0,0,0|2,0,0]=4 3484 B10R0.74 CCCSCCOC(C)CC 7a_200000230433_100000758301 [1,1,0,0,0,0|2,0,0]=4 3485 B10R0.74 CCN(C)CCCCCCF 2230a_100000225621_100015922095 [1,1,0,0,0,0|2,0,0]=4 3486 B10R0.74 CCN(C)CCCCCCF 269982a_100000225621_100015922095 [1,1,0,0,0,0|2,0,0]=4 3487 B10R0.74 CCN(C)CCCCCCO 2230a_100000225621_100000766143 [1,1,0,0,0,0|2,0,0]=4 3488 B10R0.74 CCN(C)CCCCCCO 269982a_100000225621_100000766143 [1,1,0,0,0,0|2,0,0]=4 3489 B10R0.74 CCNCCCCC(=O)OC 2230a_100015525214_100000204269 [1,1,0,0,0,0|0,0,2]=4 3490 B10R0.74 CCOCCCCC(=O)OC 34a_100000059025_100000210202 [1,1,0,0,0,0|0,0,2]=4 3491 B10R0.74 CCOCCCCC(=O)OC 34a_100121572206_100000204269 [1,1,0,0,0,0|0,0,2]=4 3492 B10R0.74 CCOCCCCC(=O)OC 7a_100000059025_100000210202 [1,1,0,0,0,0|0,0,2]=4 3493 B10R0.74 CCOCCCNC(C)CC 2230a_100000209981_100012232248 [1,1,0,0,0,0|2,0,0]=4 3494 B10R0.74 CCOCCCNC(C)CC 2230a_100000210961_100000758301 [1,1,0,0,0,0|2,0,0]=4 3495 B10R0.74 CCOCCCNC(C)CC 34a_100000210961_100011215416 [1,1,0,0,0,0|2,0,0]=4 3496 B10R0.74 CCOCCCOC(C)CC 34a_100000757476_100011215416 [1,1,0,0,0,0|2,0,0]=4 3497 B10R0.74 CCOCCCOC(C)CC 7a_100000210228_100012232248 [1,1,0,0,0,0|2,0,0]=4 3498 B10R0.74 CCOCCCOC(C)CC 7a_100000757476_100000758301 [1,1,0,0,0,0|2,0,0]=4 3499 B10R0.74 CCOCCCSC(C)CC 62a_100000758301_100012232248 [1,1,0,0,0,0|2,0,0]=4 3500 B10R0.74 CCOCCCSC(C)CC 62a_100012232248_100000758301 [1,1,0,0,0,0|2,0,0]=4 3501 B10R0.74 CCOCCCSC(C)OC 62a_100009879195_100012232248 [1,1,0,0,0,0|1,0,0]=3 3502 B10R0.74 CCOCCCSC(C)OC 62a_100012232248_100009879195 [1,1,0,0,0,0|1,0,0]=3 3503 B10R0.74 CCOCCNCC(C)CC 2230a_100020588543_100011215890 [1,1,0,0,0,0|2,0,0]=4 3504 B10R0.74 CCOCCNCC(C)CC 2230a_102516460346_100000748023 [1,1,0,0,0,0|2,0,0]=4 3505 B10R0.74 CCOCCNCC(C)CC 270004a_102516460346_100000243153 [1,1,0,0,0,0|2,0,0]=4 3506 B10R0.74 CCOCCNCC(C)CC 34a_102516460346_100000748023 [1,1,0,0,0,0|2,0,0]=4 3507 B10R0.74 CCOCCNCC(O)CC 2230a_100011218483_100011215890 [1,1,0,0,0,0|2,0,0]=4 3508 B10R0.74 CCOCCNCC(O)CC 2230a_102516460346_100011218378 [1,1,0,0,0,0|2,0,0]=4 3509 B10R0.74 CCOCCNCC(O)CC 34a_102516460346_100011218378 [1,1,0,0,0,0|2,0,0]=4 3510 B10R0.74 CCOCCNC[C@@H](C)CC 2230a_102516460346_100009816398 [1,1,0,0,0,0|2,0,0]=4 3511 B10R0.74 CCOCCNC[C@@H](C)CC 34a_102516460346_100009816398 [1,1,0,0,0,0|2,0,0]=4 3512 B10R0.74 CCOCCNC[C@@H](C)OC 2230a_100020591295_100011215890 [1,1,0,0,0,0|1,0,0]=3 3513 B10R0.74 CCOCCOCC(C)CC 34a_100000210136_100000748023 [1,1,0,0,0,0|2,0,0]=4 3514 B10R0.74 CCOCCOCC(C)CC 7a_100000210136_100000748023 [1,1,0,0,0,0|2,0,0]=4 3515 B10R0.74 CCOCCOCC(C)OC 34a_100000690652_100000210147 [1,1,0,0,0,0|1,0,0]=3 3516 B10R0.74 CCOCCOCC(O)CC 34a_100000210136_100011218378 [1,1,0,0,0,0|2,0,0]=4 3517 B10R0.74 CCOCCOCC(O)CC 7a_100000210136_100011218378 [1,1,0,0,0,0|2,0,0]=4 3518 B10R0.74 CCOCCOC[C@@H](C)CC 34a_100000210136_100009816398 [1,1,0,0,0,0|2,0,0]=4 3519 B10R0.74 CCOCCOC[C@@H](C)CC 7a_100000210136_100009816398 [1,1,0,0,0,0|2,0,0]=4 3520 B10R0.74 CCOCCOC[C@@H](C)CC 7a_100009816381_100011215890 [1,1,0,0,0,0|2,0,0]=4 3521 B10R0.74 CCOCCSCC(C)CC 62a_100000210147_100000748023 [1,1,0,0,0,0|2,0,0]=4 3522 B10R0.74 CCOCCSCC(C)CC 62a_100000748023_100011215890 [1,1,0,0,0,0|2,0,0]=4 3523 B10R0.74 CCOCCSCC(O)CC 62a_100000210147_100011218378 [1,1,0,0,0,0|2,0,0]=4 3524 B10R0.74 CCOCCSCC(O)CC 62a_100011218378_100011215890 [1,1,0,0,0,0|2,0,0]=4 3525 B10R0.74 CCOCCSC[C@@H](C)CC 62a_100000210147_100009816398 [1,1,0,0,0,0|2,0,0]=4 3526 B10R0.74 CCOCCSC[C@@H](C)CC 62a_100009816398_100011215890 [1,1,0,0,0,0|2,0,0]=4 3527 B10R0.74 CCSCCCCC(=O)OC 62a_100000204269_100000210202 [1,1,0,0,0,0|0,0,2]=4 3528 B10R0.74 CCSCCCCC(=O)OC 62a_100000210202_100000204269 [1,1,0,0,0,0|0,0,2]=4 3529 B10R0.74 CCSCCCOC(C)CC 34a_100011216438_100011215416 [1,1,0,0,0,0|2,0,0]=4 3530 B10R0.74 CCSCCCOC(C)CC 7a_100011216438_100000758301 [1,1,0,0,0,0|2,0,0]=4 3531 B10R0.74 CCSCCNCC(C)CC 2230a_100000106463_100000748023 [1,1,0,0,0,0|2,0,0]=4 3532 B10R0.74 CCSCCNCC(C)CC 2230a_100020588543_100000757381 [1,1,0,0,0,0|2,0,0]=4 3533 B10R0.74 CCSCCNCC(C)CC 270004a_100000106463_100000243153 [1,1,0,0,0,0|2,0,0]=4 3534 B10R0.74 CCSCCNCC(O)CC 2230a_100000106463_100011218378 [1,1,0,0,0,0|2,0,0]=4 3535 B10R0.74 CCSCCNCC(O)CC 2230a_100011218483_100000757381 [1,1,0,0,0,0|2,0,0]=4 3536 B10R0.74 CCSCCNC[C@@H](C)CC 2230a_100000106463_100009816398 [1,1,0,0,0,0|2,0,0]=4 3537 B10R0.74 CCSCCNC[C@@H](C)OC 2230a_100020591295_100000757381 [1,1,0,0,0,0|1,0,0]=3 3538 B10R0.74 CCSCCOCC(C)CC 34a_100000212035_100000748023 [1,1,0,0,0,0|2,0,0]=4 3539 B10R0.74 CCSCCOCC(C)CC 7a_100000212035_100000748023 [1,1,0,0,0,0|2,0,0]=4 3540 B10R0.74 CCSCCOCC(C)OC 34a_100000690652_100000757381 [1,1,0,0,0,0|1,0,0]=3 3541 B10R0.74 CCSCCOCC(O)CC 34a_100000212035_100011218378 [1,1,0,0,0,0|2,0,0]=4 3542 B10R0.74 CCSCCOCC(O)CC 7a_100000212035_100011218378 [1,1,0,0,0,0|2,0,0]=4 3543 B10R0.74 CCSCCOC[C@@H](C)CC 34a_100000212035_100009816398 [1,1,0,0,0,0|2,0,0]=4 3544 B10R0.74 CCSCCOC[C@@H](C)CC 7a_100000212035_100009816398 [1,1,0,0,0,0|2,0,0]=4 3545 B10R0.74 CCSCCOC[C@@H](C)CC 7a_100009816381_100000757381 [1,1,0,0,0,0|2,0,0]=4 3546 B10R0.74 CCSCCSCC(C)CC 62a_100000748023_100000757381 [1,1,0,0,0,0|2,0,0]=4 3547 B10R0.74 CCSCCSCC(C)CC 62a_100000757381_100000748023 [1,1,0,0,0,0|2,0,0]=4 3548 B10R0.74 CCSCCSCC(O)CC 62a_100000757381_100011218378 [1,1,0,0,0,0|2,0,0]=4 3549 B10R0.74 CCSCCSCC(O)CC 62a_100011218378_100000757381 [1,1,0,0,0,0|2,0,0]=4 3550 B10R0.74 CCSCCSC[C@@H](C)CC 62a_100000757381_100009816398 [1,1,0,0,0,0|2,0,0]=4 3551 B10R0.74 CCSCCSC[C@@H](C)CC 62a_100009816398_100000757381 [1,1,0,0,0,0|2,0,0]=4 3552 B10R0.74 CC[C@H](C)CNCCCCO 2230a_100000750430_100009816398 [1,1,0,0,0,0|2,0,0]=4 3553 B10R0.74 CC[C@H](C)CNCCCCO 34a_100000750430_100009816398 [1,1,0,0,0,0|2,0,0]=4 3554 B10R0.74 CC[C@H](C)CNCCCOC 34a_100150723488_100009816398 [1,1,0,0,0,0|2,0,0]=4 3555 B10R0.74 CC[C@H](C)CNCCCSC 2230a_100000749238_100009816398 [1,1,0,0,0,0|2,0,0]=4 3556 B10R0.74 CC[C@H](C)COCCCCBr 34a_100011216708_100009816398 [1,1,0,0,0,0|2,0,0]=4 3557 B10R0.74 CC[C@H](C)COCCCCCl 34a_100000210776_100009816398 [1,1,0,0,0,0|2,0,0]=4 3558 B10R0.74 CC[C@H](C)COCCCCCl 7a_100000210776_100009816398 [1,1,0,0,0,0|2,0,0]=4 3559 B10R0.74 CC[C@H](C)COCCCCF 34a_100011995726_100009816398 [1,1,0,0,0,0|2,0,0]=4 3560 B10R0.74 CC[C@H](C)COCCCCF 7a_100009816381_100000729493 [1,1,0,0,0,0|2,0,0]=4 3561 B10R0.74 CC[C@H](C)COCCCCF 7a_100011995726_100009816398 [1,1,0,0,0,0|2,0,0]=4 3562 B10R0.74 CC[C@H](C)COCCCCI 34a_200012148704_100009816398 [1,1,0,0,0,0|2,0,0]=4 3563 B10R0.74 CC[C@H](C)COCCCCN 34a_100000750430_100009816398 [1,1,0,0,0,0|2,0,0]=4 3564 B10R0.74 CC[C@H](C)COCCCCO 7a_100009816381_100000210776 [1,1,0,0,0,0|2,0,0]=4 3565 B10R0.74 CC[C@H](C)COCCCNC 34a_100000213112_100009816398 [1,1,0,0,0,0|2,0,0]=4 3566 B10R0.74 CC[C@H](C)COCCCOC 34a_100000740835_100009816398 [1,1,0,0,0,0|2,0,0]=4 3567 B10R0.74 CC[C@H](C)COCCCOC 7a_100009816381_100000740836 [1,1,0,0,0,0|2,0,0]=4 3568 B10R0.74 CC[C@H](C)COCCCSC 34a_100000690336_100009816398 [1,1,0,0,0,0|2,0,0]=4 3569 B10R0.74 CC[C@H](C)COCCCSC 7a_100000690336_100009816398 [1,1,0,0,0,0|2,0,0]=4 3570 B10R0.74 CC[C@H](C)CSCCCCF 62a_100000729493_100009816398 [1,1,0,0,0,0|2,0,0]=4 3571 B10R0.74 CC[C@H](C)CSCCCCF 62a_100009816398_100000729493 [1,1,0,0,0,0|2,0,0]=4 3572 B10R0.74 CC[C@H](C)CSCCCCO 62a_100000210776_100009816398 [1,1,0,0,0,0|2,0,0]=4 3573 B10R0.74 CC[C@H](C)CSCCCCO 62a_100009816398_100000210776 [1,1,0,0,0,0|2,0,0]=4 3574 B10R0.74 CC[C@H](C)CSCCCOC 62a_100000709357_100009816398 [1,1,0,0,0,0|2,0,0]=4 3575 B10R0.74 CC[C@H](C)CSCCCOC 62a_100009816398_100000709357 [1,1,0,0,0,0|2,0,0]=4 3576 B10R0.74 CNCCCCCC(=O)OC 2230a_106832991635_100009816466 [1,1,0,0,0,0|0,0,2]=4 3577 B10R0.74 CNCCCCCC(=O)OC 34a_100102657272_100009816466 [1,1,0,0,0,0|0,0,2]=4 3578 B10R0.74 CNCCCCCC(=O)OC 7a_106832991635_100009816466 [1,1,0,0,0,0|0,0,2]=4 3579 B10R0.74 COC(=O)CCCCCO[13CH3] 34a_100000074720_200025704644 [1,1,0,0,0,0|0,0,2]=4 3580 B10R0.74 COC(=O)CCCCCO[13CH3] 7a_100000074720_200025704644 [1,1,0,0,0,0|0,0,2]=4 3581 B10R0.74 COC(=O)CCCCCSC 62a_100009816466_200000210301 [1,1,0,0,0,0|0,0,2]=4 3582 B10R0.74 COC(=O)CCCCCSC 62a_200000210301_100009816466 [1,1,0,0,0,0|0,0,2]=4 3583 B10R0.74 COC(=O)CCCCCS[13CH3] 62a_100009816466_200025704644 [1,1,0,0,0,0|0,0,2]=4 3584 B10R0.74 COC(=O)CCCCCS[13CH3] 62a_200025704644_100009816466 [1,1,0,0,0,0|0,0,2]=4 3585 B10R0.74 COC(C)CCOCCC#N 7a_100000764861_100000184422 [1,1,0,0,0,0|1,0,1]=4 3586 B10R0.74 COC(C)CCOCCCF 7a_100000764861_100011934791 [1,1,0,0,0,0|1,0,0]=3 3587 B10R0.74 COC(C)CCOCCCO 7a_100000764861_100011215043 [1,1,0,0,0,0|1,0,0]=3 3588 B10R0.74 COC(C)CCOCCSC 7a_100000764861_100000212216 [1,1,0,0,0,0|1,0,0]=3 3589 B10R0.74 COC(C)COCCCCF 34a_100000690652_100000729493 [1,1,0,0,0,0|1,0,0]=3 3590 B10R0.74 COC(C)COCCCCO 34a_100000690652_100011216708 [1,1,0,0,0,0|1,0,0]=3 3591 B10R0.74 COC(C)SCCCCC#N 62a_100009879195_100000211819 [1,1,0,0,0,0|1,0,1]=4 3592 B10R0.74 COC(C)SCCCCC#N 62a_100011219923_100009879195 [1,1,0,0,0,0|1,0,1]=4 3593 B10R0.74 COC(C)SCCCCC=O 62a_100000139335_100009879195 [1,1,0,0,0,0|1,0,1]=4 3594 B10R0.74 COC(C)SCCCCC=O 62a_100009879195_100000139335 [1,1,0,0,0,0|1,0,1]=4 3595 B10R0.74 COC(C)SCCCCCF 62a_100000729378_100009879195 [1,1,0,0,0,0|1,0,0]=3 3596 B10R0.74 COC(C)SCCCCCF 62a_100009879195_100000729378 [1,1,0,0,0,0|1,0,0]=3 3597 B10R0.74 COC(C)SCCCCCO 62a_100000746330_100009879195 [1,1,0,0,0,0|1,0,0]=3 3598 B10R0.74 COC(C)SCCCCCO 62a_100009879195_100000746330 [1,1,0,0,0,0|1,0,0]=3 3599 B10R0.74 COC(C)SCCOCCO 62a_100009879195_100011215305 [1,1,0,0,0,0|2,0,0]=4 3600 B10R0.74 COC(C)SCCOCCO 62a_100011215305_100009879195 [1,1,0,0,0,0|2,0,0]=4 3601 B10R0.74 COCCCCCC(=O)OC 34a_100000074720_200000210301 [1,1,0,0,0,0|0,0,2]=4 3602 B10R0.74 COCCCCCC(=O)OC 34a_100138415774_100009816466 [1,1,0,0,0,0|0,0,2]=4 3603 B10R0.74 COCCCCCC(=O)OC 7a_100000074720_200000210301 [1,1,0,0,0,0|0,0,2]=4 3604 B10R0.74 COCCCCSC(C)OC 62a_100000730899_100009879195 [1,1,0,0,0,0|1,0,0]=3 3605 B10R0.74 COCCCCSC(C)OC 62a_100009879195_100000730899 [1,1,0,0,0,0|1,0,0]=3 3606 B10R0.74 COCCCNC[C@@H](C)OC 2230a_100020591295_100000740836 [1,1,0,0,0,0|1,0,0]=3 3607 B10R0.74 COCCCOCC(C)OC 34a_100000690652_100000740836 [1,1,0,0,0,0|1,0,0]=3 3608 B10R0.74 COCCOCCC(C)OC 7a_100000764861_100000233755 [1,1,0,0,0,0|1,0,0]=3 3609 B10R0.74 COCCOCSC(C)OC 62a_100000231047_100009879195 [1,1,0,0,0,0|2,0,0]=4 3610 B10R0.74 COCCOCSC(C)OC 62a_100009879195_100000231047 [1,1,0,0,0,0|2,0,0]=4 3611 B10R0.74 CO[C@H](C)CNCCCC#N 2230a_100020591295_100000687738 [1,1,0,0,0,0|1,0,1]=4 3612 B10R0.74 CO[C@H](C)CNCCCC=O 2230a_100020591295_200011292268 [1,1,0,0,0,0|1,0,1]=4 3613 B10R0.74 CO[C@H](C)CNCCCCF 2230a_100020591295_100000729493 [1,1,0,0,0,0|1,0,0]=3 3614 B10R0.74 CO[C@H](C)CNCCCCO 2230a_100020591295_100000210776 [1,1,0,0,0,0|1,0,0]=3 3615 B10R0.75 C=C(C)C(C)NCCCCC 269862a_100000209983_100011216138 [1,1,0,0,0,0|2,0,0]=4 3616 B10R0.75 CCCCCCC(C)C(=O)C 1458a_100000070787_100011215978 [1,1,0,0,0,0|1,0,0]=3 3617 B10R0.75 CCCCCCC(C)N(C)C 2230a_100102631434_100011215978 [1,1,0,0,0,0|1,0,0]=3 3618 B10R0.75 CCCCCCC(C)N(C)C 269982a_100102631434_100011215978 [1,1,0,0,0,0|1,0,0]=3 3619 B10R0.75 CCCCCCC(C)N(C)C 270004a_100102631434_100000210826 [1,1,0,0,0,0|1,0,0]=3 3620 B10R0.75 CCCCCCC(O)C(=O)C 1458a_100011215828_200000210301 [1,1,0,0,0,0|1,0,0]=3 3621 B10R0.75 CCCCCCC(O)C(=O)[13CH3] 1458a_100011215828_200025704644 [1,1,0,0,0,0|1,0,0]=3 3622 B10R0.75 CCCCCCN(C)C(=O)C 11a_106256046315_100015343762 [1,1,0,0,0,0|2,0,0]=4 3623 B10R0.75 CCCCCCN(C)C(=O)C 1626a_106256046315_100015343762 [1,1,0,0,0,0|2,0,0]=4 3624 B10R0.75 CCCCCCN(C)C(=O)C 240690a_106256046315_100015343762 [1,1,0,0,0,0|2,0,0]=4 3625 B10R0.75 CCCCCCN(C)C(=O)C 527a_106256046315_100103153847 [1,1,0,0,0,0|2,0,0]=4 3626 B10R0.75 CCCCCCN(C)C(C)C 2230a_106256046315_100000210206 [1,1,0,0,0,0|2,0,0]=4 3627 B10R0.75 CCCCCCN(C)C(C)C 269982a_106256046315_100000210206 [1,1,0,0,0,0|2,0,0]=4 3628 B10R0.75 CCCCCCN(C)C(C)C 269982a_200000211004_100000210757 [1,1,0,0,0,0|2,0,0]=4 3629 B10R0.75 CCCCCNC(C)C(=O)C 2230a_100000209983_100009814033 [1,1,0,0,0,0|2,0,0]=4 3630 B10R0.75 CCCCCNC(C)C(C)C 2230a_100000211541_100000210326 [1,1,0,0,0,0|2,0,0]=4 3631 B10R0.75 CCCCCOC(C)C(=O)C 34a_100000212229_100000718602 [1,1,0,0,0,0|2,0,0]=4 3632 B10R0.75 CCCCCOC(C)C(=O)C 7a_100000210253_100000179758 [1,1,0,0,0,0|2,0,0]=4 3633 B10R0.75 CCCCCOC(C)C(C)C 7a_100000748068_100000210326 [1,1,0,0,0,0|2,0,0]=4 3634 B10R0.75 CCCCCSC(C)C(=O)C 62a_100000210326_100009814033 [1,1,0,0,0,0|2,0,0]=4 3635 B10R0.75 CCCCCSC(C)C(=O)C 62a_100009814033_100000210326 [1,1,0,0,0,0|2,0,0]=4 3636 B10R0.75 CCCCNCC(O)C(C)C 2230a_100000759067_100000210211 [1,1,0,0,0,0|2,0,0]=4 3637 B10R0.75 CCCCNCC(O)C(C)C 34a_100000759067_100000210210 [1,1,0,0,0,0|2,0,0]=4 3638 B10R0.75 CCCCOCC(C)C(=O)C 34a_100000032740_100000210210 [1,1,0,0,0,0|2,0,0]=4 3639 B10R0.75 CCCCOCC(C)C(=O)C 7a_100000032740_100000210211 [1,1,0,0,0,0|2,0,0]=4 3640 B10R0.83 CCCCCC(=O)C(C)CC 1458a_100000212188_100000758301 [1,1,0,0,0,0|1,0,1]=4 3641 B10R0.83 CCCCCC(=O)C(C)CC 1458a_100011192722_100000210326 [1,1,0,0,0,0|1,0,1]=4 3642 B10R0.83 CCCCCC(=O)C(C)OC 1458a_100000743197_100000210326 [1,1,0,0,0,0|0,0,1]=3 3643 B10R0.83 CCCCCC(=O)C(C)SC 1458a_100000149566_100000210326 [1,1,0,0,0,0|0,1,1]=4 3644 B10R0.83 CCCCCC(=O)C(O)CC 1458a_100011196387_100000210326 [1,1,0,0,0,0|1,0,1]=4 3645 B10R0.83 CCCCCC(C)N(C)CC 2230a_100000225621_200011218191 [1,1,0,0,0,0|2,0,0]=4 3646 B10R0.83 CCCCCC(C)N(C)CC 269982a_100000225621_200011218191 [1,1,0,0,0,0|2,0,0]=4 3647 B10R0.83 CCCCCN(C)C(C)CC 2230a_100000223495_100000758301 [1,1,0,0,0,0|2,0,0]=4 3648 B10R0.83 CCCCCN(C)C(C)CC 2230a_100000741768_100000210326 [1,1,0,0,0,0|2,0,0]=4 3649 B10R0.83 CCCCCN(C)C(C)CC 269982a_100000223495_100000758301 [1,1,0,0,0,0|2,0,0]=4 3650 B10R0.83 CCCCCN(C)C(C)CC 269982a_100000741768_100000210215 [1,1,0,0,0,0|2,0,0]=4 3651 B10R0.83 CCCCCN(C)C(C)OC 269982a_100000223495_100009879195 [1,1,0,0,0,0|1,0,0]=3 3652 B10R0.83 CCCCNC(=O)C(C)OC 11a_100000102301_100000743197 [1,1,0,0,0,0|1,0,1]=4 3653 B10R0.83 CCCCNC(=O)C(C)OC 1626a_100000102301_100000743197 [1,1,0,0,0,0|1,0,1]=4 3654 B10R0.83 CCCCNC(=O)C(C)OC 240690a_100000102301_100000743197 [1,1,0,0,0,0|1,0,1]=4 3655 B10R0.83 CCCCNC(=O)C(C)OC 34a_100138415774_100000735917 [1,1,0,0,0,0|1,0,1]=4 3656 B10R0.83 CCCCNC(=O)C(C)OC 527a_100000102301_100000743197 [1,1,0,0,0,0|1,0,1]=4 3657 B10R0.83 CCCCNC(C)C(C)CC 269862a_100000102301_100000210599 [1,1,0,0,0,0|2,0,0]=4 3658 B10R0.83 CCCCNC(C)C(C)CC 270004a_100000102301_100000210599 [1,1,0,0,0,0|2,0,0]=4 3659 B10R0.83 CCCCOC(=O)C(C)OC 34a_100000038973_200000210301 [1,1,0,0,0,0|1,0,1]=4 3660 B10R0.83 CCCCOC(=O)C(C)OC 34a_100138415774_100000759602 [1,1,0,0,0,0|1,0,1]=4 3661 B10R0.83 CCCCOC(=O)C(C)OC 7a_100000038973_200000210301 [1,1,0,0,0,0|1,0,1]=4 3662 B10R0.83 CCCCOC(=O)C(C)O[13CH3] 34a_100000038973_200025704644 [1,1,0,0,0,0|1,0,1]=4 3663 B10R0.83 CCCCOC(=O)C(C)O[13CH3] 7a_100000038973_200025704644 [1,1,0,0,0,0|1,0,1]=4 3664 B10R0.83 CCCCOC(C)C(C)CC 7a_100011215189_100000210211 [1,1,0,0,0,0|2,0,0]=4 3665 B10R0.83 CCOCCC(=O)C(C)OC 1458a_100000743197_100011215890 [1,1,0,0,0,0|1,0,1]=4 3666 B10R0.83 CCSCCC(=O)C(C)OC 1458a_100000743197_100000757381 [1,1,0,0,0,0|1,0,1]=4 3667 B10R0.83 COC(C)C(=O)CCCCF 1458a_100000743197_100000729493 [1,1,0,0,0,0|1,0,1]=4 3668 B10R0.83 COC(C)C(=O)CCCCO 1458a_100000743197_100000210776 [1,1,0,0,0,0|1,0,1]=4 3669 B10R0.83 COC(C)N(C)CCCCO 269982a_100000717598_100009879195 [1,1,0,0,0,0|2,0,0]=4 3670 B10R0.83 COCCCC(=O)C(C)OC 1458a_100000743197_100000740836 [1,1,0,0,0,0|1,0,1]=4 3671 B10R0.83 COCCCN(C)C(C)OC 269982a_100000224831_100009879195 [1,1,0,0,0,0|2,0,0]=4 3672 B10R0.108 CCCC(=O)CCC(C)CC 1458a_100000701222_100000210303 [1,1,0,0,0,0|1,0,1]=4 3673 B10R0.108 CCCC(=O)CSC(C)OC 62a_100000747444_100009879195 [1,1,0,0,0,0|1,0,1]=4 3674 B10R0.108 CCCC(=O)CSC(C)OC 62a_100009879195_100000747444 [1,1,0,0,0,0|1,0,1]=4 3675 B10R0.108 CCCC(=O)NC[C@@H](C)OC 11a_100020591295_100000211992 [1,1,0,0,0,0|1,0,1]=4 3676 B10R0.108 CCCC(=O)NC[C@@H](C)OC 1626a_100020591295_100000211992 [1,1,0,0,0,0|1,0,1]=4 3677 B10R0.108 CCCC(=O)NC[C@@H](C)OC 240690a_100020591295_100000211992 [1,1,0,0,0,0|1,0,1]=4 3678 B10R0.108 CCCC(=O)NC[C@@H](C)OC 527a_100020591295_100000211992 [1,1,0,0,0,0|1,0,1]=4 3679 B10R0.108 CCCC(C)CCC(C)NC 270004a_106832991635_200011216527 [1,1,0,0,0,0|1,0,0]=3 3680 B10R0.108 CCCC(C)CNC(C)CC 2230a_100000209981_100011216630 [1,1,0,0,0,0|2,0,0]=4 3681 B10R0.108 CCCC(C)CNC(C)CC 270004a_100000209981_100000243154 [1,1,0,0,0,0|2,0,0]=4 3682 B10R0.108 CCCC(C)COC(C)CC 34a_100000688023_100011215416 [1,1,0,0,0,0|2,0,0]=4 3683 B10R0.108 CCCC(C)COC(C)CC 7a_100000210228_100011216630 [1,1,0,0,0,0|2,0,0]=4 3684 B10R0.108 CCCC(C)COC(C)CC 7a_100000688023_100000758301 [1,1,0,0,0,0|2,0,0]=4 3685 B10R0.108 CCCC(C)CSC(C)CC 62a_100000758301_100011216630 [1,1,0,0,0,0|2,0,0]=4 3686 B10R0.108 CCCC(C)CSC(C)CC 62a_100011216630_100000758301 [1,1,0,0,0,0|2,0,0]=4 3687 B10R0.108 CCCC(C)CSC(C)OC 62a_100009879195_100011216630 [1,1,0,0,0,0|1,0,0]=3 3688 B10R0.108 CCCC(C)CSC(C)OC 62a_100011216630_100009879195 [1,1,0,0,0,0|1,0,0]=3 3689 B10R0.108 CCCC(C)NCC(C)CC 2230a_100000741246_100000748023 [1,1,0,0,0,0|2,0,0]=4 3690 B10R0.108 CCCC(C)NCC(C)CC 2230a_100020588543_100000766640 [1,1,0,0,0,0|2,0,0]=4 3691 B10R0.108 CCCC(C)NCC(C)CC 270004a_100000741246_100000243153 [1,1,0,0,0,0|2,0,0]=4 3692 B10R0.108 CCCC(C)NCC(C)CC 270004a_100020588543_100000211909 [1,1,0,0,0,0|2,0,0]=4 3693 B10R0.108 CCCC(C)NCC(O)CC 2230a_100000741246_100011218378 [1,1,0,0,0,0|2,0,0]=4 3694 B10R0.108 CCCC(C)NCC(O)CC 2230a_100011218483_100000766640 [1,1,0,0,0,0|2,0,0]=4 3695 B10R0.108 CCCC(C)NCC(O)CC 270004a_100011218483_100000211909 [1,1,0,0,0,0|2,0,0]=4 3696 B10R0.108 CCCC(C)NC[C@@H](C)CC 2230a_100000741246_100009816398 [1,1,0,0,0,0|2,0,0]=4 3697 B10R0.108 CCCC(C)NC[C@@H](C)OC 2230a_100020591295_100000766640 [1,1,0,0,0,0|1,0,0]=3 3698 B10R0.108 CCCC(C)NC[C@@H](C)OC 270004a_100020591295_100000211909 [1,1,0,0,0,0|1,0,0]=3 3699 B10R0.108 CCCC(C)OCC(C)CC 34a_100000764384_100000748023 [1,1,0,0,0,0|2,0,0]=4 3700 B10R0.108 CCCC(C)OCC(C)CC 7a_100000764384_100000748023 [1,1,0,0,0,0|2,0,0]=4 3701 B10R0.108 CCCC(C)OCC(C)OC 34a_100000690652_100000766640 [1,1,0,0,0,0|1,0,0]=3 3702 B10R0.108 CCCC(C)OCC(O)CC 34a_100000764384_100011218378 [1,1,0,0,0,0|2,0,0]=4 3703 B10R0.108 CCCC(C)OCC(O)CC 7a_100000764384_100011218378 [1,1,0,0,0,0|2,0,0]=4 3704 B10R0.108 CCCC(C)OC[C@@H](C)CC 34a_100000764384_100009816398 [1,1,0,0,0,0|2,0,0]=4 3705 B10R0.108 CCCC(C)OC[C@@H](C)CC 7a_100000764384_100009816398 [1,1,0,0,0,0|2,0,0]=4 3706 B10R0.108 CCCC(C)OC[C@@H](C)CC 7a_100009816381_100000766640 [1,1,0,0,0,0|2,0,0]=4 3707 B10R0.108 CCCC(C)SCC(C)CC 62a_100000748023_100000766640 [1,1,0,0,0,0|2,0,0]=4 3708 B10R0.108 CCCC(C)SCC(C)CC 62a_100000766640_100000748023 [1,1,0,0,0,0|2,0,0]=4 3709 B10R0.108 CCCC(C)SCC(O)CC 62a_100000766640_100011218378 [1,1,0,0,0,0|2,0,0]=4 3710 B10R0.108 CCCC(C)SCC(O)CC 62a_100011218378_100000766640 [1,1,0,0,0,0|2,0,0]=4 3711 B10R0.108 CCCC(C)SC[C@@H](C)CC 62a_100000766640_100009816398 [1,1,0,0,0,0|2,0,0]=4 3712 B10R0.108 CCCC(C)SC[C@@H](C)CC 62a_100009816398_100000766640 [1,1,0,0,0,0|2,0,0]=4 3713 B10R0.108 CCC[C@H](N)COC(C)CC 34a_100000732646_100011215416 [1,1,0,0,0,0|2,0,0]=4 3714 B10R0.108 CCOC(=O)CCC(C)OC 34a_100138415774_100000748298 [1,1,0,0,0,0|1,0,1]=4 3715 B10R0.108 CCOC(C)CCC(C)CC 7a_200011216552_100000210202 [1,1,0,0,0,0|2,0,0]=4 3716 B10R0.108 COC(C)COC(C)CCO 34a_100000690652_100009893172 [1,1,0,0,0,0|2,0,0]=4 3717 B10R0.108 COCC(C)NC[C@@H](C)OC 2230a_100020591295_100000765312 [1,1,0,0,0,0|2,0,0]=4 3718 B10R0.108 COCC(C)NC[C@@H](C)OC 270004a_100020591295_100000749346 [1,1,0,0,0,0|2,0,0]=4 3719 B10R0.108 COCC(C)OCC(C)OC 34a_100000690652_100000765312 [1,1,0,0,0,0|2,0,0]=4 3720 B10R0.108 COCC(C)OCC(C)OC 34a_200011930013_200000210301 [1,1,0,0,0,0|2,0,0]=4 3721 B10R0.108 COCC(C)OCC(C)OC 7a_200011930013_200000210301 [1,1,0,0,0,0|2,0,0]=4 3722 B10R0.108 COCC(C)OCC(C)O[13CH3] 34a_200011930013_200025704644 [1,1,0,0,0,0|2,0,0]=4 3723 B10R0.108 COCC(C)OCC(C)O[13CH3] 7a_200011930013_200025704644 [1,1,0,0,0,0|2,0,0]=4 3724 B10R0.108 COCC(O)CSC(C)OC 62a_100009879195_100011215053 [1,1,0,0,0,0|2,0,0]=4 3725 B10R0.108 COCC(O)CSC(C)OC 62a_100011215053_100009879195 [1,1,0,0,0,0|2,0,0]=4 3726 B10R0.108 CO[C@H](C)CNC(C)CCO 2230a_100020591295_100009893172 [1,1,0,0,0,0|2,0,0]=4 3727 B10R0.108 CO[C@H](C)CNC(C)CSC 270004a_100020591295_100011216314 [1,1,0,0,0,0|2,0,0]=4 3728 B10R0.21 CCCCC(=O)C(CC)OC 1458a_100000747056_100000210211 [1,1,0,0,0,0|1,0,1]=4 3729 B10R0.21 CCCCC(=O)C(OC)OC 1458a_100000046285_100000210211 [1,1,0,0,0,0|0,0,1]=3 3730 B10R0.21 CCCNC(=O)C(OC)OC 11a_100020643023_100000046285 [1,1,0,0,0,0|1,0,1]=4 3731 B10R0.21 CCCNC(=O)C(OC)OC 240690a_100020643023_100000046285 [1,1,0,0,0,0|1,0,1]=4 3732 B10R0.21 CCCNC(=O)C(OC)OC 527a_100020643023_100000046285 [1,1,0,0,0,0|1,0,1]=4 3733 B10R0.21 CCCNC(C)C(OC)OC 270004a_100020643023_100000211384 [1,1,0,0,0,0|1,0,0]=3 3734 B10R0.21 CCCOC(C)C(OC)OC 34a_100000210258_100011222894 [1,1,0,0,0,0|1,0,0]=3 3735 B10R0.21 CCCOC(C)C(OC)OC 34a_100000754440_100000210303 [1,1,0,0,0,0|1,0,0]=3 3736 B10R0.21 CCCOC(C)C(OC)OC 7a_100000754440_100000210303 [1,1,0,0,0,0|1,0,0]=3 3737 B10R0.21 CCCSC(C)C(OC)OC 62a_100000210303_100011222894 [1,1,0,0,0,0|1,0,0]=3 3738 B10R0.21 CCCSC(C)C(OC)OC 62a_100011222894_100000210303 [1,1,0,0,0,0|1,0,0]=3 3739 B10R0.21 COC(OC)C(=O)CCCF 1458a_100000046285_100011934791 [1,1,0,0,0,0|1,0,1]=4 3740 B10R0.21 COC(OC)C(=O)CCCO 1458a_100000046285_100011215043 [1,1,0,0,0,0|1,0,1]=4 3741 B10R0.21 COC(OC)C(=O)CCSC 1458a_100000046285_100000751147 [1,1,0,0,0,0|1,0,1]=4 3742 B10R0.21 COC(OC)C(C)NCCF 34a_100000724931_100011222894 [1,1,0,0,0,0|2,0,0]=4 3743 B10R0.21 COC(OC)C(C)NCCO 270004a_100000210304_100000211384 [1,1,0,0,0,0|2,0,0]=4 3744 B10R0.21 COC(OC)C(C)NCCO 34a_100016990907_100011222894 [1,1,0,0,0,0|2,0,0]=4 3745 B10R0.21 COC(OC)C(C)OCCBr 34a_100000211926_100011222894 [1,1,0,0,0,0|2,0,0]=4 3746 B10R0.21 COC(OC)C(C)OCCF 34a_100000754440_100011217306 [1,1,0,0,0,0|2,0,0]=4 3747 B10R0.21 COC(OC)C(C)OCCF 7a_100000754440_100011217306 [1,1,0,0,0,0|2,0,0]=4 3748 B10R0.21 COC(OC)C(C)OCCN 34a_100000210304_100011222894 [1,1,0,0,0,0|2,0,0]=4 3749 B10R0.21 COC(OC)C(C)OCCO 34a_100000754440_100000211926 [1,1,0,0,0,0|2,0,0]=4 3750 B10R0.21 COC(OC)C(C)OCCO 7a_100000754440_100000211926 [1,1,0,0,0,0|2,0,0]=4 3751 B10R0.21 COC(OC)C(C)OCSC 34a_100000754440_100011218213 [1,1,0,0,0,0|2,0,0]=4 3752 B10R0.21 COC(OC)C(C)SCCF 62a_100011217306_100011222894 [1,1,0,0,0,0|2,0,0]=4 3753 B10R0.21 COC(OC)C(C)SCCF 62a_100011222894_100011217306 [1,1,0,0,0,0|2,0,0]=4 3754 B10R0.21 COC(OC)C(C)SCCO 62a_100000211926_100011222894 [1,1,0,0,0,0|2,0,0]=4 3755 B10R0.21 COC(OC)C(C)SCCO 62a_100011222894_100000211926 [1,1,0,0,0,0|2,0,0]=4 3756 B10R0.21 COC(OC)C(C)SCSC 62a_100011218213_100011222894 [1,1,0,0,0,0|2,0,0]=4 3757 B10R0.21 COC(OC)C(C)SCSC 62a_100011222894_100011218213 [1,1,0,0,0,0|2,0,0]=4 3758 B10R0.21 COCCC(=O)C(OC)OC 1458a_100000046285_100000233755 [1,1,0,0,0,0|1,0,1]=4 3759 B10R0.21 COCSC(C)C(OC)OC 62a_100000766300_100011222894 [1,1,0,0,0,0|2,0,0]=4 3760 B10R0.21 COCSC(C)C(OC)OC 62a_100011222894_100000766300 [1,1,0,0,0,0|2,0,0]=4 3761 B10R0.24 C#CC(CCCCC)OCC 34a_100011216489_100000210202 [1,1,0,0,0,0|1,0,1]=4 3762 B10R0.24 C#CC(CCCCC)OCC 7a_100011216489_100000210202 [1,1,0,0,0,0|1,0,1]=4 3763 B10R0.24 C#CC(CCCCC)OCF 34a_100011216489_100015361967 [1,1,0,0,0,0|1,0,1]=4 3764 B10R0.24 C#CC(CCCCC)OCF 7a_100011216489_100015361967 [1,1,0,0,0,0|1,0,1]=4 3765 B10R0.24 C=CC(CCCCC)OCC 34a_100011216863_100000210202 [1,1,0,0,0,0|1,0,1]=4 3766 B10R0.24 C=CC(CCCCC)OCC 7a_100011216863_100000210202 [1,1,0,0,0,0|1,0,1]=4 3767 B10R0.24 C=CC(CCCCC)OCF 34a_100011216863_100015361967 [1,1,0,0,0,0|1,0,1]=4 3768 B10R0.24 C=CC(CCCCC)OCF 7a_100011216863_100015361967 [1,1,0,0,0,0|1,0,1]=4 3769 B10R0.24 C=CCC(CCCCC)OC 34a_200011216309_200000210301 [1,1,0,0,0,0|1,0,1]=4 3770 B10R0.24 C=CCC(CCCCC)OC 7a_200011216309_200000210301 [1,1,0,0,0,0|1,0,1]=4 3771 B10R0.24 C=CCC(CCCCC)O[13CH3] 34a_200011216309_200025704644 [1,1,0,0,0,0|1,0,1]=4 3772 B10R0.24 C=CCC(CCCCC)O[13CH3] 7a_200011216309_200025704644 [1,1,0,0,0,0|1,0,1]=4 3773 B10R0.24 CCCCCC(CC)NCC 270004a_100015525214_100011215316 [1,1,0,0,0,0|2,0,0]=4 3774 B10R0.24 CCCCCC(CC)OCC 34a_100011215405_100000210202 [1,1,0,0,0,0|1,0,0]=3 3775 B10R0.24 CCCCCC(CC)OCC 7a_100011215405_100000210202 [1,1,0,0,0,0|1,0,0]=3 3776 B10R0.24 CCCCCC(CC)OCF 34a_100011215405_100015361967 [1,1,0,0,0,0|1,0,0]=3 3777 B10R0.24 CCCCCC(CC)OCF 7a_100011215405_100015361967 [1,1,0,0,0,0|1,0,0]=3 3778 B10R0.24 CCCCCC(CCC)NC 270004a_106832991635_200011216343 [1,1,0,0,0,0|2,0,0]=4 3779 B10R0.24 CCCCCC(CCC)OC 34a_200011215058_200000210301 [1,1,0,0,0,0|1,0,0]=3 3780 B10R0.24 CCCCCC(CCC)OC 7a_200011215058_200000210301 [1,1,0,0,0,0|1,0,0]=3 3781 B10R0.24 CCCCCC(CCC)O[13CH3] 34a_200011215058_200025704644 [1,1,0,0,0,0|1,0,0]=3 3782 B10R0.24 CCCCCC(CCC)O[13CH3] 7a_200011215058_200025704644 [1,1,0,0,0,0|1,0,0]=3 3783 B10R0.24 CCCCNC(CC)COC 2230a_100000757820_100000210211 [1,1,0,0,0,0|2,0,0]=4 3784 B10R0.24 CCCCNC(CC)COC 270004a_100000102301_100000757811 [1,1,0,0,0,0|2,0,0]=4 3785 B10R0.24 CCCCOC(CC)COC 7a_200011214946_100000210211 [1,1,0,0,0,0|2,0,0]=4 3786 B10R0.24 CCCNCC(CC)OCC 2230a_100015183923_100000210303 [1,1,0,0,0,0|2,0,0]=4 3787 B10R0.24 CCCNCC(CC)OCC 34a_100015183923_100000210303 [1,1,0,0,0,0|2,0,0]=4 3788 B10R0.34 CCCC(=O)CC(OC)OC 1458a_100000082724_100000210303 [1,1,0,0,0,0|0,0,1]=3 3789 B10R0.34 CCCC(=O)CC(OC)OC 1458a_100000211992_100000751394 [1,1,0,0,0,0|0,0,1]=3 3790 B10R0.34 CCCN(C)CC(OC)OC 2230a_100000747261_100000751394 [1,1,0,0,0,0|1,0,0]=3 3791 B10R0.34 CCCN(C)CC(OC)OC 269982a_100000225562_100000210303 [1,1,0,0,0,0|1,0,0]=3 3792 B10R0.34 CCCN(C)CC(OC)OC 270004a_100000747261_100000752162 [1,1,0,0,0,0|1,0,0]=3 3793 B10R0.34 CCNC(=O)CC(OC)OC 11a_100015525214_100000082724 [1,1,0,0,0,0|1,0,1]=4 3794 B10R0.34 CCNC(=O)CC(OC)OC 240690a_100015525214_100000082724 [1,1,0,0,0,0|1,0,1]=4 3795 B10R0.34 CCNC(=O)CC(OC)OC 527a_100015525214_100000082724 [1,1,0,0,0,0|1,0,1]=4 3796 B10R0.34 CCNC(C)CC(OC)OC 270004a_100015525214_100000210484 [1,1,0,0,0,0|1,0,0]=3 3797 B10R0.34 CCOC(C)CC(OC)OC 7a_100011018202_100000210202 [1,1,0,0,0,0|1,0,0]=3 3798 B10R0.34 COC(CC(=O)CCF)OC 1458a_100000082724_100011217306 [1,1,0,0,0,0|1,0,1]=4 3799 B10R0.34 COC(CC(=O)CCO)OC 1458a_100000082724_100000211926 [1,1,0,0,0,0|1,0,1]=4 3800 B10R0.34 COC(CC(=O)CCO)OC 1458a_100011216618_100000751394 [1,1,0,0,0,0|1,0,1]=4 3801 B10R0.34 COC(CC(=O)CSC)OC 1458a_100000184570_100000751394 [1,1,0,0,0,0|1,0,1]=4 3802 B10R0.34 COC(CC(C)OCF)OC 7a_100011018202_100015361967 [1,1,0,0,0,0|2,0,0]=4 3803 B10R0.34 COC(CN(C)CCF)OC 269982a_100000225562_100011217306 [1,1,0,0,0,0|2,0,0]=4 3804 B10R0.34 COC(CN(C)CCO)OC 2230a_100000210263_100000751394 [1,1,0,0,0,0|2,0,0]=4 3805 B10R0.34 COC(CN(C)CCO)OC 269982a_100000225562_100000211926 [1,1,0,0,0,0|2,0,0]=4 3806 B10R0.34 COC(CN(C)CCO)OC 270004a_100000210263_100000752162 [1,1,0,0,0,0|2,0,0]=4 3807 B10R0.34 COC(CN(C)CSC)OC 269982a_100000225562_100011218213 [1,1,0,0,0,0|2,0,0]=4 3808 B10R0.34 COCC(=O)CC(OC)OC 1458a_100000210968_100000751394 [1,1,0,0,0,0|1,0,1]=4 3809 B10R0.34 COCN(C)CC(OC)OC 269982a_100000225562_100000766300 [1,1,0,0,0,0|2,0,0]=4 3810 B10R0.45 CCC(=O)CCC(OC)OC 1458a_100000210414_100000139399 [1,1,0,0,0,0|0,0,1]=3 3811 B10R0.45 CCC(=O)CCC(OC)OC 1458a_200000082759_100000210202 [1,1,0,0,0,0|0,0,1]=3 3812 B10R0.45 CCC(=O)NCC(OC)OC 11a_100000210479_100000210414 [1,1,0,0,0,0|1,0,1]=4 3813 B10R0.45 CCC(=O)NCC(OC)OC 1626a_100000210479_100000210414 [1,1,0,0,0,0|1,0,1]=4 3814 B10R0.45 CCC(=O)NCC(OC)OC 240690a_100000210479_100000210414 [1,1,0,0,0,0|1,0,1]=4 3815 B10R0.45 CCC(=O)NCC(OC)OC 527a_100000210479_100000210414 [1,1,0,0,0,0|1,0,1]=4 3816 B10R0.45 CCC(C)NCC(OC)OC 2230a_100000209981_100000751394 [1,1,0,0,0,0|1,0,0]=3 3817 B10R0.45 CCC(C)NCC(OC)OC 270004a_100000209981_100000752162 [1,1,0,0,0,0|1,0,0]=3 3818 B10R0.45 CCC(C)OCC(CC)OC 34a_100011934954_100011215416 [1,1,0,0,0,0|2,0,0]=4 3819 B10R0.45 CCC(C)OCC(CC)OC 7a_100011934954_100000758301 [1,1,0,0,0,0|2,0,0]=4 3820 B10R0.45 CCC(C)OCC(OC)OC 34a_100011216393_100011215416 [1,1,0,0,0,0|1,0,0]=3 3821 B10R0.45 CCC(C)OCC(OC)OC 7a_100000210228_100000751394 [1,1,0,0,0,0|1,0,0]=3 3822 B10R0.45 CCC(C)SCC(OC)OC 62a_100000751394_100000758301 [1,1,0,0,0,0|1,0,0]=3 3823 B10R0.45 CCC(C)SCC(OC)OC 62a_100000758301_100000751394 [1,1,0,0,0,0|1,0,0]=3 3824 B10R0.45 CCN(C)CCC(OC)OC 2230a_100000225621_100009813347 [1,1,0,0,0,0|1,0,0]=3 3825 B10R0.45 CCN(C)CCC(OC)OC 269982a_100000225621_100000139399 [1,1,0,0,0,0|1,0,0]=3 3826 B10R0.45 CNC(=O)CCC(OC)OC 11a_106832991635_200000082759 [1,1,0,0,0,0|1,0,1]=4 3827 B10R0.45 CNC(=O)CCC(OC)OC 1626a_100102657272_200000082759 [1,1,0,0,0,0|1,0,1]=4 3828 B10R0.45 CNC(=O)CCC(OC)OC 240690a_100102657272_200000082759 [1,1,0,0,0,0|1,0,1]=4 3829 B10R0.45 CNC(=O)CCC(OC)OC 527a_100102657272_200000082759 [1,1,0,0,0,0|1,0,1]=4 3830 B10R0.45 COC(CCC(=O)CF)OC 1458a_200000082759_100015361967 [1,1,0,0,0,0|1,0,1]=4 3831 B10R0.45 COC(CCC(=O)CO)OC 1458a_100000210174_100000139399 [1,1,0,0,0,0|1,0,1]=4 3832 B10R0.45 COC(CN[C@H](C)CF)OC 270004a_100102880703_100000752162 [1,1,0,0,0,0|2,0,0]=4 3833 B10R0.45 COC(CN[C@H](C)CO)OC 2230a_100000737577_100000751394 [1,1,0,0,0,0|2,0,0]=4 3834 B10R0.45 COC(CN[C@H](C)CO)OC 270004a_100000737577_100000752162 [1,1,0,0,0,0|2,0,0]=4 3835 B10R0.45 COC(COC(C)CF)OC 34a_100016041109_100000211822 [1,1,0,0,0,0|2,0,0]=4 3836 B10R0.45 COC(COC(C)CF)OC 7a_100016041109_100000751394 [1,1,0,0,0,0|2,0,0]=4 3837 B10R0.45 COC(COC(C)CN)OC 34a_100000210904_100000211822 [1,1,0,0,0,0|2,0,0]=4 3838 B10R0.45 COC(COC(C)CO)OC 34a_100011216393_100012180447 [1,1,0,0,0,0|2,0,0]=4 3839 B10R0.45 COC(CSC(C)CO)OC 62a_100012180447_100000751394 [1,1,0,0,0,0|2,0,0]=4 3840 B10R0.45 COC(CSC(C)OC)OC 62a_100000751394_100009879195 [1,1,0,0,0,0|2,0,0]=4 3841 B10R0.45 COC(CSC(C)OC)OC 62a_100009879195_100000751394 [1,1,0,0,0,0|2,0,0]=4 3842 B10R0.45 COC(CS[C@H](C)CO)OC 62a_100000751394_100016084084 [1,1,0,0,0,0|2,0,0]=4 3843 B10R0.45 COC(CS[C@H](C)CO)OC 62a_100016084084_100000751394 [1,1,0,0,0,0|2,0,0]=4 3844 B10R0.77 C=C(C)COCC(OC)OC 34a_100000210245_100000211822 [1,1,0,0,0,0|1,0,1]=4 3845 B10R0.77 C=C(C)COCC(OC)OC 34a_100011216393_100000748629 [1,1,0,0,0,0|1,0,1]=4 3846 B10R0.77 C=C(C)CSCC(OC)OC 62a_100000748629_100000751394 [1,1,0,0,0,0|1,0,1]=4 3847 B10R0.77 C=C(C)CSCC(OC)OC 62a_100000751394_100000211660 [1,1,0,0,0,0|1,0,1]=4 3848 B10R0.77 CCC(CNCC(C)C)OC 270004a_100000731041_100000210432 [1,1,0,0,0,0|2,0,0]=4 3849 B10R0.77 CCC(COCC(C)C)OC 34a_100011934954_100000210624 [1,1,0,0,0,0|2,0,0]=4 3850 B10R0.77 CCC(COCC(C)C)OC 7a_100011934954_100000210760 [1,1,0,0,0,0|2,0,0]=4 3851 B10R0.77 CCC(COCC(C)O)OC 34a_100011934954_100011218427 [1,1,0,0,0,0|2,0,0]=4 3852 B10R0.77 CCC(COCC(C)O)OC 7a_100011934954_100011218427 [1,1,0,0,0,0|2,0,0]=4 3853 B10R0.77 CCC(COC[C@@H](C)O)OC 34a_100011934954_100009817552 [1,1,0,0,0,0|2,0,0]=4 3854 B10R0.77 CCC(COC[C@@H](C)O)OC 7a_100011934954_100009817552 [1,1,0,0,0,0|2,0,0]=4 3855 B10R0.77 COC(CCCC(=O)C)OC 1458a_100000070787_100000069011 [1,1,0,0,0,0|0,0,1]=3 3856 B10R0.77 COC(CCCN(C)C)OC 2230a_100102631434_100000069011 [1,1,0,0,0,0|1,0,0]=3 3857 B10R0.77 COC(CCCN(C)C)OC 269982a_100102631434_100000069011 [1,1,0,0,0,0|1,0,0]=3 3858 B10R0.77 COC(CCNC(C)C)OC 2230a_100138425928_100009813347 [1,1,0,0,0,0|1,0,0]=3 3859 B10R0.77 COC(CCNC(C)C)OC 34a_100138425928_100000139399 [1,1,0,0,0,0|1,0,0]=3 3860 B10R0.77 COC(CCOC(C)C)OC 34a_100000212225_100000139399 [1,1,0,0,0,0|1,0,0]=3 3861 B10R0.77 COC(CCSC(C)C)OC 62a_100000139399_100000210206 [1,1,0,0,0,0|1,0,0]=3 3862 B10R0.77 COC(CCSC(C)C)OC 62a_100000210206_100000139399 [1,1,0,0,0,0|1,0,0]=3 3863 B10R0.77 COC(CNCC(C)C)OC 2230a_100000210953_100000751394 [1,1,0,0,0,0|1,0,0]=3 3864 B10R0.77 COC(CNCC(C)C)OC 270004a_100000210479_100000210432 [1,1,0,0,0,0|1,0,0]=3 3865 B10R0.77 COC(CNCC(C)C)OC 270004a_100000210953_100000752162 [1,1,0,0,0,0|1,0,0]=3 3866 B10R0.77 COC(CNCC(C)C)OC 34a_100000210953_100000211822 [1,1,0,0,0,0|1,0,0]=3 3867 B10R0.77 COC(CNCC(C)O)OC 2230a_100000210904_100000751394 [1,1,0,0,0,0|1,0,0]=3 3868 B10R0.77 COC(CNCC(C)O)OC 270004a_100000210904_100000752162 [1,1,0,0,0,0|1,0,0]=3 3869 B10R0.77 COC(CNCC(C)O)OC 34a_100000210904_100000211822 [1,1,0,0,0,0|1,0,0]=3 3870 B10R0.77 COC(CNCC(F)F)OC 270004a_100000765723_100000752162 [1,1,0,0,0,0|2,0,0]=4 3871 B10R0.77 COC(CNCC(F)F)OC 34a_100000765723_100000211822 [1,1,0,0,0,0|2,0,0]=4 3872 B10R0.77 COC(COCC(=O)C)OC 34a_100000211253_100000211822 [1,1,0,0,0,0|1,0,1]=4 3873 B10R0.77 COC(COCC(C)Br)OC 34a_100012180447_100000211822 [1,1,0,0,0,0|1,0,0]=3 3874 B10R0.77 COC(COCC(C)C)OC 34a_100000210257_100000211822 [1,1,0,0,0,0|1,0,0]=3 3875 B10R0.77 COC(COCC(C)C)OC 34a_100011216393_100000210624 [1,1,0,0,0,0|1,0,0]=3 3876 B10R0.77 COC(COCC(C)F)OC 34a_100015925927_100000211822 [1,1,0,0,0,0|1,0,0]=3 3877 B10R0.77 COC(COCC(C)O)OC 34a_100011216393_100011218427 [1,1,0,0,0,0|1,0,0]=3 3878 B10R0.77 COC(COCC(F)F)OC 34a_100000743014_100000211822 [1,1,0,0,0,0|2,0,0]=4 3879 B10R0.77 COC(COCC(F)F)OC 34a_100011216393_100011934356 [1,1,0,0,0,0|2,0,0]=4 3880 B10R0.77 COC(COC[C@@H](C)Cl)OC 34a_100016084084_100000211822 [1,1,0,0,0,0|1,0,0]=3 3881 B10R0.77 COC(COC[C@@H](C)N)OC 34a_100000737577_100000211822 [1,1,0,0,0,0|1,0,0]=3 3882 B10R0.77 COC(COC[C@@H](C)O)OC 34a_100011216393_100009817552 [1,1,0,0,0,0|1,0,0]=3 3883 B10R0.77 COC(CSCC(C)C)OC 62a_100000210624_100000751394 [1,1,0,0,0,0|1,0,0]=3 3884 B10R0.77 COC(CSCC(C)C)OC 62a_100000751394_100000210760 [1,1,0,0,0,0|1,0,0]=3 3885 B10R0.77 COC(CSCC(C)O)OC 62a_100000751394_100011218427 [1,1,0,0,0,0|1,0,0]=3 3886 B10R0.77 COC(CSCC(C)O)OC 62a_100011218427_100000751394 [1,1,0,0,0,0|1,0,0]=3 3887 B10R0.77 COC(CSCC(F)F)OC 62a_100000751394_100011934356 [1,1,0,0,0,0|2,0,0]=4 3888 B10R0.77 COC(CSCC(F)F)OC 62a_100011934356_100000751394 [1,1,0,0,0,0|2,0,0]=4 3889 B10R0.77 COC(CSC[C@@H](C)O)OC 62a_100000751394_100009817552 [1,1,0,0,0,0|1,0,0]=3 3890 B10R0.77 COC(CSC[C@@H](C)O)OC 62a_100009817552_100000751394 [1,1,0,0,0,0|1,0,0]=3 3891 B10R0.86 CCCCCC(CC)C(=O)C 1458a_100000697129_200000210301 [1,1,0,0,0,0|2,0,0]=4 3892 B10R0.86 CCCCCC(CC)C(=O)[13CH3] 1458a_100000697129_200025704644 [1,1,0,0,0,0|2,0,0]=4 3893 B10R0.86 CCCCCC(CC)N(C)C 270004a_100102631434_100011215316 [1,1,0,0,0,0|2,0,0]=4 3894 B10R0.86 CCCCCC(OC)C(C)C 34a_200011216997_200000210301 [1,1,0,0,0,0|1,0,0]=3 3895 B10R0.86 CCCCCC(OC)C(C)C 7a_200011216997_200000210301 [1,1,0,0,0,0|1,0,0]=3 3896 B10R0.86 CCCCCC(O[13CH3])C(C)C 34a_200011216997_200025704644 [1,1,0,0,0,0|1,0,0]=3 3897 B10R0.86 CCCCCC(O[13CH3])C(C)C 7a_200011216997_200025704644 [1,1,0,0,0,0|1,0,0]=3 3898 B10R0.157 CCCNCC(C)(OC)OC 2230a_100000732740_100000210303 [1,1,0,0,0,0|1,0,0]=3 3899 B10R0.157 CCCOCC(C)(OC)OC 34a_100000210258_100000766008 [1,1,0,0,0,0|1,0,0]=3 3900 B10R0.157 CCCOCP(=O)(OC)OC 34a_100000101693_100000210303 [1,1,0,0,0,0|2,0,0]=4 3901 B10R0.157 CCCSCC(C)(OC)OC 62a_100000210303_100000766008 [1,1,0,0,0,0|1,0,0]=3 3902 B10R0.157 CCCSCC(C)(OC)OC 62a_100000766008_100000210303 [1,1,0,0,0,0|1,0,0]=3 3903 B10R0.157 CCCSC[Si](C)(OC)OC 62a_100000067953_100000210303 [1,1,0,0,0,0|1,1,0]=4 3904 B10R0.157 CCCSC[Si](C)(OC)OC 62a_100000210303_100000067953 [1,1,0,0,0,0|1,1,0]=4 3905 B10R0.157 CCOCCP(=O)(OC)OC 34a_200000043213_100000210202 [1,1,0,0,0,0|2,0,0]=4 3906 B10R0.157 CNCCC[Si](C)(OC)OC 34a_100102657272_100000031653 [1,1,0,0,0,0|1,1,0]=4 3907 B10R0.157 CNCCC[Si](C)(OC)OC 7a_106832991635_100000031653 [1,1,0,0,0,0|1,1,0]=4 3908 B10R0.157 COC(C)(CNCCF)OC 2230a_100000732740_100011217306 [1,1,0,0,0,0|2,0,0]=4 3909 B10R0.157 COC(C)(CNCCF)OC 34a_100000724931_100000766008 [1,1,0,0,0,0|2,0,0]=4 3910 B10R0.157 COC(C)(CNCCO)OC 2230a_100000732740_100000211926 [1,1,0,0,0,0|2,0,0]=4 3911 B10R0.157 COC(C)(CNCCO)OC 2230a_100016997473_100000064154 [1,1,0,0,0,0|2,0,0]=4 3912 B10R0.157 COC(C)(CNCCO)OC 34a_100016990907_100000766008 [1,1,0,0,0,0|2,0,0]=4 3913 B10R0.157 COC(C)(CNCSC)OC 2230a_100000732740_100011218213 [1,1,0,0,0,0|2,0,0]=4 3914 B10R0.157 COC(C)(COCCBr)OC 34a_100000211926_100000766008 [1,1,0,0,0,0|2,0,0]=4 3915 B10R0.157 COC(C)(COCCN)OC 34a_100000210304_100000766008 [1,1,0,0,0,0|2,0,0]=4 3916 B10R0.157 COC(C)(CSCCF)OC 62a_100000766008_100011217306 [1,1,0,0,0,0|2,0,0]=4 3917 B10R0.157 COC(C)(CSCCF)OC 62a_100011217306_100000766008 [1,1,0,0,0,0|2,0,0]=4 3918 B10R0.157 COC(C)(CSCCO)OC 62a_100000211926_100000766008 [1,1,0,0,0,0|2,0,0]=4 3919 B10R0.157 COC(C)(CSCCO)OC 62a_100000766008_100000211926 [1,1,0,0,0,0|2,0,0]=4 3920 B10R0.157 COC(C)(CSCSC)OC 62a_100000766008_100011218213 [1,1,0,0,0,0|2,0,0]=4 3921 B10R0.157 COC(C)(CSCSC)OC 62a_100011218213_100000766008 [1,1,0,0,0,0|2,0,0]=4 3922 B10R0.157 COCCC[Si](C)(OC)OC 34a_100138415774_100000031653 [1,1,0,0,0,0|1,1,0]=4 3923 B10R0.157 COCNCC(C)(OC)OC 2230a_100000732740_100000766300 [1,1,0,0,0,0|2,0,0]=4 3924 B10R0.157 COCSCC(C)(OC)OC 62a_100000766008_100000766300 [1,1,0,0,0,0|2,0,0]=4 3925 B10R0.157 COCSCC(C)(OC)OC 62a_100000766300_100000766008 [1,1,0,0,0,0|2,0,0]=4 3926 B10R0.157 CO[Si](C)(CCCSC)OC 62a_100000031653_200000210301 [1,1,0,0,0,0|1,1,0]=4 3927 B10R0.157 CO[Si](C)(CCCSC)OC 62a_200000210301_100000031653 [1,1,0,0,0,0|1,1,0]=4 3928 B10R0.157 CO[Si](C)(CCCS[13CH3])OC 62a_100000031653_200025704644 [1,1,0,0,0,0|1,1,0]=4 3929 B10R0.157 CO[Si](C)(CCCS[13CH3])OC 62a_200025704644_100000031653 [1,1,0,0,0,0|1,1,0]=4 3930 B12R0.33 C=C(C)CC(=O)CCC(OC)OC 1458a_200000082759_100000748629 [0,2,0,0,0,0|0,0,2]=4 3931 B12R0.33 C=C(C)CN(C)CCC(OC)OC 2230a_100000225649_100009813347 [0,2,0,0,0,0|1,0,1]=4 3932 B12R0.33 C=C(C)CN(C)CCC(OC)OC 269982a_100000225649_100000139399 [0,2,0,0,0,0|1,0,1]=4 3933 B12R0.33 CCC(COC(C)CC(C)C)OC 34a_100011934954_100000731052 [0,2,0,0,0,0|2,0,0]=4 3934 B12R0.33 CCC(COC(C)CC(C)C)OC 7a_100011934954_100000731052 [0,2,0,0,0,0|2,0,0]=4 3935 B12R0.33 COC(CCC(=O)CC(C)C)OC 1458a_100000210554_100000139399 [0,2,0,0,0,0|0,0,1]=3 3936 B12R0.33 COC(CCC(=O)CC(C)C)OC 1458a_200000082759_100000210624 [0,2,0,0,0,0|0,0,1]=3 3937 B12R0.33 COC(CCC(=O)CC(C)O)OC 1458a_200000082759_100011218427 [0,2,0,0,0,0|0,0,1]=3 3938 B12R0.33 COC(CCC(=O)CC(F)F)OC 1458a_200000082759_100011934356 [0,2,0,0,0,0|1,0,1]=4 3939 B12R0.33 COC(CCC(=O)CN(C)C)OC 1458a_100000750896_100000139399 [0,2,0,0,0,0|1,0,1]=4 3940 B12R0.33 COC(CCC(=O)C[C@@H](C)O)OC 1458a_100011933948_100000139399 [0,2,0,0,0,0|0,0,1]=3 3941 B12R0.33 COC(CCC(=O)C[S+](C)C)OC 1458a_200159257847_100000139399 [0,2,0,0,0,0|1,0,1]=4 3942 B12R0.33 COC(CCC(=O)NC(C)C)OC 11a_100138425928_200000082759 [0,2,0,0,0,0|1,0,1]=4 3943 B12R0.33 COC(CCC(=O)NC(C)C)OC 1626a_100138425928_200000082759 [0,2,0,0,0,0|1,0,1]=4 3944 B12R0.33 COC(CCC(=O)NC(C)C)OC 240690a_100138425928_200000082759 [0,2,0,0,0,0|1,0,1]=4 3945 B12R0.33 COC(CCC(=O)NC(C)C)OC 527a_100138425928_200000082759 [0,2,0,0,0,0|1,0,1]=4 3946 B12R0.33 COC(CCN(C)CC(C)C)OC 2230a_100000747067_100009813347 [0,2,0,0,0,0|1,0,0]=3 3947 B12R0.33 COC(CCN(C)CC(C)C)OC 269982a_100000747067_100000139399 [0,2,0,0,0,0|1,0,0]=3 3948 B12R0.33 COC(CCN(C)CC(C)O)OC 2230a_100000227577_100009813347 [0,2,0,0,0,0|1,0,0]=3 3949 B12R0.33 COC(CCN(C)CC(C)O)OC 269982a_100000227577_100000139399 [0,2,0,0,0,0|1,0,0]=3 3950 B12R0.33 COC(CNC(=O)CC(C)C)OC 11a_100000210479_100000210554 [0,2,0,0,0,0|1,0,1]=4 3951 B12R0.33 COC(CNC(=O)CC(C)C)OC 1626a_100000210479_100000210554 [0,2,0,0,0,0|1,0,1]=4 3952 B12R0.33 COC(CNC(=O)CC(C)C)OC 240690a_100000210479_100000210554 [0,2,0,0,0,0|1,0,1]=4 3953 B12R0.33 COC(CNC(=O)CC(C)C)OC 527a_100000210479_100000210554 [0,2,0,0,0,0|1,0,1]=4 3954 B12R0.33 COC(CNC(=O)C[C@@H](C)O)OC 240690a_100000210479_100011933948 [0,2,0,0,0,0|1,0,1]=4 3955 B12R0.33 COC(CNC(C)CC(C)C)OC 2230a_100000692259_100000751394 [0,2,0,0,0,0|1,0,0]=3 3956 B12R0.33 COC(CNC(C)CC(C)C)OC 270004a_100000692259_100000752162 [0,2,0,0,0,0|1,0,0]=3 3957 B12R0.33 COC(COC(C)CC(C)C)OC 34a_100000211805_100000211822 [0,2,0,0,0,0|1,0,0]=3 3958 B12R0.33 COC(COC(C)CC(C)C)OC 34a_100011216393_100000731052 [0,2,0,0,0,0|1,0,0]=3 3959 B12R0.33 COC(COC(C)CC(C)C)OC 7a_100000211805_100000751394 [0,2,0,0,0,0|1,0,0]=3 3960 B12R0.33 COC(CSC(C)CC(C)C)OC 62a_100000731052_100000751394 [0,2,0,0,0,0|1,0,0]=3 3961 B12R0.33 COC(CSC(C)CC(C)C)OC 62a_100000751394_100000731052 [0,2,0,0,0,0|1,0,0]=3 3962 B12R0.33 COC(CSC(C)CN(C)C)OC 62a_100000751394_100020606517 [0,2,0,0,0,0|2,0,0]=4 3963 B12R0.33 COC(CSC(C)CN(C)C)OC 62a_100020606517_100000751394 [0,2,0,0,0,0|2,0,0]=4 3964 B12R0.71 CCCC(=O)CC(=O)C(OC)OC 1458a_100000046285_100000747444 [0,2,0,0,0,0|0,0,2]=4 3965 B12R0.71 CCCC(C)CC(=O)C(CC)OC 1458a_100000747056_100011216630 [0,2,0,0,0,0|1,0,1]=4 3966 B12R0.71 CCCC(C)CC(=O)C(OC)OC 1458a_100000046285_100011216630 [0,2,0,0,0,0|0,0,1]=3 3967 B12R0.71 CCCC(C)NC(=O)C(OC)OC 11a_100000741246_100000046285 [0,2,0,0,0,0|1,0,1]=4 3968 B12R0.71 CCCC(C)NC(=O)C(OC)OC 240690a_100000741246_100000046285 [0,2,0,0,0,0|1,0,1]=4 3969 B12R0.71 CCCC(C)NC(=O)C(OC)OC 527a_100000741246_100000046285 [0,2,0,0,0,0|1,0,1]=4 3970 B12R0.71 CCCC(C)NC(C)C(OC)OC 270004a_100000741246_100000211384 [0,2,0,0,0,0|1,0,0]=3 3971 B12R0.71 CCCC(C)OC(C)C(OC)OC 34a_100000754440_100000766640 [0,2,0,0,0,0|1,0,0]=3 3972 B12R0.71 CCCC(C)OC(C)C(OC)OC 34a_100000764384_100011222894 [0,2,0,0,0,0|1,0,0]=3 3973 B12R0.71 CCCC(C)OC(C)C(OC)OC 7a_100000754440_100000766640 [0,2,0,0,0,0|1,0,0]=3 3974 B12R0.71 CCCC(C)SC(C)C(OC)OC 62a_100000766640_100011222894 [0,2,0,0,0,0|1,0,0]=3 3975 B12R0.71 CCCC(C)SC(C)C(OC)OC 62a_100011222894_100000766640 [0,2,0,0,0,0|1,0,0]=3 3976 B12R0.71 COC(OC)C(C)N[C@H](C)CCO 270004a_100000706166_100000211384 [0,2,0,0,0,0|2,0,0]=4 3977 B12R0.71 COC(OC)C(C)N[C@H](C)CCO 34a_100000706166_100011222894 [0,2,0,0,0,0|2,0,0]=4 3978 B12R0.71 COC(OC)C(C)OC(C)CCBr 34a_100012276601_100011222894 [0,2,0,0,0,0|2,0,0]=4 3979 B12R0.71 COC(OC)C(C)OC(C)CCO 34a_100000754440_100009893172 [0,2,0,0,0,0|2,0,0]=4 3980 B12R0.71 COC(OC)C(C)OC(C)CCO 7a_100000754440_100009893172 [0,2,0,0,0,0|2,0,0]=4 3981 B12R0.71 COC(OC)C(C)SC(C)CCO 62a_100009893172_100011222894 [0,2,0,0,0,0|2,0,0]=4 3982 B12R0.71 COC(OC)C(C)SC(C)CCO 62a_100011222894_100009893172 [0,2,0,0,0,0|2,0,0]=4 3983 B12R0.71 COCC(C)OC(C)C(OC)OC 34a_100000754440_100000765312 [0,2,0,0,0,0|2,0,0]=4 3984 B12R0.71 COCC(C)OC(C)C(OC)OC 7a_100000754440_100000765312 [0,2,0,0,0,0|2,0,0]=4 3985 B12R0.71 COCC(C)SC(C)C(OC)OC 62a_100000765312_100011222894 [0,2,0,0,0,0|2,0,0]=4 3986 B12R0.71 COCC(C)SC(C)C(OC)OC 62a_100011222894_100000765312 [0,2,0,0,0,0|2,0,0]=4 3987 B12R0.71 COC[C@@H](C)NC(C)C(OC)OC 270004a_100000764878_100000211384 [0,2,0,0,0,0|2,0,0]=4 3988 B12R0.71 COC[C@@H](C)OC(C)C(OC)OC 34a_100011934205_100011222894 [0,2,0,0,0,0|2,0,0]=4 3989 B12R0.74 CCCC(C)CNC(CC)COC 2230a_100000757820_100011216630 [0,2,0,0,0,0|2,0,0]=4 3990 B12R0.74 CCCC(C)CNC(CC)COC 270004a_100000757820_100000243154 [0,2,0,0,0,0|2,0,0]=4 3991 B12R0.74 CCCC(C)COC(CC)COC 7a_200011214946_100011216630 [0,2,0,0,0,0|2,0,0]=4 3992 B12R0.74 CCCC(C)NCC(CC)OCC 2230a_100015183923_100000766640 [0,2,0,0,0,0|2,0,0]=4 3993 B12R0.74 CCCC(C)NCC(CC)OCC 270004a_100015183923_100000211909 [0,2,0,0,0,0|2,0,0]=4 3994 B12R0.74 CCCC(C)NCC(CC)OCC 34a_100015183923_100000766640 [0,2,0,0,0,0|2,0,0]=4 3995 B12R0.133 C#CCCC(=O)CCC(OC)OC 1458a_100000692101_100000139399 [0,2,0,0,0,0|0,0,2]=4 3996 B12R0.133 C#CCCC(=O)CCC(OC)OC 1458a_200000082759_100000753159 [0,2,0,0,0,0|0,0,2]=4 3997 B12R0.133 C/C=C/CC(=O)CCC(OC)OC 1458a_200000082759_100102629194 [0,2,0,0,0,0|0,0,2]=4 3998 B12R0.133 C=CCCC(=O)CCC(OC)OC 1458a_100000749702_100000139399 [0,2,0,0,0,0|0,0,2]=4 3999 B12R0.133 C=CCCC(=O)CCC(OC)OC 1458a_200000082759_100000754431 [0,2,0,0,0,0|0,0,2]=4 4000 B12R0.133 C=CCCC(C)NCC(OC)OC 270004a_100000210479_100000762624 [0,2,0,0,0,0|0,0,2]=4 4001 B12R0.133 C=CCCC(C)OCC(OC)OC 34a_100000765329_100000211822 [0,2,0,0,0,0|0,0,2]=4 4002 B12R0.133 C=CCCC(C)OCC(OC)OC 7a_100000765329_100000751394 [0,2,0,0,0,0|0,0,2]=4 4003 B12R0.133 C=CCCN(C)CCC(OC)OC 2230a_100020639649_100009813347 [0,2,0,0,0,0|0,0,2]=4 4004 B12R0.133 C=CCCN(C)CCC(OC)OC 269982a_100020639649_100000139399 [0,2,0,0,0,0|0,0,2]=4 4005 B12R0.133 CC#CCC(=O)CCC(OC)OC 1458a_200000082759_100000748600 [0,2,0,0,0,0|0,0,2]=4 4006 B12R0.133 CC=CCC(=O)CCC(OC)OC 1458a_100121576822_100000139399 [0,2,0,0,0,0|0,0,2]=4 4007 B12R0.133 CC=CCC(=O)CCC(OC)OC 1458a_200000082759_100000070051 [0,2,0,0,0,0|0,0,2]=4 4008 B12R0.133 CCC#CC(=O)CCC(OC)OC 1458a_100011827653_100000139399 [0,2,0,0,0,0|0,0,2]=4 4009 B12R0.133 CCC#CC(C)OCC(OC)OC 34a_100000033903_100000211822 [0,2,0,0,0,0|0,0,2]=4 4010 B12R0.133 CCC#CC(C)OCC(OC)OC 7a_100000033903_100000751394 [0,2,0,0,0,0|0,0,2]=4 4011 B12R0.133 CCC(CNC(C)CCOC)OC 270004a_100000731041_100000742357 [0,2,0,0,0,0|2,0,0]=4 4012 B12R0.133 CCC(CNC(C)CCSC)OC 270004a_100000731041_100011217047 [0,2,0,0,0,0|2,0,0]=4 4013 B12R0.133 CCC=CC(=O)CCC(OC)OC 1458a_100000212282_100000139399 [0,2,0,0,0,0|0,0,2]=4 4014 B12R0.133 CCCCC(=O)CCC(OC)OC 1458a_100000210183_100000139399 [0,2,0,0,0,0|0,0,0]=2 4015 B12R0.133 CCCCC(=O)CCC(OC)OC 1458a_200000082759_100000210211 [0,2,0,0,0,0|0,0,0]=2 4016 B12R0.133 CCCCC(=O)NCC(CC)OC 11a_100000731041_100000210183 [0,2,0,0,0,0|1,0,1]=4 4017 B12R0.133 CCCCC(=O)NCC(CC)OC 1626a_100000731041_100000210183 [0,2,0,0,0,0|1,0,1]=4 4018 B12R0.133 CCCCC(=O)NCC(CC)OC 240690a_100000731041_100000210183 [0,2,0,0,0,0|1,0,1]=4 4019 B12R0.133 CCCCC(=O)NCC(CC)OC 527a_100000731041_100000210183 [0,2,0,0,0,0|1,0,1]=4 4020 B12R0.133 CCCCC(=O)NCC(OC)OC 11a_100000210479_100000210183 [0,2,0,0,0,0|0,0,1]=3 4021 B12R0.133 CCCCC(=O)NCC(OC)OC 1626a_100000210479_100000210183 [0,2,0,0,0,0|0,0,1]=3 4022 B12R0.133 CCCCC(=O)NCC(OC)OC 240690a_100000210479_100000210183 [0,2,0,0,0,0|0,0,1]=3 4023 B12R0.133 CCCCC(=O)NCC(OC)OC 527a_100000210479_100000210183 [0,2,0,0,0,0|0,0,1]=3 4024 B12R0.133 CCCCC(C)COC(CC)CC 7a_100011995851_100000210505 [0,2,0,0,0,0|2,0,0]=4 4025 B12R0.133 CCCCC(C)NCC(CC)CC 2230a_100000126638_100011215472 [0,2,0,0,0,0|2,0,0]=4 4026 B12R0.133 CCCCC(C)NCC(CC)CC 2230a_100102946423_200011215066 [0,2,0,0,0,0|2,0,0]=4 4027 B12R0.133 CCCCC(C)NCC(CC)CC 269862a_100000126638_100000211137 [0,2,0,0,0,0|2,0,0]=4 4028 B12R0.133 CCCCC(C)NCC(CC)CC 270004a_100000126638_100000211137 [0,2,0,0,0,0|2,0,0]=4 4029 B12R0.133 CCCCC(C)NCC(CC)CC 270004a_100102946423_100000210087 [0,2,0,0,0,0|2,0,0]=4 4030 B12R0.133 CCCCC(C)NCC(CC)OC 270004a_100000731041_100000210087 [0,2,0,0,0,0|1,0,0]=3 4031 B12R0.133 CCCCC(C)NCC(OC)OC 2230a_100000126638_100000751394 [0,2,0,0,0,0|0,0,0]=2 4032 B12R0.133 CCCCC(C)NCC(OC)OC 270004a_100000126638_100000752162 [0,2,0,0,0,0|0,0,0]=2 4033 B12R0.133 CCCCC(C)NCC(OC)OC 270004a_100000210479_100000210087 [0,2,0,0,0,0|0,0,0]=2 4034 B12R0.133 CCCCC(C)OCC(CC)CC 34a_100000687866_100011215472 [0,2,0,0,0,0|2,0,0]=4 4035 B12R0.133 CCCCC(C)OCC(CC)CC 7a_100000687866_100011215472 [0,2,0,0,0,0|2,0,0]=4 4036 B12R0.133 CCCCC(C)OCC(CC)CC 7a_100000703878_200011215066 [0,2,0,0,0,0|2,0,0]=4 4037 B12R0.133 CCCCC(C)OCC(CC)OC 34a_100011934954_200011215066 [0,2,0,0,0,0|1,0,0]=3 4038 B12R0.133 CCCCC(C)OCC(CC)OC 7a_100011934954_200011215066 [0,2,0,0,0,0|1,0,0]=3 4039 B12R0.133 CCCCC(C)OCC(OC)OC 34a_100000687866_100000211822 [0,2,0,0,0,0|0,0,0]=2 4040 B12R0.133 CCCCC(C)OCC(OC)OC 34a_100011216393_200011215066 [0,2,0,0,0,0|0,0,0]=2 4041 B12R0.133 CCCCC(C)OCC(OC)OC 7a_100000687866_100000751394 [0,2,0,0,0,0|0,0,0]=2 4042 B12R0.133 CCCCC(C)SCC(CC)CC 62a_100011215472_200011215066 [0,2,0,0,0,0|2,0,0]=4 4043 B12R0.133 CCCCC(C)SCC(CC)CC 62a_200011215066_100011215472 [0,2,0,0,0,0|2,0,0]=4 4044 B12R0.133 CCCCC(C)SCC(OC)OC 62a_100000751394_200011215066 [0,2,0,0,0,0|0,0,0]=2 4045 B12R0.133 CCCCC(C)SCC(OC)OC 62a_200011215066_100000751394 [0,2,0,0,0,0|0,0,0]=2 4046 B12R0.133 CCCCN(C)CCC(OC)OC 2230a_100000207549_100009813347 [0,2,0,0,0,0|0,0,0]=2 4047 B12R0.133 CCCCN(C)CCC(OC)OC 269982a_100000207549_100000139399 [0,2,0,0,0,0|0,0,0]=2 4048 B12R0.133 CCCNC(=O)CCC(OC)OC 11a_100020643023_200000082759 [0,2,0,0,0,0|0,0,1]=3 4049 B12R0.133 CCCNC(=O)CCC(OC)OC 1626a_100020643023_200000082759 [0,2,0,0,0,0|0,0,1]=3 4050 B12R0.133 CCCNC(=O)CCC(OC)OC 240690a_100020643023_200000082759 [0,2,0,0,0,0|0,0,1]=3 4051 B12R0.133 CCCNC(=O)CCC(OC)OC 527a_100020643023_200000082759 [0,2,0,0,0,0|0,0,1]=3 4052 B12R0.133 CCCNC(=O)NCC(OC)OC 2708a_100000210479_100020643023 [0,2,0,0,0,0|1,0,1]=4 4053 B12R0.133 CCCNC(=O)NCC(OC)OC 273464a_100000210479_100020643023 [0,2,0,0,0,0|1,0,1]=4 4054 B12R0.133 CCCNC(=O)NCC(OC)OC 273464a_100020643023_100000210479 [0,2,0,0,0,0|1,0,1]=4 4055 B12R0.133 CCCNC(=O)NCC(OC)OC 512a_100000210479_100020643023 [0,2,0,0,0,0|1,0,1]=4 4056 B12R0.133 CCCNC(=O)NCC(OC)OC 512a_100020643023_100000210479 [0,2,0,0,0,0|1,0,1]=4 4057 B12R0.133 CCNNC(=O)CCC(OC)OC 22a_100000756455_200000082759 [0,2,0,0,0,0|1,0,1]=4 4058 B12R0.133 CCOCC(=O)CCC(OC)OC 1458a_100000211967_100000139399 [0,2,0,0,0,0|0,0,1]=3 4059 B12R0.133 CCOCC(=O)NCC(OC)OC 11a_100000210479_100000211967 [0,2,0,0,0,0|1,0,1]=4 4060 B12R0.133 CCOCC(=O)NCC(OC)OC 1626a_100000210479_100000211967 [0,2,0,0,0,0|1,0,1]=4 4061 B12R0.133 CCOCC(=O)NCC(OC)OC 240690a_100000210479_100000211967 [0,2,0,0,0,0|1,0,1]=4 4062 B12R0.133 CCOCC(=O)NCC(OC)OC 527a_100000210479_100000211967 [0,2,0,0,0,0|1,0,1]=4 4063 B12R0.133 CCOCC(C)OCC(OC)OC 34a_100000718985_100000211822 [0,2,0,0,0,0|1,0,0]=3 4064 B12R0.133 CCOCC(C)OCC(OC)OC 7a_100000718985_100000751394 [0,2,0,0,0,0|1,0,0]=3 4065 B12R0.133 CCSCC(=O)CCC(OC)OC 1458a_100000230394_100000139399 [0,2,0,0,0,0|0,0,1]=3 4066 B12R0.133 CCSCC(=O)NCC(OC)OC 11a_100000210479_100000230394 [0,2,0,0,0,0|1,0,1]=4 4067 B12R0.133 CCSCC(=O)NCC(OC)OC 1626a_100000210479_100000230394 [0,2,0,0,0,0|1,0,1]=4 4068 B12R0.133 CCSCC(=O)NCC(OC)OC 240690a_100000210479_100000230394 [0,2,0,0,0,0|1,0,1]=4 4069 B12R0.133 CCSCC(=O)NCC(OC)OC 527a_100000210479_100000230394 [0,2,0,0,0,0|1,0,1]=4 4070 B12R0.133 CCSCC(C)NCC(CC)OC 270004a_100000731041_200011216171 [0,2,0,0,0,0|2,0,0]=4 4071 B12R0.133 CCSCC(C)NCC(OC)OC 270004a_100000210479_200011216171 [0,2,0,0,0,0|1,0,0]=3 4072 B12R0.133 COC(CCC(=O)CCC#N)OC 1458a_100011934036_100000139399 [0,2,0,0,0,0|0,0,2]=4 4073 B12R0.133 COC(CCC(=O)CCC#N)OC 1458a_200000082759_100011215226 [0,2,0,0,0,0|0,0,2]=4 4074 B12R0.133 COC(CCC(=O)CCCF)OC 1458a_200000082759_100011934791 [0,2,0,0,0,0|0,0,1]=3 4075 B12R0.133 COC(CCC(=O)CCCO)OC 1458a_200000082759_100011215043 [0,2,0,0,0,0|0,0,1]=3 4076 B12R0.133 COC(CCC(=O)CCSC)OC 1458a_100000174002_100000139399 [0,2,0,0,0,0|0,0,1]=3 4077 B12R0.133 COC(CCC(=O)CCSC)OC 1458a_200000082759_100000751147 [0,2,0,0,0,0|0,0,1]=3 4078 B12R0.133 COC(CCC(=O)NCCF)OC 11a_100000724931_200000082759 [0,2,0,0,0,0|1,0,1]=4 4079 B12R0.133 COC(CCC(=O)NCCF)OC 1626a_100000724931_200000082759 [0,2,0,0,0,0|1,0,1]=4 4080 B12R0.133 COC(CCC(=O)NCCF)OC 240690a_100000724931_200000082759 [0,2,0,0,0,0|1,0,1]=4 4081 B12R0.133 COC(CCC(=O)NCCF)OC 527a_100000724931_200000082759 [0,2,0,0,0,0|1,0,1]=4 4082 B12R0.133 COC(CCC(=O)NCCO)OC 240690a_100000210304_200000082759 [0,2,0,0,0,0|1,0,1]=4 4083 B12R0.133 COC(CCC(=O)NCCO)OC 527a_100000210304_200000082759 [0,2,0,0,0,0|1,0,1]=4 4084 B12R0.133 COC(CCN(C)CCC#N)OC 2230a_100000184479_100009813347 [0,2,0,0,0,0|1,0,1]=4 4085 B12R0.133 COC(CCN(C)CCCO)OC 2230a_100000213112_100009813347 [0,2,0,0,0,0|1,0,0]=3 4086 B12R0.133 COC(CCN(C)CCCO)OC 269982a_100000213112_100000139399 [0,2,0,0,0,0|1,0,0]=3 4087 B12R0.133 COC(CCN(C)CCSC)OC 2230a_100000686725_100009813347 [0,2,0,0,0,0|1,0,0]=3 4088 B12R0.133 COC(CCN(C)CCSC)OC 269982a_100000686725_100000139399 [0,2,0,0,0,0|1,0,0]=3 4089 B12R0.133 COC(CNC(=O)CCSC)OC 11a_100000210479_100000174002 [0,2,0,0,0,0|1,0,1]=4 4090 B12R0.133 COC(CNC(=O)CCSC)OC 1626a_100000210479_100000174002 [0,2,0,0,0,0|1,0,1]=4 4091 B12R0.133 COC(CNC(=O)CCSC)OC 240690a_100000210479_100000174002 [0,2,0,0,0,0|1,0,1]=4 4092 B12R0.133 COC(CNC(=O)CCSC)OC 527a_100000210479_100000174002 [0,2,0,0,0,0|1,0,1]=4 4093 B12R0.133 COC(CNC(C)CCSC)OC 270004a_100000210479_100011217047 [0,2,0,0,0,0|1,0,0]=3 4094 B12R0.133 COC(COC(C)CCCCl)OC 34a_200000718107_100000211822 [0,2,0,0,0,0|1,0,0]=3 4095 B12R0.133 COC(COC(C)CCCCl)OC 7a_200000718107_100000751394 [0,2,0,0,0,0|1,0,0]=3 4096 B12R0.133 COCCC(=O)CCC(OC)OC 1458a_100000749529_100000139399 [0,2,0,0,0,0|0,0,1]=3 4097 B12R0.133 COCCC(=O)CCC(OC)OC 1458a_200000082759_100000233755 [0,2,0,0,0,0|0,0,1]=3 4098 B12R0.133 COCCC(=O)NCC(OC)OC 11a_100000210479_100000749529 [0,2,0,0,0,0|1,0,1]=4 4099 B12R0.133 COCCC(=O)NCC(OC)OC 1626a_100000210479_100000749529 [0,2,0,0,0,0|1,0,1]=4 4100 B12R0.133 COCCC(=O)NCC(OC)OC 240690a_100000210479_100000749529 [0,2,0,0,0,0|1,0,1]=4 4101 B12R0.133 COCCC(=O)NCC(OC)OC 527a_100000210479_100000749529 [0,2,0,0,0,0|1,0,1]=4 4102 B12R0.133 COCCC(C)NCC(OC)OC 270004a_100000210479_100000742357 [0,2,0,0,0,0|1,0,0]=3 4103 B12R0.133 COCCN(C)CCC(OC)OC 2230a_100000743101_100009813347 [0,2,0,0,0,0|1,0,0]=3 4104 B12R0.133 COCCN(C)CCC(OC)OC 269982a_100000743101_100000139399 [0,2,0,0,0,0|1,0,0]=3 4105 B12R0.195 CCCC(=O)N(C)CC(OC)OC 11a_100000225562_100000211992 [0,2,0,0,0,0|1,0,1]=4 4106 B12R0.195 CCCC(=O)N(C)CC(OC)OC 1626a_100000225562_100000211992 [0,2,0,0,0,0|1,0,1]=4 4107 B12R0.195 CCCC(=O)N(C)CC(OC)OC 240690a_100000225562_100000211992 [0,2,0,0,0,0|1,0,1]=4 4108 B12R0.195 CCCC(=O)N(C)CC(OC)OC 527a_100000225562_100000211992 [0,2,0,0,0,0|1,0,1]=4 4109 B12R0.195 CCCC(C)C(=O)CC(OC)OC 1458a_100000082724_100000766640 [0,2,0,0,0,0|0,0,1]=3 4110 B12R0.195 CCCC(C)C(=O)CC(OC)OC 1458a_100000210906_100000751394 [0,2,0,0,0,0|0,0,1]=3 4111 B12R0.195 CCCC(C)N(C)CC(OC)OC 269982a_100000225562_100000766640 [0,2,0,0,0,0|1,0,0]=3 4112 B12R0.195 CCCC(C)N(C)CC(OC)OC 270004a_100000225562_100000211909 [0,2,0,0,0,0|1,0,0]=3 4113 B12R0.195 CCCN(C)C(=O)CC(OC)OC 11a_100000747261_100000082724 [0,2,0,0,0,0|1,0,1]=4 4114 B12R0.195 CCCN(C)C(=O)CC(OC)OC 1626a_100000747261_100000082724 [0,2,0,0,0,0|1,0,1]=4 4115 B12R0.195 CCCN(C)C(=O)CC(OC)OC 240690a_100000747261_100000082724 [0,2,0,0,0,0|1,0,1]=4 4116 B12R0.195 CCCN(C)C(=O)CC(OC)OC 527a_100000747261_100000082724 [0,2,0,0,0,0|1,0,1]=4 4117 B12R0.195 CCCN(C)C(C)CC(OC)OC 270004a_100000747261_100000210484 [0,2,0,0,0,0|1,0,0]=3 4118 B12R0.195 CCC[C@H](O)C(=O)CC(OC)OC 1458a_100009822183_100000751394 [0,2,0,0,0,0|0,0,1]=3 4119 B12R0.195 CCOC(C)C(=O)CC(OC)OC 1458a_100000739345_100000751394 [0,2,0,0,0,0|1,0,1]=4 4120 B12R0.195 CCSC(C)C(=O)CC(OC)OC 1458a_100000230601_100000751394 [0,2,0,0,0,0|1,0,1]=4 4121 B12R0.195 COC(CC(=O)C(C)CCO)OC 1458a_100000082724_100009893172 [0,2,0,0,0,0|1,0,1]=4 4122 B12R0.195 COC(CC(=O)C(C)CSC)OC 1458a_100000753918_100000751394 [0,2,0,0,0,0|1,0,1]=4 4123 B12R0.195 COC(CC(C)N(C)CCO)OC 270004a_100000210263_100000210484 [0,2,0,0,0,0|2,0,0]=4 4124 B12R0.195 COC(CN(C)C(C)CCO)OC 2230a_100000731037_100000751394 [0,2,0,0,0,0|2,0,0]=4 4125 B12R0.195 COC(CN(C)C(C)CCO)OC 269982a_100000225562_100009893172 [0,2,0,0,0,0|2,0,0]=4 4126 B12R0.195 COC(CN(C)C(C)CCO)OC 270004a_100000731037_100000752162 [0,2,0,0,0,0|2,0,0]=4 4127 B12R0.195 COC(CN(C)C(C)CSC)OC 270004a_100000225562_100011216314 [0,2,0,0,0,0|2,0,0]=4 4128 B12R0.195 COCC(C)C(=O)CC(OC)OC 1458a_100000082724_100000765312 [0,2,0,0,0,0|1,0,1]=4 4129 B12R0.195 COCC(C)C(=O)CC(OC)OC 1458a_100000751857_100000751394 [0,2,0,0,0,0|1,0,1]=4 4130 B12R0.195 COCC(C)N(C)CC(OC)OC 269982a_100000225562_100000765312 [0,2,0,0,0,0|2,0,0]=4 4131 B12R0.195 COCC(C)N(C)CC(OC)OC 270004a_100000225562_100000749346 [0,2,0,0,0,0|2,0,0]=4 4132 B12R0.344 CCC(=O)C(C)SCC(OC)OC 62a_100000742827_100000751394 [0,2,0,0,0,0|1,0,1]=4 4133 B12R0.344 CCC(=O)C(C)SCC(OC)OC 62a_100000751394_100000742827 [0,2,0,0,0,0|1,0,1]=4 4134 B12R0.344 CCC(C)C(=O)CCC(OC)OC 1458a_100011192722_100000139399 [0,2,0,0,0,0|0,0,1]=3 4135 B12R0.344 CCC(C)C(=O)CCC(OC)OC 1458a_200000082759_100000758301 [0,2,0,0,0,0|0,0,1]=3 4136 B12R0.344 CCC(C)C(=O)NCC(OC)OC 11a_100000210479_100011192722 [0,2,0,0,0,0|1,0,1]=4 4137 B12R0.344 CCC(C)C(=O)NCC(OC)OC 1626a_100000210479_100011192722 [0,2,0,0,0,0|1,0,1]=4 4138 B12R0.344 CCC(C)C(=O)NCC(OC)OC 240690a_100000210479_100011192722 [0,2,0,0,0,0|1,0,1]=4 4139 B12R0.344 CCC(C)C(=O)NCC(OC)OC 527a_100000210479_100011192722 [0,2,0,0,0,0|1,0,1]=4 4140 B12R0.344 CCC(C)C(C)NCC(OC)OC 270004a_100000210479_100000210599 [0,2,0,0,0,0|1,0,0]=3 4141 B12R0.344 CCC(C)C(C)OCC(OC)OC 7a_100011215189_100000751394 [0,2,0,0,0,0|1,0,0]=3 4142 B12R0.344 CCC(C)N(C)CCC(OC)OC 2230a_100000741768_100009813347 [0,2,0,0,0,0|1,0,0]=3 4143 B12R0.344 CCC(C)N(C)CCC(OC)OC 269982a_100000741768_100000139399 [0,2,0,0,0,0|1,0,0]=3 4144 B12R0.344 CCC(CNC(C)C(C)CC)OC 269862a_100000731041_100000210599 [0,2,0,0,0,0|2,0,0]=4 4145 B12R0.344 CCC(CNC(C)C(C)CC)OC 270004a_100000731041_100000210599 [0,2,0,0,0,0|2,0,0]=4 4146 B12R0.344 CCC(O)C(=O)CCC(OC)OC 1458a_100011196387_100000139399 [0,2,0,0,0,0|0,0,1]=3 4147 B12R0.344 CCC(O)C(=O)NCC(OC)OC 240690a_100000210479_100011196387 [0,2,0,0,0,0|1,0,1]=4 4148 B12R0.344 CCN(C)C(=O)CCC(OC)OC 11a_100000225621_200000082759 [0,2,0,0,0,0|1,0,1]=4 4149 B12R0.344 CCN(C)C(=O)CCC(OC)OC 1626a_100000225621_200000082759 [0,2,0,0,0,0|1,0,1]=4 4150 B12R0.344 CCN(C)C(=O)CCC(OC)OC 240690a_100000225621_200000082759 [0,2,0,0,0,0|1,0,1]=4 4151 B12R0.344 CCN(C)C(=O)CCC(OC)OC 527a_100000225621_200000082759 [0,2,0,0,0,0|1,0,1]=4 4152 B12R0.344 COC(CCC(=O)C(C)OC)OC 1458a_100000743197_100000139399 [0,2,0,0,0,0|1,0,1]=4 4153 B12R0.344 COC(CCC(=O)C(C)SC)OC 1458a_100000149566_100000139399 [0,2,0,0,0,0|1,0,1]=4 4154 B12R0.344 COC(CCC(=O)C(O)CO)OC 1458a_100011215603_100000139399 [0,2,0,0,0,0|1,0,1]=4 4155 B12R0.344 COC(CCN(C)C(C)CO)OC 2230a_100000693034_100009813347 [0,2,0,0,0,0|2,0,0]=4 4156 B12R0.344 COC(CCN(C)C(C)CO)OC 269982a_100000693034_100000139399 [0,2,0,0,0,0|2,0,0]=4 4157 B12R0.429 CCCC(C)(C)OCC(OC)OC 7a_100000748436_100000751394 [0,2,0,0,0,0|1,0,0]=3 4158 B12R0.429 CCCS(=O)(=O)NCC(OC)OC 274078a_100000210479_100000211391 [0,2,0,0,0,0|2,0,0]=4 4159 B12R0.429 COC(CNC(C)(C)CCO)OC 270004a_100000763138_100000752162 [0,2,0,0,0,0|2,0,0]=4 4160 B12R0.429 COC(CNC(C)(C)CSC)OC 2230a_100000759623_100000751394 [0,2,0,0,0,0|2,0,0]=4 4161 B12R0.429 COC(CNC(C)(C)CSC)OC 270004a_100000759623_100000752162 [0,2,0,0,0,0|2,0,0]=4 4162 B12R0.429 COC(CNC(C)(C)CSC)OC 7a_100000759623_100000751394 [0,2,0,0,0,0|2,0,0]=4 4163 B12R0.429 COC(COC(C)(C)CCBr)OC 7a_100000702414_100000751394 [0,2,0,0,0,0|2,0,0]=4 4164 B12R0.429 COCC(C)(C)NCC(OC)OC 2230a_100000752728_100000751394 [0,2,0,0,0,0|2,0,0]=4 4165 B12R0.429 COCC(C)(C)NCC(OC)OC 270004a_100000752728_100000752162 [0,2,0,0,0,0|2,0,0]=4 4166 B12R0.446 CCCC(=O)NCC(C)(OC)OC 11a_100000732740_100000211992 [0,2,0,0,0,0|1,0,1]=4 4167 B12R0.446 CCCC(=O)NCC(C)(OC)OC 1626a_100000732740_100000211992 [0,2,0,0,0,0|1,0,1]=4 4168 B12R0.446 CCCC(=O)NCC(C)(OC)OC 527a_100000732740_100000211992 [0,2,0,0,0,0|1,0,1]=4 4169 B12R0.446 CCCC(C)NCC(C)(OC)OC 2230a_100000732740_100000766640 [0,2,0,0,0,0|1,0,0]=3 4170 B12R0.446 CCCC(C)NCC(C)(OC)OC 2230a_100000741246_100000064154 [0,2,0,0,0,0|1,0,0]=3 4171 B12R0.446 CCCC(C)OCC(C)(OC)OC 34a_100000764384_100000766008 [0,2,0,0,0,0|1,0,0]=3 4172 B12R0.446 CCCC(C)OCP(=O)(OC)OC 34a_100000101693_100000766640 [0,2,0,0,0,0|2,0,0]=4 4173 B12R0.446 CCCC(C)SCC(C)(OC)OC 62a_100000766008_100000766640 [0,2,0,0,0,0|1,0,0]=3 4174 B12R0.446 CCCC(C)SCC(C)(OC)OC 62a_100000766640_100000766008 [0,2,0,0,0,0|1,0,0]=3 4175 B12R0.446 CCCC(C)SC[Si](C)(OC)OC 62a_100000067953_100000766640 [0,2,0,0,0,0|1,1,0]=4 4176 B12R0.446 CCCC(C)SC[Si](C)(OC)OC 62a_100000766640_100000067953 [0,2,0,0,0,0|1,1,0]=4 4177 B12R0.446 COC(C)(CNC(C)CCO)OC 2230a_100000732740_100009893172 [0,2,0,0,0,0|2,0,0]=4 4178 B12R0.446 COC(C)(CN[C@H](C)CCO)OC 2230a_100000706166_100000064154 [0,2,0,0,0,0|2,0,0]=4 4179 B12R0.446 COC(C)(CN[C@H](C)CCO)OC 34a_100000706166_100000766008 [0,2,0,0,0,0|2,0,0]=4 4180 B12R0.446 COC(C)(COC(C)CCBr)OC 34a_100012276601_100000766008 [0,2,0,0,0,0|2,0,0]=4 4181 B12R0.446 COC(C)(CSC(C)CCO)OC 62a_100000766008_100009893172 [0,2,0,0,0,0|2,0,0]=4 4182 B12R0.446 COC(C)(CSC(C)CCO)OC 62a_100009893172_100000766008 [0,2,0,0,0,0|2,0,0]=4 4183 B12R0.446 COCC(C)NCC(C)(OC)OC 2230a_100000732740_100000765312 [0,2,0,0,0,0|2,0,0]=4 4184 B12R0.446 COCC(C)SCC(C)(OC)OC 62a_100000765312_100000766008 [0,2,0,0,0,0|2,0,0]=4 4185 B12R0.446 COCC(C)SCC(C)(OC)OC 62a_100000766008_100000765312 [0,2,0,0,0,0|2,0,0]=4 4186 B12R0.446 COC[C@@H](C)NCC(C)(OC)OC 2230a_100000764878_100000064154 [0,2,0,0,0,0|2,0,0]=4 4187 B12R0.446 COC[C@@H](C)OCC(C)(OC)OC 34a_100011934205_100000766008 [0,2,0,0,0,0|2,0,0]=4 4188 B12R0.552 C#CC(CCC)OCC(OC)OC 34a_200011217317_100000211822 [0,2,0,0,0,0|1,0,0]=3 4189 B12R0.552 C#CC(CCC)OCC(OC)OC 7a_200011217317_100000751394 [0,2,0,0,0,0|1,0,0]=3 4190 B12R0.552 C=CC(CCC)OCC(OC)OC 34a_100011216692_100000211822 [0,2,0,0,0,0|1,0,0]=3 4191 B12R0.552 C=CC(CCC)OCC(OC)OC 7a_100011216692_100000751394 [0,2,0,0,0,0|1,0,0]=3 4192 B12R0.552 CCC(COC)NCC(OC)OC 2230a_100000757820_100000751394 [0,2,0,0,0,0|2,0,0]=4 4193 B12R0.552 CCC(COC)NCC(OC)OC 270004a_100000210479_100000757811 [0,2,0,0,0,0|2,0,0]=4 4194 B12R0.552 CCC(COC)NCC(OC)OC 270004a_100000757820_100000752162 [0,2,0,0,0,0|2,0,0]=4 4195 B12R0.552 CCC(COC)OCC(OC)OC 7a_200011214946_100000751394 [0,2,0,0,0,0|2,0,0]=4 4196 B12R0.552 CCCC(C#N)OCC(OC)OC 34a_100000686963_100000211822 [0,2,0,0,0,0|1,0,0]=3 4197 B12R0.552 CCCC(C#N)OCC(OC)OC 7a_100000686963_100000751394 [0,2,0,0,0,0|1,0,0]=3 4198 B12R0.552 CCCC(CC)NCC(CC)OC 270004a_100000731041_100000687865 [0,2,0,0,0,0|2,0,0]=4 4199 B12R0.552 CCCC(CC)NCC(OC)OC 2230a_100000747048_100000751394 [0,2,0,0,0,0|1,0,0]=3 4200 B12R0.552 CCCC(CC)NCC(OC)OC 270004a_100000210479_100000687865 [0,2,0,0,0,0|1,0,0]=3 4201 B12R0.552 CCCC(CC)NCC(OC)OC 270004a_100000747048_100000752162 [0,2,0,0,0,0|1,0,0]=3 4202 B12R0.552 CCCC(CC)OCC(CC)OC 7a_100011934954_100011219200 [0,2,0,0,0,0|2,0,0]=4 4203 B12R0.552 CCCC(CC)OCC(OC)OC 34a_100000687864_100000211822 [0,2,0,0,0,0|1,0,0]=3 4204 B12R0.552 CCCC(CC)OCC(OC)OC 7a_100000687864_100000751394 [0,2,0,0,0,0|1,0,0]=3 4205 B12R0.552 CCCC(CC)SCC(OC)OC 62a_100000751394_100011219200 [0,2,0,0,0,0|1,0,0]=3 4206 B12R0.552 CCCC(CC)SCC(OC)OC 62a_100011219200_100000751394 [0,2,0,0,0,0|1,0,0]=3 4207 B12R0.552 CCCN(CC)CCC(OC)OC 2230a_100000226822_100009813347 [0,2,0,0,0,0|1,0,0]=3 4208 B12R0.552 CCCN(CC)CCC(OC)OC 269982a_100000226822_100000139399 [0,2,0,0,0,0|1,0,0]=3 4209 B12R0.552 CCC[C@@H](CO)NCC(OC)OC 2230a_100000732646_100000751394 [0,2,0,0,0,0|1,0,0]=3 4210 B12R0.552 CCC[C@@H](CO)NCC(OC)OC 34a_100000732646_100000211822 [0,2,0,0,0,0|1,0,0]=3 4211 B12R0.552 CCN(CCO)CCC(OC)OC 2230a_100000210973_100009813347 [0,2,0,0,0,0|2,0,0]=4 4212 B12R0.552 CCN(CCO)CCC(OC)OC 269982a_100000210973_100000139399 [0,2,0,0,0,0|2,0,0]=4 4213 B12R0.552 COCC(CCl)OCC(OC)OC 34a_100011215053_100000211822 [0,2,0,0,0,0|2,0,0]=4 4214 B12R0.552 COCC(CN)OCC(OC)OC 34a_100000756049_100000211822 [0,2,0,0,0,0|2,0,0]=4 4215 B12R0.552 COCC(CO)NCC(OC)OC 2230a_100000724102_100000751394 [0,2,0,0,0,0|2,0,0]=4 4216 B12R0.552 COCC(CO)NCC(OC)OC 270004a_100000724102_100000752162 [0,2,0,0,0,0|2,0,0]=4 4217 B12R0.552 COCC(CO)NCC(OC)OC 34a_100000724102_100000211822 [0,2,0,0,0,0|2,0,0]=4 4218 B12R0.36 C=C(C)C(=O)CCCC(OC)OC 1458a_100000185857_100000069011 [0,2,0,0,0,0|0,0,2]=4 4219 B12R0.36 COC(CCCC(=O)C(C)C)OC 1458a_100000210198_100000069011 [0,2,0,0,0,0|0,0,1]=3 4220 B12R0.36 COC(CCCC(=O)C(C)F)OC 1458a_100000062450_100000069011 [0,2,0,0,0,0|0,0,1]=3 4221 B12R0.36 COC(CCCC(=O)C(O)O)OC 1458a_100000233687_100000069011 [0,2,0,0,0,0|1,0,1]=4 4222 B12R0.36 COC(CCCC(=O)[C@@H](C)O)OC 1458a_100000717761_100000069011 [0,2,0,0,0,0|0,0,1]=3 4223 B12R0.36 COC(CCCC(=O)[C@H](C)O)OC 1458a_217856618621_100000069011 [0,2,0,0,0,0|0,0,1]=3 4224 B12R0.36 COC(CCCN(C)C(C)C)OC 269982a_200000211004_100000069011 [0,2,0,0,0,0|1,0,0]=3 4225 B12R0.36 COC(CCNC(C)C(C)C)OC 2230a_100000211541_100009813347 [0,2,0,0,0,0|1,0,0]=3 4226 B12R0.36 COC(CCOC(C)C(=O)C)OC 34a_100000212229_100000139399 [0,2,0,0,0,0|1,0,1]=4 4227 B12R0.36 COC(CCOC(C)C(C)C)OC 7a_100000748068_100009813347 [0,2,0,0,0,0|1,0,0]=3 4228 B12R0.36 COC(CCSC(C)C(=O)C)OC 62a_100000139399_100009814033 [0,2,0,0,0,0|1,0,1]=4 4229 B12R0.36 COC(CCSC(C)C(=O)C)OC 62a_100009814033_100000139399 [0,2,0,0,0,0|1,0,1]=4 4230 B12R0.36 COC(CNCC(O)C(C)C)OC 2230a_100000759067_100000751394 [0,2,0,0,0,0|1,0,0]=3 4231 B12R0.36 COC(CNCC(O)C(C)C)OC 270004a_100000759067_100000752162 [0,2,0,0,0,0|1,0,0]=3 4232 B12R0.36 COC(CNCC(O)C(C)C)OC 34a_100000759067_100000211822 [0,2,0,0,0,0|1,0,0]=3 4233 B12R0.36 COC(COCC(=O)C(C)C)OC 34a_100011216393_100000753385 [0,2,0,0,0,0|1,0,1]=4 4234 B12R0.36 COC(COCC(C)C(=O)C)OC 34a_100000032740_100000211822 [0,2,0,0,0,0|1,0,1]=4 4235 B12R0.36 COC(COCC(C)C(=O)C)OC 7a_100000032740_100000751394 [0,2,0,0,0,0|1,0,1]=4 4236 B12R0.36 COC(COC[C@H](N)C(C)C)OC 34a_100011830312_100000211822 [0,2,0,0,0,0|1,0,0]=3 4237 B12R0.36 COC(CSCC(=O)C(C)C)OC 62a_100000751394_100000753385 [0,2,0,0,0,0|1,0,1]=4 4238 B12R0.36 COC(CSCC(=O)C(C)C)OC 62a_100000753385_100000751394 [0,2,0,0,0,0|1,0,1]=4 4239 B12R0.39 C=C(C)CCC(=O)CC(OC)OC 1458a_100000082724_100000730704 [0,2,0,0,0,0|0,0,2]=4 4240 B12R0.39 C=C(C)CCC(=O)CC(OC)OC 1458a_200000688413_100000751394 [0,2,0,0,0,0|0,0,2]=4 4241 B12R0.39 C=C(C)CCN(C)CC(OC)OC 269982a_100000225562_100000730704 [0,2,0,0,0,0|1,0,1]=4 4242 B12R0.39 C=C(C)COC(C)CC(OC)OC 7a_100011018202_100000748629 [0,2,0,0,0,0|1,0,1]=4 4243 B12R0.39 COC(CC(=O)CCC(C)C)OC 1458a_100000082724_100000210312 [0,2,0,0,0,0|0,0,1]=3 4244 B12R0.39 COC(CC(=O)CCC(C)C)OC 1458a_100000181311_100000751394 [0,2,0,0,0,0|0,0,1]=3 4245 B12R0.39 COC(CC(=O)CCC(C)O)OC 1458a_100000082724_100012276601 [0,2,0,0,0,0|0,0,1]=3 4246 B12R0.39 COC(CC(=O)CC[S+](C)C)OC 1458a_100009452791_100000751394 [0,2,0,0,0,0|1,0,1]=4 4247 B12R0.39 COC(CC(=O)COC(C)C)OC 1458a_100000745533_100000751394 [0,2,0,0,0,0|1,0,1]=4 4248 B12R0.39 COC(CC(=O)CSC(C)C)OC 1458a_100000241585_100000751394 [0,2,0,0,0,0|1,0,1]=4 4249 B12R0.39 COC(CC(=O)NCC(C)C)OC 11a_100000210953_100000082724 [0,2,0,0,0,0|1,0,1]=4 4250 B12R0.39 COC(CC(=O)NCC(C)C)OC 1626a_100000210953_100000082724 [0,2,0,0,0,0|1,0,1]=4 4251 B12R0.39 COC(CC(=O)NCC(C)C)OC 240690a_100000210953_100000082724 [0,2,0,0,0,0|1,0,1]=4 4252 B12R0.39 COC(CC(=O)NCC(C)C)OC 527a_100000210953_100000082724 [0,2,0,0,0,0|1,0,1]=4 4253 B12R0.39 COC(CC(=O)NCC(C)O)OC 11a_100000210904_100000082724 [0,2,0,0,0,0|1,0,1]=4 4254 B12R0.39 COC(CC(=O)NCC(C)O)OC 240690a_100000210904_100000082724 [0,2,0,0,0,0|1,0,1]=4 4255 B12R0.39 COC(CC(=O)NCC(C)O)OC 527a_100000210904_100000082724 [0,2,0,0,0,0|1,0,1]=4 4256 B12R0.39 COC(CC(C)NCC(C)C)OC 270004a_100000210953_100000210484 [0,2,0,0,0,0|1,0,0]=3 4257 B12R0.39 COC(CC(C)NCC(C)O)OC 270004a_100000210904_100000210484 [0,2,0,0,0,0|1,0,0]=3 4258 B12R0.39 COC(CC(C)NCC(F)F)OC 270004a_100000765723_100000210484 [0,2,0,0,0,0|2,0,0]=4 4259 B12R0.39 COC(CC(C)OCC(C)C)OC 7a_100011018202_100000210760 [0,2,0,0,0,0|1,0,0]=3 4260 B12R0.39 COC(CC(C)OCC(C)O)OC 7a_100011018202_100011218427 [0,2,0,0,0,0|1,0,0]=3 4261 B12R0.39 COC(CC(C)OCC(F)F)OC 7a_100011018202_100011934356 [0,2,0,0,0,0|2,0,0]=4 4262 B12R0.39 COC(CC(C)OC[C@@H](C)O)OC 7a_100011018202_100009817552 [0,2,0,0,0,0|1,0,0]=3 4263 B12R0.39 COC(CN(C)CCC(=O)C)OC 269982a_100000225562_100000053229 [0,2,0,0,0,0|1,0,1]=4 4264 B12R0.39 COC(CN(C)CCC(C)C)OC 2230a_100000742789_100000751394 [0,2,0,0,0,0|1,0,0]=3 4265 B12R0.39 COC(CN(C)CCC(C)C)OC 269982a_100000225562_100000210312 [0,2,0,0,0,0|1,0,0]=3 4266 B12R0.39 COC(CN(C)CCC(C)C)OC 270004a_100000742789_100000752162 [0,2,0,0,0,0|1,0,0]=3 4267 B12R0.39 COC(CN(C)CCC(C)O)OC 269982a_100000225562_100012276601 [0,2,0,0,0,0|1,0,0]=3 4268 B12R0.39 COC(CN(C)CCN(C)C)OC 269982a_100000225562_100000755713 [0,2,0,0,0,0|2,0,0]=4 4269 B12R0.39 COC(CN(C)CCN(C)C)OC 270004a_100000225618_100000752162 [0,2,0,0,0,0|2,0,0]=4 4270 B12R0.39 COC(CN(C)COC(C)C)OC 269982a_100000225562_100000709892 [0,2,0,0,0,0|2,0,0]=4 4271 B12R0.130 C#CC(C)NCCCC(OC)OC 2230a_100000707721_100000069011 [0,2,0,0,0,0|1,0,0]=3 4272 B12R0.130 C#CC(C)NCCCC(OC)OC 34a_100000707721_100000069011 [0,2,0,0,0,0|1,0,0]=3 4273 B12R0.130 C#CC(C)SCCCC(OC)OC 62a_200000035995_100000069011 [0,2,0,0,0,0|1,0,0]=3 4274 B12R0.130 C#C[C@@H](C)OCCCC(OC)OC 34a_100009815206_100000069011 [0,2,0,0,0,0|1,0,0]=3 4275 B12R0.130 C#C[C@@H](C)OCCCC(OC)OC 7a_100009815206_100000069011 [0,2,0,0,0,0|1,0,0]=3 4276 B12R0.130 C=CC(C)COCCC(OC)OC 34a_100011215527_100000139399 [0,2,0,0,0,0|1,0,0]=3 4277 B12R0.130 C=CC(C)COCCC(OC)OC 7a_100011215527_100009813347 [0,2,0,0,0,0|1,0,0]=3 4278 B12R0.130 C=CC(C)OCCCC(OC)OC 34a_100000695699_100000069011 [0,2,0,0,0,0|1,0,0]=3 4279 B12R0.130 C=CC(C)SCCCC(OC)OC 62a_100011215867_100000069011 [0,2,0,0,0,0|1,0,0]=3 4280 B12R0.130 C=CC(O)CSCCC(OC)OC 62a_100000139399_100000730141 [0,2,0,0,0,0|0,0,2]=4 4281 B12R0.130 C=CC(O)CSCCC(OC)OC 62a_100000730141_100000139399 [0,2,0,0,0,0|0,0,2]=4 4282 B12R0.130 C=C[C@H](N)COCCC(OC)OC 34a_100016989147_100000139399 [0,2,0,0,0,0|0,0,2]=4 4283 B12R0.130 CCC(=O)COCCC(OC)OC 34a_100000725409_100000139399 [0,2,0,0,0,0|0,0,1]=3 4284 B12R0.130 CCC(=O)CSCCC(OC)OC 62a_100000139399_100000747405 [0,2,0,0,0,0|0,0,1]=3 4285 B12R0.130 CCC(=O)CSCCC(OC)OC 62a_100000747405_100000139399 [0,2,0,0,0,0|0,0,1]=3 4286 B12R0.130 CCC(=O)NCCCC(OC)OC 11a_100000034021_100000210414 [0,2,0,0,0,0|0,0,1]=3 4287 B12R0.130 CCC(=O)NCCCC(OC)OC 1626a_100000034021_100000210414 [0,2,0,0,0,0|0,0,1]=3 4288 B12R0.130 CCC(=O)NCCCC(OC)OC 240690a_100000034021_100000210414 [0,2,0,0,0,0|0,0,1]=3 4289 B12R0.130 CCC(=O)NCCCC(OC)OC 527a_100000034021_100000210414 [0,2,0,0,0,0|0,0,1]=3 4290 B12R0.130 CCC(C)CCCOC(CC)CC 7a_100011216074_100000210505 [0,2,0,0,0,0|2,0,0]=4 4291 B12R0.130 CCC(C)CCNCC(CC)CC 2230a_100020591266_100011215472 [0,2,0,0,0,0|2,0,0]=4 4292 B12R0.130 CCC(C)CCNCC(CC)CC 269862a_100020591266_100000211137 [0,2,0,0,0,0|2,0,0]=4 4293 B12R0.130 CCC(C)CCNCC(CC)CC 270004a_100020591266_100000211137 [0,2,0,0,0,0|2,0,0]=4 4294 B12R0.130 CCC(C)CCNCC(OC)OC 2230a_100020591266_100000751394 [0,2,0,0,0,0|0,0,0]=2 4295 B12R0.130 CCC(C)CCNCC(OC)OC 270004a_100020591266_100000752162 [0,2,0,0,0,0|0,0,0]=2 4296 B12R0.130 CCC(C)CCOCC(CC)CC 7a_100011215188_100011215472 [0,2,0,0,0,0|2,0,0]=4 4297 B12R0.130 CCC(C)CCOCC(OC)OC 7a_100011215188_100000751394 [0,2,0,0,0,0|0,0,0]=2 4298 B12R0.130 CCC(C)CNCCC(OC)OC 2230a_100020588543_100009813347 [0,2,0,0,0,0|0,0,0]=2 4299 B12R0.130 CCC(C)CSCCC(OC)OC 62a_100000139399_100000748023 [0,2,0,0,0,0|0,0,0]=2 4300 B12R0.130 CCC(C)CSCCC(OC)OC 62a_100000748023_100000139399 [0,2,0,0,0,0|0,0,0]=2 4301 B12R0.130 CCC(C)NCCCC(OC)OC 2230a_100000209981_100000069011 [0,2,0,0,0,0|0,0,0]=2 4302 B12R0.130 CCC(C)OCCCC(OC)OC 7a_100000210228_100000069011 [0,2,0,0,0,0|0,0,0]=2 4303 B12R0.130 CCC(C)SCCCC(OC)OC 62a_100000069011_100000758301 [0,2,0,0,0,0|0,0,0]=2 4304 B12R0.130 CCC(C)SCCCC(OC)OC 62a_100000758301_100000069011 [0,2,0,0,0,0|0,0,0]=2 4305 B12R0.130 CCC(O)CNCCC(OC)OC 2230a_100011218483_100009813347 [0,2,0,0,0,0|0,0,0]=2 4306 B12R0.130 CCC(O)CNN=CC(OC)OC 4a_100015206393_100000752162 [0,2,0,0,0,0|1,0,1]=4 4307 B12R0.130 CCC(O)CSCCC(OC)OC 62a_100000139399_100011218378 [0,2,0,0,0,0|0,0,0]=2 4308 B12R0.130 CCC(O)CSCCC(OC)OC 62a_100011218378_100000139399 [0,2,0,0,0,0|0,0,0]=2 4309 B12R0.130 CC[C@H](C)COCCC(OC)OC 7a_100009816381_100009813347 [0,2,0,0,0,0|0,0,0]=2 4310 B12R0.130 CC[C@H](C)CSCCC(OC)OC 62a_100000139399_100009816398 [0,2,0,0,0,0|0,0,0]=2 4311 B12R0.130 CC[C@H](C)CSCCC(OC)OC 62a_100009816398_100000139399 [0,2,0,0,0,0|0,0,0]=2 4312 B12R0.130 CNC(=O)CCNCC(OC)OC 2230a_100000738227_100000751394 [0,2,0,0,0,0|1,0,1]=4 4313 B12R0.130 CNC(=O)CCNCC(OC)OC 270004a_100000738227_100000752162 [0,2,0,0,0,0|1,0,1]=4 4314 B12R0.130 CNC(=O)CCNCC(OC)OC 34a_100000738227_100000211822 [0,2,0,0,0,0|1,0,1]=4 4315 B12R0.130 CNC(=O)CCOCC(OC)OC 34a_100000754576_100000211822 [0,2,0,0,0,0|1,0,1]=4 4316 B12R0.130 CNC(=O)CCOCC(OC)OC 34a_100011216393_100012179268 [0,2,0,0,0,0|1,0,1]=4 4317 B12R0.130 CNC(=O)CCSCC(OC)OC 62a_100000737683_100000751394 [0,2,0,0,0,0|1,0,1]=4 4318 B12R0.130 CNC(=O)CCSCC(OC)OC 62a_100000751394_100000737683 [0,2,0,0,0,0|1,0,1]=4 4319 B12R0.130 CNC(=O)CNCCC(OC)OC 2230a_100000693194_100009813347 [0,2,0,0,0,0|1,0,1]=4 4320 B12R0.130 CNC(=O)COCCC(OC)OC 34a_100000750040_100000139399 [0,2,0,0,0,0|1,0,1]=4 4321 B12R0.130 CNC(=O)CSCCC(OC)OC 62a_100000139399_100000183359 [0,2,0,0,0,0|1,0,1]=4 4322 B12R0.130 CNC(=O)CSCCC(OC)OC 62a_100000183359_100000139399 [0,2,0,0,0,0|1,0,1]=4 4323 B12R0.130 CNC(=O)NCCCC(OC)OC 2708a_100000034021_106832991635 [0,2,0,0,0,0|1,0,1]=4 4324 B12R0.130 CNC(=O)NCCCC(OC)OC 273464a_100000034021_100102657272 [0,2,0,0,0,0|1,0,1]=4 4325 B12R0.130 CNC(=O)NCCCC(OC)OC 273464a_100102657272_100000034021 [0,2,0,0,0,0|1,0,1]=4 4326 B12R0.130 CNC(=O)NCCCC(OC)OC 512a_100000034021_100102657272 [0,2,0,0,0,0|1,0,1]=4 4327 B12R0.130 CNC(=O)NCCCC(OC)OC 512a_106832991638_100000034021 [0,2,0,0,0,0|1,0,1]=4 4328 B12R0.130 COC(=O)CCOCC(OC)OC 34a_100011216393_100000742370 [0,2,0,0,0,0|1,0,1]=4 4329 B12R0.130 COC(=O)CCSCC(OC)OC 62a_100000204255_100000751394 [0,2,0,0,0,0|1,0,1]=4 4330 B12R0.130 COC(=O)CCSCC(OC)OC 62a_100000751394_100000204255 [0,2,0,0,0,0|1,0,1]=4 4331 B12R0.130 COC(=O)CSCCC(OC)OC 62a_100000139399_100000747449 [0,2,0,0,0,0|1,0,1]=4 4332 B12R0.130 COC(=O)CSCCC(OC)OC 62a_100000747449_100000139399 [0,2,0,0,0,0|1,0,1]=4 4333 B12R0.130 COC(C)CCOCC(OC)OC 7a_100000764861_100000751394 [0,2,0,0,0,0|1,0,0]=3 4334 B12R0.130 COC(C)COCCC(OC)OC 34a_100000690652_100000139399 [0,2,0,0,0,0|1,0,0]=3 4335 B12R0.130 COC(CCCNC(=O)CO)OC 240690a_100000034021_100000210174 [0,2,0,0,0,0|1,0,1]=4 4336 B12R0.130 COC(CCCNC(=O)CO)OC 527a_100000034021_100000210174 [0,2,0,0,0,0|1,0,1]=4 4337 B12R0.130 COC(CCCNC(C)C#N)OC 2230a_100000737613_100000069011 [0,2,0,0,0,0|1,0,0]=3 4338 B12R0.130 COC(CCCN[C@H](C)CO)OC 2230a_100000737577_100000069011 [0,2,0,0,0,0|1,0,0]=3 4339 B12R0.130 COC(CCCOC(C)C#N)OC 34a_100011218135_100000069011 [0,2,0,0,0,0|1,0,0]=3 4340 B12R0.130 COC(CCCOC(C)CF)OC 34a_100016041109_100000069011 [0,2,0,0,0,0|1,0,0]=3 4341 B12R0.130 COC(CCCOC(C)CF)OC 7a_100016041109_100000069011 [0,2,0,0,0,0|1,0,0]=3 4342 B12R0.130 COC(CCCOC(C)CN)OC 34a_100000210904_100000069011 [0,2,0,0,0,0|1,0,0]=3 4343 B12R0.130 COC(CCCSC(C)C#N)OC 62a_100000069011_100000703298 [0,2,0,0,0,0|1,0,0]=3 4344 B12R0.130 COC(CCCSC(C)C#N)OC 62a_100000703298_100000069011 [0,2,0,0,0,0|1,0,0]=3 4345 B12R0.130 COC(CCCSC(C)CO)OC 62a_100012180447_100000069011 [0,2,0,0,0,0|1,0,0]=3 4346 B12R0.130 COC(CCCSC(C)OC)OC 62a_100000069011_100009879195 [0,2,0,0,0,0|1,0,0]=3 4347 B12R0.130 COC(CCCSC(C)OC)OC 62a_100009879195_100000069011 [0,2,0,0,0,0|1,0,0]=3 4348 B12R0.130 COC(CCCSC(F)C#N)OC 62a_100000069011_200000117898 [0,2,0,0,0,0|1,0,1]=4 4349 B12R0.130 COC(CCCSC(F)C#N)OC 62a_200000117898_100000069011 [0,2,0,0,0,0|1,0,1]=4 4350 B12R0.130 COC(CCCS[C@H](C)CO)OC 62a_100000069011_100016084084 [0,2,0,0,0,0|1,0,0]=3 4351 B12R0.130 COC(CCCS[C@H](C)CO)OC 62a_100016084084_100000069011 [0,2,0,0,0,0|1,0,0]=3 4352 B12R0.130 COC(CCNCC(C)CO)OC 34a_100000744482_100000139399 [0,2,0,0,0,0|1,0,0]=3 4353 B12R0.130 COC(CCNC[C@@H](C)OC)OC 2230a_100020591295_100009813347 [0,2,0,0,0,0|1,0,0]=3 4354 B12R0.130 COC(CCNC[C@@H](F)CO)OC 34a_100015665980_100000139399 [0,2,0,0,0,0|1,0,0]=3 4355 B12R0.130 COC(CCNC[C@H](O)CO)OC 2230a_100020644852_100009813347 [0,2,0,0,0,0|1,0,0]=3 4356 B12R0.130 COC(CCOCC(C)CN)OC 34a_100000744482_100000139399 [0,2,0,0,0,0|1,0,0]=3 4357 B12R0.130 COC(CCOCC(Cl)CCl)OC 34a_100000033668_100000139399 [0,2,0,0,0,0|1,0,0]=3 4358 B12R0.130 COC(CCOC[C@H](F)CN)OC 34a_100015665980_100000139399 [0,2,0,0,0,0|1,0,0]=3 4359 B12R0.130 COC(CCSCC(O)CO)OC 62a_100000139399_100011219619 [0,2,0,0,0,0|1,0,0]=3 4360 B12R0.130 COC(CCSCC(O)CO)OC 62a_100011219619_100000139399 [0,2,0,0,0,0|1,0,0]=3 4361 B12R0.130 COC(CCSC[C@@H](C)CO)OC 62a_100000059175_100000139399 [0,2,0,0,0,0|1,0,0]=3 4362 B12R0.130 COC(CCSC[C@@H](C)CO)OC 62a_100000139399_100000059175 [0,2,0,0,0,0|1,0,0]=3 4363 B12R0.130 COC(CCSC[C@@H](O)CF)OC 62a_100000139399_100015614560 [0,2,0,0,0,0|1,0,0]=3 4364 B12R0.130 COC(CCSC[C@@H](O)CF)OC 62a_100015614560_100000139399 [0,2,0,0,0,0|1,0,0]=3 4365 B12R0.130 COC(CCSC[C@@H](O)CO)OC 62a_100000139399_100009815848 [0,2,0,0,0,0|1,0,0]=3 4366 B12R0.130 COC(CCSC[C@@H](O)CO)OC 62a_100009815848_100000139399 [0,2,0,0,0,0|1,0,0]=3 4367 B12R0.130 COC(CNCCC(C)CO)OC 2230a_106354213184_100000751394 [0,2,0,0,0,0|1,0,0]=3 4368 B12R0.130 COC(CNCCC(C)CO)OC 270004a_106354213184_100000752162 [0,2,0,0,0,0|1,0,0]=3 4369 B12R0.130 COC(CNCCC(C)CO)OC 34a_106354213184_100000211822 [0,2,0,0,0,0|1,0,0]=3 4370 B12R0.224 CCC(COC)NCCCC(C)C 2230a_100000757820_100011214892 [0,2,0,0,0,0|2,0,0]=4 4371 B12R0.224 CCC(COC)NCCCC(C)C 270004a_200000737386_100000757811 [0,2,0,0,0,0|2,0,0]=4 4372 B12R0.224 CCC(COC)NCCCC(C)O 2230a_100000757820_200000718107 [0,2,0,0,0,0|2,0,0]=4 4373 B12R0.224 CCC(COC)OCCCC(C)C 7a_200011214946_100011214892 [0,2,0,0,0,0|2,0,0]=4 4374 B12R0.224 CCC(COC)OCCCC(C)O 7a_200011214946_200000718107 [0,2,0,0,0,0|2,0,0]=4 4375 B12R0.224 CCOC(CC)CNCCC(C)C 2230a_100015183923_100000210312 [0,2,0,0,0,0|2,0,0]=4 4376 B12R0.224 CCOC(CC)CNCCC(C)C 269862a_100015183923_100000185833 [0,2,0,0,0,0|2,0,0]=4 4377 B12R0.224 CCOC(CC)CNCCC(C)C 34a_100015183923_100000210312 [0,2,0,0,0,0|2,0,0]=4 4378 B12R0.224 CCOC(CC)CNCCC(C)O 2230a_100015183923_100012276601 [0,2,0,0,0,0|2,0,0]=4 4379 B12R0.224 CCOC(CC)CNCCC(C)O 34a_100015183923_100012276601 [0,2,0,0,0,0|2,0,0]=4 4380 B12R0.577 CCC(COCCC(C)(C)C)OC 34a_100011934954_100000755188 [0,2,0,0,0,0|2,0,0]=4 4381 B12R0.577 CCC(COCCC(C)(C)C)OC 7a_100011934954_100000755188 [0,2,0,0,0,0|2,0,0]=4 4382 B12R0.577 CCC(COCCC(C)(C)O)OC 34a_100011934954_100000702414 [0,2,0,0,0,0|2,0,0]=4 4383 B12R0.577 CCC(COCCC(C)(C)O)OC 7a_100011934954_100000702414 [0,2,0,0,0,0|2,0,0]=4 4384 B12R0.577 COC(CCCNC(C)(C)C)OC 2230a_100000715429_100000069011 [0,2,0,0,0,0|1,0,0]=3 4385 B12R0.577 COC(CCCOC(C)(C)C)OC 34a_100015890283_100000069011 [0,2,0,0,0,0|1,0,0]=3 4386 B12R0.577 COC(CCCOC(C)(C)C)OC 7a_100015890283_100000069011 [0,2,0,0,0,0|1,0,0]=3 4387 B12R0.577 COC(CCCSC(C)(C)C)OC 62a_100000069011_100000211941 [0,2,0,0,0,0|1,0,0]=3 4388 B12R0.577 COC(CCCSC(C)(C)C)OC 62a_100000211941_100000069011 [0,2,0,0,0,0|1,0,0]=3 4389 B12R0.577 COC(CCCSC(F)(F)F)OC 62a_100000069011_200103152311 [0,2,0,0,0,0|2,0,0]=4 4390 B12R0.577 COC(CCCSC(F)(F)F)OC 62a_200000243211_100000069011 [0,2,0,0,0,0|2,0,0]=4 4391 B12R0.577 COC(CCNCC(C)(C)C)OC 2230a_100000743828_100009813347 [0,2,0,0,0,0|1,0,0]=3 4392 B12R0.577 COC(CCNCC(C)(C)F)OC 2230a_100020643315_100009813347 [0,2,0,0,0,0|1,0,0]=3 4393 B12R0.577 COC(CCNCC(C)(C)O)OC 2230a_100000751335_100009813347 [0,2,0,0,0,0|1,0,0]=3 4394 B12R0.577 COC(CCNCC(F)(F)F)OC 34a_100000717047_100000139399 [0,2,0,0,0,0|2,0,0]=4 4395 B12R0.577 COC(CCOCC(C)(C)F)OC 34a_100000716592_100000139399 [0,2,0,0,0,0|1,0,0]=3 4396 B12R0.577 COC(CCOCC(C)(F)F)OC 34a_100000068830_100000139399 [0,2,0,0,0,0|1,0,0]=3 4397 B12R0.577 COC(CCOCC(F)(F)Br)OC 34a_100011217949_100000139399 [0,2,0,0,0,0|2,0,0]=4 4398 B12R0.577 COC(CCOCC(F)(F)Cl)OC 34a_100000734434_100000139399 [0,2,0,0,0,0|2,0,0]=4 4399 B12R0.577 COC(CCOCC(F)(F)F)OC 34a_100000210435_100000139399 [0,2,0,0,0,0|2,0,0]=4 4400 B12R0.577 COC(CCSCC(C)(C)C)OC 62a_100000139399_100011219605 [0,2,0,0,0,0|1,0,0]=3 4401 B12R0.577 COC(CCSCC(C)(C)C)OC 62a_100011219605_100000139399 [0,2,0,0,0,0|1,0,0]=3 4402 B12R0.577 COC(CCSCC(C)(C)F)OC 62a_100000139399_100011997219 [0,2,0,0,0,0|1,0,0]=3 4403 B12R0.577 COC(CCSCC(C)(C)F)OC 62a_100011997219_100000139399 [0,2,0,0,0,0|1,0,0]=3 4404 B12R0.577 COC(CCSCC(C)(C)O)OC 62a_100000139399_100000764493 [0,2,0,0,0,0|1,0,0]=3 4405 B12R0.577 COC(CCSCC(C)(C)O)OC 62a_100000764493_100000139399 [0,2,0,0,0,0|1,0,0]=3 4406 B12R0.577 COC(CCSCC(F)(F)F)OC 62a_100000139399_100000763148 [0,2,0,0,0,0|2,0,0]=4 4407 B12R0.577 COC(CCSCC(F)(F)F)OC 62a_100000763148_100000139399 [0,2,0,0,0,0|2,0,0]=4 4408 B12R0.577 COC(CCSC[N+](C)(C)C)OC 62a_100000139399_200000036245 [0,2,0,0,0,0|2,0,0]=4 4409 B12R0.577 COC(CCSC[N+](C)(C)C)OC 62a_200000036245_100000139399 [0,2,0,0,0,0|2,0,0]=4 4410 B12R0.577 COC(CCSC[Si](C)(C)C)OC 62a_100000037933_100000139399 [0,2,0,0,0,0|1,1,0]=4 4411 B12R0.577 COC(CCSC[Si](C)(C)C)OC 62a_100000139399_100000037933 [0,2,0,0,0,0|1,1,0]=4 4412 B12R0.577 COC(CNCCC(C)(C)C)OC 2230a_100000738805_100000751394 [0,2,0,0,0,0|1,0,0]=3 4413 B12R0.577 COC(CNCCC(C)(C)C)OC 270004a_100000738805_100000752162 [0,2,0,0,0,0|1,0,0]=3 4414 B12R0.577 COC(CNCCC(C)(C)F)OC 2230a_100016253952_100000751394 [0,2,0,0,0,0|1,0,0]=3 4415 B12R0.577 COC(CNCCC(C)(C)F)OC 270004a_100016253952_100000752162 [0,2,0,0,0,0|1,0,0]=3 4416 B12R0.577 COC(CNCCC(C)(C)O)OC 270004a_100000707701_100000752162 [0,2,0,0,0,0|1,0,0]=3 4417 B12R0.577 COC(CNCCC(F)(F)F)OC 2230a_100000740434_100000751394 [0,2,0,0,0,0|2,0,0]=4 4418 B12R0.577 COC(CNCCC(F)(F)F)OC 270004a_100000740434_100000752162 [0,2,0,0,0,0|2,0,0]=4 4419 B12R0.577 COC(CNCCC(F)(F)F)OC 34a_100000740434_100000211822 [0,2,0,0,0,0|2,0,0]=4 4420 B12R0.577 COC(CNCCS(=O)(=O)C)OC 2230a_100000740961_100000751394 [0,2,0,0,0,0|2,0,0]=4 4421 B12R0.577 COC(CNCCS(=O)(=O)C)OC 270004a_100000740961_100000752162 [0,2,0,0,0,0|2,0,0]=4 4422 B12R0.577 COC(CNCCS(=O)(=O)C)OC 34a_100000740961_100000211822 [0,2,0,0,0,0|2,0,0]=4 4423 B12R0.577 COC(CNCC[N+](C)(C)C)OC 270004a_100000106457_100000752162 [0,2,0,0,0,0|2,0,0]=4 4424 B12R0.577 COC(COCCC(C)(C)C)OC 34a_100011216393_100000755188 [0,2,0,0,0,0|1,0,0]=3 4425 B12R0.577 COC(COCCC(C)(C)C)OC 7a_100000765024_100000751394 [0,2,0,0,0,0|1,0,0]=3 4426 B12R0.577 COC(COCCC(C)(C)O)OC 34a_100011216393_100000702414 [0,2,0,0,0,0|1,0,0]=3 4427 B12R0.577 COC(COCCC(F)(F)F)OC 34a_100000752437_100000211822 [0,2,0,0,0,0|2,0,0]=4 4428 B12R0.577 COC(COCCC(F)(F)F)OC 34a_100011216393_100011219754 [0,2,0,0,0,0|2,0,0]=4 4429 B12R0.577 COC(COCCS(=O)(=O)C)OC 34a_100000211924_100000211822 [0,2,0,0,0,0|2,0,0]=4 4430 B12R0.577 COC(COCCS(=O)(=O)C)OC 34a_100011216393_100000731031 [0,2,0,0,0,0|2,0,0]=4 4431 B12R0.577 COC(COCCS(=O)(=O)C)OC 7a_100000211924_100000751394 [0,2,0,0,0,0|2,0,0]=4 4432 B12R0.577 COC(COCC[N+](C)(C)C)OC 34a_100011216393_100000085578 [0,2,0,0,0,0|2,0,0]=4 4433 B12R0.577 COC(COCC[N+](C)(C)C)OC 7a_200020618287_100000751394 [0,2,0,0,0,0|2,0,0]=4 4434 B12R0.577 COC(COCC[Si](C)(C)C)OC 34a_100011216393_200000733723 [0,2,0,0,0,0|1,1,0]=4 4435 B12R0.577 COC(COCC[Si](C)(C)C)OC 7a_100000039746_100000751394 [0,2,0,0,0,0|1,1,0]=4 4436 B12R0.577 COC(CSCCC(C)(C)C)OC 62a_100000751394_100000755188 [0,2,0,0,0,0|1,0,0]=3 4437 B12R0.577 COC(CSCCC(C)(C)C)OC 62a_100000755188_100000751394 [0,2,0,0,0,0|1,0,0]=3 4438 B12R0.577 COC(CSCCC(C)(C)O)OC 62a_100000702414_100000751394 [0,2,0,0,0,0|1,0,0]=3 4439 B12R0.577 COC(CSCCC(C)(C)O)OC 62a_100000751394_100000702414 [0,2,0,0,0,0|1,0,0]=3 4440 B12R0.577 COC(CSCCC(F)(F)F)OC 62a_100000751394_100011219754 [0,2,0,0,0,0|2,0,0]=4 4441 B12R0.577 COC(CSCCC(F)(F)F)OC 62a_100011219754_100000751394 [0,2,0,0,0,0|2,0,0]=4 4442 B12R0.577 COC(CSCCS(=O)(=O)C)OC 62a_100000731031_100000751394 [0,2,0,0,0,0|2,0,0]=4 4443 B12R0.577 COC(CSCCS(=O)(=O)C)OC 62a_100000751394_100000230027 [0,2,0,0,0,0|2,0,0]=4 4444 B12R0.577 COC(CSCC[N+](C)(C)C)OC 62a_100000085578_100000751394 [0,2,0,0,0,0|2,0,0]=4 4445 B12R0.577 COC(CSCC[N+](C)(C)C)OC 62a_100000751394_100000085578 [0,2,0,0,0,0|2,0,0]=4 4446 B12R0.577 COC(CSCC[Si](C)(C)C)OC 62a_100000751394_200000733723 [0,2,0,0,0,0|1,1,0]=4 4447 B12R0.577 COC(CSCC[Si](C)(C)C)OC 62a_200000733723_100000751394 [0,2,0,0,0,0|1,1,0]=4 4448 B12R0.677 C=C(C)CCOC(C)C(OC)OC 34a_100000754440_100000730704 [0,2,0,0,0,0|1,0,1]=4 4449 B12R0.677 C=C(C)CCOC(C)C(OC)OC 34a_100000764851_100011222894 [0,2,0,0,0,0|1,0,1]=4 4450 B12R0.677 C=C(C)CCOC(C)C(OC)OC 7a_100000754440_100000730704 [0,2,0,0,0,0|1,0,1]=4 4451 B12R0.677 C=C(C)CCSC(C)C(OC)OC 62a_100000730704_100011222894 [0,2,0,0,0,0|1,0,1]=4 4452 B12R0.677 C=C(C)CCSC(C)C(OC)OC 62a_100011222894_100000730704 [0,2,0,0,0,0|1,0,1]=4 4453 B12R0.677 CCC(OC)C(=O)CCCC(C)C 1458a_100000747056_100011214892 [0,2,0,0,0,0|1,0,1]=4 4454 B12R0.677 CCC(OC)C(=O)CCCC(C)O 1458a_100000747056_200000718107 [0,2,0,0,0,0|1,0,1]=4 4455 B12R0.677 COC(OC)C(=O)CCCC(=O)C 1458a_100000046285_100011215641 [0,2,0,0,0,0|0,0,2]=4 4456 B12R0.677 COC(OC)C(=O)CCCC(C)C 1458a_100000046285_100011214892 [0,2,0,0,0,0|0,0,1]=3 4457 B12R0.677 COC(OC)C(=O)CCCC(C)O 1458a_100000046285_200000718107 [0,2,0,0,0,0|0,0,1]=3 4458 B12R0.677 COC(OC)C(=O)CCCN(C)C 1458a_100000046285_100000695564 [0,2,0,0,0,0|1,0,1]=4 4459 B12R0.677 COC(OC)C(=O)CCOC(C)C 1458a_100000046285_100000211751 [0,2,0,0,0,0|1,0,1]=4 4460 B12R0.677 COC(OC)C(=O)CCSC(C)C 1458a_100000046285_100000730970 [0,2,0,0,0,0|1,0,1]=4 4461 B12R0.677 COC(OC)C(=O)NCCC(C)C 11a_100000210545_100000046285 [0,2,0,0,0,0|1,0,1]=4 4462 B12R0.677 COC(OC)C(=O)NCCC(C)C 240690a_100000210545_100000046285 [0,2,0,0,0,0|1,0,1]=4 4463 B12R0.677 COC(OC)C(=O)NCCC(C)C 527a_100000210545_100000046285 [0,2,0,0,0,0|1,0,1]=4 4464 B12R0.677 COC(OC)C(=O)NCCC(C)O 240690a_200000755665_100000046285 [0,2,0,0,0,0|1,0,1]=4 4465 B12R0.677 COC(OC)C(=O)NCCC(C)O 527a_200000755665_100000046285 [0,2,0,0,0,0|1,0,1]=4 4466 B12R0.677 COC(OC)C(C)NCCC(C)C 270004a_100000210545_100000211384 [0,2,0,0,0,0|1,0,0]=3 4467 B12R0.677 COC(OC)C(C)NCCC(C)O 270004a_200000755665_100000211384 [0,2,0,0,0,0|1,0,0]=3 4468 B12R0.677 COC(OC)C(C)NCCN(C)C 270004a_100000210585_100000211384 [0,2,0,0,0,0|2,0,0]=4 4469 B12R0.677 COC(OC)C(C)OCCC(=O)C 34a_100000759926_100011222894 [0,2,0,0,0,0|1,0,1]=4 4470 B12R0.677 COC(OC)C(C)OCCC(=O)C 7a_100000754440_100000053229 [0,2,0,0,0,0|1,0,1]=4 4471 B12R0.677 COC(OC)C(C)OCCC(C)Br 34a_100009893172_100011222894 [0,2,0,0,0,0|1,0,0]=3 4472 B12R0.677 COC(OC)C(C)OCCC(C)C 34a_100000210254_100011222894 [0,2,0,0,0,0|1,0,0]=3 4473 B12R0.677 COC(OC)C(C)OCCC(C)C 34a_100000754440_100000210312 [0,2,0,0,0,0|1,0,0]=3 4474 B12R0.677 COC(OC)C(C)OCCC(C)C 7a_100000754440_100000210626 [0,2,0,0,0,0|1,0,0]=3 4475 B12R0.677 COC(OC)C(C)OCCC(C)O 34a_100000754440_100012276601 [0,2,0,0,0,0|1,0,0]=3 4476 B12R0.677 COC(OC)C(C)OCCC(C)O 7a_100000754440_100012276601 [0,2,0,0,0,0|1,0,0]=3 4477 B12R0.677 COC(OC)C(C)OCCC(F)F 34a_100103093639_100011222894 [0,2,0,0,0,0|2,0,0]=4 4478 B12R0.677 COC(OC)C(C)OCCN(C)C 7a_100000754440_100000755713 [0,2,0,0,0,0|2,0,0]=4 4479 B12R0.677 COC(OC)C(C)OCC[C@@H](C)N 34a_100000706166_100011222894 [0,2,0,0,0,0|1,0,0]=3 4480 B12R0.677 COC(OC)C(C)OCOC(C)C 34a_100000754440_100000709892 [0,2,0,0,0,0|2,0,0]=4 4481 B12R0.677 COC(OC)C(C)SCCC(=O)C 62a_100000053229_100011222894 [0,2,0,0,0,0|1,0,1]=4 4482 B12R0.677 COC(OC)C(C)SCCC(=O)C 62a_100011222894_100000053229 [0,2,0,0,0,0|1,0,1]=4 4483 B12R0.677 COC(OC)C(C)SCCC(C)C 62a_100000210312_100011222894 [0,2,0,0,0,0|1,0,0]=3 4484 B12R0.677 COC(OC)C(C)SCCC(C)C 62a_100011222894_100000210312 [0,2,0,0,0,0|1,0,0]=3 4485 B12R0.677 COC(OC)C(C)SCCC(C)O 62a_100011222894_100012276601 [0,2,0,0,0,0|1,0,0]=3 4486 B12R0.677 COC(OC)C(C)SCCC(C)O 62a_100012276601_100011222894 [0,2,0,0,0,0|1,0,0]=3 4487 B12R0.677 COC(OC)C(C)SCCN(C)C 62a_100011222894_100000755713 [0,2,0,0,0,0|2,0,0]=4 4488 B12R0.677 COC(OC)C(C)SCOC(C)C 62a_100000709892_100011222894 [0,2,0,0,0,0|2,0,0]=4 4489 B12R0.677 COC(OC)C(C)SCOC(C)C 62a_100011222894_100000709892 [0,2,0,0,0,0|2,0,0]=4 4490 B12R0.777 C=C(C)CCNCC(C)(OC)OC 2230a_100000732740_100000730704 [0,2,0,0,0,0|1,0,1]=4 4491 B12R0.777 C=C(C)CCOCC(C)(OC)OC 34a_100000764851_100000766008 [0,2,0,0,0,0|1,0,1]=4 4492 B12R0.777 C=C(C)CCSCC(C)(OC)OC 62a_100000730704_100000766008 [0,2,0,0,0,0|1,0,1]=4 4493 B12R0.777 C=C(C)CCSCC(C)(OC)OC 62a_100000766008_100000730704 [0,2,0,0,0,0|1,0,1]=4 4494 B12R0.777 COC(C)(CNCCC(C)C)OC 2230a_100000732740_100000210312 [0,2,0,0,0,0|1,0,0]=3 4495 B12R0.777 COC(C)(CNCCC(C)C)OC 269862a_100000732740_100000185833 [0,2,0,0,0,0|1,0,0]=3 4496 B12R0.777 COC(C)(CNCCC(C)O)OC 2230a_100000732740_100012276601 [0,2,0,0,0,0|1,0,0]=3 4497 B12R0.777 COC(C)(CNCCC(C)O)OC 2230a_200000755665_100000064154 [0,2,0,0,0,0|1,0,0]=3 4498 B12R0.777 COC(C)(CNCOC(C)C)OC 2230a_100000732740_100000709892 [0,2,0,0,0,0|2,0,0]=4 4499 B12R0.777 COC(C)(COCCC(=O)C)OC 34a_100000759926_100000766008 [0,2,0,0,0,0|1,0,1]=4 4500 B12R0.777 COC(C)(COCCC(C)Br)OC 34a_100009893172_100000766008 [0,2,0,0,0,0|1,0,0]=3 4501 B12R0.777 COC(C)(COCCC(C)C)OC 34a_100000210254_100000766008 [0,2,0,0,0,0|1,0,0]=3 4502 B12R0.777 COC(C)(COCCC(F)F)OC 34a_100103093639_100000766008 [0,2,0,0,0,0|2,0,0]=4 4503 B12R0.777 COC(C)(COCC[C@@H](C)N)OC 34a_100000706166_100000766008 [0,2,0,0,0,0|1,0,0]=3 4504 B12R0.777 COC(C)(CSCCC(=O)C)OC 62a_100000053229_100000766008 [0,2,0,0,0,0|1,0,1]=4 4505 B12R0.777 COC(C)(CSCCC(=O)C)OC 62a_100000766008_100000053229 [0,2,0,0,0,0|1,0,1]=4 4506 B12R0.777 COC(C)(CSCCC(C)C)OC 62a_100000210312_100000766008 [0,2,0,0,0,0|1,0,0]=3 4507 B12R0.777 COC(C)(CSCCC(C)C)OC 62a_100000766008_100000210312 [0,2,0,0,0,0|1,0,0]=3 4508 B12R0.777 COC(C)(CSCCC(C)O)OC 62a_100000766008_100012276601 [0,2,0,0,0,0|1,0,0]=3 4509 B12R0.777 COC(C)(CSCCC(C)O)OC 62a_100012276601_100000766008 [0,2,0,0,0,0|1,0,0]=3 4510 B12R0.777 COC(C)(CSCCN(C)C)OC 62a_100000766008_100000755713 [0,2,0,0,0,0|2,0,0]=4 4511 B12R0.777 COC(C)(CSCOC(C)C)OC 62a_100000709892_100000766008 [0,2,0,0,0,0|2,0,0]=4 4512 B12R0.777 COC(C)(CSCOC(C)C)OC 62a_100000766008_100000709892 [0,2,0,0,0,0|2,0,0]=4 4513 B12R0.777 COP(=O)(CCOCC(C)C)OC 34a_200000043213_100000210624 [0,2,0,0,0,0|2,0,0]=4 4514 B12R0.777 COP(=O)(CCOCC(C)O)OC 34a_200000043213_100011218427 [0,2,0,0,0,0|2,0,0]=4 4515 B12R0.777 COP(=O)(CCOC[C@@H](C)O)OC 34a_200000043213_100009817552 [0,2,0,0,0,0|2,0,0]=4 4516 B12R0.777 COP(=O)(COCCC(C)C)OC 34a_100000101693_100000210312 [0,2,0,0,0,0|2,0,0]=4 4517 B12R0.777 COP(=O)(COCCC(C)O)OC 34a_100000101693_100012276601 [0,2,0,0,0,0|2,0,0]=4 4518 B12R0.777 CO[Si](C)(CCCNC(C)C)OC 34a_100138425928_100000031653 [0,2,0,0,0,0|1,1,0]=4 4519 B12R0.777 CO[Si](C)(CCCOC(C)C)OC 34a_100000212225_100000031653 [0,2,0,0,0,0|1,1,0]=4 4520 B12R0.777 CO[Si](C)(CCCSC(C)C)OC 62a_100000031653_100000210206 [0,2,0,0,0,0|1,1,0]=4 4521 B12R0.777 CO[Si](C)(CCCSC(C)C)OC 62a_100000210206_100000031653 [0,2,0,0,0,0|1,1,0]=4 4522 B12R0.777 CO[Si](C)(CSCCC(C)C)OC 62a_100000067953_100000210312 [0,2,0,0,0,0|1,1,0]=4 4523 B12R0.777 CO[Si](C)(CSCCC(C)C)OC 62a_100000210312_100000067953 [0,2,0,0,0,0|1,1,0]=4 4524 B12R0.777 CO[Si](C)(CSCCC(C)O)OC 62a_100000067953_100012276601 [0,2,0,0,0,0|1,1,0]=4 4525 B12R0.777 CO[Si](C)(CSCCC(C)O)OC 62a_100012276601_100000067953 [0,2,0,0,0,0|1,1,0]=4 4526 B12R0.25 CCCCC(C)C(=O)C(CC)OC 1458a_100000747056_200011215066 [0,2,0,0,0,0|1,0,1]=4 4527 B12R0.25 CCCCC(C)C(=O)C(OC)OC 1458a_100000046285_200011215066 [0,2,0,0,0,0|0,0,1]=3 4528 B12R0.25 CCCCN(C)C(=O)C(OC)OC 11a_100000207549_100000046285 [0,2,0,0,0,0|1,0,1]=4 4529 B12R0.25 CCCCN(C)C(=O)C(OC)OC 240690a_100000207549_100000046285 [0,2,0,0,0,0|1,0,1]=4 4530 B12R0.25 CCCCN(C)C(=O)C(OC)OC 527a_100000207549_100000046285 [0,2,0,0,0,0|1,0,1]=4 4531 B12R0.25 CCCCN(C)C(C)C(OC)OC 2230a_100012024948_100000210211 [0,2,0,0,0,0|1,0,0]=3 4532 B12R0.25 CCCCN(C)C(C)C(OC)OC 269982a_100012024948_100000210211 [0,2,0,0,0,0|1,0,0]=3 4533 B12R0.25 CCCCN(C)C(C)C(OC)OC 270004a_100000207549_100000211384 [0,2,0,0,0,0|1,0,0]=3 4534 B12R0.25 CCOCN(C)C(C)C(OC)OC 269982a_100012024948_100000739092 [0,2,0,0,0,0|2,0,0]=4 4535 B12R0.25 COC(OC)C(C)N(C)CCCF 2230a_100012024948_100011934791 [0,2,0,0,0,0|2,0,0]=4 4536 B12R0.25 COC(OC)C(C)N(C)CCCF 269982a_100012024948_100011934791 [0,2,0,0,0,0|2,0,0]=4 4537 B12R0.25 COC(OC)C(C)N(C)CCCO 2230a_100012024948_100000230001 [0,2,0,0,0,0|2,0,0]=4 4538 B12R0.25 COC(OC)C(C)N(C)CCCO 269982a_100012024948_100011215043 [0,2,0,0,0,0|2,0,0]=4 4539 B12R0.25 COC(OC)C(C)N(C)CCCO 270004a_100000213112_100000211384 [0,2,0,0,0,0|2,0,0]=4 4540 B12R0.25 COC(OC)C(C)N(C)CCSC 2230a_100012024948_100000751147 [0,2,0,0,0,0|2,0,0]=4 4541 B12R0.25 COC(OC)C(C)N(C)CCSC 269982a_100012024948_100000212216 [0,2,0,0,0,0|2,0,0]=4 4542 B12R0.25 COC(OC)C(C)N(C)CCSC 270004a_100000686725_100000211384 [0,2,0,0,0,0|2,0,0]=4 4543 B12R0.25 COCCN(C)C(C)C(OC)OC 2230a_100012024948_100011201679 [0,2,0,0,0,0|2,0,0]=4 4544 B12R0.25 COCCN(C)C(C)C(OC)OC 269982a_100012024948_100000233755 [0,2,0,0,0,0|2,0,0]=4 4545 B12R0.25 COCCN(C)C(C)C(OC)OC 270004a_100000743101_100000211384 [0,2,0,0,0,0|2,0,0]=4 4546 B12R0.60 CCC(=O)CC(=O)CC(OC)OC 1458a_100000082724_100000747405 [0,2,0,0,0,0|0,0,2]=4 4547 B12R0.60 CCC(=O)CN(C)CC(OC)OC 269982a_100000225562_100000747405 [0,2,0,0,0,0|1,0,1]=4 4548 B12R0.60 CCC(C)CC(=O)CC(OC)OC 1458a_100000082724_100000748023 [0,2,0,0,0,0|0,0,1]=3 4549 B12R0.60 CCC(C)CC(=O)CC(OC)OC 1458a_100000708755_100000751394 [0,2,0,0,0,0|0,0,1]=3 4550 B12R0.60 CCC(C)CN(C)CC(OC)OC 2230a_100000753921_100000751394 [0,2,0,0,0,0|1,0,0]=3 4551 B12R0.60 CCC(C)CN(C)CC(OC)OC 269982a_100000225562_100000748023 [0,2,0,0,0,0|1,0,0]=3 4552 B12R0.60 CCC(C)CN(C)CC(OC)OC 270004a_100000225562_100000243153 [0,2,0,0,0,0|1,0,0]=3 4553 B12R0.60 CCC(C)CN(C)CC(OC)OC 270004a_100000753921_100000752162 [0,2,0,0,0,0|1,0,0]=3 4554 B12R0.60 CCC(C)NC(=O)CC(OC)OC 11a_100000209981_100000082724 [0,2,0,0,0,0|1,0,1]=4 4555 B12R0.60 CCC(C)NC(=O)CC(OC)OC 1626a_100000209981_100000082724 [0,2,0,0,0,0|1,0,1]=4 4556 B12R0.60 CCC(C)NC(=O)CC(OC)OC 240690a_100000209981_100000082724 [0,2,0,0,0,0|1,0,1]=4 4557 B12R0.60 CCC(C)NC(=O)CC(OC)OC 527a_100000209981_100000082724 [0,2,0,0,0,0|1,0,1]=4 4558 B12R0.60 CCC(C)NC(C)CC(OC)OC 270004a_100000209981_100000210484 [0,2,0,0,0,0|1,0,0]=3 4559 B12R0.60 CCC(C)OC(C)CC(OC)OC 7a_100011018202_100000758301 [0,2,0,0,0,0|1,0,0]=3 4560 B12R0.60 CCC(O)CC(=O)CC(OC)OC 1458a_100000082724_100011218378 [0,2,0,0,0,0|0,0,1]=3 4561 B12R0.60 CCC(O)CC(=O)CC(OC)OC 1458a_100011667805_100000751394 [0,2,0,0,0,0|0,0,1]=3 4562 B12R0.60 CCC(O)CN(C)CC(OC)OC 269982a_100000225562_100011218378 [0,2,0,0,0,0|1,0,0]=3 4563 B12R0.60 CCN(C)CC(=O)CC(OC)OC 1458a_100116209913_100000751394 [0,2,0,0,0,0|1,0,1]=4 4564 B12R0.60 CC[C@H](C)CC(=O)CC(OC)OC 1458a_100000082724_100009816398 [0,2,0,0,0,0|0,0,1]=3 4565 B12R0.60 CC[C@H](C)CN(C)CC(OC)OC 269982a_100000225562_100009816398 [0,2,0,0,0,0|1,0,0]=3 4566 B12R0.60 COC(CC(=O)C[C@@H](C)CO)OC 1458a_100000082724_100000059175 [0,2,0,0,0,0|1,0,1]=4 4567 B12R0.60 COC(CC(C)N[C@H](C)CF)OC 270004a_100102880703_100000210484 [0,2,0,0,0,0|2,0,0]=4 4568 B12R0.60 COC(CC(C)N[C@H](C)CO)OC 270004a_100000737577_100000210484 [0,2,0,0,0,0|2,0,0]=4 4569 B12R0.60 COC(CC(C)OC(C)CO)OC 7a_100011018202_100012180447 [0,2,0,0,0,0|2,0,0]=4 4570 B12R0.60 COC(CN(C)CC(O)CO)OC 2230a_100011216503_100000751394 [0,2,0,0,0,0|2,0,0]=4 4571 B12R0.60 COC(CN(C)CC(O)CO)OC 270004a_100011216503_100000752162 [0,2,0,0,0,0|2,0,0]=4 4572 B12R0.60 COC(CN(C)C[C@@H](C)CO)OC 269982a_100000225562_100000059175 [0,2,0,0,0,0|2,0,0]=4 4573 B12R0.132 CCCCC(C)NC(CC)COC 2230a_100000757820_200011215066 [0,2,0,0,0,0|2,0,0]=4 4574 B12R0.132 CCCCC(C)NC(CC)COC 270004a_100000126638_100000757811 [0,2,0,0,0,0|2,0,0]=4 4575 B12R0.132 CCCCC(C)NC(CC)COC 270004a_100000757820_100000210087 [0,2,0,0,0,0|2,0,0]=4 4576 B12R0.132 CCCCC(C)OC(CC)COC 7a_200011214946_200011215066 [0,2,0,0,0,0|2,0,0]=4 4577 B12R0.144 C#CCCCC(=O)CC(OC)OC 1458a_100000082724_100000731252 [0,2,0,0,0,0|0,0,2]=4 4578 B12R0.144 C#CCCCC(=O)CC(OC)OC 1458a_100000690238_100000751394 [0,2,0,0,0,0|0,0,2]=4 4579 B12R0.144 C#CCCCN(C)CC(OC)OC 269982a_100000225562_100011215417 [0,2,0,0,0,0|0,0,2]=4 4580 B12R0.144 C#CCCOC(C)CC(OC)OC 7a_100011018202_100000688953 [0,2,0,0,0,0|0,0,2]=4 4581 B12R0.144 C/C=C/COC(C)CC(OC)OC 7a_100011018202_100102629194 [0,2,0,0,0,0|0,0,2]=4 4582 B12R0.144 C=CCCCC(=O)CC(OC)OC 1458a_100000082724_100000757094 [0,2,0,0,0,0|0,0,2]=4 4583 B12R0.144 C=CCCCC(=O)CC(OC)OC 1458a_100000766728_100000751394 [0,2,0,0,0,0|0,0,2]=4 4584 B12R0.144 C=CCCCN(C)CC(OC)OC 269982a_100000225562_100000757094 [0,2,0,0,0,0|0,0,2]=4 4585 B12R0.144 C=CCCNC(C)CC(OC)OC 270004a_100015191253_100000210484 [0,2,0,0,0,0|0,0,2]=4 4586 B12R0.144 C=CCCOC(C)CC(OC)OC 7a_100011018202_100000754431 [0,2,0,0,0,0|0,0,2]=4 4587 B12R0.144 CC#CCOC(C)CC(OC)OC 7a_100011018202_100000748600 [0,2,0,0,0,0|0,0,2]=4 4588 B12R0.144 CC/C=C/CC(=O)CC(OC)OC 1458a_100016274230_100000751394 [0,2,0,0,0,0|0,0,2]=4 4589 B12R0.144 CC/C=C\CC(=O)CC(OC)OC 1458a_100000082724_100103147603 [0,2,0,0,0,0|0,0,2]=4 4590 B12R0.144 CC/C=C\CN(C)CC(OC)OC 269982a_100000225562_100103147603 [0,2,0,0,0,0|0,0,2]=4 4591 B12R0.144 CC=CCOC(C)CC(OC)OC 7a_100011018202_100000070051 [0,2,0,0,0,0|0,0,2]=4 4592 B12R0.144 CCC#CCC(=O)CC(OC)OC 1458a_100000082724_100009813939 [0,2,0,0,0,0|0,0,2]=4 4593 B12R0.144 CCCC#CC(=O)CC(OC)OC 1458a_200011218047_100000751394 [0,2,0,0,0,0|0,0,2]=4 4594 B12R0.144 CCCC=CC(=O)CC(OC)OC 1458a_100000212230_100000751394 [0,2,0,0,0,0|0,0,2]=4 4595 B12R0.144 CCCCCC(=O)CC(CC)CC 1458a_100000212188_100011215472 [0,2,0,0,0,0|2,0,0]=4 4596 B12R0.144 CCCCCC(=O)CC(OC)OC 1458a_100000082724_100000210326 [0,2,0,0,0,0|0,0,0]=2 4597 B12R0.144 CCCCCC(=O)CC(OC)OC 1458a_100000212188_100000751394 [0,2,0,0,0,0|0,0,0]=2 4598 B12R0.144 CCCCCC(C)NC(CC)CC 2230a_100000199018_200011218191 [0,2,0,0,0,0|2,0,0]=4 4599 B12R0.144 CCCCCC(C)NC(CC)CC 270004a_100000199018_100000211708 [0,2,0,0,0,0|2,0,0]=4 4600 B12R0.144 CCCCCC(C)NC(CC)CC 270004a_100000211957_100000210860 [0,2,0,0,0,0|2,0,0]=4 4601 B12R0.144 CCCCCC(C)OC(CC)CC 7a_100000688536_200011218191 [0,2,0,0,0,0|2,0,0]=4 4602 B12R0.144 CCCCCC(C)OC(CC)CC 7a_100011215632_100000210505 [0,2,0,0,0,0|2,0,0]=4 4603 B12R0.144 CCCCCC(C)SC(CC)CC 62a_100000210505_200011218191 [0,2,0,0,0,0|2,0,0]=4 4604 B12R0.144 CCCCCC(C)SC(CC)CC 62a_200011218191_100000210505 [0,2,0,0,0,0|2,0,0]=4 4605 B12R0.144 CCCCCN(C)CC(CC)CC 2230a_100000223495_100011215472 [0,2,0,0,0,0|2,0,0]=4 4606 B12R0.144 CCCCCN(C)CC(CC)CC 269982a_100000223495_100011215472 [0,2,0,0,0,0|2,0,0]=4 4607 B12R0.144 CCCCCN(C)CC(CC)CC 270004a_100000223495_100000211137 [0,2,0,0,0,0|2,0,0]=4 4608 B12R0.144 CCCCCN(C)CC(OC)OC 2230a_100000223495_100000751394 [0,2,0,0,0,0|0,0,0]=2 4609 B12R0.144 CCCCCN(C)CC(OC)OC 269982a_100000225562_100000210215 [0,2,0,0,0,0|0,0,0]=2 4610 B12R0.144 CCCCCN(C)CC(OC)OC 270004a_100000223495_100000752162 [0,2,0,0,0,0|0,0,0]=2 4611 B12R0.144 CCCCNC(=O)CC(OC)OC 11a_100000102301_100000082724 [0,2,0,0,0,0|0,0,1]=3 4612 B12R0.144 CCCCNC(=O)CC(OC)OC 1626a_100000102301_100000082724 [0,2,0,0,0,0|0,0,1]=3 4613 B12R0.144 CCCCNC(=O)CC(OC)OC 240690a_100000102301_100000082724 [0,2,0,0,0,0|0,0,1]=3 4614 B12R0.144 CCCCNC(=O)CC(OC)OC 527a_100000102301_100000082724 [0,2,0,0,0,0|0,0,1]=3 4615 B12R0.144 CCCCNC(C)CC(OC)OC 270004a_100000102301_100000210484 [0,2,0,0,0,0|0,0,0]=2 4616 B12R0.144 CCCCOC(C)CC(OC)OC 7a_100011018202_100000210211 [0,2,0,0,0,0|0,0,0]=2 4617 B12R0.144 CCCNN=C(C)CC(OC)OC 4a_100000740057_100000210484 [0,2,0,0,0,0|1,0,1]=4 4618 B12R0.144 CCCNNC(=O)CC(OC)OC 22a_100000740057_100000082724 [0,2,0,0,0,0|1,0,1]=4 4619 B12R0.144 CCCOCC(=O)CC(OC)OC 1458a_100000745993_100000751394 [0,2,0,0,0,0|0,0,1]=3 4620 B12R0.144 CCCSCC(=O)CC(OC)OC 1458a_100000217233_100000751394 [0,2,0,0,0,0|0,0,1]=3 4621 B12R0.144 CCOCCC(=O)CC(OC)OC 1458a_100000082724_100011215890 [0,2,0,0,0,0|0,0,1]=3 4622 B12R0.144 CCOCCC(=O)CC(OC)OC 1458a_100000749530_100000751394 [0,2,0,0,0,0|0,0,1]=3 4623 B12R0.144 CCOCCN(C)CC(OC)OC 269982a_100000225562_100011215890 [0,2,0,0,0,0|1,0,0]=3 4624 B12R0.144 CCSCCC(=O)CC(OC)OC 1458a_100000082724_100000757381 [0,2,0,0,0,0|0,0,1]=3 4625 B12R0.144 CCSCCC(=O)CC(OC)OC 1458a_100000230768_100000751394 [0,2,0,0,0,0|0,0,1]=3 4626 B12R0.144 CCSCCN(C)CC(OC)OC 269982a_100000225562_100000757381 [0,2,0,0,0,0|1,0,0]=3 4627 B12R0.144 COC(CC(=O)CCCC#N)OC 1458a_100000075515_100000751394 [0,2,0,0,0,0|0,0,2]=4 4628 B12R0.144 COC(CC(=O)CCCC#N)OC 1458a_100000082724_100000211468 [0,2,0,0,0,0|0,0,2]=4 4629 B12R0.144 COC(CC(=O)CCCCF)OC 1458a_100000082724_100000729493 [0,2,0,0,0,0|0,0,1]=3 4630 B12R0.144 COC(CC(=O)CCCCO)OC 1458a_100000082724_100000210776 [0,2,0,0,0,0|0,0,1]=3 4631 B12R0.144 COC(CC(=O)CCCCO)OC 1458a_100000695505_100000751394 [0,2,0,0,0,0|0,0,1]=3 4632 B12R0.144 COC(CC(=O)CCCSC)OC 1458a_100000173376_100000751394 [0,2,0,0,0,0|0,0,1]=3 4633 B12R0.144 COC(CC(=O)COCCO)OC 1458a_100000708028_100000751394 [0,2,0,0,0,0|1,0,1]=4 4634 B12R0.144 COC(CC(=O)NCCCF)OC 11a_100015189416_100000082724 [0,2,0,0,0,0|1,0,1]=4 4635 B12R0.144 COC(CC(=O)NCCCF)OC 1626a_100015189416_100000082724 [0,2,0,0,0,0|1,0,1]=4 4636 B12R0.144 COC(CC(=O)NCCCF)OC 240690a_100015189416_100000082724 [0,2,0,0,0,0|1,0,1]=4 4637 B12R0.144 COC(CC(=O)NCCCF)OC 527a_100015189416_100000082724 [0,2,0,0,0,0|1,0,1]=4 4638 B12R0.144 COC(CC(=O)NCCCO)OC 240690a_100000182051_100000082724 [0,2,0,0,0,0|1,0,1]=4 4639 B12R0.144 COC(CC(=O)NCCCO)OC 527a_100000182051_100000082724 [0,2,0,0,0,0|1,0,1]=4 4640 B12R0.144 COC(CC(=O)NCCSC)OC 11a_100020590264_100000082724 [0,2,0,0,0,0|1,0,1]=4 4641 B12R0.144 COC(CC(=O)NCCSC)OC 1626a_100020590264_100000082724 [0,2,0,0,0,0|1,0,1]=4 4642 B12R0.144 COC(CC(=O)NCCSC)OC 240690a_100020590264_100000082724 [0,2,0,0,0,0|1,0,1]=4 4643 B12R0.144 COC(CC(=O)NCCSC)OC 527a_100020590264_100000082724 [0,2,0,0,0,0|1,0,1]=4 4644 B12R0.144 COC(CC(C)NCCC#N)OC 270004a_100000720768_100000210484 [0,2,0,0,0,0|1,0,1]=4 4645 B12R0.144 COC(CC(C)NCCCF)OC 270004a_100015189416_100000210484 [0,2,0,0,0,0|1,0,0]=3 4646 B12R0.144 COC(CC(C)NCCCO)OC 270004a_100000182051_100000210484 [0,2,0,0,0,0|1,0,0]=3 4647 B12R0.144 COC(CC(C)NCCSC)OC 270004a_100020590264_100000210484 [0,2,0,0,0,0|1,0,0]=3 4648 B12R0.144 COC(CC(C)OCCC#N)OC 7a_100011018202_100000184422 [0,2,0,0,0,0|1,0,1]=4 4649 B12R0.144 COC(CC(C)OCCCF)OC 7a_100011018202_100011934791 [0,2,0,0,0,0|1,0,0]=3 4650 B12R0.144 COC(CC(C)OCCCO)OC 7a_100011018202_100011215043 [0,2,0,0,0,0|1,0,0]=3 4651 B12R0.144 COC(CC(C)OCCSC)OC 7a_100011018202_100000212216 [0,2,0,0,0,0|1,0,0]=3 4652 B12R0.144 COC(CN(C)CCCC#N)OC 269982a_100000225562_100000687738 [0,2,0,0,0,0|1,0,1]=4 4653 B12R0.144 COC(CN(C)CCCC=O)OC 269982a_100000225562_200011292268 [0,2,0,0,0,0|1,0,1]=4 4654 B12R0.144 COC(CN(C)CCCCF)OC 269982a_100000225562_100000729493 [0,2,0,0,0,0|1,0,0]=3 4655 B12R0.144 COC(CN(C)CCCCO)OC 2230a_100000717598_100000751394 [0,2,0,0,0,0|1,0,0]=3 4656 B12R0.144 COC(CN(C)CCCCO)OC 269982a_100000225562_100000210776 [0,2,0,0,0,0|1,0,0]=3 4657 B12R0.144 COC(CN(C)CCCCO)OC 270004a_100000717598_100000752162 [0,2,0,0,0,0|1,0,0]=3 4658 B12R0.144 COCCCC(=O)CC(OC)OC 1458a_100000082724_100000740836 [0,2,0,0,0,0|0,0,1]=3 4659 B12R0.144 COCCCC(=O)CC(OC)OC 1458a_100000741012_100000751394 [0,2,0,0,0,0|0,0,1]=3 4660 B12R0.144 COCCCN(C)CC(OC)OC 2230a_100000224831_100000751394 [0,2,0,0,0,0|1,0,0]=3 4661 B12R0.144 COCCCN(C)CC(OC)OC 269982a_100000225562_100000740836 [0,2,0,0,0,0|1,0,0]=3 4662 B12R0.144 COCCCN(C)CC(OC)OC 270004a_100000224831_100000752162 [0,2,0,0,0,0|1,0,0]=3 4663 B12R0.144 COCCNC(=O)CC(OC)OC 1626a_100000209980_100000082724 [0,2,0,0,0,0|1,0,1]=4 4664 B12R0.144 COCCNC(=O)CC(OC)OC 240690a_100000209980_100000082724 [0,2,0,0,0,0|1,0,1]=4 4665 B12R0.144 COCCNC(=O)CC(OC)OC 527a_100000209980_100000082724 [0,2,0,0,0,0|1,0,1]=4 4666 B12R0.144 COCCNC(C)CC(OC)OC 270004a_100000209980_100000210484 [0,2,0,0,0,0|1,0,0]=3 4667 B12R0.144 COCCOC(C)CC(OC)OC 7a_100011018202_100000233755 [0,2,0,0,0,0|1,0,0]=3 4668 B12R0.218 CCCCC(CC)CC(CC)OC 7a_200011216132_200000210301 [0,2,0,0,0,0|1,0,0]=3 4669 B12R0.218 CCCCC(CC)CC(CC)O[13CH3] 7a_200011216132_200025704644 [0,2,0,0,0,0|1,0,0]=3 4670 B12R0.218 CCCCN(CC)CC(OC)OC 2230a_100000207695_100000751394 [0,2,0,0,0,0|1,0,0]=3 4671 B12R0.218 CCCCN(CC)CC(OC)OC 270004a_100000207695_100000752162 [0,2,0,0,0,0|1,0,0]=3 4672 B12R0.218 CCN(CCOC)CC(OC)OC 2230a_100000731262_100000751394 [0,2,0,0,0,0|2,0,0]=4 4673 B12R0.218 CCN(CCOC)CC(OC)OC 270004a_100000731262_100000752162 [0,2,0,0,0,0|2,0,0]=4 4674 B12R0.454 CCCCC(=O)CP(=O)(OC)OC 1458a_100000034275_100000210211 [0,2,0,0,0,0|1,0,1]=4 4675 B12R0.454 CCCCN(C)CC(C)(OC)OC 2230a_100000207549_100000064154 [0,2,0,0,0,0|1,0,0]=3 4676 B12R0.454 CCCCN(C)CC(C)(OC)OC 269982a_100000207549_100000766008 [0,2,0,0,0,0|1,0,0]=3 4677 B12R0.454 CCCCN(C)C[Si](C)(OC)OC 269982a_100000207549_100000067953 [0,2,0,0,0,0|1,1,0]=4 4678 B12R0.454 CCCNC(C)CP(=O)(OC)OC 270004a_100020643023_100000751076 [0,2,0,0,0,0|2,0,0]=4 4679 B12R0.454 COC(C)(CN(C)CCCO)OC 2230a_100000213112_100000064154 [0,2,0,0,0,0|2,0,0]=4 4680 B12R0.454 COC(C)(CN(C)CCCO)OC 269982a_100000213112_100000766008 [0,2,0,0,0,0|2,0,0]=4 4681 B12R0.454 COC(C)(CN(C)CCSC)OC 2230a_100000686725_100000064154 [0,2,0,0,0,0|2,0,0]=4 4682 B12R0.454 COC(C)(CN(C)CCSC)OC 269982a_100000686725_100000766008 [0,2,0,0,0,0|2,0,0]=4 4683 B12R0.454 COCCN(C)CC(C)(OC)OC 2230a_100000743101_100000064154 [0,2,0,0,0,0|2,0,0]=4 4684 B12R0.454 COCCN(C)CC(C)(OC)OC 269982a_100000743101_100000766008 [0,2,0,0,0,0|2,0,0]=4 4685 B12R0.200 CCCCCCC(NC)C(=O)OC 2230a_106832991635_100009813864 [0,2,0,0,0,0|1,0,0]=3 4686 B12R0.200 CCCCCCC(NC)C(=O)OC 34a_100102657272_100009813864 [0,2,0,0,0,0|1,0,0]=3 4687 B12R0.200 CCCCCCC(NC)C(=O)OC 7a_106832991635_100009813864 [0,2,0,0,0,0|1,0,0]=3 4688 B12R0.200 CCCCCCC(OC)C(=O)OC 34a_100138415774_100009813864 [0,2,0,0,0,0|0,0,0]=2 4689 B12R0.200 CCCCCCC(OC)C(C)CC 34a_200011290773_200000210301 [0,2,0,0,0,0|1,0,0]=3 4690 B12R0.200 CCCCCCC(OC)C(C)CC 7a_200011290773_200000210301 [0,2,0,0,0,0|1,0,0]=3 4691 B12R0.200 CCCCCCC(O[13CH3])C(C)CC 34a_200011290773_200025704644 [0,2,0,0,0,0|1,0,0]=3 4692 B12R0.200 CCCCCCC(O[13CH3])C(C)CC 7a_200011290773_200025704644 [0,2,0,0,0,0|1,0,0]=3 4693 B12R0.200 CCCCCCC(SC)C(=O)OC 62a_100009813864_200000210301 [0,2,0,0,0,0|0,1,0]=3 4694 B12R0.200 CCCCCCC(SC)C(=O)OC 62a_200000210301_100009813864 [0,2,0,0,0,0|0,1,0]=3 4695 B12R0.200 CCCCCCC(S[13CH3])C(=O)OC 62a_100009813864_200025704644 [0,2,0,0,0,0|0,1,0]=3 4696 B12R0.200 CCCCCCC(S[13CH3])C(=O)OC 62a_200025704644_100009813864 [0,2,0,0,0,0|0,1,0]=3 4697 B12R0.200 CCCCCNC(CC)C(=O)OC 2230a_100000209983_100000235869 [0,2,0,0,0,0|2,0,0]=4 4698 B12R0.200 CCCCCOC(CC)C(=O)OC 34a_100000210253_100000235869 [0,2,0,0,0,0|2,0,0]=4 4699 B12R0.200 CCCCCOC(CC)C(=O)OC 34a_100000695916_100000718602 [0,2,0,0,0,0|2,0,0]=4 4700 B12R0.200 CCCCCOC(CC)C(=O)OC 7a_100000210253_100000742303 [0,2,0,0,0,0|2,0,0]=4 4701 B12R0.200 CCCCCOC(CC)C(=O)OC 7a_100000695916_100000210326 [0,2,0,0,0,0|2,0,0]=4 4702 B12R0.200 CCCCCOC(OC)C(=O)OC 34a_100000036821_100000718602 [0,2,0,0,0,0|1,0,0]=3 4703 B12R0.200 CCCCCOC(OC)C(=O)OC 34a_100000210253_100000101307 [0,2,0,0,0,0|1,0,0]=3 4704 B12R0.200 CCCCCSC(CC)C(=O)OC 62a_100000210326_100000235869 [0,2,0,0,0,0|2,0,0]=4 4705 B12R0.200 CCCCCSC(CC)C(=O)OC 62a_100000235869_100000210326 [0,2,0,0,0,0|2,0,0]=4 4706 B12R0.200 CCCCCSC(OC)C(=O)OC 62a_100000101307_100000210326 [0,2,0,0,0,0|1,0,0]=3 4707 B12R0.200 CCCCCSC(OC)C(=O)OC 62a_100000210326_100000101307 [0,2,0,0,0,0|1,0,0]=3 4708 B12R0.200 CCOCCNC(OC)C(=O)OC 34a_102516460346_100000101307 [0,2,0,0,0,0|2,0,0]=4 4709 B12R0.200 CCOCCOC(OC)C(=O)OC 34a_100000036821_100000210147 [0,2,0,0,0,0|2,0,0]=4 4710 B12R0.200 CCOCCOC(OC)C(=O)OC 34a_100000210136_100000101307 [0,2,0,0,0,0|2,0,0]=4 4711 B12R0.200 CCOCCSC(OC)C(=O)OC 62a_100000101307_100011215890 [0,2,0,0,0,0|2,0,0]=4 4712 B12R0.200 CCOCCSC(OC)C(=O)OC 62a_100000210147_100000101307 [0,2,0,0,0,0|2,0,0]=4 4713 B12R0.200 CCSCCOC(OC)C(=O)OC 34a_100000036821_100000757381 [0,2,0,0,0,0|2,0,0]=4 4714 B12R0.200 CCSCCOC(OC)C(=O)OC 34a_100000212035_100000101307 [0,2,0,0,0,0|2,0,0]=4 4715 B12R0.200 CCSCCSC(OC)C(=O)OC 62a_100000101307_100000757381 [0,2,0,0,0,0|2,0,0]=4 4716 B12R0.200 CCSCCSC(OC)C(=O)OC 62a_100000757381_100000101307 [0,2,0,0,0,0|2,0,0]=4 4717 B12R0.200 CNCCCOC(OC)C(=O)OC 34a_100000213112_100000101307 [0,2,0,0,0,0|2,0,0]=4 4718 B12R0.200 COC(=O)C(NCCCCO)OC 34a_100000750430_100000101307 [0,2,0,0,0,0|2,0,0]=4 4719 B12R0.200 COC(=O)C(OC)OCCCCBr 34a_100011216708_100000101307 [0,2,0,0,0,0|2,0,0]=4 4720 B12R0.200 COC(=O)C(OC)OCCCCCl 34a_100000210776_100000101307 [0,2,0,0,0,0|2,0,0]=4 4721 B12R0.200 COC(=O)C(OC)OCCCCF 34a_100000036821_100000729493 [0,2,0,0,0,0|2,0,0]=4 4722 B12R0.200 COC(=O)C(OC)OCCCCF 34a_100011995726_100000101307 [0,2,0,0,0,0|2,0,0]=4 4723 B12R0.200 COC(=O)C(OC)OCCCCI 34a_200012148704_100000101307 [0,2,0,0,0,0|2,0,0]=4 4724 B12R0.200 COC(=O)C(OC)OCCCCN 34a_100000750430_100000101307 [0,2,0,0,0,0|2,0,0]=4 4725 B12R0.200 COC(=O)C(OC)OCCCCO 34a_100000036821_100011216708 [0,2,0,0,0,0|2,0,0]=4 4726 B12R0.200 COC(=O)C(OC)OCCCSC 34a_100000690336_100000101307 [0,2,0,0,0,0|2,0,0]=4 4727 B12R0.200 COC(=O)C(OC)SCCCCF 62a_100000101307_100000729493 [0,2,0,0,0,0|2,0,0]=4 4728 B12R0.200 COC(=O)C(OC)SCCCCF 62a_100000729493_100000101307 [0,2,0,0,0,0|2,0,0]=4 4729 B12R0.200 COC(=O)C(OC)SCCCCO 62a_100000101307_100000210776 [0,2,0,0,0,0|2,0,0]=4 4730 B12R0.200 COC(=O)C(OC)SCCCCO 62a_100000210776_100000101307 [0,2,0,0,0,0|2,0,0]=4 4731 B12R0.200 COCCCNC(OC)C(=O)OC 34a_100150723488_100000101307 [0,2,0,0,0,0|2,0,0]=4 4732 B12R0.200 COCCCOC(OC)C(=O)OC 34a_100000036821_100000740836 [0,2,0,0,0,0|2,0,0]=4 4733 B12R0.200 COCCCOC(OC)C(=O)OC 34a_100000740835_100000101307 [0,2,0,0,0,0|2,0,0]=4 4734 B12R0.200 COCCCSC(OC)C(=O)OC 62a_100000101307_100000709357 [0,2,0,0,0,0|2,0,0]=4 4735 B12R0.200 COCCCSC(OC)C(=O)OC 62a_100000709357_100000101307 [0,2,0,0,0,0|2,0,0]=4 4736 B12R0.201 CCCCCCCC(CC)N(C)C 270004a_100102631434_200011217162 [0,2,0,0,0,0|2,0,0]=4 4737 B12R0.201 CCCCCCNC(CC)C(C)C 270004a_100000210581_100000210600 [0,2,0,0,0,0|2,0,0]=4 4738 B12R0.201 CCCCCCN[C@@H](CC)[C@@H](C)O 2230a_100161114882_100000210314 [0,2,0,0,0,0|2,0,0]=4 4739 B12R0.201 CCCCCCN[C@@H](CC)[C@@H](C)O 34a_100161114882_100000210314 [0,2,0,0,0,0|2,0,0]=4 4740 B12R0.201 CCCCCCOC(CC)C(C)C 34a_100011218073_100000210314 [0,2,0,0,0,0|2,0,0]=4 4741 B12R0.201 CCCCCCOC(CC)C(C)C 7a_100011218073_100000210314 [0,2,0,0,0,0|2,0,0]=4 4742 B12R0.201 CCCCCNCC(CC)C(C)C 269862a_100000209983_100011214906 [0,2,0,0,0,0|2,0,0]=4 4743 B12R0.201 CCCCCOCC(CC)C(C)C 34a_100011995916_100000718602 [0,2,0,0,0,0|2,0,0]=4 4744 B12R0.201 CCCCCOCC(CC)C(C)C 7a_100011995916_100000210326 [0,2,0,0,0,0|2,0,0]=4 4745 B12R0.203 CCCCCCC(CCC)N(C)C 270004a_100102631434_200011215359 [0,2,0,0,0,0|2,0,0]=4 4746 B12R0.203 CCCCCNC(COC)C(C)C 2230a_100000760233_100000210326 [0,2,0,0,0,0|2,0,0]=4 4747 B12R0.35 C=C(Br)CCOCCC(OC)OC 34a_100009813270_100000139399 [0,2,0,0,0,0|0,0,2]=4 4748 B12R0.35 C=C(C)CCOCCC(OC)OC 34a_100000764851_100000139399 [0,2,0,0,0,0|0,0,1]=3 4749 B12R0.35 C=C(C)CCSCCC(OC)OC 62a_100000139399_100000730704 [0,2,0,0,0,0|0,0,1]=3 4750 B12R0.35 C=C(C)CCSCCC(OC)OC 62a_100000730704_100000139399 [0,2,0,0,0,0|0,0,1]=3 4751 B12R0.35 C=C(C)COCCCC(OC)OC 34a_100000210245_100000069011 [0,2,0,0,0,0|0,0,1]=3 4752 B12R0.35 C=C(C)CSCCCC(OC)OC 62a_100000069011_100000211660 [0,2,0,0,0,0|0,0,1]=3 4753 B12R0.35 C=C(C)CSCCCC(OC)OC 62a_100000748629_100000069011 [0,2,0,0,0,0|0,0,1]=3 4754 B12R0.35 C=C(F)COCCCC(OC)OC 34a_200010262243_100000069011 [0,2,0,0,0,0|0,0,2]=4 4755 B12R0.35 C=C(F)CSCCCC(OC)OC 62a_100000042424_100000069011 [0,2,0,0,0,0|0,0,2]=4 4756 B12R0.35 C=C(F)CSCCCC(OC)OC 62a_100000069011_100000042424 [0,2,0,0,0,0|0,0,2]=4 4757 B12R0.35 CCC(CC)CNCCCC(C)C 2230a_100102946423_100011214892 [0,2,0,0,0,0|2,0,0]=4 4758 B12R0.35 CCC(CC)CNCCCC(C)C 2230a_200000737386_100011215472 [0,2,0,0,0,0|2,0,0]=4 4759 B12R0.35 CCC(CC)CNCCCC(C)C 269862a_200000737386_100000211137 [0,2,0,0,0,0|2,0,0]=4 4760 B12R0.35 CCC(CC)CNCCCC(C)C 270004a_200000737386_100000211137 [0,2,0,0,0,0|2,0,0]=4 4761 B12R0.35 CCC(CC)CNCCCC(C)C 34a_200000737386_100011215472 [0,2,0,0,0,0|2,0,0]=4 4762 B12R0.35 CCC(CC)CNCCCC(C)O 2230a_100102946423_200000718107 [0,2,0,0,0,0|2,0,0]=4 4763 B12R0.35 CCC(CC)COCCCC(C)C 34a_100000210774_100011215472 [0,2,0,0,0,0|2,0,0]=4 4764 B12R0.35 CCC(CC)COCCCC(C)C 7a_100000210774_100011215472 [0,2,0,0,0,0|2,0,0]=4 4765 B12R0.35 CCC(CC)COCCCC(C)C 7a_100000703878_100011214892 [0,2,0,0,0,0|2,0,0]=4 4766 B12R0.35 CCC(CC)COCCCC(C)O 7a_100000703878_200000718107 [0,2,0,0,0,0|2,0,0]=4 4767 B12R0.35 CCC(CC)CSCCCC(C)C 62a_100011214892_100011215472 [0,2,0,0,0,0|2,0,0]=4 4768 B12R0.35 CCC(CC)CSCCCC(C)C 62a_100011215472_100011214892 [0,2,0,0,0,0|2,0,0]=4 4769 B12R0.35 CCC(CC)CSCCCC(C)O 62a_100011215472_200000718107 [0,2,0,0,0,0|2,0,0]=4 4770 B12R0.35 CCC(CC)CSCCCC(C)O 62a_200000718107_100011215472 [0,2,0,0,0,0|2,0,0]=4 4771 B12R0.35 CCC(CC)NCCCCC(C)C 2230a_100000199018_100011216152 [0,2,0,0,0,0|2,0,0]=4 4772 B12R0.35 CCC(CC)OCCCCC(C)C 7a_100000688536_100011216152 [0,2,0,0,0,0|2,0,0]=4 4773 B12R0.35 CCC(CC)OCCCCC(C)C 7a_100011214890_100000210505 [0,2,0,0,0,0|2,0,0]=4 4774 B12R0.35 CCC(CC)SCCCCC(C)C 62a_100000210505_100011216152 [0,2,0,0,0,0|2,0,0]=4 4775 B12R0.35 CCC(CC)SCCCCC(C)C 62a_100011216152_100000210505 [0,2,0,0,0,0|2,0,0]=4 4776 B12R0.35 CCC(COCCCC(=O)C)OC 34a_100011934954_100000685027 [0,2,0,0,0,0|1,0,1]=4 4777 B12R0.35 CCC(COCCCC(=O)C)OC 7a_100011934954_100011215641 [0,2,0,0,0,0|1,0,1]=4 4778 B12R0.35 CCC(COCCCC(C)C)OC 34a_100011934954_100011214892 [0,2,0,0,0,0|1,0,0]=3 4779 B12R0.35 CCC(COCCCC(C)C)OC 7a_100011934954_100011214892 [0,2,0,0,0,0|1,0,0]=3 4780 B12R0.35 CCC(COCCCC(C)O)OC 34a_100011934954_200000718107 [0,2,0,0,0,0|1,0,0]=3 4781 B12R0.35 CCC(COCCCC(C)O)OC 7a_100011934954_200000718107 [0,2,0,0,0,0|1,0,0]=3 4782 B12R0.35 CCC(COCCCN(C)C)OC 7a_100011934954_100000757444 [0,2,0,0,0,0|2,0,0]=4 4783 B12R0.35 CCC(COCCOC(C)C)OC 34a_100011934954_100000211751 [0,2,0,0,0,0|2,0,0]=4 4784 B12R0.35 CCC(COCCOC(C)C)OC 7a_100011934954_100000211751 [0,2,0,0,0,0|2,0,0]=4 4785 B12R0.35 CCC(COCCSC(C)C)OC 34a_100011934954_100000730970 [0,2,0,0,0,0|2,0,0]=4 4786 B12R0.35 CCC(COCCSC(C)C)OC 7a_100011934954_100000730970 [0,2,0,0,0,0|2,0,0]=4 4787 B12R0.35 COC(CCCNCC(=O)N)OC 2230a_100000711301_100000069011 [0,2,0,0,0,0|1,0,1]=4 4788 B12R0.35 COC(CCCNCC(=O)O)OC 269956a_100016091260_100000069011 [0,2,0,0,0,0|1,0,1]=4 4789 B12R0.35 COC(CCCNCC(C)C)OC 2230a_100000210953_100000069011 [0,2,0,0,0,0|0,0,0]=2 4790 B12R0.35 COC(CCCNCC(C)C)OC 270004a_100000034021_100000210432 [0,2,0,0,0,0|0,0,0]=2 4791 B12R0.35 COC(CCCNCC(C)C)OC 34a_100000210953_100000069011 [0,2,0,0,0,0|0,0,0]=2 4792 B12R0.35 COC(CCCNCC(C)O)OC 2230a_100000210904_100000069011 [0,2,0,0,0,0|0,0,0]=2 4793 B12R0.35 COC(CCCNCC(C)O)OC 34a_100000210904_100000069011 [0,2,0,0,0,0|0,0,0]=2 4794 B12R0.35 COC(CCCNCC(F)F)OC 34a_100000765723_100000069011 [0,2,0,0,0,0|1,0,0]=3 4795 B12R0.35 COC(CCCOCC(=O)C)OC 34a_100000211253_100000069011 [0,2,0,0,0,0|0,0,1]=3 4796 B12R0.35 COC(CCCOCC(C)Br)OC 34a_100012180447_100000069011 [0,2,0,0,0,0|0,0,0]=2 4797 B12R0.35 COC(CCCOCC(C)C)OC 34a_100000210257_100000069011 [0,2,0,0,0,0|0,0,0]=2 4798 B12R0.35 COC(CCCOCC(C)F)OC 34a_100015925927_100000069011 [0,2,0,0,0,0|0,0,0]=2 4799 B12R0.35 COC(CCCOCC(F)F)OC 34a_100000743014_100000069011 [0,2,0,0,0,0|1,0,0]=3 4800 B12R0.35 COC(CCCOC[C@@H](C)Cl)OC 34a_100016084084_100000069011 [0,2,0,0,0,0|0,0,0]=2 4801 B12R0.35 COC(CCCOC[C@@H](C)N)OC 34a_100000737577_100000069011 [0,2,0,0,0,0|0,0,0]=2 4802 B12R0.35 COC(CCCSCC(=O)N)OC 62a_100000069011_100000747473 [0,2,0,0,0,0|1,0,1]=4 4803 B12R0.35 COC(CCCSCC(=O)N)OC 62a_100000747473_100000069011 [0,2,0,0,0,0|1,0,1]=4 4804 B12R0.35 COC(CCCSCC(=O)[O-])OC 62a_100000069011_100020667443 [0,2,0,0,0,0|1,0,1]=4 4805 B12R0.35 COC(CCCSCC(=O)[O-])OC 62a_100020667443_100000069011 [0,2,0,0,0,0|1,0,1]=4 4806 B12R0.35 COC(CCCSCC(C)C)OC 62a_100000069011_100000210760 [0,2,0,0,0,0|0,0,0]=2 4807 B12R0.35 COC(CCCSCC(C)C)OC 62a_100000210624_100000069011 [0,2,0,0,0,0|0,0,0]=2 4808 B12R0.35 COC(CCCSCC(C)O)OC 62a_100000069011_100011218427 [0,2,0,0,0,0|0,0,0]=2 4809 B12R0.35 COC(CCCSCC(C)O)OC 62a_100011218427_100000069011 [0,2,0,0,0,0|0,0,0]=2 4810 B12R0.35 COC(CCCSCC(F)F)OC 62a_100000069011_100011934356 [0,2,0,0,0,0|1,0,0]=3 4811 B12R0.35 COC(CCCSCC(F)F)OC 62a_100011934356_100000069011 [0,2,0,0,0,0|1,0,0]=3 4812 B12R0.35 COC(CCCSC[C@@H](C)O)OC 62a_100000069011_100009817552 [0,2,0,0,0,0|0,0,0]=2 4813 B12R0.35 COC(CCCSC[C@@H](C)O)OC 62a_100009817552_100000069011 [0,2,0,0,0,0|0,0,0]=2 4814 B12R0.35 COC(CCCSC[N+](=O)[O-])OC 62a_100000069011_100000761209 [0,2,0,0,0,0|2,0,0]=4 4815 B12R0.35 COC(CCNCC=C(C)C)OC 34a_100000718196_100000139399 [0,2,0,0,0,0|0,0,2]=4 4816 B12R0.35 COC(CCNCCC(C)O)OC 2230a_200000755665_100009813347 [0,2,0,0,0,0|0,0,0]=2 4817 B12R0.35 COC(CCOCC=C(C)C)OC 34a_100000753907_100000139399 [0,2,0,0,0,0|0,0,2]=4 4818 B12R0.35 COC(CCOCCC(=O)C)OC 34a_100000759926_100000139399 [0,2,0,0,0,0|0,0,1]=3 4819 B12R0.35 COC(CCOCCC(=O)C)OC 7a_100000759926_100009813347 [0,2,0,0,0,0|0,0,1]=3 4820 B12R0.35 COC(CCOCCC(=O)N)OC 34a_100000757172_100000139399 [0,2,0,0,0,0|1,0,1]=4 4821 B12R0.35 COC(CCOCCC(=O)N)OC 7a_100000757172_100009813347 [0,2,0,0,0,0|1,0,1]=4 4822 B12R0.35 COC(CCOCCC(C)Br)OC 34a_100009893172_100000139399 [0,2,0,0,0,0|0,0,0]=2 4823 B12R0.35 COC(CCOCCC(C)C)OC 34a_100000210254_100000139399 [0,2,0,0,0,0|0,0,0]=2 4824 B12R0.35 COC(CCOCCC(C)C)OC 7a_100000210254_100009813347 [0,2,0,0,0,0|0,0,0]=2 4825 B12R0.35 COC(CCOCCC(F)F)OC 34a_100103093639_100000139399 [0,2,0,0,0,0|1,0,0]=3 4826 B12R0.35 COC(CCOCC[C@@H](C)N)OC 34a_100000706166_100000139399 [0,2,0,0,0,0|0,0,0]=2 4827 B12R0.35 COC(CCSCC=C(C)C)OC 62a_100000139399_100000761012 [0,2,0,0,0,0|0,0,2]=4 4828 B12R0.35 COC(CCSCC=C(C)C)OC 62a_100000761012_100000139399 [0,2,0,0,0,0|0,0,2]=4 4829 B12R0.35 COC(CCSCCC(=O)C)OC 62a_100000053229_100000139399 [0,2,0,0,0,0|0,0,1]=3 4830 B12R0.35 COC(CCSCCC(=O)C)OC 62a_100000139399_100000053229 [0,2,0,0,0,0|0,0,1]=3 4831 B12R0.35 COC(CCSCCC(=O)N)OC 62a_100000139399_100000744528 [0,2,0,0,0,0|1,0,1]=4 4832 B12R0.35 COC(CCSCCC(=O)N)OC 62a_100000744528_100000139399 [0,2,0,0,0,0|1,0,1]=4 4833 B12R0.35 COC(CCSCCC(C)C)OC 62a_100000139399_100000210312 [0,2,0,0,0,0|0,0,0]=2 4834 B12R0.35 COC(CCSCCC(C)C)OC 62a_100000210312_100000139399 [0,2,0,0,0,0|0,0,0]=2 4835 B12R0.35 COC(CCSCCC(C)O)OC 62a_100000139399_100012276601 [0,2,0,0,0,0|0,0,0]=2 4836 B12R0.35 COC(CCSCCC(C)O)OC 62a_100012276601_100000139399 [0,2,0,0,0,0|0,0,0]=2 4837 B12R0.35 COC(CCSCCN(C)C)OC 62a_100000139399_100000755713 [0,2,0,0,0,0|1,0,0]=3 4838 B12R0.35 COC(CCSCOC(=O)C)OC 62a_100000076356_100000139399 [0,2,0,0,0,0|1,0,1]=4 4839 B12R0.35 COC(CCSCOC(=O)C)OC 62a_100000139399_100000076356 [0,2,0,0,0,0|1,0,1]=4 4840 B12R0.35 COC(CCSCOC(C)C)OC 62a_100000139399_100000709892 [0,2,0,0,0,0|1,0,0]=3 4841 B12R0.35 COC(CCSCOC(C)C)OC 62a_100000709892_100000139399 [0,2,0,0,0,0|1,0,0]=3 4842 B12R0.35 COC(CNCCCC(=O)N)OC 34a_100000739312_100000211822 [0,2,0,0,0,0|1,0,1]=4 4843 B12R0.35 COC(CNCCCC(C)C)OC 2230a_200000737386_100000751394 [0,2,0,0,0,0|0,0,0]=2 4844 B12R0.35 COC(CNCCCC(C)C)OC 270004a_200000737386_100000752162 [0,2,0,0,0,0|0,0,0]=2 4845 B12R0.35 COC(CNCCCC(C)C)OC 34a_200000737386_100000211822 [0,2,0,0,0,0|0,0,0]=2 4846 B12R0.35 COC(CNCCCN(C)C)OC 270004a_102531767803_100000752162 [0,2,0,0,0,0|1,0,0]=3 4847 B12R0.35 COC(CNCCCS(=O)C)OC 2230a_200000753449_100000751394 [0,2,0,0,0,0|1,0,0]=3 4848 B12R0.35 COC(CNCCCS(=O)C)OC 270004a_200000753449_100000752162 [0,2,0,0,0,0|1,0,0]=3 4849 B12R0.35 COC(CNCCNC(=O)C)OC 2230a_100000209853_100000751394 [0,2,0,0,0,0|1,0,1]=4 4850 B12R0.35 COC(CNCCOC(C)C)OC 2230a_100000701111_100000751394 [0,2,0,0,0,0|1,0,0]=3 4851 B12R0.35 COC(CNCCOC(C)C)OC 270004a_100000701111_100000752162 [0,2,0,0,0,0|1,0,0]=3 4852 B12R0.35 COC(CNCCOC(C)C)OC 34a_100000701111_100000211822 [0,2,0,0,0,0|1,0,0]=3 4853 B12R0.35 COC(CNCCSC(C)C)OC 2230a_100000731138_100000751394 [0,2,0,0,0,0|1,0,0]=3 4854 B12R0.35 COC(CNCCSC(C)C)OC 270004a_100000731138_100000752162 [0,2,0,0,0,0|1,0,0]=3 4855 B12R0.35 COC(CNCCSC(C)C)OC 34a_100000731138_100000211822 [0,2,0,0,0,0|1,0,0]=3 4856 B12R0.35 COC(COCCC=C(C)C)OC 34a_100011216393_100011217483 [0,2,0,0,0,0|0,0,2]=4 4857 B12R0.35 COC(COCCCC(=O)C)OC 34a_100000759063_100000211822 [0,2,0,0,0,0|0,0,1]=3 4858 B12R0.35 COC(COCCCC(=O)C)OC 34a_100011216393_100000685027 [0,2,0,0,0,0|0,0,1]=3 4859 B12R0.35 COC(COCCCC(=O)C)OC 7a_100000759063_100000751394 [0,2,0,0,0,0|0,0,1]=3 4860 B12R0.35 COC(COCCCC(=O)N)OC 34a_100011216393_100102525003 [0,2,0,0,0,0|1,0,1]=4 4861 B12R0.35 COC(COCCCC(C)C)OC 34a_100000210774_100000211822 [0,2,0,0,0,0|0,0,0]=2 4862 B12R0.35 COC(COCCCC(C)C)OC 34a_100011216393_100011214892 [0,2,0,0,0,0|0,0,0]=2 4863 B12R0.35 COC(COCCCC(C)C)OC 7a_100000210774_100000751394 [0,2,0,0,0,0|0,0,0]=2 4864 B12R0.35 COC(COCCCC(C)O)OC 34a_100011216393_200000718107 [0,2,0,0,0,0|0,0,0]=2 4865 B12R0.35 COC(COCCC[N+](=O)[O-])OC 34a_200000037920_100000211822 [0,2,0,0,0,0|2,0,0]=4 4866 B12R0.35 COC(COCCNC(=O)C)OC 11a_100000692409_100015343762 [0,2,0,0,0,0|1,0,1]=4 4867 B12R0.35 COC(COCCNC(=O)C)OC 1626a_100000692409_100015343762 [0,2,0,0,0,0|1,0,1]=4 4868 B12R0.35 COC(COCCNC(=O)C)OC 240690a_100000692409_100015343762 [0,2,0,0,0,0|1,0,1]=4 4869 B12R0.35 COC(COCCNC(=O)C)OC 34a_100000158858_100000211822 [0,2,0,0,0,0|1,0,1]=4 4870 B12R0.35 COC(COCCNC(=O)C)OC 527a_100000692409_100103153847 [0,2,0,0,0,0|1,0,1]=4 4871 B12R0.35 COC(COCCNC(C)C)OC 34a_100000224655_100000211822 [0,2,0,0,0,0|1,0,0]=3 4872 B12R0.35 COC(COCCOC(=O)C)OC 34a_100011216393_100009814007 [0,2,0,0,0,0|1,0,1]=4 4873 B12R0.35 COC(COCCOC(C)C)OC 34a_100000211219_100000211822 [0,2,0,0,0,0|1,0,0]=3 4874 B12R0.35 COC(COCCOC(C)C)OC 34a_100011216393_100000211751 [0,2,0,0,0,0|1,0,0]=3 4875 B12R0.35 COC(COCCOC(C)C)OC 7a_100000211219_100000751394 [0,2,0,0,0,0|1,0,0]=3 4876 B12R0.35 COC(COCCSC(C)C)OC 34a_100011216393_100000730970 [0,2,0,0,0,0|1,0,0]=3 4877 B12R0.35 COC(COCCSC(C)C)OC 34a_200011212901_100000211822 [0,2,0,0,0,0|1,0,0]=3 4878 B12R0.35 COC(COCCSC(C)C)OC 7a_200011212901_100000751394 [0,2,0,0,0,0|1,0,0]=3 4879 B12R0.35 COC(CSCCC=C(C)C)OC 62a_100000751394_100011217483 [0,2,0,0,0,0|0,0,2]=4 4880 B12R0.35 COC(CSCCC=C(C)C)OC 62a_100011217483_100000751394 [0,2,0,0,0,0|0,0,2]=4 4881 B12R0.35 COC(CSCCCC(=O)C)OC 62a_100000751394_100011215641 [0,2,0,0,0,0|0,0,1]=3 4882 B12R0.35 COC(CSCCCC(=O)C)OC 62a_100011215641_100000751394 [0,2,0,0,0,0|0,0,1]=3 4883 B12R0.35 COC(CSCCCC(=O)N)OC 62a_100000751394_100102525003 [0,2,0,0,0,0|1,0,1]=4 4884 B12R0.35 COC(CSCCCC(=O)N)OC 62a_100102525003_100000751394 [0,2,0,0,0,0|1,0,1]=4 4885 B12R0.35 COC(CSCCCC(C)C)OC 62a_100000751394_100011214892 [0,2,0,0,0,0|0,0,0]=2 4886 B12R0.35 COC(CSCCCC(C)C)OC 62a_100011214892_100000751394 [0,2,0,0,0,0|0,0,0]=2 4887 B12R0.35 COC(CSCCCC(C)O)OC 62a_100000751394_200000718107 [0,2,0,0,0,0|0,0,0]=2 4888 B12R0.35 COC(CSCCCC(C)O)OC 62a_200000718107_100000751394 [0,2,0,0,0,0|0,0,0]=2 4889 B12R0.35 COC(CSCCCN(C)C)OC 62a_100000751394_100000757444 [0,2,0,0,0,0|1,0,0]=3 4890 B12R0.35 COC(CSCCNC(=O)C)OC 62a_100000189650_100000751394 [0,2,0,0,0,0|1,0,1]=4 4891 B12R0.35 COC(CSCCNC(=O)C)OC 62a_100000751394_100000189650 [0,2,0,0,0,0|1,0,1]=4 4892 B12R0.35 COC(CSCCOC(=O)C)OC 62a_100000751394_100009814007 [0,2,0,0,0,0|1,0,1]=4 4893 B12R0.35 COC(CSCCOC(=O)C)OC 62a_100009814007_100000751394 [0,2,0,0,0,0|1,0,1]=4 4894 B12R0.35 COC(CSCCOC(C)C)OC 62a_100000211751_100000751394 [0,2,0,0,0,0|1,0,0]=3 4895 B12R0.35 COC(CSCCOC(C)C)OC 62a_100000751394_100000211751 [0,2,0,0,0,0|1,0,0]=3 4896 B12R0.35 COC(CSCCSC(C)C)OC 62a_100000730970_100000751394 [0,2,0,0,0,0|1,0,0]=3 4897 B12R0.35 COC(CSCCSC(C)C)OC 62a_100000751394_100000730970 [0,2,0,0,0,0|1,0,0]=3 4898 B12R0.57 C#CCCCCNCC(OC)OC 2230a_100000706060_100000751394 [0,2,0,0,0,0|0,0,1]=3 4899 B12R0.57 C#CCCCCNCC(OC)OC 34a_100000706060_100000211822 [0,2,0,0,0,0|0,0,1]=3 4900 B12R0.57 C#CCCCCOCC(CC)OC 34a_100011934954_100010269958 [0,2,0,0,0,0|1,0,1]=4 4901 B12R0.57 C#CCCCCOCC(CC)OC 7a_100011934954_100010269958 [0,2,0,0,0,0|1,0,1]=4 4902 B12R0.57 C#CCCCCOCC(OC)OC 34a_100000766709_100000211822 [0,2,0,0,0,0|0,0,1]=3 4903 B12R0.57 C#CCCCCOCC(OC)OC 34a_100011216393_100010269958 [0,2,0,0,0,0|0,0,1]=3 4904 B12R0.57 C#CCCCCOCC(OC)OC 7a_100000766709_100000751394 [0,2,0,0,0,0|0,0,1]=3 4905 B12R0.57 C#CCCCCSCC(OC)OC 62a_100000751394_100010269958 [0,2,0,0,0,0|0,0,1]=3 4906 B12R0.57 C#CCCCCSCC(OC)OC 62a_100010269958_100000751394 [0,2,0,0,0,0|0,0,1]=3 4907 B12R0.57 C#CCCCNCCC(OC)OC 34a_100000718082_100000139399 [0,2,0,0,0,0|0,0,1]=3 4908 B12R0.57 C#CCCCOCCC(OC)OC 34a_100000215630_100000139399 [0,2,0,0,0,0|0,0,1]=3 4909 B12R0.57 C#CCCCOCCC(OC)OC 7a_100000215630_100009813347 [0,2,0,0,0,0|0,0,1]=3 4910 B12R0.57 C#CCCCSCCC(OC)OC 62a_100000139399_100011215417 [0,2,0,0,0,0|0,0,1]=3 4911 B12R0.57 C#CCCCSCCC(OC)OC 62a_100011215417_100000139399 [0,2,0,0,0,0|0,0,1]=3 4912 B12R0.57 C#CCCNCCCC(OC)OC 34a_100000755551_100000069011 [0,2,0,0,0,0|0,0,1]=3 4913 B12R0.57 C#CCCOCCCC(OC)OC 34a_100011215631_100000069011 [0,2,0,0,0,0|0,0,1]=3 4914 B12R0.57 C#CCCSCCCC(OC)OC 62a_100000069011_100000688953 [0,2,0,0,0,0|0,0,1]=3 4915 B12R0.57 C#CCCSCCCC(OC)OC 62a_100000688953_100000069011 [0,2,0,0,0,0|0,0,1]=3 4916 B12R0.57 C#CCOCCNCC(OC)OC 2230a_100000700922_100000751394 [0,2,0,0,0,0|0,0,2]=4 4917 B12R0.57 C#CCOCCNCC(OC)OC 34a_100000700922_100000211822 [0,2,0,0,0,0|0,0,2]=4 4918 B12R0.57 C#CCOCCOCC(OC)OC 34a_100000054580_100000211822 [0,2,0,0,0,0|0,0,2]=4 4919 B12R0.57 C#CCOCCOCC(OC)OC 34a_100011216393_100010402529 [0,2,0,0,0,0|0,0,2]=4 4920 B12R0.57 C#CCOCCOCC(OC)OC 7a_100000054580_100000751394 [0,2,0,0,0,0|0,0,2]=4 4921 B12R0.57 C#CCOCCSCC(OC)OC 62a_100000751394_100010402529 [0,2,0,0,0,0|0,0,2]=4 4922 B12R0.57 C#CCOCCSCC(OC)OC 62a_100010402529_100000751394 [0,2,0,0,0,0|0,0,2]=4 4923 B12R0.57 C/C=C/CCOCCC(OC)OC 34a_100016278192_100000139399 [0,2,0,0,0,0|0,0,1]=3 4924 B12R0.57 C/C=C/COCCCC(OC)OC 34a_100016270725_100000069011 [0,2,0,0,0,0|0,0,1]=3 4925 B12R0.57 C/C=C/CSCCCC(OC)OC 62a_100000069011_100102629194 [0,2,0,0,0,0|0,0,1]=3 4926 B12R0.57 C/C=C/CSCCCC(OC)OC 62a_100102629194_100000069011 [0,2,0,0,0,0|0,0,1]=3 4927 B12R0.57 C=CCCCCNCC(OC)OC 2230a_100000703577_100000751394 [0,2,0,0,0,0|0,0,1]=3 4928 B12R0.57 C=CCCCCNCC(OC)OC 270004a_100000703577_100000752162 [0,2,0,0,0,0|0,0,1]=3 4929 B12R0.57 C=CCCCCNCC(OC)OC 34a_100000703577_100000211822 [0,2,0,0,0,0|0,0,1]=3 4930 B12R0.57 C=CCCCCOCC(CC)OC 34a_100011934954_100011215482 [0,2,0,0,0,0|1,0,1]=4 4931 B12R0.57 C=CCCCCOCC(CC)OC 7a_100011934954_100011215482 [0,2,0,0,0,0|1,0,1]=4 4932 B12R0.57 C=CCCCCOCC(OC)OC 34a_100000766645_100000211822 [0,2,0,0,0,0|0,0,1]=3 4933 B12R0.57 C=CCCCCOCC(OC)OC 34a_100011216393_100011215482 [0,2,0,0,0,0|0,0,1]=3 4934 B12R0.57 C=CCCCCOCC(OC)OC 7a_100000766645_100000751394 [0,2,0,0,0,0|0,0,1]=3 4935 B12R0.57 C=CCCCCSCC(OC)OC 62a_100000751394_100011215482 [0,2,0,0,0,0|0,0,1]=3 4936 B12R0.57 C=CCCCCSCC(OC)OC 62a_100011215482_100000751394 [0,2,0,0,0,0|0,0,1]=3 4937 B12R0.57 C=CCCCNCCC(OC)OC 2230a_100000700776_100009813347 [0,2,0,0,0,0|0,0,1]=3 4938 B12R0.57 C=CCCCNCCC(OC)OC 34a_100000700776_100000139399 [0,2,0,0,0,0|0,0,1]=3 4939 B12R0.57 C=CCCCOCCC(OC)OC 34a_100000758997_100000139399 [0,2,0,0,0,0|0,0,1]=3 4940 B12R0.57 C=CCCCOCCC(OC)OC 7a_100000758997_100009813347 [0,2,0,0,0,0|0,0,1]=3 4941 B12R0.57 C=CCCCSCCC(OC)OC 62a_100000139399_100000757094 [0,2,0,0,0,0|0,0,1]=3 4942 B12R0.57 C=CCCCSCCC(OC)OC 62a_100011713584_100000139399 [0,2,0,0,0,0|0,0,1]=3 4943 B12R0.57 C=CCCNCCCC(OC)OC 2230a_100015191253_100000069011 [0,2,0,0,0,0|0,0,1]=3 4944 B12R0.57 C=CCCOCCCC(OC)OC 34a_100011205117_100000069011 [0,2,0,0,0,0|0,0,1]=3 4945 B12R0.57 C=CCCSCCCC(OC)OC 62a_100000069011_100000754431 [0,2,0,0,0,0|0,0,1]=3 4946 B12R0.57 C=CCCSCCCC(OC)OC 62a_100000754431_100000069011 [0,2,0,0,0,0|0,0,1]=3 4947 B12R0.57 C=CCOCCOCC(OC)OC 34a_100000037705_100000211822 [0,2,0,0,0,0|0,0,2]=4 4948 B12R0.57 C=CCOCCOCC(OC)OC 7a_100000037705_100000751394 [0,2,0,0,0,0|0,0,2]=4 4949 B12R0.57 C=COCCCNCC(OC)OC 2230a_100000210767_100000751394 [0,2,0,0,0,0|0,0,2]=4 4950 B12R0.57 C=COCCCNCC(OC)OC 270004a_100000210767_100000752162 [0,2,0,0,0,0|0,0,2]=4 4951 B12R0.57 C=COCCCNCC(OC)OC 34a_100000210767_100000211822 [0,2,0,0,0,0|0,0,2]=4 4952 B12R0.57 C=COCCOCCC(OC)OC 34a_100000033082_100000139399 [0,2,0,0,0,0|0,0,2]=4 4953 B12R0.57 C=COCCSCCC(OC)OC 62a_100000039644_100000139399 [0,2,0,0,0,0|0,0,2]=4 4954 B12R0.57 C=COCCSCCC(OC)OC 62a_100000139399_100000039644 [0,2,0,0,0,0|0,0,2]=4 4955 B12R0.57 CC#CCCOCCC(OC)OC 34a_100000750427_100000139399 [0,2,0,0,0,0|0,0,1]=3 4956 B12R0.57 CC#CCNCCCC(OC)OC 2230a_100000685387_100000069011 [0,2,0,0,0,0|0,0,1]=3 4957 B12R0.57 CC#CCNCCCC(OC)OC 34a_100000685387_100000069011 [0,2,0,0,0,0|0,0,1]=3 4958 B12R0.57 CC#CCOCCCC(OC)OC 34a_100000761923_100000069011 [0,2,0,0,0,0|0,0,1]=3 4959 B12R0.57 CC#CCSCCCC(OC)OC 62a_100000069011_100000748600 [0,2,0,0,0,0|0,0,1]=3 4960 B12R0.57 CC#CCSCCCC(OC)OC 62a_100000748600_100000069011 [0,2,0,0,0,0|0,0,1]=3 4961 B12R0.57 CC/C=C\CCOCC(CC)OC 34a_100011934954_100015370543 [0,2,0,0,0,0|1,0,1]=4 4962 B12R0.57 CC/C=C\CCOCC(CC)OC 7a_100011934954_100015370543 [0,2,0,0,0,0|1,0,1]=4 4963 B12R0.57 CC/C=C\CCOCC(OC)OC 34a_100011216393_100015370543 [0,2,0,0,0,0|0,0,1]=3 4964 B12R0.57 CC/C=C\CCOCC(OC)OC 34a_100016288707_100000211822 [0,2,0,0,0,0|0,0,1]=3 4965 B12R0.57 CC/C=C\CCOCC(OC)OC 7a_100016288707_100000751394 [0,2,0,0,0,0|0,0,1]=3 4966 B12R0.57 CC/C=C\CCSCC(OC)OC 62a_100000751394_100015370543 [0,2,0,0,0,0|0,0,1]=3 4967 B12R0.57 CC/C=C\CCSCC(OC)OC 62a_100015370543_100000751394 [0,2,0,0,0,0|0,0,1]=3 4968 B12R0.57 CC/C=C\COCCC(OC)OC 34a_100016268518_100000139399 [0,2,0,0,0,0|0,0,1]=3 4969 B12R0.57 CC/C=C\CSCCC(OC)OC 62a_100000139399_100103147603 [0,2,0,0,0,0|0,0,1]=3 4970 B12R0.57 CC/C=C\CSCCC(OC)OC 62a_100103147603_100000139399 [0,2,0,0,0,0|0,0,1]=3 4971 B12R0.57 CC=C=CCCOCC(OC)OC 34a_100011020354_100000211822 [0,2,0,0,0,0|0,0,2]=4 4972 B12R0.57 CC=CCCCOCC(OC)OC 34a_100020645299_100000211822 [0,2,0,0,0,0|0,0,1]=3 4973 B12R0.57 CC=CCSCCCC(OC)OC 62a_100000069011_100000070051 [0,2,0,0,0,0|0,0,1]=3 4974 B12R0.57 CC=CCSCCCC(OC)OC 62a_100000070051_100000069011 [0,2,0,0,0,0|0,0,1]=3 4975 B12R0.57 CCC#CCCOCC(OC)OC 34a_100000036655_100000211822 [0,2,0,0,0,0|0,0,1]=3 4976 B12R0.57 CCC#CCCOCC(OC)OC 7a_100000036655_100000751394 [0,2,0,0,0,0|0,0,1]=3 4977 B12R0.57 CCC#CCOCCC(OC)OC 34a_100000032950_100000139399 [0,2,0,0,0,0|0,0,1]=3 4978 B12R0.57 CCC#CCSCCC(OC)OC 62a_100000139399_100009813939 [0,2,0,0,0,0|0,0,1]=3 4979 B12R0.57 CCC#CCSCCC(OC)OC 62a_100009813939_100000139399 [0,2,0,0,0,0|0,0,1]=3 4980 B12R0.57 CCC(CC)CNCCCCCF 2230a_100102946423_100000729378 [0,2,0,0,0,0|2,0,0]=4 4981 B12R0.57 CCC(CC)CNCCCCCO 2230a_100000762737_100011215472 [0,2,0,0,0,0|2,0,0]=4 4982 B12R0.57 CCC(CC)CNCCCCCO 2230a_100102946423_100000746330 [0,2,0,0,0,0|2,0,0]=4 4983 B12R0.57 CCC(CC)CNCCCCCO 269862a_100000762737_100000211137 [0,2,0,0,0,0|2,0,0]=4 4984 B12R0.57 CCC(CC)CNCCCCCO 270004a_100000762737_100000211137 [0,2,0,0,0,0|2,0,0]=4 4985 B12R0.57 CCC(CC)CNCCCCCO 34a_100000762737_100011215472 [0,2,0,0,0,0|2,0,0]=4 4986 B12R0.57 CCC(CC)CNCCCCOC 2230a_100102946423_100000730899 [0,2,0,0,0,0|2,0,0]=4 4987 B12R0.57 CCC(CC)COCCCCCBr 34a_100000746331_100011215472 [0,2,0,0,0,0|2,0,0]=4 4988 B12R0.57 CCC(CC)COCCCCCBr 7a_100000746331_100011215472 [0,2,0,0,0,0|2,0,0]=4 4989 B12R0.57 CCC(CC)COCCCCCCl 34a_100000746330_100011215472 [0,2,0,0,0,0|2,0,0]=4 4990 B12R0.57 CCC(CC)COCCCCCCl 7a_100000746330_100011215472 [0,2,0,0,0,0|2,0,0]=4 4991 B12R0.57 CCC(CC)COCCCCCF 7a_100000703878_100000729378 [0,2,0,0,0,0|2,0,0]=4 4992 B12R0.57 CCC(CC)COCCCCCI 34a_200012148887_100011215472 [0,2,0,0,0,0|2,0,0]=4 4993 B12R0.57 CCC(CC)COCCCCCI 7a_200012148887_100011215472 [0,2,0,0,0,0|2,0,0]=4 4994 B12R0.57 CCC(CC)COCCCCCN 34a_100000762737_100011215472 [0,2,0,0,0,0|2,0,0]=4 4995 B12R0.57 CCC(CC)COCCCCCO 7a_100000703878_100000746330 [0,2,0,0,0,0|2,0,0]=4 4996 B12R0.57 CCC(CC)COCCCCOC 34a_100000740925_100011215472 [0,2,0,0,0,0|2,0,0]=4 4997 B12R0.57 CCC(CC)COCCCCOC 7a_100000703878_100000730899 [0,2,0,0,0,0|2,0,0]=4 4998 B12R0.57 CCC(CC)COCCCCSC 34a_100011217163_100011215472 [0,2,0,0,0,0|2,0,0]=4 4999 B12R0.57 CCC(CC)COCCCCSC 7a_100011217163_100011215472 [0,2,0,0,0,0|2,0,0]=4 5000 B12R0.57 CCC(CC)CSCCCCCF 62a_100000729378_100011215472 [0,2,0,0,0,0|2,0,0]=4 5001 B12R0.57 CCC(CC)CSCCCCCF 62a_100011215472_100000729378 [0,2,0,0,0,0|2,0,0]=4 5002 B12R0.57 CCC(CC)CSCCCCCO 62a_100000746330_100011215472 [0,2,0,0,0,0|2,0,0]=4 5003 B12R0.57 CCC(CC)CSCCCCCO 62a_100011215472_100000746330 [0,2,0,0,0,0|2,0,0]=4 5004 B12R0.57 CCC(CC)CSCCCCOC 62a_100000730899_100011215472 [0,2,0,0,0,0|2,0,0]=4 5005 B12R0.57 CCC(CC)CSCCCCOC 62a_100011215472_100000730899 [0,2,0,0,0,0|2,0,0]=4 5006 B12R0.57 CCC(CC)NCCCCCCF 2230a_100000199018_100015922095 [0,2,0,0,0,0|2,0,0]=4 5007 B12R0.57 CCC(CC)NCCCCCCO 2230a_100000199018_100000766143 [0,2,0,0,0,0|2,0,0]=4 5008 B12R0.57 CCC(CC)NCCCCCCO 270004a_100000686447_100000210860 [0,2,0,0,0,0|2,0,0]=4 5009 B12R0.57 CCC(CC)NCCCCCOC 270004a_100000747528_100000210860 [0,2,0,0,0,0|2,0,0]=4 5010 B12R0.57 CCC(CC)OCCCCCCBr 7a_100011215345_100000210505 [0,2,0,0,0,0|2,0,0]=4 5011 B12R0.57 CCC(CC)OCCCCCCCl 7a_100000766143_100000210505 [0,2,0,0,0,0|2,0,0]=4 5012 B12R0.57 CCC(CC)OCCCCCCF 7a_100000688536_100015922095 [0,2,0,0,0,0|2,0,0]=4 5013 B12R0.57 CCC(CC)OCCCCCCF 7a_100000732779_100000210505 [0,2,0,0,0,0|2,0,0]=4 5014 B12R0.57 CCC(CC)OCCCCCCO 7a_100000688536_100000766143 [0,2,0,0,0,0|2,0,0]=4 5015 B12R0.57 CCC(CC)SCCCCCCF 62a_100000210505_100015922095 [0,2,0,0,0,0|2,0,0]=4 5016 B12R0.57 CCC(CC)SCCCCCCF 62a_100015922095_100000210505 [0,2,0,0,0,0|2,0,0]=4 5017 B12R0.57 CCC(CC)SCCCCCCO 62a_100000210505_100000766143 [0,2,0,0,0,0|2,0,0]=4 5018 B12R0.57 CCC(CC)SCCCCCCO 62a_100000766143_100000210505 [0,2,0,0,0,0|2,0,0]=4 5019 B12R0.57 CCC(COCCCCC#N)OC 7a_100011934954_100000211819 [0,2,0,0,0,0|1,0,1]=4 5020 B12R0.57 CCC(COCCCCC=O)OC 7a_100011934954_100000139335 [0,2,0,0,0,0|1,0,1]=4 5021 B12R0.57 CCC(COCCCCCF)OC 34a_100011934954_100000729378 [0,2,0,0,0,0|1,0,0]=3 5022 B12R0.57 CCC(COCCCCCF)OC 7a_100011934954_100000729378 [0,2,0,0,0,0|1,0,0]=3 5023 B12R0.57 CCC(COCCCCCO)OC 34a_100011934954_100000746330 [0,2,0,0,0,0|1,0,0]=3 5024 B12R0.57 CCC(COCCCCCO)OC 7a_100011934954_100000746330 [0,2,0,0,0,0|1,0,0]=3 5025 B12R0.57 CCC(COCCCCOC)OC 34a_100011934954_100000755781 [0,2,0,0,0,0|1,0,0]=3 5026 B12R0.57 CCC(COCCCCOC)OC 7a_100011934954_100000730899 [0,2,0,0,0,0|1,0,0]=3 5027 B12R0.57 CCC(COCCOCCO)OC 34a_100011934954_100000692535 [0,2,0,0,0,0|2,0,0]=4 5028 B12R0.57 CCC(COCCOCCO)OC 7a_100011934954_100011215305 [0,2,0,0,0,0|2,0,0]=4 5029 B12R0.57 CCC/C=C/COCC(OC)OC 34a_100016278788_100000211822 [0,2,0,0,0,0|0,0,1]=3 5030 B12R0.57 CCC/C=C/COCC(OC)OC 7a_100016278788_100000751394 [0,2,0,0,0,0|0,0,1]=3 5031 B12R0.57 CCCC#CCOCC(OC)OC 34a_100000034806_100000211822 [0,2,0,0,0,0|0,0,1]=3 5032 B12R0.57 CCCC#CCOCC(OC)OC 7a_100000034806_100000751394 [0,2,0,0,0,0|0,0,1]=3 5033 B12R0.57 CCCCCCCCC(CC)NC 270004a_106832991635_200011217995 [0,2,0,0,0,0|2,0,0]=4 5034 B12R0.57 CCCCCCCCC(CC)OC 34a_200011216270_200000210301 [0,2,0,0,0,0|1,0,0]=3 5035 B12R0.57 CCCCCCCCC(CC)OC 7a_200011216270_200000210301 [0,2,0,0,0,0|1,0,0]=3 5036 B12R0.57 CCCCCCCCC(CC)O[13CH3] 34a_200011216270_200025704644 [0,2,0,0,0,0|1,0,0]=3 5037 B12R0.57 CCCCCCCCC(CC)O[13CH3] 7a_200011216270_200025704644 [0,2,0,0,0,0|1,0,0]=3 5038 B12R0.57 CCCCCCCNC(CC)CC 2230a_100000199018_100000210681 [0,2,0,0,0,0|2,0,0]=4 5039 B12R0.57 CCCCCCCNC(CC)CC 270004a_100000229938_100000210860 [0,2,0,0,0,0|2,0,0]=4 5040 B12R0.57 CCCCCCCOC(CC)CC 7a_100000210272_100000210505 [0,2,0,0,0,0|2,0,0]=4 5041 B12R0.57 CCCCCCCOC(CC)CC 7a_100000688536_100000210614 [0,2,0,0,0,0|2,0,0]=4 5042 B12R0.57 CCCCCCCSC(CC)CC 62a_100000210505_100000210316 [0,2,0,0,0,0|2,0,0]=4 5043 B12R0.57 CCCCCCCSC(CC)CC 62a_100000210614_100000210505 [0,2,0,0,0,0|2,0,0]=4 5044 B12R0.57 CCCCCCNCC(CC)CC 2230a_100000210581_100011215472 [0,2,0,0,0,0|2,0,0]=4 5045 B12R0.57 CCCCCCNCC(CC)CC 2230a_100102946423_100000210314 [0,2,0,0,0,0|2,0,0]=4 5046 B12R0.57 CCCCCCNCC(CC)CC 269862a_100000210581_100000211137 [0,2,0,0,0,0|2,0,0]=4 5047 B12R0.57 CCCCCCNCC(CC)CC 270004a_100000210581_100000211137 [0,2,0,0,0,0|2,0,0]=4 5048 B12R0.57 CCCCCCNCC(OC)OC 2230a_100000210581_100000751394 [0,2,0,0,0,0|0,0,0]=2 5049 B12R0.57 CCCCCCNCC(OC)OC 270004a_100000210581_100000752162 [0,2,0,0,0,0|0,0,0]=2 5050 B12R0.57 CCCCCCOCC(CC)CC 34a_100000210259_100011215472 [0,2,0,0,0,0|2,0,0]=4 5051 B12R0.57 CCCCCCOCC(CC)CC 7a_100000210259_100011215472 [0,2,0,0,0,0|2,0,0]=4 5052 B12R0.57 CCCCCCOCC(CC)CC 7a_100000703878_100000210314 [0,2,0,0,0,0|2,0,0]=4 5053 B12R0.57 CCCCCCOCC(CC)OC 34a_100011934954_100000210314 [0,2,0,0,0,0|1,0,0]=3 5054 B12R0.57 CCCCCCOCC(CC)OC 7a_100011934954_100000210314 [0,2,0,0,0,0|1,0,0]=3 5055 B12R0.57 CCCCCCOCC(OC)OC 34a_100000210259_100000211822 [0,2,0,0,0,0|0,0,0]=2 5056 B12R0.57 CCCCCCOCC(OC)OC 34a_100011216393_100000210314 [0,2,0,0,0,0|0,0,0]=2 5057 B12R0.57 CCCCCCOCC(OC)OC 7a_100000210259_100000751394 [0,2,0,0,0,0|0,0,0]=2 5058 B12R0.57 CCCCCCSCC(CC)CC 62a_100000210314_100011215472 [0,2,0,0,0,0|2,0,0]=4 5059 B12R0.57 CCCCCCSCC(CC)CC 62a_100011215472_100000210757 [0,2,0,0,0,0|2,0,0]=4 5060 B12R0.57 CCCCCCSCC(OC)OC 62a_100000210314_100000751394 [0,2,0,0,0,0|0,0,0]=2 5061 B12R0.57 CCCCCCSCC(OC)OC 62a_100000751394_100000210757 [0,2,0,0,0,0|0,0,0]=2 5062 B12R0.57 CCCCCNCCC(OC)OC 2230a_100000209983_100009813347 [0,2,0,0,0,0|0,0,0]=2 5063 B12R0.57 CCCCCNN=CC(OC)OC 4a_100000694160_100000752162 [0,2,0,0,0,0|0,0,1]=3 5064 B12R0.57 CCCCCOCCC(OC)OC 34a_100000210253_100000139399 [0,2,0,0,0,0|0,0,0]=2 5065 B12R0.57 CCCCCOCCC(OC)OC 7a_100000210253_100009813347 [0,2,0,0,0,0|0,0,0]=2 5066 B12R0.57 CCCCCSCCC(OC)OC 62a_100000139399_100000210326 [0,2,0,0,0,0|0,0,0]=2 5067 B12R0.57 CCCCCSCCC(OC)OC 62a_100000210326_100000139399 [0,2,0,0,0,0|0,0,0]=2 5068 B12R0.57 CCCCNCCCC(OC)OC 2230a_100000102301_100000069011 [0,2,0,0,0,0|0,0,0]=2 5069 B12R0.57 CCCCNCCCC(OC)OC 7a_106832991798_100000069011 [0,2,0,0,0,0|0,0,0]=2 5070 B12R0.57 CCCCOCCCC(OC)OC 34a_100000210227_100000069011 [0,2,0,0,0,0|0,0,0]=2 5071 B12R0.57 CCCCOCCCC(OC)OC 7a_100000210227_100000069011 [0,2,0,0,0,0|0,0,0]=2 5072 B12R0.57 CCCCOCCNC(CC)CC 2230a_100000199018_100000743108 [0,2,0,0,0,0|2,0,0]=4 5073 B12R0.57 CCCCOCCOC(CC)CC 7a_100000210238_100000210505 [0,2,0,0,0,0|2,0,0]=4 5074 B12R0.57 CCCCOCCOC(CC)CC 7a_100000688536_100000743108 [0,2,0,0,0,0|2,0,0]=4 5075 B12R0.57 CCCCOCCSC(CC)CC 62a_100000210505_100000743108 [0,2,0,0,0,0|2,0,0]=4 5076 B12R0.57 CCCCOCCSC(CC)CC 62a_100000743108_100000210505 [0,2,0,0,0,0|2,0,0]=4 5077 B12R0.57 CCCCOCNCC(CC)CC 2230a_100102946423_100011995733 [0,2,0,0,0,0|2,0,0]=4 5078 B12R0.57 CCCCOCOCC(CC)OC 34a_100011934954_100011995733 [0,2,0,0,0,0|1,0,0]=3 5079 B12R0.57 CCCCOCOCC(OC)OC 34a_100011216393_100011995733 [0,2,0,0,0,0|0,0,0]=2 5080 B12R0.57 CCCCOCSCC(CC)CC 62a_100011215472_100011995733 [0,2,0,0,0,0|2,0,0]=4 5081 B12R0.57 CCCCOCSCC(CC)CC 62a_100011995733_100011215472 [0,2,0,0,0,0|2,0,0]=4 5082 B12R0.57 CCCCOCSCC(OC)OC 62a_100000751394_100011995733 [0,2,0,0,0,0|0,0,0]=2 5083 B12R0.57 CCCCOCSCC(OC)OC 62a_100011995733_100000751394 [0,2,0,0,0,0|0,0,0]=2 5084 B12R0.57 CCCCSCCCC(OC)OC 62a_100000069011_100000210210 [0,2,0,0,0,0|0,0,0]=2 5085 B12R0.57 CCCCSCCCC(OC)OC 62a_100000210211_100000069011 [0,2,0,0,0,0|0,0,0]=2 5086 B12R0.57 CCCCSCCNC(CC)CC 270004a_100025743550_100000210860 [0,2,0,0,0,0|2,0,0]=4 5087 B12R0.57 CCCCSCCOC(CC)CC 7a_200000230436_100000210505 [0,2,0,0,0,0|2,0,0]=4 5088 B12R0.57 CCCOCCCNC(CC)CC 270004a_100011217757_100000210860 [0,2,0,0,0,0|2,0,0]=4 5089 B12R0.57 CCCOCCNCC(CC)CC 2230a_100102946423_100011215938 [0,2,0,0,0,0|2,0,0]=4 5090 B12R0.57 CCCOCCNCC(CC)CC 2230a_100161115042_100011215472 [0,2,0,0,0,0|2,0,0]=4 5091 B12R0.57 CCCOCCNCC(CC)CC 269862a_100161115042_100000211137 [0,2,0,0,0,0|2,0,0]=4 5092 B12R0.57 CCCOCCNCC(CC)CC 270004a_100161115042_100000211137 [0,2,0,0,0,0|2,0,0]=4 5093 B12R0.57 CCCOCCNCC(CC)CC 34a_100161115042_100011215472 [0,2,0,0,0,0|2,0,0]=4 5094 B12R0.57 CCCOCCNCC(OC)OC 2230a_100161115042_100000751394 [0,2,0,0,0,0|0,0,0]=2 5095 B12R0.57 CCCOCCNCC(OC)OC 270004a_100161115042_100000752162 [0,2,0,0,0,0|0,0,0]=2 5096 B12R0.57 CCCOCCNCC(OC)OC 34a_100161115042_100000211822 [0,2,0,0,0,0|0,0,0]=2 5097 B12R0.57 CCCOCCOCC(CC)CC 34a_100000752267_100011215472 [0,2,0,0,0,0|2,0,0]=4 5098 B12R0.57 CCCOCCOCC(CC)CC 7a_100000703878_100011215938 [0,2,0,0,0,0|2,0,0]=4 5099 B12R0.57 CCCOCCOCC(CC)CC 7a_100000752267_100011215472 [0,2,0,0,0,0|2,0,0]=4 5100 B12R0.57 CCCOCCOCC(CC)OC 34a_100011934954_100011215938 [0,2,0,0,0,0|1,0,0]=3 5101 B12R0.57 CCCOCCOCC(CC)OC 7a_100011934954_100011215938 [0,2,0,0,0,0|1,0,0]=3 5102 B12R0.57 CCCOCCOCC(OC)OC 34a_100000752267_100000211822 [0,2,0,0,0,0|0,0,0]=2 5103 B12R0.57 CCCOCCOCC(OC)OC 34a_100011216393_100011215938 [0,2,0,0,0,0|0,0,0]=2 5104 B12R0.57 CCCOCCOCC(OC)OC 7a_100000752267_100000751394 [0,2,0,0,0,0|0,0,0]=2 5105 B12R0.57 CCCOCCSCC(CC)CC 62a_100011215472_100011215938 [0,2,0,0,0,0|2,0,0]=4 5106 B12R0.57 CCCOCCSCC(CC)CC 62a_100011215938_100011215472 [0,2,0,0,0,0|2,0,0]=4 5107 B12R0.57 CCCOCCSCC(OC)OC 62a_100000751394_100011215938 [0,2,0,0,0,0|0,0,0]=2 5108 B12R0.57 CCCOCCSCC(OC)OC 62a_100011215938_100000751394 [0,2,0,0,0,0|0,0,0]=2 5109 B12R0.57 CCCSCCNCC(CC)CC 2230a_100020603323_100011215472 [0,2,0,0,0,0|2,0,0]=4 5110 B12R0.57 CCCSCCNCC(CC)CC 269862a_100020603323_100000211137 [0,2,0,0,0,0|2,0,0]=4 5111 B12R0.57 CCCSCCNCC(CC)CC 270004a_100020603323_100000211137 [0,2,0,0,0,0|2,0,0]=4 5112 B12R0.57 CCCSCCNCC(OC)OC 2230a_100020603323_100000751394 [0,2,0,0,0,0|0,0,0]=2 5113 B12R0.57 CCCSCCNCC(OC)OC 270004a_100020603323_100000752162 [0,2,0,0,0,0|0,0,0]=2 5114 B12R0.57 CCCSCCOCC(CC)CC 34a_200000230433_100011215472 [0,2,0,0,0,0|2,0,0]=4 5115 B12R0.57 CCCSCCOCC(CC)CC 7a_200000230433_100011215472 [0,2,0,0,0,0|2,0,0]=4 5116 B12R0.57 CCCSCCOCC(OC)OC 34a_200000230433_100000211822 [0,2,0,0,0,0|0,0,0]=2 5117 B12R0.57 CCCSCCOCC(OC)OC 7a_200000230433_100000751394 [0,2,0,0,0,0|0,0,0]=2 5118 B12R0.57 CCOCCCNCC(CC)CC 2230a_100000210961_100011215472 [0,2,0,0,0,0|2,0,0]=4 5119 B12R0.57 CCOCCCNCC(CC)CC 2230a_100102946423_100012232248 [0,2,0,0,0,0|2,0,0]=4 5120 B12R0.57 CCOCCCNCC(CC)CC 269862a_100000210961_100000211137 [0,2,0,0,0,0|2,0,0]=4 5121 B12R0.57 CCOCCCNCC(CC)CC 270004a_100000210961_100000211137 [0,2,0,0,0,0|2,0,0]=4 5122 B12R0.57 CCOCCCNCC(CC)CC 34a_100000210961_100011215472 [0,2,0,0,0,0|2,0,0]=4 5123 B12R0.57 CCOCCCNCC(OC)OC 2230a_100000210961_100000751394 [0,2,0,0,0,0|0,0,0]=2 5124 B12R0.57 CCOCCCNCC(OC)OC 270004a_100000210961_100000752162 [0,2,0,0,0,0|0,0,0]=2 5125 B12R0.57 CCOCCCNCC(OC)OC 34a_100000210961_100000211822 [0,2,0,0,0,0|0,0,0]=2 5126 B12R0.57 CCOCCCOCC(CC)CC 34a_100000757476_100011215472 [0,2,0,0,0,0|2,0,0]=4 5127 B12R0.57 CCOCCCOCC(CC)CC 7a_100000703878_100012232248 [0,2,0,0,0,0|2,0,0]=4 5128 B12R0.57 CCOCCCOCC(CC)CC 7a_100000757476_100011215472 [0,2,0,0,0,0|2,0,0]=4 5129 B12R0.57 CCOCCCOCC(CC)OC 34a_100011934954_100012232248 [0,2,0,0,0,0|1,0,0]=3 5130 B12R0.57 CCOCCCOCC(CC)OC 7a_100011934954_100012232248 [0,2,0,0,0,0|1,0,0]=3 5131 B12R0.57 CCOCCCOCC(OC)OC 34a_100000757476_100000211822 [0,2,0,0,0,0|0,0,0]=2 5132 B12R0.57 CCOCCCOCC(OC)OC 34a_100011216393_100012232248 [0,2,0,0,0,0|0,0,0]=2 5133 B12R0.57 CCOCCCOCC(OC)OC 7a_100000757476_100000751394 [0,2,0,0,0,0|0,0,0]=2 5134 B12R0.57 CCOCCCSCC(CC)CC 62a_100011215472_100012232248 [0,2,0,0,0,0|2,0,0]=4 5135 B12R0.57 CCOCCCSCC(CC)CC 62a_100012232248_100011215472 [0,2,0,0,0,0|2,0,0]=4 5136 B12R0.57 CCOCCCSCC(OC)OC 62a_100000751394_100012232248 [0,2,0,0,0,0|0,0,0]=2 5137 B12R0.57 CCOCCCSCC(OC)OC 62a_100012232248_100000751394 [0,2,0,0,0,0|0,0,0]=2 5138 B12R0.57 CCOCCNCCC(OC)OC 2230a_102516460346_100009813347 [0,2,0,0,0,0|0,0,0]=2 5139 B12R0.57 CCOCCNCCC(OC)OC 34a_102516460346_100000139399 [0,2,0,0,0,0|0,0,0]=2 5140 B12R0.57 CCOCCNN=CC(OC)OC 4a_100000732670_100000752162 [0,2,0,0,0,0|1,0,1]=4 5141 B12R0.57 CCOCCOCCC(OC)OC 34a_100000210136_100000139399 [0,2,0,0,0,0|0,0,0]=2 5142 B12R0.57 CCOCCOCCC(OC)OC 7a_100000210136_100009813347 [0,2,0,0,0,0|0,0,0]=2 5143 B12R0.57 CCOCCSCCC(OC)OC 62a_100000139399_100011215890 [0,2,0,0,0,0|0,0,0]=2 5144 B12R0.57 CCOCCSCCC(OC)OC 62a_100000210147_100000139399 [0,2,0,0,0,0|0,0,0]=2 5145 B12R0.57 CCOCSCCCC(OC)OC 62a_100000069011_100000739092 [0,2,0,0,0,0|0,0,0]=2 5146 B12R0.57 CCOCSCCCC(OC)OC 62a_100000739092_100000069011 [0,2,0,0,0,0|0,0,0]=2 5147 B12R0.57 CCSCCCOCC(CC)CC 34a_100011216438_100011215472 [0,2,0,0,0,0|2,0,0]=4 5148 B12R0.57 CCSCCCOCC(CC)CC 7a_100011216438_100011215472 [0,2,0,0,0,0|2,0,0]=4 5149 B12R0.57 CCSCCCOCC(OC)OC 34a_100011216438_100000211822 [0,2,0,0,0,0|0,0,0]=2 5150 B12R0.57 CCSCCCOCC(OC)OC 7a_100011216438_100000751394 [0,2,0,0,0,0|0,0,0]=2 5151 B12R0.57 CCSCCNCCC(OC)OC 2230a_100000106463_100009813347 [0,2,0,0,0,0|0,0,0]=2 5152 B12R0.57 CCSCCOCCC(OC)OC 34a_100000212035_100000139399 [0,2,0,0,0,0|0,0,0]=2 5153 B12R0.57 CCSCCOCCC(OC)OC 7a_100000212035_100009813347 [0,2,0,0,0,0|0,0,0]=2 5154 B12R0.57 CCSCCSCCC(OC)OC 62a_100000139399_100000757381 [0,2,0,0,0,0|0,0,0]=2 5155 B12R0.57 CCSCCSCCC(OC)OC 62a_100000757381_100000139399 [0,2,0,0,0,0|0,0,0]=2 5156 B12R0.57 CNCCCOCCC(OC)OC 34a_100000213112_100000139399 [0,2,0,0,0,0|0,0,0]=2 5157 B12R0.57 COC(CCCNCCCF)OC 2230a_100015189416_100000069011 [0,2,0,0,0,0|0,0,0]=2 5158 B12R0.57 COC(CCCNCCCF)OC 34a_100015189416_100000069011 [0,2,0,0,0,0|0,0,0]=2 5159 B12R0.57 COC(CCCNCCSC)OC 2230a_100020590264_100000069011 [0,2,0,0,0,0|0,0,0]=2 5160 B12R0.57 COC(CCCOCCCBr)OC 34a_100011217188_100000069011 [0,2,0,0,0,0|0,0,0]=2 5161 B12R0.57 COC(CCCOCCCCl)OC 34a_100000230001_100000069011 [0,2,0,0,0,0|0,0,0]=2 5162 B12R0.57 COC(CCCOCCCF)OC 34a_100000759539_100000069011 [0,2,0,0,0,0|0,0,0]=2 5163 B12R0.57 COC(CCCOCCCN)OC 34a_100000182051_100000069011 [0,2,0,0,0,0|0,0,0]=2 5164 B12R0.57 COC(CCCOCCON)OC 34a_100000700252_100000069011 [0,2,0,0,0,0|1,0,0]=3 5165 B12R0.57 COC(CCCOCCSC)OC 34a_100000230434_100000069011 [0,2,0,0,0,0|0,0,0]=2 5166 B12R0.57 COC(CCCOCCSC)OC 7a_100000230434_100000069011 [0,2,0,0,0,0|0,0,0]=2 5167 B12R0.57 COC(CCCSCCC#N)OC 62a_100000069011_100011215226 [0,2,0,0,0,0|0,0,1]=3 5168 B12R0.57 COC(CCCSCCC#N)OC 62a_100011215226_100000069011 [0,2,0,0,0,0|0,0,1]=3 5169 B12R0.57 COC(CCCSCCCF)OC 62a_100000069011_100011934791 [0,2,0,0,0,0|0,0,0]=2 5170 B12R0.57 COC(CCCSCCCF)OC 62a_100011934791_100000069011 [0,2,0,0,0,0|0,0,0]=2 5171 B12R0.57 COC(CCCSCCCO)OC 62a_100000069011_100011215043 [0,2,0,0,0,0|0,0,0]=2 5172 B12R0.57 COC(CCCSCCCO)OC 62a_100011215043_100000069011 [0,2,0,0,0,0|0,0,0]=2 5173 B12R0.57 COC(CCCSCCSC)OC 62a_100000069011_100000751147 [0,2,0,0,0,0|0,0,0]=2 5174 B12R0.57 COC(CCCSCCSC)OC 62a_100000212216_100000069011 [0,2,0,0,0,0|0,0,0]=2 5175 B12R0.57 COC(CCCSCSC#N)OC 62a_100000069011_100000211825 [0,2,0,0,0,0|1,0,1]=4 5176 B12R0.57 COC(CCCSCSC#N)OC 62a_100000211825_100000069011 [0,2,0,0,0,0|1,0,1]=4 5177 B12R0.57 COC(CCNCCCCO)OC 2230a_100000750430_100009813347 [0,2,0,0,0,0|0,0,0]=2 5178 B12R0.57 COC(CCNCCCCO)OC 34a_100000750430_100000139399 [0,2,0,0,0,0|0,0,0]=2 5179 B12R0.57 COC(CCNCCCSC)OC 2230a_100000749238_100009813347 [0,2,0,0,0,0|0,0,0]=2 5180 B12R0.57 COC(CCOCC#CCCl)OC 34a_200000047223_100000139399 [0,2,0,0,0,0|0,0,2]=4 5181 B12R0.57 COC(CCOCCCCBr)OC 34a_100011216708_100000139399 [0,2,0,0,0,0|0,0,0]=2 5182 B12R0.57 COC(CCOCCCCCl)OC 34a_100000210776_100000139399 [0,2,0,0,0,0|0,0,0]=2 5183 B12R0.57 COC(CCOCCCCCl)OC 7a_100000210776_100009813347 [0,2,0,0,0,0|0,0,0]=2 5184 B12R0.57 COC(CCOCCCCF)OC 34a_100011995726_100000139399 [0,2,0,0,0,0|0,0,0]=2 5185 B12R0.57 COC(CCOCCCCF)OC 7a_100011995726_100009813347 [0,2,0,0,0,0|0,0,0]=2 5186 B12R0.57 COC(CCOCCCCI)OC 34a_200012148704_100000139399 [0,2,0,0,0,0|0,0,0]=2 5187 B12R0.57 COC(CCOCCCCN)OC 34a_100000750430_100000139399 [0,2,0,0,0,0|0,0,0]=2 5188 B12R0.57 COC(CCOCCCSC)OC 34a_100000690336_100000139399 [0,2,0,0,0,0|0,0,0]=2 5189 B12R0.57 COC(CCOCCCSC)OC 7a_100000690336_100009813347 [0,2,0,0,0,0|0,0,0]=2 5190 B12R0.57 COC(CCSCC#CCO)OC 62a_100000139399_200000047223 [0,2,0,0,0,0|0,0,2]=4 5191 B12R0.57 COC(CCSCC#CCO)OC 62a_200000047223_100000139399 [0,2,0,0,0,0|0,0,2]=4 5192 B12R0.57 COC(CCSCCCC#N)OC 62a_100000139399_100000687738 [0,2,0,0,0,0|0,0,1]=3 5193 B12R0.57 COC(CCSCCCC#N)OC 62a_100000687738_100000139399 [0,2,0,0,0,0|0,0,1]=3 5194 B12R0.57 COC(CCSCCCC=O)OC 62a_100000139399_200011292268 [0,2,0,0,0,0|0,0,1]=3 5195 B12R0.57 COC(CCSCCCC=O)OC 62a_200011292268_100000139399 [0,2,0,0,0,0|0,0,1]=3 5196 B12R0.57 COC(CCSCCCCF)OC 62a_100000139399_100000729493 [0,2,0,0,0,0|0,0,0]=2 5197 B12R0.57 COC(CCSCCCCF)OC 62a_100000729493_100000139399 [0,2,0,0,0,0|0,0,0]=2 5198 B12R0.57 COC(CCSCCCCO)OC 62a_100000139399_100000210776 [0,2,0,0,0,0|0,0,0]=2 5199 B12R0.57 COC(CCSCCCCO)OC 62a_100000210776_100000139399 [0,2,0,0,0,0|0,0,0]=2 5200 B12R0.57 COC(CCSCCSC#N)OC 62a_100000034367_100000139399 [0,2,0,0,0,0|1,0,1]=4 5201 B12R0.57 COC(CCSCCSC#N)OC 62a_100000139399_100000034367 [0,2,0,0,0,0|1,0,1]=4 5202 B12R0.57 COC(CNCCCCC#N)OC 270004a_100000751965_100000752162 [0,2,0,0,0,0|0,0,1]=3 5203 B12R0.57 COC(CNCCCCCO)OC 2230a_100000762737_100000751394 [0,2,0,0,0,0|0,0,0]=2 5204 B12R0.57 COC(CNCCCCCO)OC 270004a_100000762737_100000752162 [0,2,0,0,0,0|0,0,0]=2 5205 B12R0.57 COC(CNCCCCCO)OC 34a_100000762737_100000211822 [0,2,0,0,0,0|0,0,0]=2 5206 B12R0.57 COC(CNCCCN=[N+]=[N-])OC 2230a_100000744732_100000751394 [0,2,0,0,0,0|2,0,0]=4 5207 B12R0.57 COC(CNCCCN=[N+]=[N-])OC 270004a_100000744732_100000752162 [0,2,0,0,0,0|2,0,0]=4 5208 B12R0.57 COC(CNCCOCCO)OC 2230a_100000211614_100000751394 [0,2,0,0,0,0|1,0,0]=3 5209 B12R0.57 COC(CNCCOCCO)OC 270004a_100000211614_100000752162 [0,2,0,0,0,0|1,0,0]=3 5210 B12R0.57 COC(CNCCOCCO)OC 34a_100000211614_100000211822 [0,2,0,0,0,0|1,0,0]=3 5211 B12R0.57 COC(CNCCSCCO)OC 2230a_100011219999_100000751394 [0,2,0,0,0,0|1,0,0]=3 5212 B12R0.57 COC(CNCCSCCO)OC 270004a_100011219999_100000752162 [0,2,0,0,0,0|1,0,0]=3 5213 B12R0.57 COC(COCCCCCBr)OC 34a_100000746331_100000211822 [0,2,0,0,0,0|0,0,0]=2 5214 B12R0.57 COC(COCCCCCBr)OC 7a_100000746331_100000751394 [0,2,0,0,0,0|0,0,0]=2 5215 B12R0.57 COC(COCCCCCCl)OC 34a_100000746330_100000211822 [0,2,0,0,0,0|0,0,0]=2 5216 B12R0.57 COC(COCCCCCCl)OC 7a_100000746330_100000751394 [0,2,0,0,0,0|0,0,0]=2 5217 B12R0.57 COC(COCCCCCF)OC 34a_100011216393_100000729378 [0,2,0,0,0,0|0,0,0]=2 5218 B12R0.57 COC(COCCCCCI)OC 34a_200012148887_100000211822 [0,2,0,0,0,0|0,0,0]=2 5219 B12R0.57 COC(COCCCCCI)OC 7a_200012148887_100000751394 [0,2,0,0,0,0|0,0,0]=2 5220 B12R0.57 COC(COCCCCCN)OC 34a_100000762737_100000211822 [0,2,0,0,0,0|0,0,0]=2 5221 B12R0.57 COC(COCCCCCO)OC 34a_100011216393_100000746330 [0,2,0,0,0,0|0,0,0]=2 5222 B12R0.57 COC(COCCCCSC)OC 34a_100011217163_100000211822 [0,2,0,0,0,0|0,0,0]=2 5223 B12R0.57 COC(COCCCCSC)OC 7a_100011217163_100000751394 [0,2,0,0,0,0|0,0,0]=2 5224 B12R0.57 COC(COCCOCCBr)OC 34a_100000692535_100000211822 [0,2,0,0,0,0|1,0,0]=3 5225 B12R0.57 COC(COCCOCCBr)OC 7a_100000692535_100000751394 [0,2,0,0,0,0|1,0,0]=3 5226 B12R0.57 COC(COCCOCCCl)OC 34a_100011215305_100000211822 [0,2,0,0,0,0|1,0,0]=3 5227 B12R0.57 COC(COCCOCCCl)OC 7a_100011215305_100000751394 [0,2,0,0,0,0|1,0,0]=3 5228 B12R0.57 COC(COCCOCCF)OC 34a_200015357709_100000211822 [0,2,0,0,0,0|1,0,0]=3 5229 B12R0.57 COC(COCCOCCF)OC 7a_200015357709_100000751394 [0,2,0,0,0,0|1,0,0]=3 5230 B12R0.57 COC(COCCOCCI)OC 34a_100012149058_100000211822 [0,2,0,0,0,0|1,0,0]=3 5231 B12R0.57 COC(COCCOCCI)OC 7a_100012149058_100000751394 [0,2,0,0,0,0|1,0,0]=3 5232 B12R0.57 COC(COCCOCCN)OC 34a_100000211614_100000211822 [0,2,0,0,0,0|1,0,0]=3 5233 B12R0.57 COC(COCCOCCO)OC 34a_100011216393_100000692535 [0,2,0,0,0,0|1,0,0]=3 5234 B12R0.57 COC(CSCCCCC#N)OC 62a_100000751394_100000211819 [0,2,0,0,0,0|0,0,1]=3 5235 B12R0.57 COC(CSCCCCC#N)OC 62a_100011219923_100000751394 [0,2,0,0,0,0|0,0,1]=3 5236 B12R0.57 COC(CSCCCCC=O)OC 62a_100000139335_100000751394 [0,2,0,0,0,0|0,0,1]=3 5237 B12R0.57 COC(CSCCCCC=O)OC 62a_100000751394_100000139335 [0,2,0,0,0,0|0,0,1]=3 5238 B12R0.57 COC(CSCCCCCF)OC 62a_100000729378_100000751394 [0,2,0,0,0,0|0,0,0]=2 5239 B12R0.57 COC(CSCCCCCF)OC 62a_100000751394_100000729378 [0,2,0,0,0,0|0,0,0]=2 5240 B12R0.57 COC(CSCCCCCO)OC 62a_100000746330_100000751394 [0,2,0,0,0,0|0,0,0]=2 5241 B12R0.57 COC(CSCCCCCO)OC 62a_100000751394_100000746330 [0,2,0,0,0,0|0,0,0]=2 5242 B12R0.57 COC(CSCCOCC#N)OC 62a_100000751394_200000047693 [0,2,0,0,0,0|1,0,1]=4 5243 B12R0.57 COC(CSCCOCC#N)OC 62a_200000047693_100000751394 [0,2,0,0,0,0|1,0,1]=4 5244 B12R0.57 COC(CSCCOCCO)OC 62a_100000751394_100011215305 [0,2,0,0,0,0|1,0,0]=3 5245 B12R0.57 COC(CSCCOCCO)OC 62a_100011215305_100000751394 [0,2,0,0,0,0|1,0,0]=3 5246 B12R0.57 COCCCCOCC(OC)OC 34a_100000740925_100000211822 [0,2,0,0,0,0|0,0,0]=2 5247 B12R0.57 COCCCCOCC(OC)OC 34a_100011216393_100000755781 [0,2,0,0,0,0|0,0,0]=2 5248 B12R0.57 COCCCCSCC(OC)OC 62a_100000730899_100000751394 [0,2,0,0,0,0|0,0,0]=2 5249 B12R0.57 COCCCCSCC(OC)OC 62a_100000751394_100000730899 [0,2,0,0,0,0|0,0,0]=2 5250 B12R0.57 COCCCNCCC(OC)OC 34a_100150723488_100000139399 [0,2,0,0,0,0|0,0,0]=2 5251 B12R0.57 COCCCOCCC(OC)OC 34a_100000740835_100000139399 [0,2,0,0,0,0|0,0,0]=2 5252 B12R0.57 COCCCSCCC(OC)OC 62a_100000139399_100000709357 [0,2,0,0,0,0|0,0,0]=2 5253 B12R0.57 COCCCSCCC(OC)OC 62a_100000709357_100000139399 [0,2,0,0,0,0|0,0,0]=2 5254 B12R0.57 COCCNCCCC(OC)OC 2230a_100000209980_100000069011 [0,2,0,0,0,0|0,0,0]=2 5255 B12R0.57 COCCOCCCC(OC)OC 34a_100000210237_100000069011 [0,2,0,0,0,0|0,0,0]=2 5256 B12R0.57 COCCOCSCC(OC)OC 62a_100000231047_100000751394 [0,2,0,0,0,0|1,0,0]=3 5257 B12R0.57 COCCOCSCC(OC)OC 62a_100000751394_100000231047 [0,2,0,0,0,0|1,0,0]=3 5258 B12R0.57 COCCSCCCC(OC)OC 62a_100000069011_100000233755 [0,2,0,0,0,0|0,0,0]=2 5259 B12R0.57 COCCSCCCC(OC)OC 62a_100000233755_100000069011 [0,2,0,0,0,0|0,0,0]=2 5260 B12R0.116 C#CCCCCC(=O)C(OC)OC 1458a_100000046285_100010269958 [0,2,0,0,0,0|0,0,2]=4 5261 B12R0.116 C#CCCCNC(C)C(OC)OC 270004a_100000718082_100000211384 [0,2,0,0,0,0|0,0,2]=4 5262 B12R0.116 C#CCCCNC(C)C(OC)OC 34a_100000718082_100011222894 [0,2,0,0,0,0|0,0,2]=4 5263 B12R0.116 C#CCCCOC(C)C(OC)OC 34a_100000215630_100011222894 [0,2,0,0,0,0|0,0,2]=4 5264 B12R0.116 C#CCCCOC(C)C(OC)OC 34a_100000754440_100000695029 [0,2,0,0,0,0|0,0,2]=4 5265 B12R0.116 C#CCCCOC(C)C(OC)OC 7a_100000754440_100011215417 [0,2,0,0,0,0|0,0,2]=4 5266 B12R0.116 C#CCCCSC(C)C(OC)OC 62a_100011215417_100011222894 [0,2,0,0,0,0|0,0,2]=4 5267 B12R0.116 C#CCCCSC(C)C(OC)OC 62a_100011222894_100011215417 [0,2,0,0,0,0|0,0,2]=4 5268 B12R0.116 C/C=C/CCOC(C)C(OC)OC 34a_100016278192_100011222894 [0,2,0,0,0,0|0,0,2]=4 5269 B12R0.116 C=CCCCCC(=O)C(OC)OC 1458a_100000046285_100011215482 [0,2,0,0,0,0|0,0,2]=4 5270 B12R0.116 C=CCCCNC(C)C(OC)OC 270004a_100000700776_100000211384 [0,2,0,0,0,0|0,0,2]=4 5271 B12R0.116 C=CCCCNC(C)C(OC)OC 34a_100000700776_100011222894 [0,2,0,0,0,0|0,0,2]=4 5272 B12R0.116 C=CCCCOC(C)C(OC)OC 34a_100000754440_100000757094 [0,2,0,0,0,0|0,0,2]=4 5273 B12R0.116 C=CCCCOC(C)C(OC)OC 34a_100000758997_100011222894 [0,2,0,0,0,0|0,0,2]=4 5274 B12R0.116 C=CCCCOC(C)C(OC)OC 7a_100000754440_100000757094 [0,2,0,0,0,0|0,0,2]=4 5275 B12R0.116 C=CCCCSC(C)C(OC)OC 62a_100011222894_100000757094 [0,2,0,0,0,0|0,0,2]=4 5276 B12R0.116 C=CCCCSC(C)C(OC)OC 62a_100011713584_100011222894 [0,2,0,0,0,0|0,0,2]=4 5277 B12R0.116 CC#CCCOC(C)C(OC)OC 34a_100000750427_100011222894 [0,2,0,0,0,0|0,0,2]=4 5278 B12R0.116 CC/C=C\CCC(=O)C(OC)OC 1458a_100000046285_100015370543 [0,2,0,0,0,0|0,0,2]=4 5279 B12R0.116 CC/C=C\COC(C)C(OC)OC 34a_100000754440_100103147603 [0,2,0,0,0,0|0,0,2]=4 5280 B12R0.116 CC/C=C\COC(C)C(OC)OC 34a_100016268518_100011222894 [0,2,0,0,0,0|0,0,2]=4 5281 B12R0.116 CC/C=C\COC(C)C(OC)OC 7a_100000754440_100103147603 [0,2,0,0,0,0|0,0,2]=4 5282 B12R0.116 CC/C=C\CSC(C)C(OC)OC 62a_100011222894_100103147603 [0,2,0,0,0,0|0,0,2]=4 5283 B12R0.116 CC/C=C\CSC(C)C(OC)OC 62a_100103147603_100011222894 [0,2,0,0,0,0|0,0,2]=4 5284 B12R0.116 CCC#CCOC(C)C(OC)OC 34a_100000032950_100011222894 [0,2,0,0,0,0|0,0,2]=4 5285 B12R0.116 CCC#CCOC(C)C(OC)OC 34a_100000754440_100009813939 [0,2,0,0,0,0|0,0,2]=4 5286 B12R0.116 CCC#CCOC(C)C(OC)OC 7a_100000754440_100009813939 [0,2,0,0,0,0|0,0,2]=4 5287 B12R0.116 CCC#CCSC(C)C(OC)OC 62a_100009813939_100011222894 [0,2,0,0,0,0|0,0,2]=4 5288 B12R0.116 CCC#CCSC(C)C(OC)OC 62a_100011222894_100009813939 [0,2,0,0,0,0|0,0,2]=4 5289 B12R0.116 CCC(OC)C(=O)CCCCCF 1458a_100000747056_100000729378 [0,2,0,0,0,0|1,0,1]=4 5290 B12R0.116 CCC(OC)C(=O)CCCCCO 1458a_100000747056_100000746330 [0,2,0,0,0,0|1,0,1]=4 5291 B12R0.116 CCC(OC)C(=O)CCCCOC 1458a_100000747056_100000755781 [0,2,0,0,0,0|1,0,1]=4 5292 B12R0.116 CCCCCCC(=O)C(CC)CC 1458a_100000211163_100000210757 [0,2,0,0,0,0|2,0,0]=4 5293 B12R0.116 CCCCCCC(=O)C(CC)CC 1458a_100102632555_100000210505 [0,2,0,0,0,0|2,0,0]=4 5294 B12R0.116 CCCCCCC(=O)C(CC)OC 1458a_100000747056_100000210757 [0,2,0,0,0,0|1,0,0]=3 5295 B12R0.116 CCCCCCC(=O)C(OC)OC 1458a_100000046285_100000210757 [0,2,0,0,0,0|0,0,0]=2 5296 B12R0.116 CCCCCCN(C)C(CC)CC 2230a_100000737045_100000210314 [0,2,0,0,0,0|2,0,0]=4 5297 B12R0.116 CCCCCCN(C)C(CC)CC 269982a_100000737045_100000210757 [0,2,0,0,0,0|2,0,0]=4 5298 B12R0.116 CCCCCCN(C)C(CC)CC 269982a_106256046315_100000210505 [0,2,0,0,0,0|2,0,0]=4 5299 B12R0.116 CCCCCCN(C)C(CC)CC 270004a_106256046315_100000210860 [0,2,0,0,0,0|2,0,0]=4 5300 B12R0.116 CCCCCNC(=O)C(CC)OC 11a_100000209983_100000747056 [0,2,0,0,0,0|1,0,1]=4 5301 B12R0.116 CCCCCNC(=O)C(CC)OC 1626a_100000209983_100000747056 [0,2,0,0,0,0|1,0,1]=4 5302 B12R0.116 CCCCCNC(=O)C(CC)OC 240690a_100000209983_100000747056 [0,2,0,0,0,0|1,0,1]=4 5303 B12R0.116 CCCCCNC(=O)C(CC)OC 527a_100000209983_100000747056 [0,2,0,0,0,0|1,0,1]=4 5304 B12R0.116 CCCCCNC(=O)C(OC)OC 11a_100000209983_100000046285 [0,2,0,0,0,0|0,0,1]=3 5305 B12R0.116 CCCCCNC(=O)C(OC)OC 240690a_100000209983_100000046285 [0,2,0,0,0,0|0,0,1]=3 5306 B12R0.116 CCCCCNC(=O)C(OC)OC 527a_100000209983_100000046285 [0,2,0,0,0,0|0,0,1]=3 5307 B12R0.116 CCCCCNC(C)C(CC)CC 269862a_100000209983_100011393642 [0,2,0,0,0,0|2,0,0]=4 5308 B12R0.116 CCCCCNC(C)C(CC)CC 270004a_100000209983_100011393642 [0,2,0,0,0,0|2,0,0]=4 5309 B12R0.116 CCCCCNC(C)C(OC)OC 270004a_100000209983_100000211384 [0,2,0,0,0,0|0,0,0]=2 5310 B12R0.116 CCCCCOC(C)C(OC)OC 34a_100000210253_100011222894 [0,2,0,0,0,0|0,0,0]=2 5311 B12R0.116 CCCCCOC(C)C(OC)OC 34a_100000754440_100000718602 [0,2,0,0,0,0|0,0,0]=2 5312 B12R0.116 CCCCCOC(C)C(OC)OC 7a_100000754440_100000210326 [0,2,0,0,0,0|0,0,0]=2 5313 B12R0.116 CCCCCSC(C)C(OC)OC 62a_100000210326_100011222894 [0,2,0,0,0,0|0,0,0]=2 5314 B12R0.116 CCCCCSC(C)C(OC)OC 62a_100011222894_100000210326 [0,2,0,0,0,0|0,0,0]=2 5315 B12R0.116 CCCCNN=C(C)C(OC)OC 4a_100025702795_100000211384 [0,2,0,0,0,0|1,0,1]=4 5316 B12R0.116 CCCCNNC(=O)C(OC)OC 22a_100025702795_100000046285 [0,2,0,0,0,0|1,0,1]=4 5317 B12R0.116 CCCCOCC(=O)C(CC)OC 1458a_100000747056_100011995733 [0,2,0,0,0,0|1,0,1]=4 5318 B12R0.116 CCCCOCC(=O)C(OC)OC 1458a_100000046285_100011995733 [0,2,0,0,0,0|0,0,1]=3 5319 B12R0.116 CCCOCCC(=O)C(CC)OC 1458a_100000747056_100011215938 [0,2,0,0,0,0|1,0,1]=4 5320 B12R0.116 CCCOCCC(=O)C(OC)OC 1458a_100000046285_100011215938 [0,2,0,0,0,0|0,0,1]=3 5321 B12R0.116 CCOCCCC(=O)C(CC)OC 1458a_100000747056_100012232248 [0,2,0,0,0,0|1,0,1]=4 5322 B12R0.116 CCOCCCC(=O)C(OC)OC 1458a_100000046285_100012232248 [0,2,0,0,0,0|0,0,1]=3 5323 B12R0.116 CCOCCNC(=O)C(OC)OC 11a_100011200944_100000046285 [0,2,0,0,0,0|1,0,1]=4 5324 B12R0.116 CCOCCNC(=O)C(OC)OC 240690a_100011200944_100000046285 [0,2,0,0,0,0|1,0,1]=4 5325 B12R0.116 CCOCCNC(=O)C(OC)OC 527a_100011200944_100000046285 [0,2,0,0,0,0|1,0,1]=4 5326 B12R0.116 CCOCCNC(C)C(OC)OC 270004a_102516460346_100000211384 [0,2,0,0,0,0|1,0,0]=3 5327 B12R0.116 CCOCCNC(C)C(OC)OC 34a_102516460346_100011222894 [0,2,0,0,0,0|1,0,0]=3 5328 B12R0.116 CCOCCOC(C)C(OC)OC 34a_100000210136_100011222894 [0,2,0,0,0,0|1,0,0]=3 5329 B12R0.116 CCOCCOC(C)C(OC)OC 34a_100000754440_100000210147 [0,2,0,0,0,0|1,0,0]=3 5330 B12R0.116 CCOCCOC(C)C(OC)OC 7a_100000754440_100011215890 [0,2,0,0,0,0|1,0,0]=3 5331 B12R0.116 CCOCCSC(C)C(OC)OC 62a_100000210147_100011222894 [0,2,0,0,0,0|1,0,0]=3 5332 B12R0.116 CCOCCSC(C)C(OC)OC 62a_100011222894_100011215890 [0,2,0,0,0,0|1,0,0]=3 5333 B12R0.116 CCSCCNC(=O)C(OC)OC 11a_100000106463_100000046285 [0,2,0,0,0,0|1,0,1]=4 5334 B12R0.116 CCSCCNC(=O)C(OC)OC 240690a_100000106463_100000046285 [0,2,0,0,0,0|1,0,1]=4 5335 B12R0.116 CCSCCNC(=O)C(OC)OC 527a_100000106463_100000046285 [0,2,0,0,0,0|1,0,1]=4 5336 B12R0.116 CCSCCNC(C)C(OC)OC 270004a_100000106463_100000211384 [0,2,0,0,0,0|1,0,0]=3 5337 B12R0.116 CCSCCOC(C)C(OC)OC 34a_100000212035_100011222894 [0,2,0,0,0,0|1,0,0]=3 5338 B12R0.116 CCSCCOC(C)C(OC)OC 34a_100000754440_100000757381 [0,2,0,0,0,0|1,0,0]=3 5339 B12R0.116 CCSCCOC(C)C(OC)OC 7a_100000754440_100000757381 [0,2,0,0,0,0|1,0,0]=3 5340 B12R0.116 CCSCCSC(C)C(OC)OC 62a_100000757381_100011222894 [0,2,0,0,0,0|1,0,0]=3 5341 B12R0.116 CCSCCSC(C)C(OC)OC 62a_100011222894_100000757381 [0,2,0,0,0,0|1,0,0]=3 5342 B12R0.116 CNCCCOC(C)C(OC)OC 34a_100000213112_100011222894 [0,2,0,0,0,0|1,0,0]=3 5343 B12R0.116 COC(OC)C(=O)CCCCC#N 1458a_100000046285_100000211819 [0,2,0,0,0,0|0,0,2]=4 5344 B12R0.116 COC(OC)C(=O)CCCCCF 1458a_100000046285_100000729378 [0,2,0,0,0,0|0,0,1]=3 5345 B12R0.116 COC(OC)C(=O)CCCCCO 1458a_100000046285_100000746330 [0,2,0,0,0,0|0,0,1]=3 5346 B12R0.116 COC(OC)C(=O)CCOCCO 1458a_100000046285_100011215305 [0,2,0,0,0,0|1,0,1]=4 5347 B12R0.116 COC(OC)C(=O)NCCCCO 240690a_100000750430_100000046285 [0,2,0,0,0,0|1,0,1]=4 5348 B12R0.116 COC(OC)C(=O)NCCCCO 527a_100000750430_100000046285 [0,2,0,0,0,0|1,0,1]=4 5349 B12R0.116 COC(OC)C(=O)NCCCSC 11a_100000749238_100000046285 [0,2,0,0,0,0|1,0,1]=4 5350 B12R0.116 COC(OC)C(=O)NCCCSC 240690a_100000749238_100000046285 [0,2,0,0,0,0|1,0,1]=4 5351 B12R0.116 COC(OC)C(=O)NCCCSC 527a_100000749238_100000046285 [0,2,0,0,0,0|1,0,1]=4 5352 B12R0.116 COC(OC)C(C)NCCCCO 270004a_100000750430_100000211384 [0,2,0,0,0,0|1,0,0]=3 5353 B12R0.116 COC(OC)C(C)NCCCCO 34a_100000750430_100011222894 [0,2,0,0,0,0|1,0,0]=3 5354 B12R0.116 COC(OC)C(C)NCCCSC 270004a_100000749238_100000211384 [0,2,0,0,0,0|1,0,0]=3 5355 B12R0.116 COC(OC)C(C)OCCCC#N 7a_100000754440_100000687738 [0,2,0,0,0,0|1,0,1]=4 5356 B12R0.116 COC(OC)C(C)OCCCC=O 7a_100000754440_200011292268 [0,2,0,0,0,0|1,0,1]=4 5357 B12R0.116 COC(OC)C(C)OCCCCBr 34a_100011216708_100011222894 [0,2,0,0,0,0|1,0,0]=3 5358 B12R0.116 COC(OC)C(C)OCCCCCl 34a_100000210776_100011222894 [0,2,0,0,0,0|1,0,0]=3 5359 B12R0.116 COC(OC)C(C)OCCCCF 34a_100000754440_100000729493 [0,2,0,0,0,0|1,0,0]=3 5360 B12R0.116 COC(OC)C(C)OCCCCF 34a_100011995726_100011222894 [0,2,0,0,0,0|1,0,0]=3 5361 B12R0.116 COC(OC)C(C)OCCCCF 7a_100000754440_100000729493 [0,2,0,0,0,0|1,0,0]=3 5362 B12R0.116 COC(OC)C(C)OCCCCI 34a_200012148704_100011222894 [0,2,0,0,0,0|1,0,0]=3 5363 B12R0.116 COC(OC)C(C)OCCCCN 34a_100000750430_100011222894 [0,2,0,0,0,0|1,0,0]=3 5364 B12R0.116 COC(OC)C(C)OCCCCO 34a_100000754440_100011216708 [0,2,0,0,0,0|1,0,0]=3 5365 B12R0.116 COC(OC)C(C)OCCCCO 7a_100000754440_100000210776 [0,2,0,0,0,0|1,0,0]=3 5366 B12R0.116 COC(OC)C(C)OCCCSC 34a_100000690336_100011222894 [0,2,0,0,0,0|1,0,0]=3 5367 B12R0.116 COC(OC)C(C)SCCCC#N 62a_100000687738_100011222894 [0,2,0,0,0,0|1,0,1]=4 5368 B12R0.116 COC(OC)C(C)SCCCC#N 62a_100011222894_100000687738 [0,2,0,0,0,0|1,0,1]=4 5369 B12R0.116 COC(OC)C(C)SCCCC=O 62a_100011222894_200011292268 [0,2,0,0,0,0|1,0,1]=4 5370 B12R0.116 COC(OC)C(C)SCCCC=O 62a_200011292268_100011222894 [0,2,0,0,0,0|1,0,1]=4 5371 B12R0.116 COC(OC)C(C)SCCCCF 62a_100000729493_100011222894 [0,2,0,0,0,0|1,0,0]=3 5372 B12R0.116 COC(OC)C(C)SCCCCF 62a_100011222894_100000729493 [0,2,0,0,0,0|1,0,0]=3 5373 B12R0.116 COC(OC)C(C)SCCCCO 62a_100000210776_100011222894 [0,2,0,0,0,0|1,0,0]=3 5374 B12R0.116 COC(OC)C(C)SCCCCO 62a_100011222894_100000210776 [0,2,0,0,0,0|1,0,0]=3 5375 B12R0.116 COCCCCC(=O)C(OC)OC 1458a_100000046285_100000755781 [0,2,0,0,0,0|0,0,1]=3 5376 B12R0.116 COCCCNC(=O)C(OC)OC 240690a_100150723488_100000046285 [0,2,0,0,0,0|1,0,1]=4 5377 B12R0.116 COCCCNC(=O)C(OC)OC 527a_100150723488_100000046285 [0,2,0,0,0,0|1,0,1]=4 5378 B12R0.116 COCCCNC(C)C(OC)OC 270004a_100150723488_100000211384 [0,2,0,0,0,0|1,0,0]=3 5379 B12R0.116 COCCCNC(C)C(OC)OC 34a_100150723488_100011222894 [0,2,0,0,0,0|1,0,0]=3 5380 B12R0.116 COCCCOC(C)C(OC)OC 34a_100000740835_100011222894 [0,2,0,0,0,0|1,0,0]=3 5381 B12R0.116 COCCCOC(C)C(OC)OC 34a_100000754440_100000740836 [0,2,0,0,0,0|1,0,0]=3 5382 B12R0.116 COCCCOC(C)C(OC)OC 7a_100000754440_100000740836 [0,2,0,0,0,0|1,0,0]=3 5383 B12R0.116 COCCCSC(C)C(OC)OC 62a_100000709357_100011222894 [0,2,0,0,0,0|1,0,0]=3 5384 B12R0.116 COCCCSC(C)C(OC)OC 62a_100011222894_100000709357 [0,2,0,0,0,0|1,0,0]=3 5385 B12R0.121 C=CC(CCCCCCC)OCC 34a_200011934235_100000210202 [0,2,0,0,0,0|1,0,1]=4 5386 B12R0.121 C=CC(CCCCCCC)OCC 7a_200011934235_100000210202 [0,2,0,0,0,0|1,0,1]=4 5387 B12R0.121 C=CC(CCCCCCC)OCF 34a_200011934235_100015361967 [0,2,0,0,0,0|1,0,1]=4 5388 B12R0.121 C=CC(CCCCCCC)OCF 7a_200011934235_100015361967 [0,2,0,0,0,0|1,0,1]=4 5389 B12R0.121 CC#CC(CC)OCCCCCC 34a_200011219922_100000210314 [0,2,0,0,0,0|2,0,0]=4 5390 B12R0.121 CC#CC(CC)OCCCCCC 7a_200011219922_100000210314 [0,2,0,0,0,0|2,0,0]=4 5391 B12R0.121 CCC(COC)NCCCCCF 2230a_100000757820_100000729378 [0,2,0,0,0,0|2,0,0]=4 5392 B12R0.121 CCC(COC)NCCCCCO 2230a_100000757820_100000746330 [0,2,0,0,0,0|2,0,0]=4 5393 B12R0.121 CCC(COC)NCCCCCO 270004a_100000762737_100000757811 [0,2,0,0,0,0|2,0,0]=4 5394 B12R0.121 CCC(COC)NCCCCOC 2230a_100000757820_100000730899 [0,2,0,0,0,0|2,0,0]=4 5395 B12R0.121 CCC(COC)OCCCCCF 7a_200011214946_100000729378 [0,2,0,0,0,0|2,0,0]=4 5396 B12R0.121 CCC(COC)OCCCCCO 7a_200011214946_100000746330 [0,2,0,0,0,0|2,0,0]=4 5397 B12R0.121 CCC(COC)OCCCCOC 7a_200011214946_100000730899 [0,2,0,0,0,0|2,0,0]=4 5398 B12R0.121 CCCCCCCC(CC)NCC 270004a_100015525214_200011217162 [0,2,0,0,0,0|2,0,0]=4 5399 B12R0.121 CCCCCCCC(CC)OCC 34a_200011217053_100000210202 [0,2,0,0,0,0|1,0,0]=3 5400 B12R0.121 CCCCCCCC(CC)OCC 7a_200011217053_100000210202 [0,2,0,0,0,0|1,0,0]=3 5401 B12R0.121 CCCCCCCC(CC)OCF 34a_200011217053_100015361967 [0,2,0,0,0,0|1,0,0]=3 5402 B12R0.121 CCCCCCCC(CC)OCF 7a_200011217053_100015361967 [0,2,0,0,0,0|1,0,0]=3 5403 B12R0.121 CCCCCCCC(CCC)NC 270004a_106832991635_200011216337 [0,2,0,0,0,0|2,0,0]=4 5404 B12R0.121 CCCCCCCN(CC)COC 2230a_100000228213_100000766300 [0,2,0,0,0,0|2,0,0]=4 5405 B12R0.121 CCCCCCCN(CC)COC 269982a_100000228213_100000766300 [0,2,0,0,0,0|2,0,0]=4 5406 B12R0.121 CCCCCCNC(CC)CCC 2230a_100000747048_100000210314 [0,2,0,0,0,0|2,0,0]=4 5407 B12R0.121 CCCCCCNC(CC)CCC 270004a_100000210581_100000687865 [0,2,0,0,0,0|2,0,0]=4 5408 B12R0.121 CCCCCCNC(CC)COC 2230a_100000757820_100000210314 [0,2,0,0,0,0|1,0,0]=3 5409 B12R0.121 CCCCCCNC(CC)COC 270004a_100000210581_100000757811 [0,2,0,0,0,0|1,0,0]=3 5410 B12R0.121 CCCCCCNC(CO)COC 2230a_100000724102_100000210314 [0,2,0,0,0,0|2,0,0]=4 5411 B12R0.121 CCCCCCNC(CO)COC 34a_100000724102_100000210314 [0,2,0,0,0,0|2,0,0]=4 5412 B12R0.121 CCCCCCOC(CC)CCC 34a_100000687864_100000210314 [0,2,0,0,0,0|2,0,0]=4 5413 B12R0.121 CCCCCCOC(CC)CCC 7a_100000210259_100011219200 [0,2,0,0,0,0|2,0,0]=4 5414 B12R0.121 CCCCCCOC(CC)CCC 7a_100000687864_100000210314 [0,2,0,0,0,0|2,0,0]=4 5415 B12R0.121 CCCCCCOC(CC)COC 7a_200011214946_100000210314 [0,2,0,0,0,0|1,0,0]=3 5416 B12R0.121 CCCCCCOC(CCl)COC 34a_100011215053_100000210314 [0,2,0,0,0,0|2,0,0]=4 5417 B12R0.121 CCCCCCOC(CN)COC 34a_100000756049_100000210314 [0,2,0,0,0,0|2,0,0]=4 5418 B12R0.121 CCCCCCSC(CC)CCC 62a_100000210314_100011219200 [0,2,0,0,0,0|2,0,0]=4 5419 B12R0.121 CCCCCCSC(CC)CCC 62a_100011219200_100000210757 [0,2,0,0,0,0|2,0,0]=4 5420 B12R0.121 CCCCCNCC(CC)OCC 2230a_100015183923_100000210326 [0,2,0,0,0,0|1,0,0]=3 5421 B12R0.121 CCCCCNCC(CC)OCC 34a_100015183923_100000718602 [0,2,0,0,0,0|1,0,0]=3 5422 B12R0.121 CCCCOCCC(CCC)SC 34a_100000032865_100000210210 [0,2,0,0,0,0|1,1,0]=4 5423 B12R0.121 CCCCOCCC(CCC)SC 7a_100000032865_100000210211 [0,2,0,0,0,0|1,1,0]=4 5424 B12R0.121 CCCCOCNC(CC)COC 2230a_100000757820_100011995733 [0,2,0,0,0,0|2,0,0]=4 5425 B12R0.121 CCCOCCNC(CC)COC 2230a_100000757820_100011215938 [0,2,0,0,0,0|2,0,0]=4 5426 B12R0.121 CCCOCCNC(CC)COC 270004a_100161115042_100000757811 [0,2,0,0,0,0|2,0,0]=4 5427 B12R0.121 CCCOCCOC(CC)COC 7a_200011214946_100011215938 [0,2,0,0,0,0|2,0,0]=4 5428 B12R0.121 CCCSCCNC(CC)COC 270004a_100020603323_100000757811 [0,2,0,0,0,0|2,0,0]=4 5429 B12R0.121 CCOC(CC)CNCCCCF 2230a_100015183923_100000729493 [0,2,0,0,0,0|2,0,0]=4 5430 B12R0.121 CCOC(CC)CNCCCCF 34a_100015183923_100000729493 [0,2,0,0,0,0|2,0,0]=4 5431 B12R0.121 CCOC(CC)CNCCCCO 2230a_100015183923_100000210776 [0,2,0,0,0,0|2,0,0]=4 5432 B12R0.121 CCOC(CC)CNCCCCO 34a_100015183923_100011216708 [0,2,0,0,0,0|2,0,0]=4 5433 B12R0.121 CCOC(CC)CNCCCOC 2230a_100015183923_100000740836 [0,2,0,0,0,0|2,0,0]=4 5434 B12R0.121 CCOC(CC)CNCCCOC 34a_100015183923_100000740836 [0,2,0,0,0,0|2,0,0]=4 5435 B12R0.121 CCOC(CC)CNCCSCC 2230a_100015183923_100000757381 [0,2,0,0,0,0|2,0,0]=4 5436 B12R0.121 CCOC(CC)CNCCSCC 34a_100015183923_100000757381 [0,2,0,0,0,0|2,0,0]=4 5437 B12R0.121 CCOCCCNC(CC)COC 2230a_100000757820_100012232248 [0,2,0,0,0,0|2,0,0]=4 5438 B12R0.121 CCOCCCNC(CC)COC 270004a_100000210961_100000757811 [0,2,0,0,0,0|2,0,0]=4 5439 B12R0.121 CCOCCCOC(CC)COC 7a_200011214946_100012232248 [0,2,0,0,0,0|2,0,0]=4 5440 B12R0.121 CCOCCNCC(CC)OCC 2230a_100015183923_100011215890 [0,2,0,0,0,0|2,0,0]=4 5441 B12R0.121 CCOCCNCC(CC)OCC 34a_100015183923_100000210147 [0,2,0,0,0,0|2,0,0]=4 5442 B12R0.265 C#CCC(=O)CCCC(OC)OC 1458a_100011220946_100000069011 [0,2,0,0,0,0|0,0,2]=4 5443 B12R0.265 C#CCC(C)OCCC(OC)OC 34a_100000685586_100000139399 [0,2,0,0,0,0|0,0,2]=4 5444 B12R0.265 C#CCC(C)OCCC(OC)OC 7a_100000685586_100009813347 [0,2,0,0,0,0|0,0,2]=4 5445 B12R0.265 C#CCN(C)CCCC(OC)OC 2230a_100000225692_100000069011 [0,2,0,0,0,0|0,0,2]=4 5446 B12R0.265 C#CCN(C)CCCC(OC)OC 34a_100000225692_100000069011 [0,2,0,0,0,0|0,0,2]=4 5447 B12R0.265 C/C=C/C(C)OCCC(OC)OC 34a_200102604097_100000139399 [0,2,0,0,0,0|0,0,2]=4 5448 B12R0.265 C=CCC(=O)CCCC(OC)OC 1458a_100000210193_100000069011 [0,2,0,0,0,0|0,0,2]=4 5449 B12R0.265 C=CCC(C)COCC(OC)OC 34a_100009832082_100000211822 [0,2,0,0,0,0|0,0,2]=4 5450 B12R0.265 C=CCC(C)COCC(OC)OC 7a_100009832082_100000751394 [0,2,0,0,0,0|0,0,2]=4 5451 B12R0.265 C=CCN(C)CCCC(OC)OC 2230a_100000225617_100000069011 [0,2,0,0,0,0|0,0,2]=4 5452 B12R0.265 C=CCN(C)CCCC(OC)OC 269982a_100000225617_100000069011 [0,2,0,0,0,0|0,0,2]=4 5453 B12R0.265 C=CC[C@@H](C)OCCC(OC)OC 34a_100000731007_100000139399 [0,2,0,0,0,0|0,0,2]=4 5454 B12R0.265 C=CC[C@@H](C)OCCC(OC)OC 7a_100000731007_100009813347 [0,2,0,0,0,0|0,0,2]=4 5455 B12R0.265 C=CC[C@@H](N)COCC(OC)OC 34a_100020615467_100000211822 [0,2,0,0,0,0|0,0,2]=4 5456 B12R0.265 CC#CC(=O)CCCC(OC)OC 1458a_100000763181_100000069011 [0,2,0,0,0,0|0,0,2]=4 5457 B12R0.265 CC#CC(C)OCCC(OC)OC 34a_100011216543_100000139399 [0,2,0,0,0,0|0,0,2]=4 5458 B12R0.265 CC=CC(=O)CCCC(OC)OC 1458a_100000210699_100000069011 [0,2,0,0,0,0|0,0,2]=4 5459 B12R0.265 CCC(COCC(O)COC)OC 34a_100011934954_100011215053 [0,2,0,0,0,0|2,0,0]=4 5460 B12R0.265 CCC(COCC(O)COC)OC 7a_100011934954_100011215053 [0,2,0,0,0,0|2,0,0]=4 5461 B12R0.265 CCCC(=O)CCCC(OC)OC 1458a_100000211992_100000069011 [0,2,0,0,0,0|0,0,0]=2 5462 B12R0.265 CCCC(=O)COCC(CC)OC 7a_100011934954_100000747444 [0,2,0,0,0,0|1,0,1]=4 5463 B12R0.265 CCCC(=O)CSCC(OC)OC 62a_100000747444_100000751394 [0,2,0,0,0,0|0,0,1]=3 5464 B12R0.265 CCCC(=O)CSCC(OC)OC 62a_100000751394_100000747444 [0,2,0,0,0,0|0,0,1]=3 5465 B12R0.265 CCCC(C)CCOC(CC)CC 7a_100011217855_100000210505 [0,2,0,0,0,0|2,0,0]=4 5466 B12R0.265 CCCC(C)CNCC(CC)CC 2230a_100102946423_100011216630 [0,2,0,0,0,0|2,0,0]=4 5467 B12R0.265 CCCC(C)CNCC(CC)CC 270004a_100102946423_100000243154 [0,2,0,0,0,0|2,0,0]=4 5468 B12R0.265 CCCC(C)CNCC(CC)OC 270004a_100000731041_100000243154 [0,2,0,0,0,0|1,0,0]=3 5469 B12R0.265 CCCC(C)CNCC(OC)OC 270004a_100000210479_100000243154 [0,2,0,0,0,0|0,0,0]=2 5470 B12R0.265 CCCC(C)COCC(CC)CC 34a_100000688023_100011215472 [0,2,0,0,0,0|2,0,0]=4 5471 B12R0.265 CCCC(C)COCC(CC)CC 7a_100000688023_100011215472 [0,2,0,0,0,0|2,0,0]=4 5472 B12R0.265 CCCC(C)COCC(CC)CC 7a_100000703878_100011216630 [0,2,0,0,0,0|2,0,0]=4 5473 B12R0.265 CCCC(C)COCC(CC)OC 34a_100011934954_100011216630 [0,2,0,0,0,0|1,0,0]=3 5474 B12R0.265 CCCC(C)COCC(CC)OC 7a_100011934954_100011216630 [0,2,0,0,0,0|1,0,0]=3 5475 B12R0.265 CCCC(C)COCC(OC)OC 34a_100000688023_100000211822 [0,2,0,0,0,0|0,0,0]=2 5476 B12R0.265 CCCC(C)COCC(OC)OC 34a_100011216393_100011216630 [0,2,0,0,0,0|0,0,0]=2 5477 B12R0.265 CCCC(C)COCC(OC)OC 7a_100000688023_100000751394 [0,2,0,0,0,0|0,0,0]=2 5478 B12R0.265 CCCC(C)CSCC(CC)CC 62a_100011215472_100011216630 [0,2,0,0,0,0|2,0,0]=4 5479 B12R0.265 CCCC(C)CSCC(CC)CC 62a_100011216630_100011215472 [0,2,0,0,0,0|2,0,0]=4 5480 B12R0.265 CCCC(C)CSCC(OC)OC 62a_100000751394_100011216630 [0,2,0,0,0,0|0,0,0]=2 5481 B12R0.265 CCCC(C)CSCC(OC)OC 62a_100011216630_100000751394 [0,2,0,0,0,0|0,0,0]=2 5482 B12R0.265 CCCC(C)NCCC(OC)OC 2230a_100000741246_100009813347 [0,2,0,0,0,0|0,0,0]=2 5483 B12R0.265 CCCC(C)OCCC(OC)OC 34a_100000764384_100000139399 [0,2,0,0,0,0|0,0,0]=2 5484 B12R0.265 CCCC(C)OCCC(OC)OC 7a_100000764384_100009813347 [0,2,0,0,0,0|0,0,0]=2 5485 B12R0.265 CCCC(C)SCCC(OC)OC 62a_100000139399_100000766640 [0,2,0,0,0,0|0,0,0]=2 5486 B12R0.265 CCCC(C)SCCC(OC)OC 62a_100000766640_100000139399 [0,2,0,0,0,0|0,0,0]=2 5487 B12R0.265 CCCN(C)CCCC(OC)OC 2230a_100000747261_100000069011 [0,2,0,0,0,0|0,0,0]=2 5488 B12R0.265 CCCN(C)CCCC(OC)OC 269982a_100000747261_100000069011 [0,2,0,0,0,0|0,0,0]=2 5489 B12R0.265 CCC[C@H](N)COCC(CC)CC 34a_100000732646_100011215472 [0,2,0,0,0,0|2,0,0]=4 5490 B12R0.265 CCC[C@H](N)COCC(OC)OC 34a_100000732646_100000211822 [0,2,0,0,0,0|0,0,0]=2 5491 B12R0.265 CCNC(=O)CNCC(OC)OC 2230a_100016988866_100000751394 [0,2,0,0,0,0|1,0,1]=4 5492 B12R0.265 CCNC(=O)CNCC(OC)OC 270004a_100016988866_100000752162 [0,2,0,0,0,0|1,0,1]=4 5493 B12R0.265 CCNC(=O)COCC(OC)OC 34a_100011216393_100000183381 [0,2,0,0,0,0|1,0,1]=4 5494 B12R0.265 CCNC(=O)CSCC(OC)OC 62a_100000183381_100000751394 [0,2,0,0,0,0|1,0,1]=4 5495 B12R0.265 CCNC(=O)CSCC(OC)OC 62a_100000751394_100000183381 [0,2,0,0,0,0|1,0,1]=4 5496 B12R0.265 CCOC(=O)COCC(OC)OC 34a_100011216393_100000188475 [0,2,0,0,0,0|1,0,1]=4 5497 B12R0.265 CCOC(=O)CSCC(OC)OC 62a_100000188475_100000751394 [0,2,0,0,0,0|1,0,1]=4 5498 B12R0.265 CCOC(=O)CSCC(OC)OC 62a_100000751394_100000188475 [0,2,0,0,0,0|1,0,1]=4 5499 B12R0.265 COC(CCCC(=O)CC#N)OC 1458a_100051588842_100000069011 [0,2,0,0,0,0|0,0,2]=4 5500 B12R0.265 COC(CCCC(=O)CCO)OC 1458a_100011216618_100000069011 [0,2,0,0,0,0|0,0,1]=3 5501 B12R0.265 COC(CCCC(=O)CSC)OC 1458a_100000184570_100000069011 [0,2,0,0,0,0|0,0,1]=3 5502 B12R0.265 COC(CCCN(C)CC#N)OC 2230a_100000748184_100000069011 [0,2,0,0,0,0|1,0,1]=4 5503 B12R0.265 COC(CCCN(C)CCO)OC 2230a_100000210263_100000069011 [0,2,0,0,0,0|1,0,0]=3 5504 B12R0.265 COC(CCCN(C)CCO)OC 269982a_100000210263_100000069011 [0,2,0,0,0,0|1,0,0]=3 5505 B12R0.265 COC(CCN[C@@H](C)CC#N)OC 2230a_100016994482_100009813347 [0,2,0,0,0,0|1,0,1]=4 5506 B12R0.265 COC(CCN[C@H](C)CCO)OC 2230a_100000706166_100009813347 [0,2,0,0,0,0|1,0,0]=3 5507 B12R0.265 COC(CCN[C@H](C)CCO)OC 34a_100000706166_100000139399 [0,2,0,0,0,0|1,0,0]=3 5508 B12R0.265 COC(CCOC(C)CCBr)OC 34a_100012276601_100000139399 [0,2,0,0,0,0|1,0,0]=3 5509 B12R0.265 COC(CCSC(C)CC#N)OC 62a_100000139399_100009813641 [0,2,0,0,0,0|1,0,1]=4 5510 B12R0.265 COC(CCSC(C)CC#N)OC 62a_100009813641_100000139399 [0,2,0,0,0,0|1,0,1]=4 5511 B12R0.265 COC(CCSC(C)CCO)OC 62a_100000139399_100009893172 [0,2,0,0,0,0|1,0,0]=3 5512 B12R0.265 COC(CCSC(C)CCO)OC 62a_100009893172_100000139399 [0,2,0,0,0,0|1,0,0]=3 5513 B12R0.265 COC(COCC(C)CCN)OC 34a_106354213184_100000211822 [0,2,0,0,0,0|1,0,0]=3 5514 B12R0.265 COC(CSC[C@@H](O)CC#N)OC 62a_100000001066_100000751394 [0,2,0,0,0,0|1,0,1]=4 5515 B12R0.265 COC(CSC[C@@H](O)CC#N)OC 62a_100000751394_100000001066 [0,2,0,0,0,0|1,0,1]=4 5516 B12R0.265 COCC(=O)CCCC(OC)OC 1458a_100000210968_100000069011 [0,2,0,0,0,0|0,0,1]=3 5517 B12R0.265 COCC(C)SCCC(OC)OC 62a_100000139399_100000765312 [0,2,0,0,0,0|1,0,0]=3 5518 B12R0.265 COCC(C)SCCC(OC)OC 62a_100000765312_100000139399 [0,2,0,0,0,0|1,0,0]=3 5519 B12R0.265 COCC(N)COCC(OC)OC 34a_100000724102_100000211822 [0,2,0,0,0,0|1,0,0]=3 5520 B12R0.265 COCC(O)CNCC(OC)OC 2230a_100000756049_100000751394 [0,2,0,0,0,0|1,0,0]=3 5521 B12R0.265 COCC(O)CNCC(OC)OC 270004a_100000756049_100000752162 [0,2,0,0,0,0|1,0,0]=3 5522 B12R0.265 COCC(O)CNCC(OC)OC 34a_100000756049_100000211822 [0,2,0,0,0,0|1,0,0]=3 5523 B12R0.265 COCC(O)COCC(OC)OC 34a_100011216393_100011215053 [0,2,0,0,0,0|1,0,0]=3 5524 B12R0.265 COCC(O)CSCC(OC)OC 62a_100000751394_100011215053 [0,2,0,0,0,0|1,0,0]=3 5525 B12R0.265 COCC(O)CSCC(OC)OC 62a_100011215053_100000751394 [0,2,0,0,0,0|1,0,0]=3 5526 B12R0.265 COC[C@@H](C)NCCC(OC)OC 2230a_100000764878_100009813347 [0,2,0,0,0,0|1,0,0]=3 5527 B12R0.265 COC[C@@H](C)OCCC(OC)OC 34a_100011934205_100000139399 [0,2,0,0,0,0|1,0,0]=3 5528 B12R0.435 C#CCCCNCC(C)(OC)OC 2230a_100000732740_100000731252 [0,2,0,0,0,0|0,0,2]=4 5529 B12R0.435 C#CCCCNCC(C)(OC)OC 34a_100000718082_100000766008 [0,2,0,0,0,0|0,0,2]=4 5530 B12R0.435 C#CCCCOCC(C)(OC)OC 34a_100000215630_100000766008 [0,2,0,0,0,0|0,0,2]=4 5531 B12R0.435 C#CCCCSCC(C)(OC)OC 62a_100000766008_100011215417 [0,2,0,0,0,0|0,0,2]=4 5532 B12R0.435 C#CCCCSCC(C)(OC)OC 62a_100011215417_100000766008 [0,2,0,0,0,0|0,0,2]=4 5533 B12R0.435 C/C=C/CCOCC(C)(OC)OC 34a_100016278192_100000766008 [0,2,0,0,0,0|0,0,2]=4 5534 B12R0.435 C=CCCCNCC(C)(OC)OC 2230a_100000700776_100000064154 [0,2,0,0,0,0|0,0,2]=4 5535 B12R0.435 C=CCCCNCC(C)(OC)OC 2230a_100000732740_100011713584 [0,2,0,0,0,0|0,0,2]=4 5536 B12R0.435 C=CCCCNCC(C)(OC)OC 34a_100000700776_100000766008 [0,2,0,0,0,0|0,0,2]=4 5537 B12R0.435 C=CCCCOCC(C)(OC)OC 34a_100000758997_100000766008 [0,2,0,0,0,0|0,0,2]=4 5538 B12R0.435 C=CCCCSCC(C)(OC)OC 62a_100000766008_100000757094 [0,2,0,0,0,0|0,0,2]=4 5539 B12R0.435 C=CCCCSCC(C)(OC)OC 62a_100011713584_100000766008 [0,2,0,0,0,0|0,0,2]=4 5540 B12R0.435 CC#CCCOCC(C)(OC)OC 34a_100000750427_100000766008 [0,2,0,0,0,0|0,0,2]=4 5541 B12R0.435 CC/C=C\CNCC(C)(OC)OC 2230a_100000732740_100103147603 [0,2,0,0,0,0|0,0,2]=4 5542 B12R0.435 CC/C=C\COCC(C)(OC)OC 34a_100016268518_100000766008 [0,2,0,0,0,0|0,0,2]=4 5543 B12R0.435 CC/C=C\CSCC(C)(OC)OC 62a_100000766008_100103147603 [0,2,0,0,0,0|0,0,2]=4 5544 B12R0.435 CC/C=C\CSCC(C)(OC)OC 62a_100103147603_100000766008 [0,2,0,0,0,0|0,0,2]=4 5545 B12R0.435 CCC#CCNCC(C)(OC)OC 2230a_100000732740_100009813939 [0,2,0,0,0,0|0,0,2]=4 5546 B12R0.435 CCC#CCOCC(C)(OC)OC 34a_100000032950_100000766008 [0,2,0,0,0,0|0,0,2]=4 5547 B12R0.435 CCC#CCSCC(C)(OC)OC 62a_100000766008_100009813939 [0,2,0,0,0,0|0,0,2]=4 5548 B12R0.435 CCC#CCSCC(C)(OC)OC 62a_100009813939_100000766008 [0,2,0,0,0,0|0,0,2]=4 5549 B12R0.435 CCCCCCOC(C)(CC)CC 7a_100000210259_100009817345 [0,2,0,0,0,0|2,0,0]=4 5550 B12R0.435 CCCCCCOC(C)(CC)CC 7a_100000755174_100000210314 [0,2,0,0,0,0|2,0,0]=4 5551 B12R0.435 CCCCCCSC(C)(CC)CC 62a_100000210314_100009817345 [0,2,0,0,0,0|2,0,0]=4 5552 B12R0.435 CCCCCCSC(C)(CC)CC 62a_100009817345_100000210757 [0,2,0,0,0,0|2,0,0]=4 5553 B12R0.435 CCCCCNCC(C)(OC)OC 2230a_100000209983_100000064154 [0,2,0,0,0,0|0,0,0]=2 5554 B12R0.435 CCCCCNCC(C)(OC)OC 2230a_100000732740_100000210326 [0,2,0,0,0,0|0,0,0]=2 5555 B12R0.435 CCCCCOCC(C)(OC)OC 34a_100000210253_100000766008 [0,2,0,0,0,0|0,0,0]=2 5556 B12R0.435 CCCCCOCP(=O)(OC)OC 34a_100000101693_100000718602 [0,2,0,0,0,0|1,0,0]=3 5557 B12R0.435 CCCCCSCC(C)(OC)OC 62a_100000210326_100000766008 [0,2,0,0,0,0|0,0,0]=2 5558 B12R0.435 CCCCCSCC(C)(OC)OC 62a_100000766008_100000210326 [0,2,0,0,0,0|0,0,0]=2 5559 B12R0.435 CCCCCSC[Si](C)(OC)OC 62a_100000067953_100000210326 [0,2,0,0,0,0|0,1,0]=3 5560 B12R0.435 CCCCCSC[Si](C)(OC)OC 62a_100000210326_100000067953 [0,2,0,0,0,0|0,1,0]=3 5561 B12R0.435 CCCCOCCP(=O)(OC)OC 34a_200000043213_100000210210 [0,2,0,0,0,0|1,0,0]=3 5562 B12R0.435 CCCOCCC[Si](C)(OC)OC 34a_100000210258_100000031653 [0,2,0,0,0,0|0,1,0]=3 5563 B12R0.435 CCCSCCC[Si](C)(OC)OC 62a_100000031653_100000210303 [0,2,0,0,0,0|0,1,0]=3 5564 B12R0.435 CCCSCCC[Si](C)(OC)OC 62a_100000210303_100000031653 [0,2,0,0,0,0|0,1,0]=3 5565 B12R0.435 CCOCCNCC(C)(OC)OC 2230a_100000732740_100011215890 [0,2,0,0,0,0|1,0,0]=3 5566 B12R0.435 CCOCCNCC(C)(OC)OC 2230a_102516460346_100000064154 [0,2,0,0,0,0|1,0,0]=3 5567 B12R0.435 CCOCCNCC(C)(OC)OC 34a_102516460346_100000766008 [0,2,0,0,0,0|1,0,0]=3 5568 B12R0.435 CCOCCOCC(C)(OC)OC 34a_100000210136_100000766008 [0,2,0,0,0,0|1,0,0]=3 5569 B12R0.435 CCOCCOCP(=O)(OC)OC 34a_100000101693_100000210147 [0,2,0,0,0,0|2,0,0]=4 5570 B12R0.435 CCOCCSCC(C)(OC)OC 62a_100000210147_100000766008 [0,2,0,0,0,0|1,0,0]=3 5571 B12R0.435 CCOCCSCC(C)(OC)OC 62a_100000766008_100011215890 [0,2,0,0,0,0|1,0,0]=3 5572 B12R0.435 CCOCCSC[Si](C)(OC)OC 62a_100000067953_100011215890 [0,2,0,0,0,0|1,1,0]=4 5573 B12R0.435 CCOCCSC[Si](C)(OC)OC 62a_100000210147_100000067953 [0,2,0,0,0,0|1,1,0]=4 5574 B12R0.435 CCSCCNCC(C)(OC)OC 2230a_100000106463_100000064154 [0,2,0,0,0,0|1,0,0]=3 5575 B12R0.435 CCSCCNCC(C)(OC)OC 2230a_100000732740_100000757381 [0,2,0,0,0,0|1,0,0]=3 5576 B12R0.435 CCSCCOCC(C)(OC)OC 34a_100000212035_100000766008 [0,2,0,0,0,0|1,0,0]=3 5577 B12R0.435 CCSCCOCP(=O)(OC)OC 34a_100000101693_100000757381 [0,2,0,0,0,0|2,0,0]=4 5578 B12R0.435 CCSCCSCC(C)(OC)OC 62a_100000757381_100000766008 [0,2,0,0,0,0|1,0,0]=3 5579 B12R0.435 CCSCCSCC(C)(OC)OC 62a_100000766008_100000757381 [0,2,0,0,0,0|1,0,0]=3 5580 B12R0.435 CCSCCSC[Si](C)(OC)OC 62a_100000067953_100000757381 [0,2,0,0,0,0|1,1,0]=4 5581 B12R0.435 CCSCCSC[Si](C)(OC)OC 62a_100000757381_100000067953 [0,2,0,0,0,0|1,1,0]=4 5582 B12R0.435 CNCCCOCC(C)(OC)OC 34a_100000213112_100000766008 [0,2,0,0,0,0|1,0,0]=3 5583 B12R0.435 COC(C)(CNCCCC#N)OC 2230a_100000732740_100000687738 [0,2,0,0,0,0|1,0,1]=4 5584 B12R0.435 COC(C)(CNCCCC=O)OC 2230a_100000732740_200011292268 [0,2,0,0,0,0|1,0,1]=4 5585 B12R0.435 COC(C)(CNCCCCF)OC 2230a_100000732740_100000729493 [0,2,0,0,0,0|1,0,0]=3 5586 B12R0.435 COC(C)(CNCCCCO)OC 2230a_100000732740_100000210776 [0,2,0,0,0,0|1,0,0]=3 5587 B12R0.435 COC(C)(CNCCCCO)OC 2230a_100000750430_100000064154 [0,2,0,0,0,0|1,0,0]=3 5588 B12R0.435 COC(C)(CNCCCCO)OC 34a_100000750430_100000766008 [0,2,0,0,0,0|1,0,0]=3 5589 B12R0.435 COC(C)(CNCCCSC)OC 2230a_100000749238_100000064154 [0,2,0,0,0,0|1,0,0]=3 5590 B12R0.435 COC(C)(COCCCCBr)OC 34a_100011216708_100000766008 [0,2,0,0,0,0|1,0,0]=3 5591 B12R0.435 COC(C)(COCCCCCl)OC 34a_100000210776_100000766008 [0,2,0,0,0,0|1,0,0]=3 5592 B12R0.435 COC(C)(COCCCCF)OC 34a_100011995726_100000766008 [0,2,0,0,0,0|1,0,0]=3 5593 B12R0.435 COC(C)(COCCCCI)OC 34a_200012148704_100000766008 [0,2,0,0,0,0|1,0,0]=3 5594 B12R0.435 COC(C)(COCCCCN)OC 34a_100000750430_100000766008 [0,2,0,0,0,0|1,0,0]=3 5595 B12R0.435 COC(C)(COCCCSC)OC 34a_100000690336_100000766008 [0,2,0,0,0,0|1,0,0]=3 5596 B12R0.435 COC(C)(CSCCCC#N)OC 62a_100000687738_100000766008 [0,2,0,0,0,0|1,0,1]=4 5597 B12R0.435 COC(C)(CSCCCC#N)OC 62a_100000766008_100000687738 [0,2,0,0,0,0|1,0,1]=4 5598 B12R0.435 COC(C)(CSCCCC=O)OC 62a_100000766008_200011292268 [0,2,0,0,0,0|1,0,1]=4 5599 B12R0.435 COC(C)(CSCCCC=O)OC 62a_200011292268_100000766008 [0,2,0,0,0,0|1,0,1]=4 5600 B12R0.435 COC(C)(CSCCCCF)OC 62a_100000729493_100000766008 [0,2,0,0,0,0|1,0,0]=3 5601 B12R0.435 COC(C)(CSCCCCF)OC 62a_100000766008_100000729493 [0,2,0,0,0,0|1,0,0]=3 5602 B12R0.435 COC(C)(CSCCCCO)OC 62a_100000210776_100000766008 [0,2,0,0,0,0|1,0,0]=3 5603 B12R0.435 COC(C)(CSCCCCO)OC 62a_100000766008_100000210776 [0,2,0,0,0,0|1,0,0]=3 5604 B12R0.435 COCCCNCC(C)(OC)OC 2230a_100000732740_100000740836 [0,2,0,0,0,0|1,0,0]=3 5605 B12R0.435 COCCCNCC(C)(OC)OC 34a_100150723488_100000766008 [0,2,0,0,0,0|1,0,0]=3 5606 B12R0.435 COCCCOCC(C)(OC)OC 34a_100000740835_100000766008 [0,2,0,0,0,0|1,0,0]=3 5607 B12R0.435 COCCCOCP(=O)(OC)OC 34a_100000101693_100000740836 [0,2,0,0,0,0|2,0,0]=4 5608 B12R0.435 COCCCSCC(C)(OC)OC 62a_100000709357_100000766008 [0,2,0,0,0,0|1,0,0]=3 5609 B12R0.435 COCCCSCC(C)(OC)OC 62a_100000766008_100000709357 [0,2,0,0,0,0|1,0,0]=3 5610 B12R0.435 COCCCSC[Si](C)(OC)OC 62a_100000067953_100000709357 [0,2,0,0,0,0|1,1,0]=4 5611 B12R0.435 COCCCSC[Si](C)(OC)OC 62a_100000709357_100000067953 [0,2,0,0,0,0|1,1,0]=4 5612 B12R0.435 COCCOCCP(=O)(OC)OC 34a_200000043213_100011201679 [0,2,0,0,0,0|2,0,0]=4 5613 B12R0.435 COCSCCC[Si](C)(OC)OC 62a_100000031653_100000766300 [0,2,0,0,0,0|1,1,0]=4 5614 B12R0.435 COCSCCC[Si](C)(OC)OC 62a_100000766300_100000031653 [0,2,0,0,0,0|1,1,0]=4 5615 B12R0.435 COP(=O)(CCOCCCF)OC 34a_200000043213_100011934791 [0,2,0,0,0,0|2,0,0]=4 5616 B12R0.435 COP(=O)(CCOCCCO)OC 34a_200000043213_100000230001 [0,2,0,0,0,0|2,0,0]=4 5617 B12R0.435 COP(=O)(CCOCCSC)OC 34a_200000043213_100000212216 [0,2,0,0,0,0|2,0,0]=4 5618 B12R0.435 COP(=O)(COCCCCF)OC 34a_100000101693_100000729493 [0,2,0,0,0,0|2,0,0]=4 5619 B12R0.435 COP(=O)(COCCCCO)OC 34a_100000101693_100011216708 [0,2,0,0,0,0|2,0,0]=4 5620 B12R0.435 CO[Si](C)(CCCNCCF)OC 34a_100000724931_100000031653 [0,2,0,0,0,0|1,1,0]=4 5621 B12R0.435 CO[Si](C)(CCCNCCO)OC 34a_100016990907_100000031653 [0,2,0,0,0,0|1,1,0]=4 5622 B12R0.435 CO[Si](C)(CCCOCCBr)OC 34a_100000211926_100000031653 [0,2,0,0,0,0|1,1,0]=4 5623 B12R0.435 CO[Si](C)(CCCOCCN)OC 34a_100000210304_100000031653 [0,2,0,0,0,0|1,1,0]=4 5624 B12R0.435 CO[Si](C)(CCCSCCF)OC 62a_100000031653_100011217306 [0,2,0,0,0,0|1,1,0]=4 5625 B12R0.435 CO[Si](C)(CCCSCCF)OC 62a_100011217306_100000031653 [0,2,0,0,0,0|1,1,0]=4 5626 B12R0.435 CO[Si](C)(CCCSCCO)OC 62a_100000031653_100000211926 [0,2,0,0,0,0|1,1,0]=4 5627 B12R0.435 CO[Si](C)(CCCSCCO)OC 62a_100000211926_100000031653 [0,2,0,0,0,0|1,1,0]=4 5628 B12R0.435 CO[Si](C)(CCCSCSC)OC 62a_100000031653_100011218213 [0,2,0,0,0,0|1,1,0]=4 5629 B12R0.435 CO[Si](C)(CCCSCSC)OC 62a_100011218213_100000031653 [0,2,0,0,0,0|1,1,0]=4 5630 B12R0.435 CO[Si](C)(CSCCCCF)OC 62a_100000067953_100000729493 [0,2,0,0,0,0|1,1,0]=4 5631 B12R0.435 CO[Si](C)(CSCCCCF)OC 62a_100000729493_100000067953 [0,2,0,0,0,0|1,1,0]=4 5632 B12R0.435 CO[Si](C)(CSCCCCO)OC 62a_100000067953_100000210776 [0,2,0,0,0,0|1,1,0]=4 5633 B12R0.435 CO[Si](C)(CSCCCCO)OC 62a_100000210776_100000067953 [0,2,0,0,0,0|1,1,0]=4 5634 B12R0.109 CCCCCN(C)C(CC)COC 270004a_100000223495_100000757811 [0,2,0,0,0,0|2,0,0]=4 5635 B12R0.149 CCC(=O)COC(C)C(OC)OC 34a_100000725409_100011222894 [0,2,0,0,0,0|1,0,1]=4 5636 B12R0.149 CCC(=O)COC(C)C(OC)OC 7a_100000754440_100000747405 [0,2,0,0,0,0|1,0,1]=4 5637 B12R0.149 CCC(=O)CSC(C)C(OC)OC 62a_100000747405_100011222894 [0,2,0,0,0,0|1,0,1]=4 5638 B12R0.149 CCC(=O)CSC(C)C(OC)OC 62a_100011222894_100000747405 [0,2,0,0,0,0|1,0,1]=4 5639 B12R0.149 CCC(C)CNC(=O)C(OC)OC 11a_100020588543_100000046285 [0,2,0,0,0,0|1,0,1]=4 5640 B12R0.149 CCC(C)CNC(=O)C(OC)OC 240690a_100020588543_100000046285 [0,2,0,0,0,0|1,0,1]=4 5641 B12R0.149 CCC(C)CNC(=O)C(OC)OC 527a_100020588543_100000046285 [0,2,0,0,0,0|1,0,1]=4 5642 B12R0.149 CCC(C)CNC(C)C(OC)OC 270004a_100020588543_100000211384 [0,2,0,0,0,0|1,0,0]=3 5643 B12R0.149 CCC(C)COC(C)C(OC)OC 34a_100000754440_100000748023 [0,2,0,0,0,0|1,0,0]=3 5644 B12R0.149 CCC(C)COC(C)C(OC)OC 7a_100000754440_100000748023 [0,2,0,0,0,0|1,0,0]=3 5645 B12R0.149 CCC(C)CSC(C)C(OC)OC 62a_100000748023_100011222894 [0,2,0,0,0,0|1,0,0]=3 5646 B12R0.149 CCC(C)CSC(C)C(OC)OC 62a_100011222894_100000748023 [0,2,0,0,0,0|1,0,0]=3 5647 B12R0.149 CCC(O)CNC(=O)C(OC)OC 11a_100011218483_100000046285 [0,2,0,0,0,0|1,0,1]=4 5648 B12R0.149 CCC(O)CNC(=O)C(OC)OC 240690a_100011218483_100000046285 [0,2,0,0,0,0|1,0,1]=4 5649 B12R0.149 CCC(O)CNC(=O)C(OC)OC 527a_100011218483_100000046285 [0,2,0,0,0,0|1,0,1]=4 5650 B12R0.149 CCC(O)CNC(C)C(OC)OC 270004a_100011218483_100000211384 [0,2,0,0,0,0|1,0,0]=3 5651 B12R0.149 CCC(O)COC(C)C(OC)OC 34a_100000754440_100011218378 [0,2,0,0,0,0|1,0,0]=3 5652 B12R0.149 CCC(O)COC(C)C(OC)OC 7a_100000754440_100011218378 [0,2,0,0,0,0|1,0,0]=3 5653 B12R0.149 CCC(O)CSC(C)C(OC)OC 62a_100011218378_100011222894 [0,2,0,0,0,0|1,0,0]=3 5654 B12R0.149 CCC(O)CSC(C)C(OC)OC 62a_100011222894_100011218378 [0,2,0,0,0,0|1,0,0]=3 5655 B12R0.149 CC[C@H](C)COC(C)C(OC)OC 34a_100000754440_100009816398 [0,2,0,0,0,0|1,0,0]=3 5656 B12R0.149 CC[C@H](C)COC(C)C(OC)OC 7a_100000754440_100009816398 [0,2,0,0,0,0|1,0,0]=3 5657 B12R0.149 CC[C@H](C)CSC(C)C(OC)OC 62a_100009816398_100011222894 [0,2,0,0,0,0|1,0,0]=3 5658 B12R0.149 CC[C@H](C)CSC(C)C(OC)OC 62a_100011222894_100009816398 [0,2,0,0,0,0|1,0,0]=3 5659 B12R0.149 COC(C)COC(C)C(OC)OC 34a_100000690652_100011222894 [0,2,0,0,0,0|2,0,0]=4 5660 B12R0.149 COC(OC)C(C)NCC(C)CO 34a_100000744482_100011222894 [0,2,0,0,0,0|2,0,0]=4 5661 B12R0.149 COC(OC)C(C)NC[C@@H](C)OC 270004a_100020591295_100000211384 [0,2,0,0,0,0|2,0,0]=4 5662 B12R0.149 COC(OC)C(C)NC[C@@H](F)CO 270004a_100015665980_100000211384 [0,2,0,0,0,0|2,0,0]=4 5663 B12R0.149 COC(OC)C(C)NC[C@@H](F)CO 34a_100015665980_100011222894 [0,2,0,0,0,0|2,0,0]=4 5664 B12R0.149 COC(OC)C(C)OCC(C)CN 34a_100000744482_100011222894 [0,2,0,0,0,0|2,0,0]=4 5665 B12R0.149 COC(OC)C(C)OCC(Cl)CCl 34a_100000033668_100011222894 [0,2,0,0,0,0|2,0,0]=4 5666 B12R0.149 COC(OC)C(C)OCC(O)CO 34a_100000754440_100011219619 [0,2,0,0,0,0|2,0,0]=4 5667 B12R0.149 COC(OC)C(C)OCC(O)CO 7a_100000754440_100011219619 [0,2,0,0,0,0|2,0,0]=4 5668 B12R0.149 COC(OC)C(C)OC[C@@H](C)CO 34a_100000754440_100000059175 [0,2,0,0,0,0|2,0,0]=4 5669 B12R0.149 COC(OC)C(C)OC[C@@H](C)CO 7a_100000754440_100000059175 [0,2,0,0,0,0|2,0,0]=4 5670 B12R0.149 COC(OC)C(C)OC[C@@H](O)CF 34a_100000754440_100015614560 [0,2,0,0,0,0|2,0,0]=4 5671 B12R0.149 COC(OC)C(C)OC[C@@H](O)CF 7a_100000754440_100015614560 [0,2,0,0,0,0|2,0,0]=4 5672 B12R0.149 COC(OC)C(C)OC[C@@H](O)CO 34a_100000754440_100009815848 [0,2,0,0,0,0|2,0,0]=4 5673 B12R0.149 COC(OC)C(C)OC[C@@H](O)CO 7a_100000754440_100009815848 [0,2,0,0,0,0|2,0,0]=4 5674 B12R0.149 COC(OC)C(C)OC[C@H](F)CN 34a_100015665980_100011222894 [0,2,0,0,0,0|2,0,0]=4 5675 B12R0.149 COC(OC)C(C)SCC(O)CO 62a_100011219619_100011222894 [0,2,0,0,0,0|2,0,0]=4 5676 B12R0.149 COC(OC)C(C)SCC(O)CO 62a_100011222894_100011219619 [0,2,0,0,0,0|2,0,0]=4 5677 B12R0.149 COC(OC)C(C)SC[C@@H](C)CO 62a_100000059175_100011222894 [0,2,0,0,0,0|2,0,0]=4 5678 B12R0.149 COC(OC)C(C)SC[C@@H](C)CO 62a_100011222894_100000059175 [0,2,0,0,0,0|2,0,0]=4 5679 B12R0.149 COC(OC)C(C)SC[C@@H](O)CF 62a_100011222894_100015614560 [0,2,0,0,0,0|2,0,0]=4 5680 B12R0.149 COC(OC)C(C)SC[C@@H](O)CF 62a_100015614560_100011222894 [0,2,0,0,0,0|2,0,0]=4 5681 B12R0.149 COC(OC)C(C)SC[C@@H](O)CO 62a_100009815848_100011222894 [0,2,0,0,0,0|2,0,0]=4 5682 B12R0.149 COC(OC)C(C)SC[C@@H](O)CO 62a_100011222894_100009815848 [0,2,0,0,0,0|2,0,0]=4 5683 B12R0.111 C#CCOC(C=C)CCCCCC 34a_200011215977_100000184674 [0,2,0,0,0,0|1,0,1]=4 5684 B12R0.111 C#CCOC(C=C)CCCCCC 7a_200011215977_100000038162 [0,2,0,0,0,0|1,0,1]=4 5685 B12R0.111 C#CCOC(CC)CCCCCC 34a_100011215785_100000184674 [0,2,0,0,0,0|1,0,0]=3 5686 B12R0.111 C#CCOC(CC)CCCCCC 7a_100011215785_100000038162 [0,2,0,0,0,0|1,0,0]=3 5687 B12R0.111 C=CC(CCCCCC)OCC#N 7a_200011215977_100011215382 [0,2,0,0,0,0|1,0,1]=4 5688 B12R0.111 C=CC(CCCCCC)OCC=O 34a_200011215977_200009817547 [0,2,0,0,0,0|1,0,1]=4 5689 B12R0.111 C=CC(CCCCCC)OCC=O 7a_200011215977_200015260668 [0,2,0,0,0,0|1,0,1]=4 5690 B12R0.111 C=CC(CCCCCC)OCCC 34a_200011215977_100000210303 [0,2,0,0,0,0|1,0,1]=4 5691 B12R0.111 C=CC(CCCCCC)OCCC 7a_200011215977_100000210303 [0,2,0,0,0,0|1,0,1]=4 5692 B12R0.111 C=CC(CCCCCC)OCCF 34a_200011215977_100011217306 [0,2,0,0,0,0|1,0,1]=4 5693 B12R0.111 C=CC(CCCCCC)OCCF 7a_200011215977_100011217306 [0,2,0,0,0,0|1,0,1]=4 5694 B12R0.111 C=CC(CCCCCC)OCCO 34a_200011215977_100000211926 [0,2,0,0,0,0|1,0,1]=4 5695 B12R0.111 C=CC(CCCCCC)OCCO 7a_200011215977_100000211926 [0,2,0,0,0,0|1,0,1]=4 5696 B12R0.111 C=CC(CCCCCC)OCSC 34a_200011215977_100011218213 [0,2,0,0,0,0|1,0,1]=4 5697 B12R0.111 C=CCNC(CC)CCCCCC 270004a_100020586998_100011219640 [0,2,0,0,0,0|2,0,0]=4 5698 B12R0.111 C=CCOC(C=C)CCCCCC 34a_200011215977_100015514636 [0,2,0,0,0,0|1,0,1]=4 5699 B12R0.111 C=CCOC(C=C)CCCCCC 7a_200011215977_100015514636 [0,2,0,0,0,0|1,0,1]=4 5700 B12R0.111 C=CCOC(CC)CCCCCC 34a_100011215785_100015514636 [0,2,0,0,0,0|1,0,0]=3 5701 B12R0.111 C=CCOC(CC)CCCCCC 7a_100011215785_100015514636 [0,2,0,0,0,0|1,0,0]=3 5702 B12R0.111 CCCCCCC(CC)NCCC 270004a_100020643023_100011219640 [0,2,0,0,0,0|2,0,0]=4 5703 B12R0.111 CCCCCCC(CC)NCCO 270004a_100000210304_100011219640 [0,2,0,0,0,0|2,0,0]=4 5704 B12R0.111 CCCCCCC(CC)OCC#N 7a_100011215785_100011215382 [0,2,0,0,0,0|1,0,0]=3 5705 B12R0.111 CCCCCCC(CC)OCC=O 34a_100011215785_200009817547 [0,2,0,0,0,0|1,0,0]=3 5706 B12R0.111 CCCCCCC(CC)OCC=O 7a_100011215785_200015260668 [0,2,0,0,0,0|1,0,0]=3 5707 B12R0.111 CCCCCCC(CC)OCCC 34a_100011215785_100000210303 [0,2,0,0,0,0|1,0,0]=3 5708 B12R0.111 CCCCCCC(CC)OCCC 7a_100011215785_100000210303 [0,2,0,0,0,0|1,0,0]=3 5709 B12R0.111 CCCCCCC(CC)OCCF 34a_100011215785_100011217306 [0,2,0,0,0,0|1,0,0]=3 5710 B12R0.111 CCCCCCC(CC)OCCF 7a_100011215785_100011217306 [0,2,0,0,0,0|1,0,0]=3 5711 B12R0.111 CCCCCCC(CC)OCCO 34a_100011215785_100000211926 [0,2,0,0,0,0|1,0,0]=3 5712 B12R0.111 CCCCCCC(CC)OCCO 7a_100011215785_100000211926 [0,2,0,0,0,0|1,0,0]=3 5713 B12R0.111 CCCCCCC(CC)OCSC 34a_100011215785_100011218213 [0,2,0,0,0,0|1,0,0]=3 5714 B12R0.111 CCCCCCC(CCCC)NC 270004a_106832991635_200011215745 [0,2,0,0,0,0|2,0,0]=4 5715 B12R0.111 CCCCCCC(CCCC)OC 34a_200011216055_200000210301 [0,2,0,0,0,0|1,0,0]=3 5716 B12R0.111 CCCCCCC(CCCC)OC 7a_200011216055_200000210301 [0,2,0,0,0,0|1,0,0]=3 5717 B12R0.111 CCCCCCC(CCCC)O[13CH3] 34a_200011216055_200025704644 [0,2,0,0,0,0|1,0,0]=3 5718 B12R0.111 CCCCCCC(CCCC)O[13CH3] 7a_200011216055_200025704644 [0,2,0,0,0,0|1,0,0]=3 5719 B12R0.111 CCCCCCN(CC)CCOC 2230a_100000731262_100000210314 [0,2,0,0,0,0|2,0,0]=4 5720 B12R0.111 CCCCCCN(CC)CCOC 269982a_100000731262_100000210757 [0,2,0,0,0,0|2,0,0]=4 5721 B12R0.202 C=CC(CCCCCC)OC(C)C 34a_200011215977_100000210206 [0,2,0,0,0,0|1,0,1]=4 5722 B12R0.202 C=CC(CCCCCC)OC(C)C 7a_200011215977_100000210206 [0,2,0,0,0,0|1,0,1]=4 5723 B12R0.202 CCCCCCC(CC)OC(C)C 34a_100011215785_100000210206 [0,2,0,0,0,0|1,0,0]=3 5724 B12R0.202 CCCCCCC(CC)OC(C)C 7a_100011215785_100000210206 [0,2,0,0,0,0|1,0,0]=3 5725 B12R0.205 CCCCCCC(CCC)NCC 270004a_100015525214_200011215359 [0,2,0,0,0,0|2,0,0]=4 5726 B12R0.205 CCCCCCC(CCC)OCC 34a_200011215193_100000210202 [0,2,0,0,0,0|1,0,0]=3 5727 B12R0.205 CCCCCCC(CCC)OCC 7a_200011215193_100000210202 [0,2,0,0,0,0|1,0,0]=3 5728 B12R0.205 CCCCCCC(CCC)OCF 34a_200011215193_100015361967 [0,2,0,0,0,0|1,0,0]=3 5729 B12R0.205 CCCCCCC(CCC)OCF 7a_200011215193_100015361967 [0,2,0,0,0,0|1,0,0]=3 5730 B12R0.205 CCCCCNC(COC)COC 2230a_100011997029_100000210326 [0,2,0,0,0,0|1,0,0]=3 5731 B12R0.205 CCCCCNC(COC)COC 270004a_100000209983_100000761750 [0,2,0,0,0,0|1,0,0]=3 5732 B12R0.205 CCCCCOC(COC)COC 34a_100000766098_100000718602 [0,2,0,0,0,0|1,0,0]=3 5733 B12R0.205 CCCCNCC(OCC)OCC 2230a_100000102301_100000210512 [0,2,0,0,0,0|1,0,0]=3 5734 B12R0.205 CCCCNCC(OCC)OCC 34a_100000211098_100000210210 [0,2,0,0,0,0|1,0,0]=3 5735 B12R0.205 CCCCNCC(OCC)OCC 7a_106832991798_100000210512 [0,2,0,0,0,0|1,0,0]=3 5736 B12R0.205 CCCCOCC(OCC)OCC 34a_100000210227_100000210512 [0,2,0,0,0,0|1,0,0]=3 5737 B12R0.205 CCCCOCC(OCC)OCC 34a_100011216334_100000210210 [0,2,0,0,0,0|1,0,0]=3 5738 B12R0.205 CCCCOCC(OCC)OCC 7a_100000210227_100000210512 [0,2,0,0,0,0|1,0,0]=3 5739 B12R0.205 CCCCOCC(OCC)OCC 7a_100011216334_100000210211 [0,2,0,0,0,0|1,0,0]=3 5740 B12R0.205 CCCCSCC(OCC)OCC 62a_100000210211_100000210512 [0,2,0,0,0,0|1,0,0]=3 5741 B12R0.205 CCCCSCC(OCC)OCC 62a_100000210512_100000210210 [0,2,0,0,0,0|1,0,0]=3 5742 B12R0.205 CCCNCCC(OCC)OCC 34a_100000748396_100000210303 [0,2,0,0,0,0|1,0,0]=3 5743 B12R0.205 CCCOCCC(OCC)OCC 34a_100000210258_100000033671 [0,2,0,0,0,0|1,0,0]=3 5744 B12R0.205 CCCOCCC(OCC)OCC 34a_100011218310_100000210303 [0,2,0,0,0,0|1,0,0]=3 5745 B12R0.205 CCCOCCC(OCC)OCC 7a_100011218310_100000210303 [0,2,0,0,0,0|1,0,0]=3 5746 B12R0.205 CCCSCCC(OCC)OCC 62a_100000033671_100000210303 [0,2,0,0,0,0|1,0,0]=3 5747 B12R0.205 CCCSCCC(OCC)OCC 62a_100000210303_100000033671 [0,2,0,0,0,0|1,0,0]=3 5748 B12R0.205 CCNCCCC(OCC)OCC 2230a_100015525214_100000034166 [0,2,0,0,0,0|1,0,0]=3 5749 B12R0.205 CCNCCCC(OCC)OCC 34a_100000211155_100000210202 [0,2,0,0,0,0|1,0,0]=3 5750 B12R0.205 CCOC(CCCNCF)OCC 34a_100000211155_100015361967 [0,2,0,0,0,0|2,0,0]=4 5751 B12R0.205 CCOC(CCCSCC)OCC 62a_100000034166_100000210202 [0,2,0,0,0,0|1,0,0]=3 5752 B12R0.205 CCOC(CCCSCC)OCC 62a_100000210202_100000034166 [0,2,0,0,0,0|1,0,0]=3 5753 B12R0.205 CCOC(CCCSCF)OCC 62a_100000034166_100015361967 [0,2,0,0,0,0|2,0,0]=4 5754 B12R0.205 CCOC(CCCSCF)OCC 62a_100015361967_100000034166 [0,2,0,0,0,0|2,0,0]=4 5755 B12R0.205 CCOC(CCNCCF)OCC 34a_100000724931_100000033671 [0,2,0,0,0,0|2,0,0]=4 5756 B12R0.205 CCOC(CCNCCF)OCC 34a_100000748396_100011217306 [0,2,0,0,0,0|2,0,0]=4 5757 B12R0.205 CCOC(CCNCCO)OCC 2230a_100016997473_100000033671 [0,2,0,0,0,0|2,0,0]=4 5758 B12R0.205 CCOC(CCNCCO)OCC 34a_100000748396_100000211926 [0,2,0,0,0,0|2,0,0]=4 5759 B12R0.205 CCOC(CCNCCO)OCC 34a_100016990907_100000033671 [0,2,0,0,0,0|2,0,0]=4 5760 B12R0.205 CCOC(CCNCSC)OCC 34a_100000748396_100011218213 [0,2,0,0,0,0|2,0,0]=4 5761 B12R0.205 CCOC(CCOCCBr)OCC 34a_100000211926_100000033671 [0,2,0,0,0,0|2,0,0]=4 5762 B12R0.205 CCOC(CCOCCF)OCC 34a_100011218310_100011217306 [0,2,0,0,0,0|2,0,0]=4 5763 B12R0.205 CCOC(CCOCCF)OCC 7a_100011218310_100011217306 [0,2,0,0,0,0|2,0,0]=4 5764 B12R0.205 CCOC(CCOCCN)OCC 34a_100000210304_100000033671 [0,2,0,0,0,0|2,0,0]=4 5765 B12R0.205 CCOC(CCOCCO)OCC 34a_100011218310_100000211926 [0,2,0,0,0,0|2,0,0]=4 5766 B12R0.205 CCOC(CCOCCO)OCC 7a_100011218310_100000211926 [0,2,0,0,0,0|2,0,0]=4 5767 B12R0.205 CCOC(CCOCSC)OCC 34a_100011218310_100011218213 [0,2,0,0,0,0|2,0,0]=4 5768 B12R0.205 CCOC(CCSCCF)OCC 62a_100000033671_100011217306 [0,2,0,0,0,0|2,0,0]=4 5769 B12R0.205 CCOC(CCSCCF)OCC 62a_100011217306_100000033671 [0,2,0,0,0,0|2,0,0]=4 5770 B12R0.205 CCOC(CCSCCO)OCC 62a_100000033671_100000211926 [0,2,0,0,0,0|2,0,0]=4 5771 B12R0.205 CCOC(CCSCCO)OCC 62a_100000211926_100000033671 [0,2,0,0,0,0|2,0,0]=4 5772 B12R0.205 CCOC(CCSCOC)OCC 62a_100000033671_100000766300 [0,2,0,0,0,0|2,0,0]=4 5773 B12R0.205 CCOC(CCSCOC)OCC 62a_100000766300_100000033671 [0,2,0,0,0,0|2,0,0]=4 5774 B12R0.205 CCOC(CCSCSC)OCC 62a_100000033671_100011218213 [0,2,0,0,0,0|2,0,0]=4 5775 B12R0.205 CCOC(CCSCSC)OCC 62a_100011218213_100000033671 [0,2,0,0,0,0|2,0,0]=4 5776 B12R0.205 CCOC(CNCCCF)OCC 2230a_100015189416_100000210512 [0,2,0,0,0,0|2,0,0]=4 5777 B12R0.205 CCOC(CNCCCF)OCC 34a_100000211098_100011934791 [0,2,0,0,0,0|2,0,0]=4 5778 B12R0.205 CCOC(CNCCCF)OCC 34a_100015189416_100000210512 [0,2,0,0,0,0|2,0,0]=4 5779 B12R0.205 CCOC(CNCCCO)OCC 34a_100000211098_100000230001 [0,2,0,0,0,0|2,0,0]=4 5780 B12R0.205 CCOC(CNCCOC)OCC 2230a_100000209980_100000210512 [0,2,0,0,0,0|2,0,0]=4 5781 B12R0.205 CCOC(CNCCOC)OCC 34a_100000211098_100011201679 [0,2,0,0,0,0|2,0,0]=4 5782 B12R0.205 CCOC(CNCCSC)OCC 2230a_100020590264_100000210512 [0,2,0,0,0,0|2,0,0]=4 5783 B12R0.205 CCOC(CNCCSC)OCC 34a_100000211098_100000212216 [0,2,0,0,0,0|2,0,0]=4 5784 B12R0.205 CCOC(COCCCBr)OCC 34a_100011217188_100000210512 [0,2,0,0,0,0|2,0,0]=4 5785 B12R0.205 CCOC(COCCCCl)OCC 34a_100000230001_100000210512 [0,2,0,0,0,0|2,0,0]=4 5786 B12R0.205 CCOC(COCCCF)OCC 34a_100000759539_100000210512 [0,2,0,0,0,0|2,0,0]=4 5787 B12R0.205 CCOC(COCCCF)OCC 34a_100011216334_100011934791 [0,2,0,0,0,0|2,0,0]=4 5788 B12R0.205 CCOC(COCCCF)OCC 7a_100011216334_100011934791 [0,2,0,0,0,0|2,0,0]=4 5789 B12R0.205 CCOC(COCCCN)OCC 34a_100000182051_100000210512 [0,2,0,0,0,0|2,0,0]=4 5790 B12R0.205 CCOC(COCCCO)OCC 34a_100011216334_100000230001 [0,2,0,0,0,0|2,0,0]=4 5791 B12R0.205 CCOC(COCCCO)OCC 7a_100011216334_100011215043 [0,2,0,0,0,0|2,0,0]=4 5792 B12R0.205 CCOC(COCCOC)OCC 34a_100000210237_100000210512 [0,2,0,0,0,0|2,0,0]=4 5793 B12R0.205 CCOC(COCCOC)OCC 34a_100011216334_100011201679 [0,2,0,0,0,0|2,0,0]=4 5794 B12R0.205 CCOC(COCCOC)OCC 7a_100011216334_100000233755 [0,2,0,0,0,0|2,0,0]=4 5795 B12R0.205 CCOC(COCCSC)OCC 34a_100000230434_100000210512 [0,2,0,0,0,0|2,0,0]=4 5796 B12R0.205 CCOC(COCCSC)OCC 34a_100011216334_100000212216 [0,2,0,0,0,0|2,0,0]=4 5797 B12R0.205 CCOC(COCCSC)OCC 7a_100000230434_100000210512 [0,2,0,0,0,0|2,0,0]=4 5798 B12R0.205 CCOC(COCCSC)OCC 7a_100011216334_100000212216 [0,2,0,0,0,0|2,0,0]=4 5799 B12R0.205 CCOC(CSCCCF)OCC 62a_100000210512_100011934791 [0,2,0,0,0,0|2,0,0]=4 5800 B12R0.205 CCOC(CSCCCF)OCC 62a_100011934791_100000210512 [0,2,0,0,0,0|2,0,0]=4 5801 B12R0.205 CCOC(CSCCCO)OCC 62a_100000210512_100011215043 [0,2,0,0,0,0|2,0,0]=4 5802 B12R0.205 CCOC(CSCCCO)OCC 62a_100011215043_100000210512 [0,2,0,0,0,0|2,0,0]=4 5803 B12R0.205 CCOC(CSCCOC)OCC 62a_100000210512_100000233755 [0,2,0,0,0,0|2,0,0]=4 5804 B12R0.205 CCOC(CSCCOC)OCC 62a_100000233755_100000210512 [0,2,0,0,0,0|2,0,0]=4 5805 B12R0.205 CCOC(CSCCSC)OCC 62a_100000210512_100000751147 [0,2,0,0,0,0|2,0,0]=4 5806 B12R0.205 CCOC(CSCCSC)OCC 62a_100000212216_100000210512 [0,2,0,0,0,0|2,0,0]=4 5807 B12R0.205 CCOCCCC(OCC)OCC 34a_100121572206_100000034166 [0,2,0,0,0,0|1,0,0]=3 5808 B12R0.205 CCOCCNC(COC)COC 2230a_100011997029_100011215890 [0,2,0,0,0,0|2,0,0]=4 5809 B12R0.205 CCOCCNC(COC)COC 270004a_102516460346_100000761750 [0,2,0,0,0,0|2,0,0]=4 5810 B12R0.205 CCOCCOC(COC)COC 34a_100000766098_100000210147 [0,2,0,0,0,0|2,0,0]=4 5811 B12R0.205 CCOCSCC(OCC)OCC 62a_100000210512_100000739092 [0,2,0,0,0,0|2,0,0]=4 5812 B12R0.205 CCOCSCC(OCC)OCC 62a_100000739092_100000210512 [0,2,0,0,0,0|2,0,0]=4 5813 B12R0.205 CCSCCNC(COC)COC 2230a_100011997029_100000757381 [0,2,0,0,0,0|2,0,0]=4 5814 B12R0.205 CCSCCNC(COC)COC 270004a_100000106463_100000761750 [0,2,0,0,0,0|2,0,0]=4 5815 B12R0.205 CCSCCOC(COC)COC 34a_100000766098_100000757381 [0,2,0,0,0,0|2,0,0]=4 5816 B12R0.205 COCC(COC)NCCCCF 2230a_100011997029_100000729493 [0,2,0,0,0,0|2,0,0]=4 5817 B12R0.205 COCC(COC)NCCCCO 2230a_100011997029_100000210776 [0,2,0,0,0,0|2,0,0]=4 5818 B12R0.205 COCC(COC)NCCCCO 270004a_100000750430_100000761750 [0,2,0,0,0,0|2,0,0]=4 5819 B12R0.205 COCC(COC)NCCCSC 270004a_100000749238_100000761750 [0,2,0,0,0,0|2,0,0]=4 5820 B12R0.205 COCC(COC)OCCCCF 34a_100000766098_100000729493 [0,2,0,0,0,0|2,0,0]=4 5821 B12R0.205 COCC(COC)OCCCCO 34a_100000766098_100011216708 [0,2,0,0,0,0|2,0,0]=4 5822 B12R0.205 COCCCNC(COC)COC 2230a_100011997029_100000740836 [0,2,0,0,0,0|2,0,0]=4 5823 B12R0.205 COCCCNC(COC)COC 270004a_100150723488_100000761750 [0,2,0,0,0,0|2,0,0]=4 5824 B12R0.205 COCCCOC(COC)COC 34a_100000766098_100000740836 [0,2,0,0,0,0|2,0,0]=4 5825 B12R0.229 CCC(C)CCNC(CC)COC 270004a_100020591266_100000757811 [0,2,0,0,0,0|2,0,0]=4 5826 B12R0.229 CCOC(CC)CNCC(C)CC 2230a_100015183923_100000748023 [0,2,0,0,0,0|2,0,0]=4 5827 B12R0.229 CCOC(CC)CNCC(C)CC 270004a_100015183923_100000243153 [0,2,0,0,0,0|2,0,0]=4 5828 B12R0.229 CCOC(CC)CNCC(C)CC 34a_100015183923_100000748023 [0,2,0,0,0,0|2,0,0]=4 5829 B12R0.229 CCOC(CC)CNCC(O)CC 2230a_100015183923_100011218378 [0,2,0,0,0,0|2,0,0]=4 5830 B12R0.229 CCOC(CC)CNCC(O)CC 34a_100015183923_100011218378 [0,2,0,0,0,0|2,0,0]=4 5831 B12R0.229 CCOC(CC)CNC[C@@H](C)CC 2230a_100015183923_100009816398 [0,2,0,0,0,0|2,0,0]=4 5832 B12R0.229 CCOC(CC)CNC[C@@H](C)CC 34a_100015183923_100009816398 [0,2,0,0,0,0|2,0,0]=4 5833 B12R0.599 C#CC(C)(CCCCCC)OCC 34a_200000042405_100000210202 [0,2,0,0,0,0|1,0,1]=4 5834 B12R0.599 C#CC(C)(CCCCCC)OCC 7a_200000042405_100000210202 [0,2,0,0,0,0|1,0,1]=4 5835 B12R0.599 C#CC(C)(CCCCCC)OCF 34a_200000042405_100015361967 [0,2,0,0,0,0|1,0,1]=4 5836 B12R0.599 C#CC(C)(CCCCCC)OCF 7a_200000042405_100015361967 [0,2,0,0,0,0|1,0,1]=4 5837 B12R0.334 C#CC(CC)OCCC(OC)OC 34a_100000758843_100000139399 [0,2,0,0,0,0|1,0,0]=3 5838 B12R0.334 C#CC(CC)OCCC(OC)OC 7a_100000758843_100009813347 [0,2,0,0,0,0|1,0,0]=3 5839 B12R0.334 C=CC(CC)OCCC(OC)OC 34a_100000766422_100000139399 [0,2,0,0,0,0|1,0,0]=3 5840 B12R0.334 C=CC(CC)OCCC(OC)OC 7a_100000766422_100009813347 [0,2,0,0,0,0|1,0,0]=3 5841 B12R0.334 C=C[C@@H](CO)NCCC(OC)OC 2230a_100016989147_100009813347 [0,2,0,0,0,0|2,0,0]=4 5842 B12R0.334 C=C[C@@H](CO)NCCC(OC)OC 34a_100016989147_100000139399 [0,2,0,0,0,0|2,0,0]=4 5843 B12R0.334 CCC(CC)CNCC(CC)OC 269862a_100000731041_100000211137 [0,2,0,0,0,0|2,0,0]=4 5844 B12R0.334 CCC(CC)CNCC(CC)OC 270004a_100000731041_100000211137 [0,2,0,0,0,0|2,0,0]=4 5845 B12R0.334 CCC(CC)CNCC(OC)OC 2230a_100102946423_100000751394 [0,2,0,0,0,0|1,0,0]=3 5846 B12R0.334 CCC(CC)CNCC(OC)OC 270004a_100000210479_100000211137 [0,2,0,0,0,0|1,0,0]=3 5847 B12R0.334 CCC(CC)CNCC(OC)OC 270004a_100102946423_100000752162 [0,2,0,0,0,0|1,0,0]=3 5848 B12R0.334 CCC(CC)COCC(CC)OC 34a_100011934954_100011215472 [0,2,0,0,0,0|2,0,0]=4 5849 B12R0.334 CCC(CC)COCC(CC)OC 7a_100011934954_100011215472 [0,2,0,0,0,0|2,0,0]=4 5850 B12R0.334 CCC(CC)COCC(OC)OC 34a_100011216393_100011215472 [0,2,0,0,0,0|1,0,0]=3 5851 B12R0.334 CCC(CC)COCC(OC)OC 7a_100000703878_100000751394 [0,2,0,0,0,0|1,0,0]=3 5852 B12R0.334 CCC(CC)CSCC(OC)OC 62a_100000751394_100011215472 [0,2,0,0,0,0|1,0,0]=3 5853 B12R0.334 CCC(CC)CSCC(OC)OC 62a_100011215472_100000751394 [0,2,0,0,0,0|1,0,0]=3 5854 B12R0.334 CCC(CC)NCCC(OC)OC 2230a_100000199018_100009813347 [0,2,0,0,0,0|1,0,0]=3 5855 B12R0.334 CCC(CC)OCCC(OC)OC 7a_100000688536_100009813347 [0,2,0,0,0,0|1,0,0]=3 5856 B12R0.334 CCC(CC)SCCC(OC)OC 62a_100000139399_100000210505 [0,2,0,0,0,0|1,0,0]=3 5857 B12R0.334 CCC(CC)SCCC(OC)OC 62a_100000210505_100000139399 [0,2,0,0,0,0|1,0,0]=3 5858 B12R0.334 CCC(CNCC(OC)OC)OC 270004a_100000731041_100000752162 [0,2,0,0,0,0|1,0,0]=3 5859 B12R0.334 CCC(COCC(OC)OC)OC 34a_100011934954_100000211822 [0,2,0,0,0,0|1,0,0]=3 5860 B12R0.334 CCC(COCC(OC)OC)OC 7a_100011934954_100000751394 [0,2,0,0,0,0|1,0,0]=3 5861 B12R0.334 CCN(CC)CCCC(OC)OC 2230a_100000724800_100000069011 [0,2,0,0,0,0|1,0,0]=3 5862 B12R0.334 CCN(CC)CCCC(OC)OC 269956a_100000042499_100000069011 [0,2,0,0,0,0|1,0,0]=3 5863 B12R0.334 CCN(CC)CCCC(OC)OC 269982a_100000724800_100000069011 [0,2,0,0,0,0|1,0,0]=3 5864 B12R0.334 CCN(CC)COCC(OC)OC 7a_200015374951_100000751394 [0,2,0,0,0,0|2,0,0]=4 5865 B12R0.334 CC[C@@H](CO)NCCC(OC)OC 2230a_100000709445_100009813347 [0,2,0,0,0,0|1,0,0]=3 5866 B12R0.334 COC(CCNC(CO)CO)OC 2230a_100000759517_100009813347 [0,2,0,0,0,0|2,0,0]=4 5867 B12R0.334 COC(CCOC(CCl)CCl)OC 7a_100000737055_100009813347 [0,2,0,0,0,0|2,0,0]=4 5868 B12R0.334 COC(CCOC(CF)CF)OC 34a_100000032261_100000139399 [0,2,0,0,0,0|2,0,0]=4 5869 B12R0.334 COC(CCOC(CF)CF)OC 7a_100000032261_100009813347 [0,2,0,0,0,0|2,0,0]=4 5870 B12R0.334 COC(CCOC(CN)CN)OC 34a_100000031598_100000139399 [0,2,0,0,0,0|2,0,0]=4 5871 B12R0.334 COC(CCO[C@@H](CF)CCl)OC 34a_100015614560_100000139399 [0,2,0,0,0,0|2,0,0]=4 5872 B12R0.334 COC(CCO[C@@H](CF)CCl)OC 7a_100015614560_100009813347 [0,2,0,0,0,0|2,0,0]=4 5873 B12R0.334 COC(CNCC(OC)OC)OC 270004a_100000210479_100000752162 [0,2,0,0,0,0|2,0,0]=4 5874 B12R0.334 COC(COCC(OC)OC)OC 34a_100011216393_100000211822 [0,2,0,0,0,0|2,0,0]=4 5875 B12R0.334 COC(CSCC(OC)OC)OC 62a_100000751394_100000751394 [0,2,0,0,0,0|2,0,0]=4 5876 B12R0.468 CCC(=O)COCC(C)(OC)OC 34a_100000725409_100000766008 [0,2,0,0,0,0|1,0,1]=4 5877 B12R0.468 CCC(=O)CSCC(C)(OC)OC 62a_100000747405_100000766008 [0,2,0,0,0,0|1,0,1]=4 5878 B12R0.468 CCC(=O)CSCC(C)(OC)OC 62a_100000766008_100000747405 [0,2,0,0,0,0|1,0,1]=4 5879 B12R0.468 CCC(C)CNCC(C)(OC)OC 2230a_100000732740_100000748023 [0,2,0,0,0,0|1,0,0]=3 5880 B12R0.468 CCC(C)CNCC(C)(OC)OC 2230a_100020588543_100000064154 [0,2,0,0,0,0|1,0,0]=3 5881 B12R0.468 CCC(C)COCP(=O)(OC)OC 34a_100000101693_100000748023 [0,2,0,0,0,0|2,0,0]=4 5882 B12R0.468 CCC(C)CSCC(C)(OC)OC 62a_100000748023_100000766008 [0,2,0,0,0,0|1,0,0]=3 5883 B12R0.468 CCC(C)CSCC(C)(OC)OC 62a_100000766008_100000748023 [0,2,0,0,0,0|1,0,0]=3 5884 B12R0.468 CCC(C)CSC[Si](C)(OC)OC 62a_100000067953_100000748023 [0,2,0,0,0,0|1,1,0]=4 5885 B12R0.468 CCC(C)CSC[Si](C)(OC)OC 62a_100000748023_100000067953 [0,2,0,0,0,0|1,1,0]=4 5886 B12R0.468 CCC(C)OCCP(=O)(OC)OC 34a_200000043213_100011215416 [0,2,0,0,0,0|2,0,0]=4 5887 B12R0.468 CCC(O)CNCC(C)(OC)OC 2230a_100000732740_100011218378 [0,2,0,0,0,0|1,0,0]=3 5888 B12R0.468 CCC(O)CNCC(C)(OC)OC 2230a_100011218483_100000064154 [0,2,0,0,0,0|1,0,0]=3 5889 B12R0.468 CCC(O)COCP(=O)(OC)OC 34a_100000101693_100011218378 [0,2,0,0,0,0|2,0,0]=4 5890 B12R0.468 CCC(O)CSCC(C)(OC)OC 62a_100000766008_100011218378 [0,2,0,0,0,0|1,0,0]=3 5891 B12R0.468 CCC(O)CSCC(C)(OC)OC 62a_100011218378_100000766008 [0,2,0,0,0,0|1,0,0]=3 5892 B12R0.468 CCC(O)CSC[Si](C)(OC)OC 62a_100000067953_100011218378 [0,2,0,0,0,0|1,1,0]=4 5893 B12R0.468 CCC(O)CSC[Si](C)(OC)OC 62a_100011218378_100000067953 [0,2,0,0,0,0|1,1,0]=4 5894 B12R0.468 CCN(C)CCC[Si](C)(OC)OC 269982a_100000225621_100000031653 [0,2,0,0,0,0|1,1,0]=4 5895 B12R0.468 CC[C@H](C)CNCC(C)(OC)OC 2230a_100000732740_100009816398 [0,2,0,0,0,0|1,0,0]=3 5896 B12R0.468 CC[C@H](C)COCP(=O)(OC)OC 34a_100000101693_100009816398 [0,2,0,0,0,0|2,0,0]=4 5897 B12R0.468 CC[C@H](C)CSCC(C)(OC)OC 62a_100000766008_100009816398 [0,2,0,0,0,0|1,0,0]=3 5898 B12R0.468 CC[C@H](C)CSCC(C)(OC)OC 62a_100009816398_100000766008 [0,2,0,0,0,0|1,0,0]=3 5899 B12R0.468 CC[C@H](C)CSC[Si](C)(OC)OC 62a_100000067953_100009816398 [0,2,0,0,0,0|1,1,0]=4 5900 B12R0.468 CC[C@H](C)CSC[Si](C)(OC)OC 62a_100009816398_100000067953 [0,2,0,0,0,0|1,1,0]=4 5901 B12R0.468 COC(C)(CNCC(C)CO)OC 34a_100000744482_100000766008 [0,2,0,0,0,0|2,0,0]=4 5902 B12R0.468 COC(C)(CNCC(O)CO)OC 2230a_100000732740_100011219619 [0,2,0,0,0,0|2,0,0]=4 5903 B12R0.468 COC(C)(CNC[C@@H](C)CO)OC 2230a_100000732740_100000059175 [0,2,0,0,0,0|2,0,0]=4 5904 B12R0.468 COC(C)(CNC[C@@H](F)CO)OC 34a_100015665980_100000766008 [0,2,0,0,0,0|2,0,0]=4 5905 B12R0.468 COC(C)(CNC[C@@H](O)CF)OC 2230a_100000732740_100015614560 [0,2,0,0,0,0|2,0,0]=4 5906 B12R0.468 COC(C)(CNC[C@@H](O)CO)OC 2230a_100000732740_100009815848 [0,2,0,0,0,0|2,0,0]=4 5907 B12R0.468 COC(C)(CNC[C@H](O)CO)OC 2230a_100020644852_100000064154 [0,2,0,0,0,0|2,0,0]=4 5908 B12R0.468 COC(C)(COCC(C)CN)OC 34a_100000744482_100000766008 [0,2,0,0,0,0|2,0,0]=4 5909 B12R0.468 COC(C)(COCC(Cl)CCl)OC 34a_100000033668_100000766008 [0,2,0,0,0,0|2,0,0]=4 5910 B12R0.468 COC(C)(COC[C@H](F)CN)OC 34a_100015665980_100000766008 [0,2,0,0,0,0|2,0,0]=4 5911 B12R0.468 COC(C)(CSCC(O)CO)OC 62a_100000766008_100011219619 [0,2,0,0,0,0|2,0,0]=4 5912 B12R0.468 COC(C)(CSCC(O)CO)OC 62a_100011219619_100000766008 [0,2,0,0,0,0|2,0,0]=4 5913 B12R0.468 COC(C)(CSC[C@@H](C)CO)OC 62a_100000059175_100000766008 [0,2,0,0,0,0|2,0,0]=4 5914 B12R0.468 COC(C)(CSC[C@@H](C)CO)OC 62a_100000766008_100000059175 [0,2,0,0,0,0|2,0,0]=4 5915 B12R0.468 COC(C)(CSC[C@@H](O)CF)OC 62a_100000766008_100015614560 [0,2,0,0,0,0|2,0,0]=4 5916 B12R0.468 COC(C)(CSC[C@@H](O)CF)OC 62a_100015614560_100000766008 [0,2,0,0,0,0|2,0,0]=4 5917 B12R0.468 COC(C)(CSC[C@@H](O)CO)OC 62a_100000766008_100009815848 [0,2,0,0,0,0|2,0,0]=4 5918 B12R0.468 COC(C)(CSC[C@@H](O)CO)OC 62a_100009815848_100000766008 [0,2,0,0,0,0|2,0,0]=4 5919 B12R0.468 COC(C)COCC(C)(OC)OC 34a_100000690652_100000766008 [0,2,0,0,0,0|2,0,0]=4 5920 B12R0.468 CO[C@H](C)CNCC(C)(OC)OC 2230a_100020591295_100000064154 [0,2,0,0,0,0|2,0,0]=4 5921 B12R0.617 CCC(C)(C)COCC(OC)OC 7a_100000765029_100000751394 [0,2,0,0,0,0|1,0,0]=3 5922 B12R0.617 CCC(C)(C)NCCC(OC)OC 2230a_100000211385_100009813347 [0,2,0,0,0,0|1,0,0]=3 5923 B12R0.617 CCC(C)(C)OCCC(OC)OC 7a_100000210230_100009813347 [0,2,0,0,0,0|1,0,0]=3 5924 B12R0.617 CCC(C)(C)SCCC(OC)OC 62a_100000032637_100000139399 [0,2,0,0,0,0|1,0,0]=3 5925 B12R0.617 CCC(C)(C)SCCC(OC)OC 62a_100000139399_100000032637 [0,2,0,0,0,0|1,0,0]=3 5926 B12R0.617 COC(CCNC(C)(C)CO)OC 2230a_100000210608_100009813347 [0,2,0,0,0,0|2,0,0]=4 5927 B12R0.617 COC(CCOC(C)(C)CCl)OC 7a_100000764493_100009813347 [0,2,0,0,0,0|2,0,0]=4 5928 B12R0.617 COC(CCSC(F)(F)CO)OC 62a_100000139399_100011217949 [0,2,0,0,0,0|2,0,0]=4 5929 B12R0.617 COC(CCSC(F)(F)CO)OC 62a_100011217949_100000139399 [0,2,0,0,0,0|2,0,0]=4 5930 B12R0.617 COC(CNCC(C)(C)CO)OC 2230a_100020635058_100000751394 [0,2,0,0,0,0|2,0,0]=4 5931 B12R0.617 COC(CNCC(C)(C)CO)OC 270004a_100020635058_100000752162 [0,2,0,0,0,0|2,0,0]=4 5932 B12R0.617 COC(CNCC(C)(C)OC)OC 2230a_100000763424_100000751394 [0,2,0,0,0,0|2,0,0]=4 5933 B12R0.617 COC(CNCC(C)(C)OC)OC 270004a_100000763424_100000752162 [0,2,0,0,0,0|2,0,0]=4 5934 B12R0.617 COC(CNCC(C)(C)SC)OC 270004a_100000210479_100009845794 [0,2,0,0,0,0|2,0,0]=4 5935 B12R0.617 COC(COCC(C)(C)CCl)OC 7a_100011217199_100000751394 [0,2,0,0,0,0|2,0,0]=4 5936 B12R0.617 COC(COCC(C)(C)CO)OC 34a_100011216393_100009813988 [0,2,0,0,0,0|2,0,0]=4 5937 B12R0.617 COC(COCC(C)(C)OC)OC 34a_100011216393_100000701081 [0,2,0,0,0,0|2,0,0]=4 5938 B12R0.617 COC(COCC(F)(F)CN)OC 34a_100000703232_100000211822 [0,2,0,0,0,0|2,0,0]=4 5939 B12R0.617 COC(CSCC(C)(C)CO)OC 62a_100000751394_100009813988 [0,2,0,0,0,0|2,0,0]=4 5940 B12R0.617 COC(CSCC(C)(C)CO)OC 62a_100009813988_100000751394 [0,2,0,0,0,0|2,0,0]=4 5941 B12R0.617 COC(CSCC(C)(C)OC)OC 62a_100000701081_100000751394 [0,2,0,0,0,0|2,0,0]=4 5942 B12R0.617 COC(CSCC(C)(C)OC)OC 62a_100000751394_100000701081 [0,2,0,0,0,0|2,0,0]=4 5943 B12R0.404 CCCCOCC(OC)(OC)OC 34a_100000210227_100000037187 [0,2,0,0,0,0|1,0,0]=3 5944 B12R0.404 CCCCSCC(OC)(OC)OC 62a_100000037187_100000210210 [0,2,0,0,0,0|1,0,0]=3 5945 B12R0.404 CCCCSCC(OC)(OC)OC 62a_100000210211_100000037187 [0,2,0,0,0,0|1,0,0]=3 5946 B12R0.404 CCCCSC[Si](OC)(OC)OC 62a_100000066200_100000210210 [0,2,0,0,0,0|1,1,0]=4 5947 B12R0.404 CCCCSC[Si](OC)(OC)OC 62a_100000210211_100000066200 [0,2,0,0,0,0|1,1,0]=4 5948 B12R0.404 CCOCCCC(OC)(OC)OC 34a_100121572206_200009813395 [0,2,0,0,0,0|1,0,0]=3 5949 B12R0.404 CCOCCC[Si](OC)(OC)OC 34a_100121572206_100000033577 [0,2,0,0,0,0|1,1,0]=4 5950 B12R0.404 CCOCSCC(OC)(OC)OC 62a_100000037187_100000739092 [0,2,0,0,0,0|2,0,0]=4 5951 B12R0.404 CCOCSCC(OC)(OC)OC 62a_100000739092_100000037187 [0,2,0,0,0,0|2,0,0]=4 5952 B12R0.404 CCSCCCC(OC)(OC)OC 62a_100000210202_200009813395 [0,2,0,0,0,0|1,0,0]=3 5953 B12R0.404 CCSCCCC(OC)(OC)OC 62a_200009813395_100000210202 [0,2,0,0,0,0|1,0,0]=3 5954 B12R0.404 CCSCCC[Si](OC)(OC)OC 62a_100000033577_100000210202 [0,2,0,0,0,0|1,1,0]=4 5955 B12R0.404 CCSCCC[Si](OC)(OC)OC 62a_100000210202_100000033577 [0,2,0,0,0,0|1,1,0]=4 5956 B12R0.404 CNCCCC[Si](OC)(OC)OC 34a_100102657272_100010219032 [0,2,0,0,0,0|1,1,0]=4 5957 B12R0.404 COC(CCCSCF)(OC)OC 62a_100015361967_200009813395 [0,2,0,0,0,0|2,0,0]=4 5958 B12R0.404 COC(CCCSCF)(OC)OC 62a_200009813395_100015361967 [0,2,0,0,0,0|2,0,0]=4 5959 B12R0.404 COC(CNCCCF)(OC)OC 34a_100015189416_100000037187 [0,2,0,0,0,0|2,0,0]=4 5960 B12R0.404 COC(COCCCBr)(OC)OC 34a_100011217188_100000037187 [0,2,0,0,0,0|2,0,0]=4 5961 B12R0.404 COC(COCCCCl)(OC)OC 34a_100000230001_100000037187 [0,2,0,0,0,0|2,0,0]=4 5962 B12R0.404 COC(COCCCF)(OC)OC 34a_100000759539_100000037187 [0,2,0,0,0,0|2,0,0]=4 5963 B12R0.404 COC(COCCCN)(OC)OC 34a_100000182051_100000037187 [0,2,0,0,0,0|2,0,0]=4 5964 B12R0.404 COC(COCCSC)(OC)OC 34a_100000230434_100000037187 [0,2,0,0,0,0|2,0,0]=4 5965 B12R0.404 COC(CSCCCF)(OC)OC 62a_100000037187_100011934791 [0,2,0,0,0,0|2,0,0]=4 5966 B12R0.404 COC(CSCCCF)(OC)OC 62a_100011934791_100000037187 [0,2,0,0,0,0|2,0,0]=4 5967 B12R0.404 COC(CSCCCO)(OC)OC 62a_100000037187_100011215043 [0,2,0,0,0,0|2,0,0]=4 5968 B12R0.404 COC(CSCCCO)(OC)OC 62a_100011215043_100000037187 [0,2,0,0,0,0|2,0,0]=4 5969 B12R0.404 COC(CSCCSC)(OC)OC 62a_100000037187_100000751147 [0,2,0,0,0,0|2,0,0]=4 5970 B12R0.404 COC(CSCCSC)(OC)OC 62a_100000212216_100000037187 [0,2,0,0,0,0|2,0,0]=4 5971 B12R0.404 COCCCC[Si](OC)(OC)OC 34a_100138415774_100010219032 [0,2,0,0,0,0|1,1,0]=4 5972 B12R0.404 COCCOCC(OC)(OC)OC 34a_100000210237_100000037187 [0,2,0,0,0,0|2,0,0]=4 5973 B12R0.404 COCCSCC(OC)(OC)OC 62a_100000037187_100000233755 [0,2,0,0,0,0|2,0,0]=4 5974 B12R0.404 COCCSCC(OC)(OC)OC 62a_100000233755_100000037187 [0,2,0,0,0,0|2,0,0]=4 5975 B12R0.404 CO[Si](CCCCSC)(OC)OC 62a_100010219032_200000210301 [0,2,0,0,0,0|1,1,0]=4 5976 B12R0.404 CO[Si](CCCCSC)(OC)OC 62a_200000210301_100010219032 [0,2,0,0,0,0|1,1,0]=4 5977 B12R0.404 CO[Si](CCCCS[13CH3])(OC)OC 62a_100010219032_200025704644 [0,2,0,0,0,0|1,1,0]=4 5978 B12R0.404 CO[Si](CCCCS[13CH3])(OC)OC 62a_200025704644_100010219032 [0,2,0,0,0,0|1,1,0]=4 5979 B10R1.1 CC1CCC(CC1)CN[13CH3] 2230a_103436935547_200025704644 [1,0,0,1,0,0|2,0,0]=4 5980 B10R1.1 CC1CCC(CC1)CN[13CH3] 34a_103436935547_200025704644 [1,0,0,1,0,0|2,0,0]=4 5981 B10R1.1 CC1CCC(CC1)CO[13CH3] 34a_100000701341_200025704644 [1,0,0,1,0,0|2,0,0]=4 5982 B10R1.1 CCCC1CCN(CC1)C 2230a_100015355601_200000210301 [1,0,0,1,0,0|2,0,0]=4 5983 B10R1.1 CCCC1CCN(CC1)C 269982a_100015355601_200000210301 [1,0,0,1,0,0|2,0,0]=4 5984 B10R1.1 CCCC1CCN(CC1)C 34a_100015355601_200000210301 [1,0,0,1,0,0|2,0,0]=4 5985 B10R1.1 CCCC1CCN(CC1)[13CH3] 2230a_100015355601_200025704644 [1,0,0,1,0,0|2,0,0]=4 5986 B10R1.1 CCCC1CCN(CC1)[13CH3] 269982a_100015355601_200025704644 [1,0,0,1,0,0|2,0,0]=4 5987 B10R1.1 CCCC1CCN(CC1)[13CH3] 34a_100015355601_200025704644 [1,0,0,1,0,0|2,0,0]=4 5988 B10R1.1 CCCN1CCC(CC1)C 2230a_100000188429_100000210303 [1,0,0,1,0,0|2,0,0]=4 5989 B10R1.1 CCCN1CCC(CC1)C 269982a_100000188429_100000210303 [1,0,0,1,0,0|2,0,0]=4 5990 B10R1.1 CCCN1CCC(CC1)C 34a_100000188429_100000210303 [1,0,0,1,0,0|2,0,0]=4 5991 B10R1.1 CCCN1CCC(CC1)O 2230a_100025773856_100000210303 [1,0,0,1,0,0|2,0,0]=4 5992 B10R1.1 CCCN1CCC(CC1)O 269982a_100025773856_100000210303 [1,0,0,1,0,0|2,0,0]=4 5993 B10R1.1 CCNC1CCC(CC1)C 270004a_100015525214_100000185489 [1,0,0,1,0,0|2,0,0]=4 5994 B10R1.1 CCNC1CCC(CC1)O 270004a_100015525214_100000764474 [1,0,0,1,0,0|2,0,0]=4 5995 B10R1.1 CCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000210202 [1,0,0,1,0,0|2,0,0]=4 5996 B10R1.1 CCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000210202 [1,0,0,1,0,0|2,0,0]=4 5997 B10R1.1 CCOC1CCC(CC1)C 34a_100000210714_100000210202 [1,0,0,1,0,0|2,0,0]=4 5998 B10R1.1 CCOC1CCC(CC1)C 34a_100121572206_200011216234 [1,0,0,1,0,0|2,0,0]=4 5999 B10R1.1 CCOC1CCC(CC1)C 7a_100000210714_100000210202 [1,0,0,1,0,0|2,0,0]=4 6000 B10R1.1 CCSC1CCC(CC1)C 62a_100000210202_200011216234 [1,0,0,1,0,0|2,0,0]=4 6001 B10R1.1 CNCC1CCC(CC1)C 2230a_103436935547_200000210301 [1,0,0,1,0,0|2,0,0]=4 6002 B10R1.1 CNCC1CCC(CC1)C 34a_103436935547_200000210301 [1,0,0,1,0,0|2,0,0]=4 6003 B10R1.1 COCC1CCC(CC1)C 34a_100000701341_200000210301 [1,0,0,1,0,0|2,0,0]=4 6004 B10R1.2 CC1CCCC(C1C)N[13CH3] 2230a_100000211273_200025704644 [1,0,0,1,0,0|2,0,0]=4 6005 B10R1.2 CC1CCCC(C1C)N[13CH3] 34a_100000211273_200025704644 [1,0,0,1,0,0|2,0,0]=4 6006 B10R1.2 CC1CCCC(C1C)O[13CH3] 34a_100011217532_200025704644 [1,0,0,1,0,0|2,0,0]=4 6007 B10R1.2 CC1CCCC(C1C)O[13CH3] 7a_100011217532_200025704644 [1,0,0,1,0,0|2,0,0]=4 6008 B10R1.2 CNC1CCCC(C1C)C 2230a_100000211273_200000210301 [1,0,0,1,0,0|2,0,0]=4 6009 B10R1.2 CNC1CCCC(C1C)C 34a_100000211273_200000210301 [1,0,0,1,0,0|2,0,0]=4 6010 B10R1.2 COC1CCCC(C1C)C 34a_100011217532_200000210301 [1,0,0,1,0,0|2,0,0]=4 6011 B10R1.2 COC1CCCC(C1C)C 7a_100011217532_200000210301 [1,0,0,1,0,0|2,0,0]=4 6012 B10R1.15 CC(O[13CH3])C1CCCCC1 34a_100011216961_200025704644 [1,0,0,1,0,0|0,0,0]=2 6013 B10R1.15 CC(O[13CH3])C1CCCCC1 7a_100011216961_200025704644 [1,0,0,1,0,0|0,0,0]=2 6014 B10R1.15 CC(O[13CH3])C1CCCNC1 34a_100000740858_200025704644 [1,0,0,1,0,0|1,0,0]=3 6015 B10R1.15 CC(O[13CH3])C1CCNCC1 34a_100011728446_200025704644 [1,0,0,1,0,0|1,0,0]=3 6016 B10R1.15 CCN(C)C1CCCCC1 2230a_100000201195_200000210301 [1,0,0,1,0,0|2,0,0]=4 6017 B10R1.15 CCN(C)C1CCCCC1 2230a_100000207522_100000210202 [1,0,0,1,0,0|2,0,0]=4 6018 B10R1.15 CCN(C)C1CCCCC1 269982a_100000201195_200000210301 [1,0,0,1,0,0|2,0,0]=4 6019 B10R1.15 CCN(C)C1CCCCC1 269982a_100000207522_100000204670 [1,0,0,1,0,0|2,0,0]=4 6020 B10R1.15 CCN(C)C1CCCCC1 269982a_100000225621_100000210327 [1,0,0,1,0,0|2,0,0]=4 6021 B10R1.15 CCN(C)C1CCCCC1 34a_100000201195_200000210301 [1,0,0,1,0,0|2,0,0]=4 6022 B10R1.15 CCN(C)C1CCCCC1 34a_100000207522_100000210202 [1,0,0,1,0,0|2,0,0]=4 6023 B10R1.15 CCN([13CH3])C1CCCCC1 2230a_100000201195_200025704644 [1,0,0,1,0,0|2,0,0]=4 6024 B10R1.15 CCN([13CH3])C1CCCCC1 269982a_100000201195_200025704644 [1,0,0,1,0,0|2,0,0]=4 6025 B10R1.15 CCN([13CH3])C1CCCCC1 34a_100000201195_200025704644 [1,0,0,1,0,0|2,0,0]=4 6026 B10R1.15 CNC(C)C1CCCCC1 269862a_106832991636_100000210989 [1,0,0,1,0,0|1,0,0]=3 6027 B10R1.15 CNC(C)C1CCCCN1 269862a_106832991636_200011997754 [1,0,0,1,0,0|2,0,0]=4 6028 B10R1.15 CNC(C)C1CCCNC1 269862a_106832991636_100011320585 [1,0,0,1,0,0|2,0,0]=4 6029 B10R1.15 CNC(C)C1CCNCC1 269862a_106832991636_100015204191 [1,0,0,1,0,0|2,0,0]=4 6030 B10R1.15 CNC(C)C1CCOCC1 269862a_106832991636_100000759496 [1,0,0,1,0,0|2,0,0]=4 6031 B10R1.15 CN[C@H](C)C1CCCCC1 2230a_100025707633_200000210301 [1,0,0,1,0,0|1,0,0]=3 6032 B10R1.15 CN[C@H](C)C1CCCCC1 34a_100025707633_200000210301 [1,0,0,1,0,0|1,0,0]=3 6033 B10R1.15 COC(C)C1CCCCC1 34a_100011216961_200000210301 [1,0,0,1,0,0|0,0,0]=2 6034 B10R1.15 COC(C)C1CCCCC1 7a_100011216961_200000210301 [1,0,0,1,0,0|0,0,0]=2 6035 B10R1.15 COC(C)C1CCCNC1 34a_100000740858_200000210301 [1,0,0,1,0,0|1,0,0]=3 6036 B10R1.15 COC(C)C1CCNCC1 34a_100011728446_200000210301 [1,0,0,1,0,0|1,0,0]=3 6037 B10R1.15 COC(C)N1CCCOC1 269982a_100000131196_100009879195 [1,0,0,1,0,0|2,0,0]=4 6038 B10R1.15 COC(C)N1CCOCC1 269982a_100015191051_100009879195 [1,0,0,1,0,0|2,0,0]=4 6039 B10R1.15 COC(C)N1CCSCC1 269982a_100000737611_100009879195 [1,0,0,1,0,0|2,0,0]=4 6040 B10R1.15 CO[C@H](C)C1CCOCC1 34a_100000703848_200000210301 [1,0,0,1,0,0|1,0,0]=3 6041 B10R1.15 CO[C@H](C)C1CCOCC1 7a_100000703848_200000210301 [1,0,0,1,0,0|1,0,0]=3 6042 B10R1.15 C[C@@H](N[13CH3])C1CCCCC1 2230a_100025707633_200025704644 [1,0,0,1,0,0|1,0,0]=3 6043 B10R1.15 C[C@@H](N[13CH3])C1CCCCC1 34a_100025707633_200025704644 [1,0,0,1,0,0|1,0,0]=3 6044 B10R1.15 C[C@@H](O[13CH3])C1CCOCC1 34a_100000703848_200025704644 [1,0,0,1,0,0|1,0,0]=3 6045 B10R1.15 C[C@@H](O[13CH3])C1CCOCC1 7a_100000703848_200025704644 [1,0,0,1,0,0|1,0,0]=3 6046 B10R1.16 CCCCN1CCC(C1)O 2230a_100011215560_100000210211 [1,0,0,1,0,0|2,0,0]=4 6047 B10R1.16 CCCCN1CCC(C1)O 269982a_100011215560_100000210211 [1,0,0,1,0,0|2,0,0]=4 6048 B10R1.16 CCCCN1CC[C@H](C1)C 2230a_100016987628_100000210211 [1,0,0,1,0,0|2,0,0]=4 6049 B10R1.16 CCCCN1CC[C@H](C1)C 269982a_100016987628_100000210211 [1,0,0,1,0,0|2,0,0]=4 6050 B10R1.16 CCCCN1CC[C@H](C1)C 34a_100016987628_100000210210 [1,0,0,1,0,0|2,0,0]=4 6051 B10R1.16 CCCNC1CCC(C1)C 270004a_100020643023_100011215218 [1,0,0,1,0,0|2,0,0]=4 6052 B10R1.16 CCCNC1CCC(C1)O 270004a_100020643023_100012614533 [1,0,0,1,0,0|2,0,0]=4 6053 B10R1.16 CCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000210303 [1,0,0,1,0,0|2,0,0]=4 6054 B10R1.16 CCCOC1CCC(C1)C 34a_100000698185_100000210303 [1,0,0,1,0,0|2,0,0]=4 6055 B10R1.27 CCC(C)CN1CCCC1 2230a_100000188435_100000748023 [1,0,0,1,0,0|2,0,0]=4 6056 B10R1.27 CCC(C)CN1CCCC1 269982a_100000188435_100000748023 [1,0,0,1,0,0|2,0,0]=4 6057 B10R1.27 CCC(C)CN1CCCC1 270004a_100000188435_100000243153 [1,0,0,1,0,0|2,0,0]=4 6058 B10R1.27 CCC(C)NC1CCCC1 2230a_100000209981_100000179811 [1,0,0,1,0,0|2,0,0]=4 6059 B10R1.27 CCC(C)NC1CCCC1 2230a_100000211070_100000758301 [1,0,0,1,0,0|2,0,0]=4 6060 B10R1.27 CCC(C)NC1CCCC1 270004a_100000209981_100000210133 [1,0,0,1,0,0|2,0,0]=4 6061 B10R1.27 CCC(C)NC1CCCC1 34a_100000211070_100011215416 [1,0,0,1,0,0|2,0,0]=4 6062 B10R1.27 CCC(C)OC1CCCC1 34a_100000210269_100011215416 [1,0,0,1,0,0|2,0,0]=4 6063 B10R1.27 CCC(C)OC1CCCC1 7a_100000210228_100000179811 [1,0,0,1,0,0|2,0,0]=4 6064 B10R1.27 CCC(C)OC1CCCC1 7a_100000210269_100000758301 [1,0,0,1,0,0|2,0,0]=4 6065 B10R1.27 CCC(C)SC1CCCC1 62a_100000758301_100000179811 [1,0,0,1,0,0|2,0,0]=4 6066 B10R1.27 CCC(C)SC1CCCC1 62a_100011217020_100000758301 [1,0,0,1,0,0|2,0,0]=4 6067 B10R1.27 CCC(O)CN1CCCC1 2230a_100000188435_100011218378 [1,0,0,1,0,0|2,0,0]=4 6068 B10R1.27 CCC(O)CN1CCCC1 269982a_100000188435_100011218378 [1,0,0,1,0,0|2,0,0]=4 6069 B10R1.27 CCN(C)CC1CCCC1 2230a_100000225621_100000740388 [1,0,0,1,0,0|2,0,0]=4 6070 B10R1.27 CCN(C)CC1CCCC1 269982a_100000225621_100000740388 [1,0,0,1,0,0|2,0,0]=4 6071 B10R1.27 CC[C@H](C)CN1CCCC1 2230a_100000188435_100009816398 [1,0,0,1,0,0|2,0,0]=4 6072 B10R1.27 CC[C@H](C)CN1CCCC1 269982a_100000188435_100009816398 [1,0,0,1,0,0|2,0,0]=4 6073 B10R1.27 CNC(C)CC1CCCC1 270004a_106832991635_100000692464 [1,0,0,1,0,0|1,0,0]=3 6074 B10R1.27 COC(C)SC1CCCC1 62a_100009879195_100000179811 [1,0,0,1,0,0|1,0,0]=3 6075 B10R1.27 COC(C)SC1CCCC1 62a_100011217020_100009879195 [1,0,0,1,0,0|1,0,0]=3 6076 B10R1.27 COC(C)SC1CCOC1 62a_100009879195_100000690089 [1,0,0,1,0,0|2,0,0]=4 6077 B10R1.37 CCCCCN1CCC1C 269982a_100000755817_100000210215 [1,0,0,1,0,0|2,0,0]=4 6078 B10R1.37 CCCCCN1CCC1C 34a_100000755817_100000718602 [1,0,0,1,0,0|2,0,0]=4 6079 B10R1.56 CCCCOCC1CC1C 34a_100000744939_100000210210 [1,0,0,1,0,0|2,0,0]=4 6080 B10R1.56 CCCCOCC1CC1C 7a_100000744939_100000210211 [1,0,0,1,0,0|2,0,0]=4 6081 B10R1.57 BrCCCOCC1CCO1 34a_100011217188_100000103362 [1,0,0,1,0,0|2,0,0]=4 6082 B10R1.57 CCCCCCN1CCC1 269982a_100000754969_100000210757 [1,0,0,1,0,0|2,0,0]=4 6083 B10R1.57 CCCCCNC1CCC1 2230a_100000749019_100000210326 [1,0,0,1,0,0|2,0,0]=4 6084 B10R1.57 CCCCCNC1CCC1 270004a_100000209983_100000241760 [1,0,0,1,0,0|2,0,0]=4 6085 B10R1.57 CCCCCNC1CCC1 34a_100000749019_100000718602 [1,0,0,1,0,0|2,0,0]=4 6086 B10R1.57 CCCCCOC1CCC1 34a_100000210253_100000749161 [1,0,0,1,0,0|2,0,0]=4 6087 B10R1.57 CCCCCOC1CCC1 34a_100000748187_100000718602 [1,0,0,1,0,0|2,0,0]=4 6088 B10R1.57 CCCCCSC1CCC1 62a_100000210326_100000749161 [1,0,0,1,0,0|2,0,0]=4 6089 B10R1.57 CCCCNCC1CCC1 2230a_100000102301_100000763275 [1,0,0,1,0,0|2,0,0]=4 6090 B10R1.57 CCCCNCC1CCC1 2230a_100000738700_100000210211 [1,0,0,1,0,0|2,0,0]=4 6091 B10R1.57 CCCCNCC1CCC1 269862a_100000102301_100000753134 [1,0,0,1,0,0|2,0,0]=4 6092 B10R1.57 CCCCNCC1CCC1 34a_100000738700_100000210210 [1,0,0,1,0,0|2,0,0]=4 6093 B10R1.57 CCCCNCC1CCC1 7a_106832991798_100000763275 [1,0,0,1,0,0|2,0,0]=4 6094 B10R1.57 CCCCNCC1CCO1 2230a_100000102301_100000103362 [1,0,0,1,0,0|1,0,0]=3 6095 B10R1.57 CCCCNCC1CCO1 7a_106832991798_100000103362 [1,0,0,1,0,0|1,0,0]=3 6096 B10R1.57 CCCCNC[C@@H]1CCO1 2230a_100020831831_100000210211 [1,0,0,1,0,0|1,0,0]=3 6097 B10R1.57 CCCCNC[C@@H]1CCO1 34a_100020831831_100000210210 [1,0,0,1,0,0|1,0,0]=3 6098 B10R1.57 CCCCOCC1CCC1 34a_100000210227_100000763275 [1,0,0,1,0,0|2,0,0]=4 6099 B10R1.57 CCCCOCC1CCC1 34a_100000760304_100000210210 [1,0,0,1,0,0|2,0,0]=4 6100 B10R1.57 CCCCOCC1CCC1 7a_100000210227_100000763275 [1,0,0,1,0,0|2,0,0]=4 6101 B10R1.57 CCCCOCC1CCO1 34a_100000039022_100000210210 [1,0,0,1,0,0|1,0,0]=3 6102 B10R1.57 CCCCOCC1CCO1 34a_100000210227_100000103362 [1,0,0,1,0,0|1,0,0]=3 6103 B10R1.57 CCCCOCC1CCO1 7a_100000210227_100000103362 [1,0,0,1,0,0|1,0,0]=3 6104 B10R1.57 CCCCSCC1CCC1 62a_100000210211_100000763275 [1,0,0,1,0,0|2,0,0]=4 6105 B10R1.57 CCCCSCC1CCC1 62a_100000763275_100000210210 [1,0,0,1,0,0|2,0,0]=4 6106 B10R1.57 CCCCSCC1CCO1 62a_100000103362_100000210210 [1,0,0,1,0,0|1,0,0]=3 6107 B10R1.57 CCCCSCC1CCO1 62a_100000210211_100000103362 [1,0,0,1,0,0|1,0,0]=3 6108 B10R1.57 CCOCSCC1CCO1 62a_100000103362_100000739092 [1,0,0,1,0,0|2,0,0]=4 6109 B10R1.57 CCOCSCC1CCO1 62a_100000739092_100000103362 [1,0,0,1,0,0|2,0,0]=4 6110 B10R1.57 COCCNCC1CCO1 2230a_100000209980_100000103362 [1,0,0,1,0,0|2,0,0]=4 6111 B10R1.57 COCCNC[C@@H]1CCO1 2230a_100020831831_100011201679 [1,0,0,1,0,0|2,0,0]=4 6112 B10R1.57 COCCNC[C@@H]1CCO1 34a_100020831831_100011201679 [1,0,0,1,0,0|2,0,0]=4 6113 B10R1.57 COCCOCC1CCO1 34a_100000039022_100011201679 [1,0,0,1,0,0|2,0,0]=4 6114 B10R1.57 COCCOCC1CCO1 34a_100000210237_100000103362 [1,0,0,1,0,0|2,0,0]=4 6115 B10R1.57 COCCSCC1CCO1 62a_100000103362_100000233755 [1,0,0,1,0,0|2,0,0]=4 6116 B10R1.57 COCCSCC1CCO1 62a_100000233755_100000103362 [1,0,0,1,0,0|2,0,0]=4 6117 B10R1.57 CSCCNCC1CCO1 2230a_100020590264_100000103362 [1,0,0,1,0,0|2,0,0]=4 6118 B10R1.57 CSCCNC[C@@H]1CCO1 2230a_100020831831_100000751147 [1,0,0,1,0,0|2,0,0]=4 6119 B10R1.57 CSCCNC[C@@H]1CCO1 34a_100020831831_100000212216 [1,0,0,1,0,0|2,0,0]=4 6120 B10R1.57 CSCCOCC1CCO1 34a_100000039022_100000212216 [1,0,0,1,0,0|2,0,0]=4 6121 B10R1.57 CSCCOCC1CCO1 34a_100000230434_100000103362 [1,0,0,1,0,0|2,0,0]=4 6122 B10R1.57 CSCCOCC1CCO1 7a_100000230434_100000103362 [1,0,0,1,0,0|2,0,0]=4 6123 B10R1.57 CSCCSCC1CCO1 62a_100000103362_100000751147 [1,0,0,1,0,0|2,0,0]=4 6124 B10R1.57 CSCCSCC1CCO1 62a_100000212216_100000103362 [1,0,0,1,0,0|2,0,0]=4 6125 B10R1.57 ClCCCOCC1CCO1 34a_100000230001_100000103362 [1,0,0,1,0,0|2,0,0]=4 6126 B10R1.57 FCCCNCC1CCO1 2230a_100015189416_100000103362 [1,0,0,1,0,0|2,0,0]=4 6127 B10R1.57 FCCCNCC1CCO1 34a_100015189416_100000103362 [1,0,0,1,0,0|2,0,0]=4 6128 B10R1.57 FCCCNC[C@@H]1CCO1 2230a_100020831831_100011934791 [1,0,0,1,0,0|2,0,0]=4 6129 B10R1.57 FCCCNC[C@@H]1CCO1 34a_100020831831_100011934791 [1,0,0,1,0,0|2,0,0]=4 6130 B10R1.57 FCCCOCC1CCO1 34a_100000039022_100011934791 [1,0,0,1,0,0|2,0,0]=4 6131 B10R1.57 FCCCOCC1CCO1 34a_100000759539_100000103362 [1,0,0,1,0,0|2,0,0]=4 6132 B10R1.57 FCCCSCC1CCO1 62a_100000103362_100011934791 [1,0,0,1,0,0|2,0,0]=4 6133 B10R1.57 FCCCSCC1CCO1 62a_100011934791_100000103362 [1,0,0,1,0,0|2,0,0]=4 6134 B10R1.57 NCCCOCC1CCO1 34a_100000182051_100000103362 [1,0,0,1,0,0|2,0,0]=4 6135 B10R1.57 OCCCNC[C@@H]1CCO1 2230a_100020831831_100000230001 [1,0,0,1,0,0|2,0,0]=4 6136 B10R1.57 OCCCNC[C@@H]1CCO1 34a_100020831831_100000230001 [1,0,0,1,0,0|2,0,0]=4 6137 B10R1.57 OCCCOCC1CCO1 34a_100000039022_100000230001 [1,0,0,1,0,0|2,0,0]=4 6138 B10R1.57 OCCCSCC1CCO1 62a_100000103362_100011215043 [1,0,0,1,0,0|2,0,0]=4 6139 B10R1.57 OCCCSCC1CCO1 62a_100011215043_100000103362 [1,0,0,1,0,0|2,0,0]=4 6140 B10R1.70 CC1(CO1)CNCCCF 34a_100015189416_100000760498 [1,0,0,1,0,0|2,0,0]=4 6141 B10R1.70 CC1(CO1)COCCCBr 34a_100011217188_100000760498 [1,0,0,1,0,0|2,0,0]=4 6142 B10R1.70 CC1(CO1)COCCCCl 34a_100000230001_100000760498 [1,0,0,1,0,0|2,0,0]=4 6143 B10R1.70 CC1(CO1)COCCCF 34a_100000759539_100000760498 [1,0,0,1,0,0|2,0,0]=4 6144 B10R1.70 CC1(CO1)COCCCN 34a_100000182051_100000760498 [1,0,0,1,0,0|2,0,0]=4 6145 B10R1.70 CC1(CO1)CSCCCF 62a_100000760498_100011934791 [1,0,0,1,0,0|2,0,0]=4 6146 B10R1.70 CC1(CO1)CSCCCF 62a_100011934791_100000760498 [1,0,0,1,0,0|2,0,0]=4 6147 B10R1.70 CC1(CO1)CSCCCO 62a_100000760498_100011215043 [1,0,0,1,0,0|2,0,0]=4 6148 B10R1.70 CC1(CO1)CSCCCO 62a_100011215043_100000760498 [1,0,0,1,0,0|2,0,0]=4 6149 B10R1.70 CCCCCNC1(CC1)C 2230a_100000757604_100000210326 [1,0,0,1,0,0|2,0,0]=4 6150 B10R1.70 CCCCCOC1(CC1)C 7a_100011725673_100000210326 [1,0,0,1,0,0|2,0,0]=4 6151 B10R1.70 CCCCNCC1(CC1)C 2230a_100000766693_100000210211 [1,0,0,1,0,0|2,0,0]=4 6152 B10R1.70 CCCCNCC1(CC1)O 2230a_100011936951_100000210211 [1,0,0,1,0,0|2,0,0]=4 6153 B10R1.70 CCCCOCC1(CC1)C 7a_100000698024_100000210211 [1,0,0,1,0,0|2,0,0]=4 6154 B10R1.70 CCCCOCC1(CO1)C 34a_100000210227_100000760498 [1,0,0,1,0,0|1,0,0]=3 6155 B10R1.70 CCCCSCC1(CO1)C 62a_100000210211_100000760498 [1,0,0,1,0,0|1,0,0]=3 6156 B10R1.70 CCCCSCC1(CO1)C 62a_100000760498_100000210210 [1,0,0,1,0,0|1,0,0]=3 6157 B10R1.70 CCOCSCC1(CO1)C 62a_100000739092_100000760498 [1,0,0,1,0,0|2,0,0]=4 6158 B10R1.70 CCOCSCC1(CO1)C 62a_100000760498_100000739092 [1,0,0,1,0,0|2,0,0]=4 6159 B10R1.70 COCCOCC1(CO1)C 34a_100000210237_100000760498 [1,0,0,1,0,0|2,0,0]=4 6160 B10R1.70 COCCSCC1(CO1)C 62a_100000233755_100000760498 [1,0,0,1,0,0|2,0,0]=4 6161 B10R1.70 COCCSCC1(CO1)C 62a_100000760498_100000233755 [1,0,0,1,0,0|2,0,0]=4 6162 B10R1.70 CSCCOCC1(CO1)C 34a_100000230434_100000760498 [1,0,0,1,0,0|2,0,0]=4 6163 B10R1.70 CSCCSCC1(CO1)C 62a_100000212216_100000760498 [1,0,0,1,0,0|2,0,0]=4 6164 B10R1.70 CSCCSCC1(CO1)C 62a_100000760498_100000751147 [1,0,0,1,0,0|2,0,0]=4 6165 B10R1.78 CN1CCCCCCCC1 2230a_100000039187_200000210301 [1,0,0,1,0,0|2,0,0]=4 6166 B10R1.78 CN1CCCCCCCC1 269982a_100000039187_200000210301 [1,0,0,1,0,0|2,0,0]=4 6167 B10R1.78 CN1CCCCCCCC1 34a_100000039187_200000210301 [1,0,0,1,0,0|2,0,0]=4 6168 B10R1.78 [13CH3]N1CCCCCCCC1 2230a_100000039187_200025704644 [1,0,0,1,0,0|2,0,0]=4 6169 B10R1.78 [13CH3]N1CCCCCCCC1 269982a_100000039187_200025704644 [1,0,0,1,0,0|2,0,0]=4 6170 B10R1.78 [13CH3]N1CCCCCCCC1 34a_100000039187_200025704644 [1,0,0,1,0,0|2,0,0]=4 6171 B10R1.96 CCCC1CCC(C1)NC 270004a_106832991635_200012087856 [1,0,0,1,0,0|1,0,0]=3 6172 B10R1.96 CCCN1CC[C@H](C1)OC 2230a_100000766984_100000210303 [1,0,0,1,0,0|1,0,0]=3 6173 B10R1.96 CCCN1CC[C@H](C1)OC 269982a_100000766984_100000210303 [1,0,0,1,0,0|1,0,0]=3 6174 B10R1.96 CCNC1CCC(C1)CC 270004a_100015525214_100011218773 [1,0,0,1,0,0|2,0,0]=4 6175 B10R1.96 COCN1CC[C@H](C1)OC 2230a_100000766984_100000766300 [1,0,0,1,0,0|2,0,0]=4 6176 B10R1.96 COCN1CC[C@H](C1)OC 269982a_100000766984_100000766300 [1,0,0,1,0,0|2,0,0]=4 6177 B10R1.96 CO[C@@H]1CCN(C1)CCF 2230a_100000766984_100011217306 [1,0,0,1,0,0|2,0,0]=4 6178 B10R1.96 CO[C@@H]1CCN(C1)CCF 269982a_100000766984_100011217306 [1,0,0,1,0,0|2,0,0]=4 6179 B10R1.96 CO[C@@H]1CCN(C1)CCO 2230a_100000766984_100000211926 [1,0,0,1,0,0|2,0,0]=4 6180 B10R1.96 CO[C@@H]1CCN(C1)CCO 269982a_100000766984_100000211926 [1,0,0,1,0,0|2,0,0]=4 6181 B10R1.96 CO[C@@H]1CCN(C1)CSC 2230a_100000766984_100011218213 [1,0,0,1,0,0|2,0,0]=4 6182 B10R1.96 CO[C@@H]1CCN(C1)CSC 269982a_100000766984_100011218213 [1,0,0,1,0,0|2,0,0]=4 6183 B10R1.143 CCCCN1CC(C1)CC 2230a_100015205115_100000210211 [1,0,0,1,0,0|2,0,0]=4 6184 B10R1.143 CCCCN1CC(C1)CC 269982a_100015205115_100000210211 [1,0,0,1,0,0|2,0,0]=4 6185 B10R1.143 CCCCN1CC(C1)OC 269982a_100000755009_100000210211 [1,0,0,1,0,0|1,0,0]=3 6186 B10R1.143 CCCCN1CC(C1)SC 269982a_100016990038_100000210211 [1,0,0,1,0,0|1,1,0]=4 6187 B10R1.143 CCCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100000210303 [1,0,0,1,0,0|1,0,0]=3 6188 B10R1.143 CCOCN1CC(C1)OC 269982a_100000755009_100000739092 [1,0,0,1,0,0|2,0,0]=4 6189 B10R1.143 COC1CN(C1)CCCF 269982a_100000755009_100011934791 [1,0,0,1,0,0|2,0,0]=4 6190 B10R1.143 COC1CN(C1)CCCO 269982a_100000755009_100011215043 [1,0,0,1,0,0|2,0,0]=4 6191 B10R1.143 COC1CN(C1)CCSC 269982a_100000755009_100000212216 [1,0,0,1,0,0|2,0,0]=4 6192 B10R1.143 COCCN1CC(C1)OC 269982a_100000755009_100000233755 [1,0,0,1,0,0|2,0,0]=4 6193 B10R1.143 COCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100000766300 [1,0,0,1,0,0|2,0,0]=4 6194 B10R1.143 CO[C@H]1C[C@@H](C1)NCCF 2230a_100121570643_100011217306 [1,0,0,1,0,0|2,0,0]=4 6195 B10R1.143 CO[C@H]1C[C@@H](C1)NCCO 2230a_100121570643_100000211926 [1,0,0,1,0,0|2,0,0]=4 6196 B10R1.143 CO[C@H]1C[C@@H](C1)NCSC 2230a_100121570643_100011218213 [1,0,0,1,0,0|2,0,0]=4 6197 B10R1.149 CCC(C)N1CCC[C@@H]1C 2230a_100020605311_100000758301 [1,0,0,1,0,0|2,0,0]=4 6198 B10R1.149 CCC(C)N1CCC[C@@H]1C 269982a_100020605311_100000758301 [1,0,0,1,0,0|2,0,0]=4 6199 B10R1.149 CCC(C)N1CCC[C@H]1C 2230a_100015189458_100000758301 [1,0,0,1,0,0|2,0,0]=4 6200 B10R1.149 CCC(C)N1CCC[C@H]1C 269982a_100015189458_100000758301 [1,0,0,1,0,0|2,0,0]=4 6201 B10R1.149 CCC(C)N1CCC[C@H]1C 34a_100015189458_100011215416 [1,0,0,1,0,0|2,0,0]=4 6202 B10R1.149 COC(C)N1CCC[C@@H]1C 269982a_100020605311_100009879195 [1,0,0,1,0,0|1,0,0]=3 6203 B10R1.149 COC(C)N1CCC[C@H]1C 269982a_100015189458_100009879195 [1,0,0,1,0,0|1,0,0]=3 6204 B10R1.149 COC(C)N1CCSC1C 269982a_200011216479_100009879195 [1,0,0,1,0,0|2,0,0]=4 6205 B10R1.149 CO[C@@H](C)[C@@H]1CCCN1C 34a_100160487421_200000210301 [1,0,0,1,0,0|1,0,0]=3 6206 B10R1.149 C[C@H](O[13CH3])[C@@H]1CCCN1C 34a_100160487421_200025704644 [1,0,0,1,0,0|1,0,0]=3 6207 B10R1.151 CCC(C)CNC1CCC1 2230a_100000749019_100000748023 [1,0,0,1,0,0|2,0,0]=4 6208 B10R1.151 CCC(C)CNC1CCC1 270004a_100020588543_100000241760 [1,0,0,1,0,0|2,0,0]=4 6209 B10R1.151 CCC(C)CNC1CCC1 34a_100000749019_100000748023 [1,0,0,1,0,0|2,0,0]=4 6210 B10R1.151 CCC(C)COC1CCC1 34a_100000748187_100000748023 [1,0,0,1,0,0|2,0,0]=4 6211 B10R1.151 CCC(C)CSC1CCC1 62a_100000748023_100000749161 [1,0,0,1,0,0|2,0,0]=4 6212 B10R1.151 CCC(C)NCC1CCC1 2230a_100000209981_100000763275 [1,0,0,1,0,0|2,0,0]=4 6213 B10R1.151 CCC(C)NCC1CCC1 2230a_100000738700_100000758301 [1,0,0,1,0,0|2,0,0]=4 6214 B10R1.151 CCC(C)NCC1CCC1 269862a_100000209981_100000753134 [1,0,0,1,0,0|2,0,0]=4 6215 B10R1.151 CCC(C)NCC1CCC1 34a_100000738700_100011215416 [1,0,0,1,0,0|2,0,0]=4 6216 B10R1.151 CCC(C)OCC1CCC1 34a_100000760304_100011215416 [1,0,0,1,0,0|2,0,0]=4 6217 B10R1.151 CCC(C)OCC1CCC1 7a_100000210228_100000763275 [1,0,0,1,0,0|2,0,0]=4 6218 B10R1.151 CCC(C)SCC1CCC1 62a_100000758301_100000763275 [1,0,0,1,0,0|2,0,0]=4 6219 B10R1.151 CCC(C)SCC1CCC1 62a_100000763275_100000758301 [1,0,0,1,0,0|2,0,0]=4 6220 B10R1.151 CCC(O)CNC1CCC1 2230a_100000749019_100011218378 [1,0,0,1,0,0|2,0,0]=4 6221 B10R1.151 CCC(O)CNC1CCC1 270004a_100011218483_100000241760 [1,0,0,1,0,0|2,0,0]=4 6222 B10R1.151 CCC(O)CNC1CCC1 34a_100000749019_100011218378 [1,0,0,1,0,0|2,0,0]=4 6223 B10R1.151 CCC(O)COC1CCC1 34a_100000748187_100011218378 [1,0,0,1,0,0|2,0,0]=4 6224 B10R1.151 CCC(O)CSC1CCC1 62a_100011218378_100000749161 [1,0,0,1,0,0|2,0,0]=4 6225 B10R1.151 CC[C@H](C)CNC1CCC1 2230a_100000749019_100009816398 [1,0,0,1,0,0|2,0,0]=4 6226 B10R1.151 CC[C@H](C)CNC1CCC1 34a_100000749019_100009816398 [1,0,0,1,0,0|2,0,0]=4 6227 B10R1.151 CC[C@H](C)COC1CCC1 34a_100000748187_100009816398 [1,0,0,1,0,0|2,0,0]=4 6228 B10R1.151 CC[C@H](C)CSC1CCC1 62a_100009816398_100000749161 [1,0,0,1,0,0|2,0,0]=4 6229 B10R1.151 COC(C)COC1CCC1 34a_100000690652_100000749161 [1,0,0,1,0,0|1,0,0]=3 6230 B10R1.151 COC(C)COC1COC1 34a_100000690652_100009818527 [1,0,0,1,0,0|2,0,0]=4 6231 B10R1.151 COC(C)SCC1CCC1 62a_100000763275_100009879195 [1,0,0,1,0,0|1,0,0]=3 6232 B10R1.151 COC(C)SCC1CCC1 62a_100009879195_100000763275 [1,0,0,1,0,0|1,0,0]=3 6233 B10R1.151 COC(C)SCC1CCO1 62a_100000103362_100009879195 [1,0,0,1,0,0|2,0,0]=4 6234 B10R1.151 COC(C)SCC1CCO1 62a_100009879195_100000103362 [1,0,0,1,0,0|2,0,0]=4 6235 B10R1.151 COC(C)SCC1COC1 62a_100009879195_100010264016 [1,0,0,1,0,0|2,0,0]=4 6236 B10R1.151 COC(C)SCC1COC1 62a_100010264016_100009879195 [1,0,0,1,0,0|2,0,0]=4 6237 B10R1.151 CO[C@H](C)CNC1CCC1 270004a_100020591295_100000241760 [1,0,0,1,0,0|1,0,0]=3 6238 B10R1.153 CCC(C)CNCC1CC1 2230a_100000735609_100000748023 [1,0,0,1,0,0|2,0,0]=4 6239 B10R1.153 CCC(C)CNCC1CC1 2230a_100020588543_100000742324 [1,0,0,1,0,0|2,0,0]=4 6240 B10R1.153 CCC(C)CNCC1CC1 269862a_100020588543_100000741477 [1,0,0,1,0,0|2,0,0]=4 6241 B10R1.153 CCC(C)CNCC1CC1 270004a_100000735609_100000243153 [1,0,0,1,0,0|2,0,0]=4 6242 B10R1.153 CCC(C)CNCC1CC1 34a_100000735609_100000748023 [1,0,0,1,0,0|2,0,0]=4 6243 B10R1.153 CCC(C)COCC1CC1 34a_100000211283_100000748023 [1,0,0,1,0,0|2,0,0]=4 6244 B10R1.153 CCC(C)CSCC1CC1 62a_100000748023_100000742324 [1,0,0,1,0,0|2,0,0]=4 6245 B10R1.153 CCC(C)CSCC1CC1 62a_100000756562_100000748023 [1,0,0,1,0,0|2,0,0]=4 6246 B10R1.153 CCC(C)NCCC1CC1 2230a_100000209981_100000694398 [1,0,0,1,0,0|2,0,0]=4 6247 B10R1.153 CCC(C)NCCC1CC1 34a_100000764129_100011215416 [1,0,0,1,0,0|2,0,0]=4 6248 B10R1.153 CCC(C)OCCC1CC1 34a_100000754188_100011215416 [1,0,0,1,0,0|2,0,0]=4 6249 B10R1.153 CCC(C)OCCC1CC1 7a_100000210228_100000764125 [1,0,0,1,0,0|2,0,0]=4 6250 B10R1.153 CCC(C)OCCC1CC1 7a_100000754188_100000758301 [1,0,0,1,0,0|2,0,0]=4 6251 B10R1.153 CCC(C)SCCC1CC1 62a_100000758301_100000764125 [1,0,0,1,0,0|2,0,0]=4 6252 B10R1.153 CCC(C)SCCC1CC1 62a_100000764125_100000758301 [1,0,0,1,0,0|2,0,0]=4 6253 B10R1.153 CCC(O)CNCC1CC1 2230a_100000735609_100011218378 [1,0,0,1,0,0|2,0,0]=4 6254 B10R1.153 CCC(O)CNCC1CC1 2230a_100011218483_100000742324 [1,0,0,1,0,0|2,0,0]=4 6255 B10R1.153 CCC(O)CNCC1CC1 269862a_100011218483_100000741477 [1,0,0,1,0,0|2,0,0]=4 6256 B10R1.153 CCC(O)CNCC1CC1 34a_100000735609_100011218378 [1,0,0,1,0,0|2,0,0]=4 6257 B10R1.153 CCC(O)COCC1CC1 34a_100000211283_100011218378 [1,0,0,1,0,0|2,0,0]=4 6258 B10R1.153 CCC(O)CSCC1CC1 62a_100000756562_100011218378 [1,0,0,1,0,0|2,0,0]=4 6259 B10R1.153 CCC(O)CSCC1CC1 62a_100011218378_100000742324 [1,0,0,1,0,0|2,0,0]=4 6260 B10R1.153 CC[C@H](C)CNCC1CC1 2230a_100000735609_100009816398 [1,0,0,1,0,0|2,0,0]=4 6261 B10R1.153 CC[C@H](C)CNCC1CC1 34a_100000735609_100009816398 [1,0,0,1,0,0|2,0,0]=4 6262 B10R1.153 CC[C@H](C)COCC1CC1 34a_100000211283_100009816398 [1,0,0,1,0,0|2,0,0]=4 6263 B10R1.153 CC[C@H](C)COCC1CC1 7a_100009816381_100000742324 [1,0,0,1,0,0|2,0,0]=4 6264 B10R1.153 CC[C@H](C)CSCC1CC1 62a_100000756562_100009816398 [1,0,0,1,0,0|2,0,0]=4 6265 B10R1.153 CC[C@H](C)CSCC1CC1 62a_100009816398_100000742324 [1,0,0,1,0,0|2,0,0]=4 6266 B10R1.153 COC(C)COCC1CC1 34a_100000690652_100000742324 [1,0,0,1,0,0|1,0,0]=3 6267 B10R1.153 COC(C)COCC1CO1 34a_100000690652_102125554688 [1,0,0,1,0,0|2,0,0]=4 6268 B10R1.153 COC(C)SCCC1CC1 62a_100000764125_100009879195 [1,0,0,1,0,0|1,0,0]=3 6269 B10R1.153 COC(C)SCCC1CC1 62a_100009879195_100000764125 [1,0,0,1,0,0|1,0,0]=3 6270 B10R1.153 COC(C)SCCC1CO1 62a_100000732470_100009879195 [1,0,0,1,0,0|2,0,0]=4 6271 B10R1.153 COC(C)SCCC1CO1 62a_100009879195_100000732470 [1,0,0,1,0,0|2,0,0]=4 6272 B10R1.153 CO[C@H](C)CNCC1CC1 2230a_100020591295_100000742324 [1,0,0,1,0,0|1,0,0]=3 6273 B10R1.153 CO[C@H](C)CNCC1CC1 269862a_100020591295_100000741477 [1,0,0,1,0,0|1,0,0]=3 6274 B10R1.153 CO[C@H](C)CNCC1CO1 2230a_100020591295_100011216344 [1,0,0,1,0,0|2,0,0]=4 6275 B10R1.161 CCN1CCCCCCC1 2230a_100000211400_100000210202 [1,0,0,1,0,0|2,0,0]=4 6276 B10R1.161 CCN1CCCCCCC1 269982a_100000211400_100000204670 [1,0,0,1,0,0|2,0,0]=4 6277 B10R1.161 CCN1CCCCCCC1 34a_100000211400_100000210202 [1,0,0,1,0,0|2,0,0]=4 6278 B10R1.161 CNC1CCCCCCC1 2230a_100000211152_200000210301 [1,0,0,1,0,0|1,0,0]=3 6279 B10R1.161 CNC1CCCCCCC1 270004a_106832991635_100000210524 [1,0,0,1,0,0|1,0,0]=3 6280 B10R1.161 CNC1CCCCCCC1 34a_100000211152_200000210301 [1,0,0,1,0,0|1,0,0]=3 6281 B10R1.161 COC1C=CCCCCC1 34a_100000688657_200000210301 [1,0,0,1,0,0|0,0,2]=4 6282 B10R1.161 COC1CC/C=C\CCC1 34a_100016989180_200000210301 [1,0,0,1,0,0|0,0,2]=4 6283 B10R1.161 COC1CC/C=C\CCC1 34a_100138415774_100021000466 [1,0,0,1,0,0|0,0,2]=4 6284 B10R1.161 COC1CCCCCCC1 34a_100000210054_200000210301 [1,0,0,1,0,0|0,0,0]=2 6285 B10R1.161 COC1CCCCCCC1 7a_100000210054_200000210301 [1,0,0,1,0,0|0,0,0]=2 6286 B10R1.161 [13CH3]NC1CCCCCCC1 2230a_100000211152_200025704644 [1,0,0,1,0,0|1,0,0]=3 6287 B10R1.161 [13CH3]NC1CCCCCCC1 34a_100000211152_200025704644 [1,0,0,1,0,0|1,0,0]=3 6288 B10R1.161 [13CH3]OC1C=CCCCCC1 34a_100000688657_200025704644 [1,0,0,1,0,0|0,0,2]=4 6289 B10R1.161 [13CH3]OC1CC/C=C\CCC1 34a_100016989180_200025704644 [1,0,0,1,0,0|0,0,2]=4 6290 B10R1.161 [13CH3]OC1CCCCCCC1 34a_100000210054_200025704644 [1,0,0,1,0,0|0,0,0]=2 6291 B10R1.161 [13CH3]OC1CCCCCCC1 7a_100000210054_200025704644 [1,0,0,1,0,0|0,0,0]=2 6292 B10R1.172 CCC1CCCC(C1)NC 270004a_106832991635_100000756783 [1,0,0,1,0,0|1,0,0]=3 6293 B10R1.172 CCC1CCCC(C1)OC 7a_100011985506_200000210301 [1,0,0,1,0,0|0,0,0]=2 6294 B10R1.172 CCC1CCCC(C1)O[13CH3] 7a_100011985506_200025704644 [1,0,0,1,0,0|0,0,0]=2 6295 B10R1.172 CCN1CCCC(C1)OC 2230a_100000695604_100000210202 [1,0,0,1,0,0|1,0,0]=3 6296 B10R1.172 CCN1CCCC(C1)OC 269982a_100000695604_100000204670 [1,0,0,1,0,0|1,0,0]=3 6297 B10R1.172 CCN1CCCC(C1)OC 34a_100000695604_100000210202 [1,0,0,1,0,0|1,0,0]=3 6298 B10R1.172 CCN1CCC[C@H](C1)NC 2230a_100025775482_200000210301 [1,0,0,1,0,0|2,0,0]=4 6299 B10R1.172 CCN1CCC[C@H](C1)N[13CH3] 2230a_100025775482_200025704644 [1,0,0,1,0,0|2,0,0]=4 6300 B10R1.172 CNC1CCCC(C1)SC 270004a_106832991635_100012138059 [1,0,0,1,0,0|1,1,0]=4 6301 B10R1.172 COC1CCCC(C1)CN 34a_100011254705_200000210301 [1,0,0,1,0,0|1,0,0]=3 6302 B10R1.172 COC1CCCN(C1)CF 269982a_100000695604_100015361967 [1,0,0,1,0,0|2,0,0]=4 6303 B10R1.172 COC1CCCN(C1)CF 34a_100000695604_100015361967 [1,0,0,1,0,0|2,0,0]=4 6304 B10R1.172 [13CH3]OC1CCCC(C1)CN 34a_100011254705_200025704644 [1,0,0,1,0,0|1,0,0]=3 6305 B10R1.197 CCC1CCCN(CC1)C 2230a_100000757272_200000210301 [1,0,0,1,0,0|2,0,0]=4 6306 B10R1.197 CCC1CCCN(CC1)C 269982a_100000757272_200000210301 [1,0,0,1,0,0|2,0,0]=4 6307 B10R1.197 CCC1CCCN(CC1)C 34a_100000757272_200000210301 [1,0,0,1,0,0|2,0,0]=4 6308 B10R1.197 CCC1CCCN(CC1)[13CH3] 2230a_100000757272_200025704644 [1,0,0,1,0,0|2,0,0]=4 6309 B10R1.197 CCC1CCCN(CC1)[13CH3] 269982a_100000757272_200025704644 [1,0,0,1,0,0|2,0,0]=4 6310 B10R1.197 CCC1CCCN(CC1)[13CH3] 34a_100000757272_200025704644 [1,0,0,1,0,0|2,0,0]=4 6311 B10R1.197 CCN1CCCC(CC1)C 2230a_100025706717_100000210202 [1,0,0,1,0,0|2,0,0]=4 6312 B10R1.197 CCN1CCCC(CC1)C 269982a_100025706717_100000204670 [1,0,0,1,0,0|2,0,0]=4 6313 B10R1.197 CCN1CCCC(CC1)C 34a_100025706717_100000210202 [1,0,0,1,0,0|2,0,0]=4 6314 B10R1.197 CCN1CCCC(CC1)O 2230a_100015186869_100000210202 [1,0,0,1,0,0|2,0,0]=4 6315 B10R1.197 CCN1CCCC(CC1)O 269982a_100015186869_100000204670 [1,0,0,1,0,0|2,0,0]=4 6316 B10R1.206 CCC(C)OCC1CC1C 34a_100000744939_100011215416 [1,0,0,1,0,0|2,0,0]=4 6317 B10R1.206 CCC(C)OCC1CC1C 7a_100000744939_100000758301 [1,0,0,1,0,0|2,0,0]=4 6318 B10R1.217 CCCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_100000210211 [1,0,0,1,0,0|2,0,0]=4 6319 B10R1.217 CCCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_100000210211 [1,0,0,1,0,0|2,0,0]=4 6320 B10R1.232 CC1(CCCCCC1)N[13CH3] 2230a_100000704638_200025704644 [1,0,0,1,0,0|1,0,0]=3 6321 B10R1.232 CC1(CCCCCC1)N[13CH3] 34a_100000704638_200025704644 [1,0,0,1,0,0|1,0,0]=3 6322 B10R1.232 CC1(CCCCCC1)O[13CH3] 34a_100000708895_200025704644 [1,0,0,1,0,0|0,0,0]=2 6323 B10R1.232 CC1(CCCCCC1)O[13CH3] 7a_100000708895_200025704644 [1,0,0,1,0,0|0,0,0]=2 6324 B10R1.232 CC1(CCCNCC1)O[13CH3] 34a_100000723723_200025704644 [1,0,0,1,0,0|1,0,0]=3 6325 B10R1.232 CNC1(CCCCCC1)C 2230a_100000704638_200000210301 [1,0,0,1,0,0|1,0,0]=3 6326 B10R1.232 CNC1(CCCCCC1)C 34a_100000704638_200000210301 [1,0,0,1,0,0|1,0,0]=3 6327 B10R1.232 COC1(CCCCCC1)C 34a_100000708895_200000210301 [1,0,0,1,0,0|0,0,0]=2 6328 B10R1.232 COC1(CCCCCC1)C 7a_100000708895_200000210301 [1,0,0,1,0,0|0,0,0]=2 6329 B10R1.232 COC1(CCCNCC1)C 34a_100000723723_200000210301 [1,0,0,1,0,0|1,0,0]=3 6330 B10R1.463 CCC(C)CN1CCC1C 269982a_100000755817_100000748023 [1,0,0,1,0,0|2,0,0]=4 6331 B10R1.463 CCC(C)CN1CCC1C 34a_100000755817_100000748023 [1,0,0,1,0,0|2,0,0]=4 6332 B10R1.463 CCC(O)CN1CCC1C 269982a_100000755817_100011218378 [1,0,0,1,0,0|2,0,0]=4 6333 B10R1.463 CCC(O)CN1CCC1C 34a_100000755817_100011218378 [1,0,0,1,0,0|2,0,0]=4 6334 B10R1.463 CC[C@H](C)CN1CCC1C 269982a_100000755817_100009816398 [1,0,0,1,0,0|2,0,0]=4 6335 B10R1.463 CC[C@H](C)CN1CCC1C 34a_100000755817_100009816398 [1,0,0,1,0,0|2,0,0]=4 6336 B10R1.3 CCC1CCC(CC1)NC 2230a_100011194317_200000210301 [1,0,0,1,0,0|2,0,0]=4 6337 B10R1.3 CCC1CCC(CC1)NC 270004a_106832991635_100000210631 [1,0,0,1,0,0|2,0,0]=4 6338 B10R1.3 CCC1CCC(CC1)NC 34a_100011194317_200000210301 [1,0,0,1,0,0|2,0,0]=4 6339 B10R1.3 CCC1CCC(CC1)N[13CH3] 2230a_100011194317_200025704644 [1,0,0,1,0,0|2,0,0]=4 6340 B10R1.3 CCC1CCC(CC1)N[13CH3] 34a_100011194317_200025704644 [1,0,0,1,0,0|2,0,0]=4 6341 B10R1.3 CCC1CCC(CC1)OC 34a_100011215326_200000210301 [1,0,0,1,0,0|1,0,0]=3 6342 B10R1.3 CCC1CCC(CC1)OC 7a_100011215326_200000210301 [1,0,0,1,0,0|1,0,0]=3 6343 B10R1.3 CCC1CCC(CC1)O[13CH3] 34a_100011215326_200025704644 [1,0,0,1,0,0|1,0,0]=3 6344 B10R1.3 CCC1CCC(CC1)O[13CH3] 7a_100011215326_200025704644 [1,0,0,1,0,0|1,0,0]=3 6345 B10R1.3 CCN1CCC(CC1)OC 2230a_100000234800_100000210202 [1,0,0,1,0,0|2,0,0]=4 6346 B10R1.3 CCN1CCC(CC1)OC 269982a_100000234800_100000204670 [1,0,0,1,0,0|2,0,0]=4 6347 B10R1.3 CCN1CCC(CC1)OC 34a_100000234800_100000210202 [1,0,0,1,0,0|2,0,0]=4 6348 B10R1.3 CCN1CCC(CC1)OC 7a_100000231353_200000210301 [1,0,0,1,0,0|2,0,0]=4 6349 B10R1.3 CCN1CCC(CC1)O[13CH3] 7a_100000231353_200025704644 [1,0,0,1,0,0|2,0,0]=4 6350 B10R1.3 CNC1CCC(CC1)OC 270004a_106832991635_100000747084 [1,0,0,1,0,0|2,0,0]=4 6351 B10R1.3 CNC1CCC(CC1)OC 34a_100015205214_200000210301 [1,0,0,1,0,0|2,0,0]=4 6352 B10R1.3 CN[C@H]1CC[C@H](CC1)OC 34a_100020636401_200000210301 [1,0,0,1,0,0|2,0,0]=4 6353 B10R1.3 CN[C@H]1CC[C@H](CC1)O[13CH3] 34a_100020636401_200025704644 [1,0,0,1,0,0|2,0,0]=4 6354 B10R1.3 COC1CCC(CC1)N[13CH3] 34a_100015205214_200025704644 [1,0,0,1,0,0|2,0,0]=4 6355 B10R1.3 COC1CCC(CC1)OC 34a_100011581665_200000210301 [1,0,0,1,0,0|2,0,0]=4 6356 B10R1.3 COC1CCC(CC1)OC 7a_100011581665_200000210301 [1,0,0,1,0,0|2,0,0]=4 6357 B10R1.3 COC1CCC(CC1)O[13CH3] 34a_100011581665_200025704644 [1,0,0,1,0,0|2,0,0]=4 6358 B10R1.3 COC1CCC(CC1)O[13CH3] 7a_100011581665_200025704644 [1,0,0,1,0,0|2,0,0]=4 6359 B10R1.9 CCC(NC)C1CCCC1 269862a_106832991636_100011350732 [1,0,0,1,0,0|2,0,0]=4 6360 B10R1.9 CCC(NC)C1CCCC1 270004a_106832991635_100011350732 [1,0,0,1,0,0|2,0,0]=4 6361 B10R1.21 BrCCOCC1OCCO1 34a_100000211926_100000755774 [1,0,0,1,0,0|2,0,0]=4 6362 B10R1.21 CCCCOC1CCCO1 34a_100000085407_100000210210 [1,0,0,1,0,0|2,0,0]=4 6363 B10R1.21 CCCNCC1OCCO1 2230a_100000036311_100000210303 [1,0,0,1,0,0|1,0,0]=3 6364 B10R1.21 CCCNCC1OCCO1 34a_100000036311_100000210303 [1,0,0,1,0,0|1,0,0]=3 6365 B10R1.21 CCCNC[C@@H]1CCCO1 2230a_100020590478_100000210303 [1,0,0,1,0,0|2,0,0]=4 6366 B10R1.21 CCCNC[C@@H]1CCCO1 34a_100020590478_100000210303 [1,0,0,1,0,0|2,0,0]=4 6367 B10R1.21 CCCOCC1CCCO1 34a_100000210270_100000210303 [1,0,0,1,0,0|2,0,0]=4 6368 B10R1.21 CCCOCC1CCCO1 7a_100000210270_100000210303 [1,0,0,1,0,0|2,0,0]=4 6369 B10R1.21 CCCOCC1OCCO1 34a_100000087154_100000210303 [1,0,0,1,0,0|1,0,0]=3 6370 B10R1.21 CCCOCC1OCCO1 34a_100000210258_100000755774 [1,0,0,1,0,0|1,0,0]=3 6371 B10R1.21 CCCSCC1CCCO1 62a_100000203698_100000210303 [1,0,0,1,0,0|2,0,0]=4 6372 B10R1.21 CCCSCC1CCCO1 62a_100000210303_100000203698 [1,0,0,1,0,0|2,0,0]=4 6373 B10R1.21 CCCSCC1OCCO1 62a_100000210303_100000755774 [1,0,0,1,0,0|1,0,0]=3 6374 B10R1.21 CCCSCC1OCCO1 62a_100000755774_100000210303 [1,0,0,1,0,0|1,0,0]=3 6375 B10R1.21 CCNCCC1OCCO1 2230a_100000034215_100000210202 [1,0,0,1,0,0|1,0,0]=3 6376 B10R1.21 CCNCCC1OCCO1 2230a_100015525214_100000740749 [1,0,0,1,0,0|1,0,0]=3 6377 B10R1.21 CCNCCC1OCCO1 34a_100000034215_100000210202 [1,0,0,1,0,0|1,0,0]=3 6378 B10R1.21 CCOCCC1OCCO1 34a_100121572206_100000740749 [1,0,0,1,0,0|1,0,0]=3 6379 B10R1.21 CCSCCC1OCCO1 62a_100000210202_100000740749 [1,0,0,1,0,0|1,0,0]=3 6380 B10R1.21 CNCCCC1OCCO1 2230a_106832991635_100000042513 [1,0,0,1,0,0|1,0,0]=3 6381 B10R1.21 CNCCCC1OCCO1 34a_100102657272_100009861162 [1,0,0,1,0,0|1,0,0]=3 6382 B10R1.21 CNCCCC1OCCO1 7a_106832991635_100000042513 [1,0,0,1,0,0|1,0,0]=3 6383 B10R1.21 COCCCC1OCCO1 34a_100009871617_200000210301 [1,0,0,1,0,0|1,0,0]=3 6384 B10R1.21 COCCCC1OCCO1 34a_100138415774_100009861162 [1,0,0,1,0,0|1,0,0]=3 6385 B10R1.21 COCCCC1OCCO1 7a_100009871617_200000210301 [1,0,0,1,0,0|1,0,0]=3 6386 B10R1.21 COCNCC1OCCO1 2230a_100000036311_100000766300 [1,0,0,1,0,0|2,0,0]=4 6387 B10R1.21 COCSCC1OCCO1 62a_100000755774_100000766300 [1,0,0,1,0,0|2,0,0]=4 6388 B10R1.21 COCSCC1OCCO1 62a_100000766300_100000755774 [1,0,0,1,0,0|2,0,0]=4 6389 B10R1.21 CSCCCC1OCCO1 62a_200000210301_100000042513 [1,0,0,1,0,0|1,0,0]=3 6390 B10R1.21 CSCNCC1OCCO1 2230a_100000036311_100011218213 [1,0,0,1,0,0|2,0,0]=4 6391 B10R1.21 CSCNCC1OCCO1 34a_100000036311_100011218213 [1,0,0,1,0,0|2,0,0]=4 6392 B10R1.21 CSCOCC1OCCO1 34a_100000087154_100011218213 [1,0,0,1,0,0|2,0,0]=4 6393 B10R1.21 CSCSCC1OCCO1 62a_100000755774_100011218213 [1,0,0,1,0,0|2,0,0]=4 6394 B10R1.21 CSCSCC1OCCO1 62a_100011218213_100000755774 [1,0,0,1,0,0|2,0,0]=4 6395 B10R1.21 FCCNCC1OCCO1 2230a_100000036311_100011217306 [1,0,0,1,0,0|2,0,0]=4 6396 B10R1.21 FCCNCC1OCCO1 34a_100000036311_100011217306 [1,0,0,1,0,0|2,0,0]=4 6397 B10R1.21 FCCNCC1OCCO1 34a_100000724931_100000755774 [1,0,0,1,0,0|2,0,0]=4 6398 B10R1.21 FCCOCC1OCCO1 34a_100000087154_100011217306 [1,0,0,1,0,0|2,0,0]=4 6399 B10R1.21 FCCSCC1OCCO1 62a_100000755774_100011217306 [1,0,0,1,0,0|2,0,0]=4 6400 B10R1.21 FCCSCC1OCCO1 62a_100011217306_100000755774 [1,0,0,1,0,0|2,0,0]=4 6401 B10R1.21 FCNCCC1OCCO1 34a_100000034215_100015361967 [1,0,0,1,0,0|2,0,0]=4 6402 B10R1.21 FCSCCC1OCCO1 62a_100015361967_100000740749 [1,0,0,1,0,0|2,0,0]=4 6403 B10R1.21 NCCOCC1OCCO1 34a_100000210304_100000755774 [1,0,0,1,0,0|2,0,0]=4 6404 B10R1.21 OCCNCC1OCCO1 2230a_100000036311_100000211926 [1,0,0,1,0,0|2,0,0]=4 6405 B10R1.21 OCCNCC1OCCO1 2230a_100016997473_100000755774 [1,0,0,1,0,0|2,0,0]=4 6406 B10R1.21 OCCNCC1OCCO1 34a_100000036311_100000211926 [1,0,0,1,0,0|2,0,0]=4 6407 B10R1.21 OCCNCC1OCCO1 34a_100016990907_100000755774 [1,0,0,1,0,0|2,0,0]=4 6408 B10R1.21 OCCOCC1OCCO1 34a_100000087154_100000211926 [1,0,0,1,0,0|2,0,0]=4 6409 B10R1.21 OCCSCC1OCCO1 62a_100000211926_100000755774 [1,0,0,1,0,0|2,0,0]=4 6410 B10R1.21 OCCSCC1OCCO1 62a_100000755774_100000211926 [1,0,0,1,0,0|2,0,0]=4 6411 B10R1.21 [13CH3]OCCCC1OCCO1 34a_100009871617_200025704644 [1,0,0,1,0,0|1,0,0]=3 6412 B10R1.21 [13CH3]OCCCC1OCCO1 7a_100009871617_200025704644 [1,0,0,1,0,0|1,0,0]=3 6413 B10R1.21 [13CH3]SCCCC1OCCO1 62a_200025704644_100000042513 [1,0,0,1,0,0|1,0,0]=3 6414 B10R1.123 CCC(COC1CC1)OC 34a_100011934954_100000211595 [1,0,0,1,0,0|2,0,0]=4 6415 B10R1.123 COC(CNC1CC1)OC 34a_100000212008_100000211822 [1,0,0,1,0,0|1,0,0]=3 6416 B10R1.123 COC(COC1CC1)OC 34a_100011216393_100000211595 [1,0,0,1,0,0|1,0,0]=3 6417 B10R1.123 COC(CSC1CC1)OC 62a_100000751394_100000211595 [1,0,0,1,0,0|1,0,0]=3 6418 B10R1.459 CCCOCC1(CO1)CC 34a_100000210258_200000139556 [1,0,0,1,0,0|2,0,0]=4 6419 B10R1.459 CCCSCC1(CO1)CC 62a_100000210303_200000139556 [1,0,0,1,0,0|2,0,0]=4 6420 B10R1.459 CCCSCC1(CO1)CC 62a_200000139556_100000210303 [1,0,0,1,0,0|2,0,0]=4 6421 B10R1.487 C#CC1(CCCCC1)OC 34a_100011215672_200000210301 [1,0,0,1,0,0|1,0,1]=4 6422 B10R1.487 C#CC1(CCCCC1)OC 7a_100011215672_200000210301 [1,0,0,1,0,0|1,0,1]=4 6423 B10R1.487 C#CC1(CCCCC1)O[13CH3] 34a_100011215672_200025704644 [1,0,0,1,0,0|1,0,1]=4 6424 B10R1.487 C#CC1(CCCCC1)O[13CH3] 7a_100011215672_200025704644 [1,0,0,1,0,0|1,0,1]=4 6425 B10R1.487 C=CC1(CCCCC1)OC 34a_200011934219_200000210301 [1,0,0,1,0,0|1,0,1]=4 6426 B10R1.487 C=CC1(CCCCC1)OC 7a_200011934219_200000210301 [1,0,0,1,0,0|1,0,1]=4 6427 B10R1.487 C=CC1(CCCCC1)O[13CH3] 34a_200011934219_200025704644 [1,0,0,1,0,0|1,0,1]=4 6428 B10R1.487 C=CC1(CCCCC1)O[13CH3] 7a_200011934219_200025704644 [1,0,0,1,0,0|1,0,1]=4 6429 B10R1.487 CCC1(CCCCC1)OC 34a_100011216009_200000210301 [1,0,0,1,0,0|1,0,0]=3 6430 B10R1.487 CCC1(CCCCC1)OC 7a_100011216009_200000210301 [1,0,0,1,0,0|1,0,0]=3 6431 B10R1.487 CCC1(CCCCC1)O[13CH3] 34a_100011216009_200025704644 [1,0,0,1,0,0|1,0,0]=3 6432 B10R1.487 CCC1(CCCCC1)O[13CH3] 7a_100011216009_200025704644 [1,0,0,1,0,0|1,0,0]=3 6433 B10R1.487 COC1(CCCCC1)CN 34a_100000748649_200000210301 [1,0,0,1,0,0|2,0,0]=4 6434 B10R1.487 [13CH3]OC1(CCCCC1)CN 34a_100000748649_200025704644 [1,0,0,1,0,0|2,0,0]=4 6435 B12R1.51 CC(CCBr)OCC1OCCO1 34a_100012276601_100000755774 [0,1,0,1,0,0|2,0,0]=4 6436 B12R1.51 CC(CCO)NCC1OCCO1 2230a_100000036311_100009893172 [0,1,0,1,0,0|2,0,0]=4 6437 B12R1.51 CC(CCO)NCC1OCCO1 34a_100000036311_100009893172 [0,1,0,1,0,0|2,0,0]=4 6438 B12R1.51 CC(CCO)OCC1OCCO1 34a_100000087154_100009893172 [0,1,0,1,0,0|2,0,0]=4 6439 B12R1.51 CC(CCO)SCC1OCCO1 62a_100000755774_100009893172 [0,1,0,1,0,0|2,0,0]=4 6440 B12R1.51 CC(CCO)SCC1OCCO1 62a_100009893172_100000755774 [0,1,0,1,0,0|2,0,0]=4 6441 B12R1.51 CCCC(=O)CCC1CCCO1 1458a_100011247709_100000210303 [0,1,0,1,0,0|1,0,1]=4 6442 B12R1.51 CCCC(=O)CCC1OCCO1 1458a_100000082924_100000210303 [0,1,0,1,0,0|0,0,1]=3 6443 B12R1.51 CCCC(=O)CCC1OCCO1 1458a_100000211992_100000740749 [0,1,0,1,0,0|0,0,1]=3 6444 B12R1.51 CCCC(=O)NCC1OCCO1 11a_100000036311_100000211992 [0,1,0,1,0,0|1,0,1]=4 6445 B12R1.51 CCCC(=O)NCC1OCCO1 1626a_100000036311_100000211992 [0,1,0,1,0,0|1,0,1]=4 6446 B12R1.51 CCCC(=O)NCC1OCCO1 527a_100000036311_100000211992 [0,1,0,1,0,0|1,0,1]=4 6447 B12R1.51 CCCC(C)COC1CCCO1 34a_100000085407_100011216630 [0,1,0,1,0,0|2,0,0]=4 6448 B12R1.51 CCCC(C)NCC1CCCO1 2230a_100000741246_100000203698 [0,1,0,1,0,0|2,0,0]=4 6449 B12R1.51 CCCC(C)NCC1OCCO1 2230a_100000036311_100000766640 [0,1,0,1,0,0|1,0,0]=3 6450 B12R1.51 CCCC(C)NCC1OCCO1 2230a_100000741246_100000755774 [0,1,0,1,0,0|1,0,0]=3 6451 B12R1.51 CCCC(C)NCC1OCCO1 270004a_100000036311_100000211909 [0,1,0,1,0,0|1,0,0]=3 6452 B12R1.51 CCCC(C)NCC1OCCO1 34a_100000036311_100000766640 [0,1,0,1,0,0|1,0,0]=3 6453 B12R1.51 CCCC(C)NC[C@@H]1CCCO1 2230a_100020590478_100000766640 [0,1,0,1,0,0|2,0,0]=4 6454 B12R1.51 CCCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100000211909 [0,1,0,1,0,0|2,0,0]=4 6455 B12R1.51 CCCC(C)NC[C@@H]1CCCO1 34a_100020590478_100000766640 [0,1,0,1,0,0|2,0,0]=4 6456 B12R1.51 CCCC(C)OCC1CCCO1 34a_100000210270_100000766640 [0,1,0,1,0,0|2,0,0]=4 6457 B12R1.51 CCCC(C)OCC1CCCO1 7a_100000210270_100000766640 [0,1,0,1,0,0|2,0,0]=4 6458 B12R1.51 CCCC(C)OCC1CCCO1 7a_100000764384_100000203698 [0,1,0,1,0,0|2,0,0]=4 6459 B12R1.51 CCCC(C)OCC1OCCO1 34a_100000087154_100000766640 [0,1,0,1,0,0|1,0,0]=3 6460 B12R1.51 CCCC(C)OCC1OCCO1 34a_100000764384_100000755774 [0,1,0,1,0,0|1,0,0]=3 6461 B12R1.51 CCCC(C)OCC1OCCO1 7a_100000764384_100000755774 [0,1,0,1,0,0|1,0,0]=3 6462 B12R1.51 CCCC(C)SCC1CCCO1 62a_100000203698_100000766640 [0,1,0,1,0,0|2,0,0]=4 6463 B12R1.51 CCCC(C)SCC1CCCO1 62a_100000766640_100000203698 [0,1,0,1,0,0|2,0,0]=4 6464 B12R1.51 CCCC(C)SCC1OCCO1 62a_100000755774_100000766640 [0,1,0,1,0,0|1,0,0]=3 6465 B12R1.51 CCCC(C)SCC1OCCO1 62a_100000766640_100000755774 [0,1,0,1,0,0|1,0,0]=3 6466 B12R1.51 CCCN(C)CCC1OCCO1 2230a_100000747261_100000740749 [0,1,0,1,0,0|1,0,0]=3 6467 B12R1.51 CCCN(C)CCC1OCCO1 269982a_100000747261_100000740749 [0,1,0,1,0,0|1,0,0]=3 6468 B12R1.51 CN(CCO)CCC1OCCO1 2230a_100000210263_100000740749 [0,1,0,1,0,0|2,0,0]=4 6469 B12R1.51 CN(CCO)CCC1OCCO1 269982a_100000210263_100000740749 [0,1,0,1,0,0|2,0,0]=4 6470 B12R1.51 COCC(=O)CCC1OCCO1 1458a_100000210968_100000740749 [0,1,0,1,0,0|1,0,1]=4 6471 B12R1.51 COCC(C)NCC1OCCO1 2230a_100000036311_100000765312 [0,1,0,1,0,0|2,0,0]=4 6472 B12R1.51 COCC(C)NCC1OCCO1 270004a_100000036311_100000749346 [0,1,0,1,0,0|2,0,0]=4 6473 B12R1.51 COCC(C)NCC1OCCO1 34a_100000036311_100000765312 [0,1,0,1,0,0|2,0,0]=4 6474 B12R1.51 COCC(C)OCC1OCCO1 34a_100000087154_100000765312 [0,1,0,1,0,0|2,0,0]=4 6475 B12R1.51 COCC(C)SCC1OCCO1 62a_100000755774_100000765312 [0,1,0,1,0,0|2,0,0]=4 6476 B12R1.51 COCC(C)SCC1OCCO1 62a_100000765312_100000755774 [0,1,0,1,0,0|2,0,0]=4 6477 B12R1.51 COC[C@@H](C)NCC1OCCO1 2230a_100000764878_100000755774 [0,1,0,1,0,0|2,0,0]=4 6478 B12R1.51 COC[C@@H](C)OCC1OCCO1 34a_100011934205_100000755774 [0,1,0,1,0,0|2,0,0]=4 6479 B12R1.51 CSCC(=O)CCC1OCCO1 1458a_100000184570_100000740749 [0,1,0,1,0,0|1,0,1]=4 6480 B12R1.51 CSCC(C)NCC1OCCO1 270004a_100000036311_100011216314 [0,1,0,1,0,0|2,0,0]=4 6481 B12R1.51 C[C@H](CCO)NCC1OCCO1 2230a_100000706166_100000755774 [0,1,0,1,0,0|2,0,0]=4 6482 B12R1.51 C[C@H](CCO)NCC1OCCO1 34a_100000706166_100000755774 [0,1,0,1,0,0|2,0,0]=4 6483 B12R1.51 O=C(CCF)CCC1OCCO1 1458a_100000082924_100011217306 [0,1,0,1,0,0|1,0,1]=4 6484 B12R1.51 O=C(CCO)CCC1OCCO1 1458a_100000082924_100000211926 [0,1,0,1,0,0|1,0,1]=4 6485 B12R1.51 O=C(CCO)CCC1OCCO1 1458a_100011216618_100000740749 [0,1,0,1,0,0|1,0,1]=4 6486 B12R1.246 C=C1CC(C1)NCC(OC)OC 2230a_100132301982_100000751394 [0,1,0,1,0,0|1,0,1]=4 6487 B12R1.246 C=C1CC(C1)NCC(OC)OC 270004a_100132301982_100000752162 [0,1,0,1,0,0|1,0,1]=4 6488 B12R1.246 COC(CCN1CC(C1)C)OC 2230a_100000702820_100009813347 [0,1,0,1,0,0|1,0,0]=3 6489 B12R1.246 COC(CCN1CC(C1)C)OC 269982a_100000702820_100000139399 [0,1,0,1,0,0|1,0,0]=3 6490 B12R1.246 COC(CCN1CC(C1)C)OC 34a_100000702820_100000139399 [0,1,0,1,0,0|1,0,0]=3 6491 B12R1.246 COC(CCN1CC(C1)F)OC 2230a_100000690557_100009813347 [0,1,0,1,0,0|1,0,0]=3 6492 B12R1.246 COC(CCN1CC(C1)F)OC 269982a_100000690557_100000139399 [0,1,0,1,0,0|1,0,0]=3 6493 B12R1.246 COC(CCN1CC(C1)F)OC 34a_100000690557_100000139399 [0,1,0,1,0,0|1,0,0]=3 6494 B12R1.246 COC(CCN1CC(C1)O)OC 269982a_100000749847_100000139399 [0,1,0,1,0,0|1,0,0]=3 6495 B12R1.246 COC(CNC1CC(C1)F)OC 2230a_100016993743_100000751394 [0,1,0,1,0,0|1,0,0]=3 6496 B12R1.246 COC(CNC1CC(C1)F)OC 270004a_100016993743_100000752162 [0,1,0,1,0,0|1,0,0]=3 6497 B12R1.246 COC(CNC1CN(C1)C)OC 270004a_100015196640_100000752162 [0,1,0,1,0,0|2,0,0]=4 6498 B12R1.246 COC(CN[C@H]1C[C@@H](C1)O)OC 2230a_100020629032_100000751394 [0,1,0,1,0,0|1,0,0]=3 6499 B12R1.246 COC(CN[C@H]1C[C@@H](C1)O)OC 270004a_100020629032_100000752162 [0,1,0,1,0,0|1,0,0]=3 6500 B12R1.246 COC(CSC1CC(=O)C1)OC 62a_100009894365_100000751394 [0,1,0,1,0,0|1,0,1]=4 6501 B12R1.251 CCC(CC)CN1CCC[C@@H]1C 2230a_100020605311_100011215472 [0,1,0,1,0,0|2,0,0]=4 6502 B12R1.251 CCC(CC)CN1CCC[C@@H]1C 269982a_100020605311_100011215472 [0,1,0,1,0,0|2,0,0]=4 6503 B12R1.251 CCC(CC)CN1CCC[C@@H]1C 270004a_100020605311_100000211137 [0,1,0,1,0,0|2,0,0]=4 6504 B12R1.251 CCC(CC)CN1CCC[C@H]1C 2230a_100015189458_100011215472 [0,1,0,1,0,0|2,0,0]=4 6505 B12R1.251 CCC(CC)CN1CCC[C@H]1C 269982a_100015189458_100011215472 [0,1,0,1,0,0|2,0,0]=4 6506 B12R1.251 CCC(CC)CN1CCC[C@H]1C 270004a_100015189458_100000211137 [0,1,0,1,0,0|2,0,0]=4 6507 B12R1.251 CCC(CC)CN1CCC[C@H]1C 34a_100015189458_100011215472 [0,1,0,1,0,0|2,0,0]=4 6508 B12R1.251 CCC(CC)NC1CCCC1C 269862a_100000199018_100000752053 [0,1,0,1,0,0|2,0,0]=4 6509 B12R1.251 CCC(CC)OC1CCCC1C 7a_100011216460_100000210505 [0,1,0,1,0,0|2,0,0]=4 6510 B12R1.251 COC(CN1CCC[C@@H]1C)OC 2230a_100020605311_100000751394 [0,1,0,1,0,0|0,0,0]=2 6511 B12R1.251 COC(CN1CCC[C@@H]1C)OC 270004a_100020605311_100000752162 [0,1,0,1,0,0|0,0,0]=2 6512 B12R1.251 COC(CN1CCC[C@H]1C)OC 2230a_100015189458_100000751394 [0,1,0,1,0,0|0,0,0]=2 6513 B12R1.251 COC(CN1CCC[C@H]1C)OC 270004a_100015189458_100000752162 [0,1,0,1,0,0|0,0,0]=2 6514 B12R1.251 COC(CN1CCC[C@H]1C)OC 34a_100015189458_100000211822 [0,1,0,1,0,0|0,0,0]=2 6515 B12R1.251 COC(CN1CCSC1C)OC 2230a_200011216479_100000751394 [0,1,0,1,0,0|1,0,0]=3 6516 B12R1.251 COC(CN1CCSC1C)OC 270004a_200011216479_100000752162 [0,1,0,1,0,0|1,0,0]=3 6517 B12R1.251 COC(CN1CCSC1C)OC 34a_200011216479_100000211822 [0,1,0,1,0,0|1,0,0]=3 6518 B12R1.288 CCCN1CC[C@H]([C@@H](C1)O)OC 2230a_200015396376_100000210303 [0,1,0,1,0,0|2,0,0]=4 6519 B12R1.288 CCCN1CC[C@H]([C@@H](C1)O)OC 269982a_200015396376_100000210303 [0,1,0,1,0,0|2,0,0]=4 6520 B12R1.297 CCC(CC)CNC1CCCC1 2230a_100000211070_100011215472 [0,1,0,1,0,0|2,0,0]=4 6521 B12R1.297 CCC(CC)CNC1CCCC1 2230a_100102946423_100000179811 [0,1,0,1,0,0|2,0,0]=4 6522 B12R1.297 CCC(CC)CNC1CCCC1 269862a_100000211070_100000211137 [0,1,0,1,0,0|2,0,0]=4 6523 B12R1.297 CCC(CC)CNC1CCCC1 270004a_100000211070_100000211137 [0,1,0,1,0,0|2,0,0]=4 6524 B12R1.297 CCC(CC)CNC1CCCC1 270004a_100102946423_100000210133 [0,1,0,1,0,0|2,0,0]=4 6525 B12R1.297 CCC(CC)CNC1CCCC1 34a_100000211070_100011215472 [0,1,0,1,0,0|2,0,0]=4 6526 B12R1.297 CCC(CC)COC1CCCC1 34a_100000210269_100011215472 [0,1,0,1,0,0|2,0,0]=4 6527 B12R1.297 CCC(CC)COC1CCCC1 7a_100000210269_100011215472 [0,1,0,1,0,0|2,0,0]=4 6528 B12R1.297 CCC(CC)COC1CCCC1 7a_100000703878_100000179811 [0,1,0,1,0,0|2,0,0]=4 6529 B12R1.297 CCC(CC)CSC1CCCC1 62a_100011215472_100000179811 [0,1,0,1,0,0|2,0,0]=4 6530 B12R1.297 CCC(CC)CSC1CCCC1 62a_100011217020_100011215472 [0,1,0,1,0,0|2,0,0]=4 6531 B12R1.297 CCC(CC)NCC1CCCC1 2230a_100000199018_100000740388 [0,1,0,1,0,0|2,0,0]=4 6532 B12R1.297 CCC(CC)NCC1CCCC1 269862a_100000199018_100000746403 [0,1,0,1,0,0|2,0,0]=4 6533 B12R1.297 CCC(CC)NCC1CCCC1 270004a_100000737975_100000210860 [0,1,0,1,0,0|2,0,0]=4 6534 B12R1.297 CCC(CC)OCC1CCCC1 7a_100000688536_100000740388 [0,1,0,1,0,0|2,0,0]=4 6535 B12R1.297 CCC(CC)OCC1CCCC1 7a_100000742336_100000210505 [0,1,0,1,0,0|2,0,0]=4 6536 B12R1.297 CCC(CC)SCC1CCCC1 62a_100000210505_100000740388 [0,1,0,1,0,0|2,0,0]=4 6537 B12R1.297 CCC(CC)SCC1CCCC1 62a_100000740388_100000210505 [0,1,0,1,0,0|2,0,0]=4 6538 B12R1.297 CCC(CNC1CCCC1)OC 270004a_100000731041_100000210133 [0,1,0,1,0,0|1,0,0]=3 6539 B12R1.297 CCC(CNC1CCOC1)OC 270004a_100000731041_100000752484 [0,1,0,1,0,0|2,0,0]=4 6540 B12R1.297 CCC(CNC1CCSC1)OC 270004a_100000731041_100000212027 [0,1,0,1,0,0|2,0,0]=4 6541 B12R1.297 CCC(COC1CCCC1)OC 34a_100011934954_100000179811 [0,1,0,1,0,0|1,0,0]=3 6542 B12R1.297 CCC(COC1CCCC1)OC 7a_100011934954_100000179811 [0,1,0,1,0,0|1,0,0]=3 6543 B12R1.297 CCC(COC1CCOC1)OC 34a_100011934954_100000690089 [0,1,0,1,0,0|2,0,0]=4 6544 B12R1.297 CCC(COC1CCOC1)OC 7a_100011934954_100000731011 [0,1,0,1,0,0|2,0,0]=4 6545 B12R1.297 COC(CCN1CC=CC1)OC 269982a_100015195280_100000139399 [0,1,0,1,0,0|0,0,2]=4 6546 B12R1.297 COC(CCN1CCCC1)OC 2230a_100000188435_100009813347 [0,1,0,1,0,0|0,0,0]=2 6547 B12R1.297 COC(CCN1CCCC1)OC 269982a_100000188435_100000139399 [0,1,0,1,0,0|0,0,0]=2 6548 B12R1.297 COC(CCN1CCSC1)OC 2230a_100011215254_100009813347 [0,1,0,1,0,0|1,0,0]=3 6549 B12R1.297 COC(CCN1CCSC1)OC 269982a_100011215254_100000139399 [0,1,0,1,0,0|1,0,0]=3 6550 B12R1.297 COC(CNC1CC=CC1)OC 2230a_100015188752_100000751394 [0,1,0,1,0,0|0,0,2]=4 6551 B12R1.297 COC(CNC1CC=CC1)OC 270004a_100015188752_100000752162 [0,1,0,1,0,0|0,0,2]=4 6552 B12R1.297 COC(CNC1CCCC1)OC 2230a_100000211070_100000751394 [0,1,0,1,0,0|0,0,0]=2 6553 B12R1.297 COC(CNC1CCCC1)OC 270004a_100000210479_100000210133 [0,1,0,1,0,0|0,0,0]=2 6554 B12R1.297 COC(CNC1CCCC1)OC 270004a_100000211070_100000752162 [0,1,0,1,0,0|0,0,0]=2 6555 B12R1.297 COC(CNC1CCCC1)OC 34a_100000211070_100000211822 [0,1,0,1,0,0|0,0,0]=2 6556 B12R1.297 COC(CNC1CCOC1)OC 270004a_100000210479_100000752484 [0,1,0,1,0,0|1,0,0]=3 6557 B12R1.297 COC(CNC1CCSC1)OC 270004a_100000210479_100000212027 [0,1,0,1,0,0|1,0,0]=3 6558 B12R1.297 COC(CN[C@@H]1CCOC1)OC 2230a_200015188469_100000751394 [0,1,0,1,0,0|1,0,0]=3 6559 B12R1.297 COC(CN[C@@H]1CCOC1)OC 270004a_200015188469_100000752162 [0,1,0,1,0,0|1,0,0]=3 6560 B12R1.297 COC(CN[C@H]1CCOC1)OC 2230a_100015188467_100000751394 [0,1,0,1,0,0|1,0,0]=3 6561 B12R1.297 COC(CN[C@H]1CCOC1)OC 270004a_100015188467_100000752162 [0,1,0,1,0,0|1,0,0]=3 6562 B12R1.297 COC(CN[C@H]1CCOC1)OC 34a_100015188467_100000211822 [0,1,0,1,0,0|1,0,0]=3 6563 B12R1.297 COC(COC1CCCC1)OC 34a_100000210269_100000211822 [0,1,0,1,0,0|0,0,0]=2 6564 B12R1.297 COC(COC1CCCC1)OC 34a_100011216393_100000179811 [0,1,0,1,0,0|0,0,0]=2 6565 B12R1.297 COC(COC1CCCC1)OC 7a_100000210269_100000751394 [0,1,0,1,0,0|0,0,0]=2 6566 B12R1.297 COC(COC1CCCO1)OC 34a_100000085407_100000211822 [0,1,0,1,0,0|1,0,0]=3 6567 B12R1.297 COC(COC1CCOC1)OC 34a_100011216393_100000690089 [0,1,0,1,0,0|1,0,0]=3 6568 B12R1.297 COC(COC1CCSC1)OC 7a_100011232664_100000751394 [0,1,0,1,0,0|1,0,0]=3 6569 B12R1.297 COC(CO[C@H]1CCOC1)OC 34a_100000717292_100000211822 [0,1,0,1,0,0|1,0,0]=3 6570 B12R1.297 COC(CSC1CCCC1)OC 62a_100000751394_100000179811 [0,1,0,1,0,0|0,0,0]=2 6571 B12R1.297 COC(CSC1CCCC1)OC 62a_100011217020_100000751394 [0,1,0,1,0,0|0,0,0]=2 6572 B12R1.297 COC(CSC1CCOC1)OC 62a_100000751394_100000690089 [0,1,0,1,0,0|1,0,0]=3 6573 B12R1.312 CCCC(C)N1CC[C@H](C1)OC 2230a_100000766984_100000766640 [0,1,0,1,0,0|2,0,0]=4 6574 B12R1.312 CCCC(C)N1CC[C@H](C1)OC 269982a_100000766984_100000766640 [0,1,0,1,0,0|2,0,0]=4 6575 B12R1.312 CCCC(C)N1CC[C@H](C1)OC 270004a_100000766984_100000211909 [0,1,0,1,0,0|2,0,0]=4 6576 B12R1.1128 CCCN1CCC(C1)(OC)OC 2230a_100025715670_100000210303 [0,1,0,1,0,0|1,0,0]=3 6577 B12R1.1128 CCCN1CCC(C1)(OC)OC 269982a_100025715670_100000210303 [0,1,0,1,0,0|1,0,0]=3 6578 B12R1.1128 COC1(CCN(C1)CCF)OC 2230a_100025715670_100011217306 [0,1,0,1,0,0|2,0,0]=4 6579 B12R1.1128 COC1(CCN(C1)CCF)OC 269982a_100025715670_100011217306 [0,1,0,1,0,0|2,0,0]=4 6580 B12R1.1128 COC1(CCN(C1)CCO)OC 2230a_100025715670_100000211926 [0,1,0,1,0,0|2,0,0]=4 6581 B12R1.1128 COC1(CCN(C1)CCO)OC 269982a_100025715670_100000211926 [0,1,0,1,0,0|2,0,0]=4 6582 B12R1.1128 COC1(CCN(C1)CSC)OC 2230a_100025715670_100011218213 [0,1,0,1,0,0|2,0,0]=4 6583 B12R1.1128 COC1(CCN(C1)CSC)OC 269982a_100025715670_100011218213 [0,1,0,1,0,0|2,0,0]=4 6584 B12R1.1128 COCN1CCC(C1)(OC)OC 2230a_100025715670_100000766300 [0,1,0,1,0,0|2,0,0]=4 6585 B12R1.1128 COCN1CCC(C1)(OC)OC 269982a_100025715670_100000766300 [0,1,0,1,0,0|2,0,0]=4 6586 B12R1.1143 CCC1CCCN(CC1)COC 2230a_100000757272_100000766300 [0,1,0,1,0,0|2,0,0]=4 6587 B12R1.1143 CCC1CCCN(CC1)COC 269982a_100000757272_100000766300 [0,1,0,1,0,0|2,0,0]=4 6588 B12R1.1143 CCCN1CCCC(CC1)CC 2230a_100000757272_100000210303 [0,1,0,1,0,0|2,0,0]=4 6589 B12R1.1143 CCCN1CCCC(CC1)CC 269982a_100000757272_100000210303 [0,1,0,1,0,0|2,0,0]=4 6590 B12R1.1143 CCCN1CCCC(CC1)CC 34a_100000757272_100000210303 [0,1,0,1,0,0|2,0,0]=4 6591 B12R1.1143 CCCN1CCCC(CC1)OC 2230a_100016993962_100000210303 [0,1,0,1,0,0|1,0,0]=3 6592 B12R1.1143 CCCN1CCCC(CC1)OC 269982a_100016993962_100000210303 [0,1,0,1,0,0|1,0,0]=3 6593 B12R1.1143 CCCN1CCCC(CC1)OC 34a_100016993962_100000210303 [0,1,0,1,0,0|1,0,0]=3 6594 B12R1.1143 COC1CCCN(CC1)CCF 2230a_100016993962_100011217306 [0,1,0,1,0,0|2,0,0]=4 6595 B12R1.1143 COC1CCCN(CC1)CCF 269982a_100016993962_100011217306 [0,1,0,1,0,0|2,0,0]=4 6596 B12R1.1143 COC1CCCN(CC1)CCF 34a_100016993962_100011217306 [0,1,0,1,0,0|2,0,0]=4 6597 B12R1.1143 COC1CCCN(CC1)CCO 2230a_100016993962_100000211926 [0,1,0,1,0,0|2,0,0]=4 6598 B12R1.1143 COC1CCCN(CC1)CCO 269982a_100016993962_100000211926 [0,1,0,1,0,0|2,0,0]=4 6599 B12R1.1143 COC1CCCN(CC1)CCO 34a_100016993962_100000211926 [0,1,0,1,0,0|2,0,0]=4 6600 B12R1.1143 COC1CCCN(CC1)CSC 2230a_100016993962_100011218213 [0,1,0,1,0,0|2,0,0]=4 6601 B12R1.1143 COC1CCCN(CC1)CSC 269982a_100016993962_100011218213 [0,1,0,1,0,0|2,0,0]=4 6602 B12R1.1143 COC1CCCN(CC1)CSC 34a_100016993962_100011218213 [0,1,0,1,0,0|2,0,0]=4 6603 B12R1.1143 COCN1CCCC(CC1)OC 2230a_100016993962_100000766300 [0,1,0,1,0,0|2,0,0]=4 6604 B12R1.1143 COCN1CCCC(CC1)OC 269982a_100016993962_100000766300 [0,1,0,1,0,0|2,0,0]=4 6605 B12R1.1294 COC(CNC1(CCC1)C)OC 2230a_100000692455_100000751394 [0,1,0,1,0,0|1,0,0]=3 6606 B12R1.1294 COC(CNC1(CCC1)C)OC 270004a_100000692455_100000752162 [0,1,0,1,0,0|1,0,0]=3 6607 B12R1.1294 COC(CNC1(CCC1)C)OC 34a_100000692455_100000211822 [0,1,0,1,0,0|1,0,0]=3 6608 B12R1.1294 COC(CNC1(COC1)C)OC 2230a_100000732644_100000751394 [0,1,0,1,0,0|2,0,0]=4 6609 B12R1.1294 COC(CNC1(COC1)C)OC 270004a_100000732644_100000752162 [0,1,0,1,0,0|2,0,0]=4 6610 B12R1.1294 COC(COC1(CCC1)C)OC 34a_100000759064_100000211822 [0,1,0,1,0,0|1,0,0]=3 6611 B12R1.1294 COC(COC1(CCC1)C)OC 7a_100000759064_100000751394 [0,1,0,1,0,0|1,0,0]=3 6612 B12R1.1294 COC(COC1(CSC1)C)OC 7a_100016018533_100000751394 [0,1,0,1,0,0|2,0,0]=4 6613 B12R1.1538 CCC(CNC(C)C1CC1)OC 269862a_100000731041_100000210639 [0,1,0,1,0,0|2,0,0]=4 6614 B12R1.1538 COC(CCC(=O)C1CC1)OC 1458a_100000210395_100000139399 [0,1,0,1,0,0|0,0,1]=3 6615 B12R1.1538 COC(CCC(=O)C1CO1)OC 1458a_100000701028_100000139399 [0,1,0,1,0,0|1,0,1]=4 6616 B12R1.1538 COC(CCN(C)C1CC1)OC 2230a_100000226674_100009813347 [0,1,0,1,0,0|1,0,0]=3 6617 B12R1.1538 COC(CCN(C)C1CC1)OC 269982a_100000226674_100000139399 [0,1,0,1,0,0|1,0,0]=3 6618 B12R1.1538 COC(CNC(=O)C1CC1)OC 11a_100000210479_100000210395 [0,1,0,1,0,0|1,0,1]=4 6619 B12R1.1538 COC(CNC(=O)C1CC1)OC 1626a_100000210479_100000210395 [0,1,0,1,0,0|1,0,1]=4 6620 B12R1.1538 COC(CNC(=O)C1CC1)OC 240690a_100000210479_100000210395 [0,1,0,1,0,0|1,0,1]=4 6621 B12R1.1538 COC(CNC(=O)C1CC1)OC 527a_100000210479_100000210395 [0,1,0,1,0,0|1,0,1]=4 6622 B12R1.1538 COC(CNC(C)C1CC1)OC 2230a_100000700016_100000751394 [0,1,0,1,0,0|1,0,0]=3 6623 B12R1.1538 COC(CNC(C)C1CC1)OC 270004a_100000700016_100000752162 [0,1,0,1,0,0|1,0,0]=3 6624 B12R1.1538 COC(CNC(C)C1CC1)OC 34a_100000700016_100000211822 [0,1,0,1,0,0|1,0,0]=3 6625 B12R1.1538 COC(CNC(C)C1CO1)OC 270004a_100000210479_100000031964 [0,1,0,1,0,0|2,0,0]=4 6626 B12R1.1538 COC(COC(C)C1CC1)OC 34a_100000744524_100000211822 [0,1,0,1,0,0|1,0,0]=3 6627 B12R1.1538 COC(COC(C)C1CC1)OC 7a_100000744524_100000751394 [0,1,0,1,0,0|1,0,0]=3 6628 B12R1.3402 CCCC(C)OCC1(CO1)CC 34a_100000764384_200000139556 [0,1,0,1,0,0|2,0,0]=4 6629 B12R1.3402 CCCC(C)OCC1(CO1)CC 7a_100000764384_200000139556 [0,1,0,1,0,0|2,0,0]=4 6630 B12R1.3402 CCCC(C)SCC1(CO1)CC 62a_100000766640_200000139556 [0,1,0,1,0,0|2,0,0]=4 6631 B12R1.3402 CCCC(C)SCC1(CO1)CC 62a_200000139556_100000766640 [0,1,0,1,0,0|2,0,0]=4 6632 B12R1.4 COC1CCC(CC1)CC(=O)C 1458a_100000070787_100013032858 [0,1,0,1,0,0|1,0,1]=4 6633 B12R1.4 COC1CCC(CC1)CN(C)C 2230a_100102631434_100013032858 [0,1,0,1,0,0|2,0,0]=4 6634 B12R1.4 COC1CCC(CC1)CN(C)C 269982a_100102631434_100013032858 [0,1,0,1,0,0|2,0,0]=4 6635 B12R1.4 COC1CCC(CC1)NC(C)C 34a_100015205214_100000210206 [0,1,0,1,0,0|2,0,0]=4 6636 B12R1.4 COC1CCC(CC1)OC(C)C 34a_100011581665_100000210206 [0,1,0,1,0,0|2,0,0]=4 6637 B12R1.4 COC1CCC(CC1)OC(C)C 7a_100011581665_100000210206 [0,1,0,1,0,0|2,0,0]=4 6638 B12R1.4 COC1CCN(CC1)CC(C)C 2230a_100000234800_100000210760 [0,1,0,1,0,0|2,0,0]=4 6639 B12R1.4 COC1CCN(CC1)CC(C)C 269982a_100000234800_100000210624 [0,1,0,1,0,0|2,0,0]=4 6640 B12R1.4 COC1CCN(CC1)CC(C)C 270004a_100000234800_100000210432 [0,1,0,1,0,0|2,0,0]=4 6641 B12R1.4 COC1CCN(CC1)CC(C)C 34a_100000234800_100000210624 [0,1,0,1,0,0|2,0,0]=4 6642 B12R1.4 COC1CCN(CC1)CC(C)O 2230a_100000234800_100011218427 [0,1,0,1,0,0|2,0,0]=4 6643 B12R1.4 COC1CCN(CC1)CC(C)O 269982a_100000234800_100011218427 [0,1,0,1,0,0|2,0,0]=4 6644 B12R1.4 COC1CCN(CC1)CC(C)O 34a_100000234800_100011218427 [0,1,0,1,0,0|2,0,0]=4 6645 B12R1.4 COC1CCN(CC1)C[C@@H](C)O 2230a_100000234800_100009817552 [0,1,0,1,0,0|2,0,0]=4 6646 B12R1.4 COC1CCN(CC1)C[C@@H](C)O 269982a_100000234800_100009817552 [0,1,0,1,0,0|2,0,0]=4 6647 B12R1.4 COC1CCN(CC1)C[C@@H](C)O 34a_100000234800_100009817552 [0,1,0,1,0,0|2,0,0]=4 6648 B12R1.59 CO[C@@H]1CCN(C1)CCC(C)C 2230a_100000766984_100000210312 [0,1,0,1,0,0|2,0,0]=4 6649 B12R1.59 CO[C@@H]1CCN(C1)CCC(C)C 269982a_100000766984_100000210312 [0,1,0,1,0,0|2,0,0]=4 6650 B12R1.59 CO[C@@H]1CCN(C1)CCC(C)O 2230a_100000766984_100012276601 [0,1,0,1,0,0|2,0,0]=4 6651 B12R1.59 CO[C@@H]1CCN(C1)CCC(C)O 269982a_100000766984_100012276601 [0,1,0,1,0,0|2,0,0]=4 6652 B12R1.117 COC(CN1CCC(C1)O)OC 2230a_100011215560_100000751394 [0,1,0,1,0,0|1,0,0]=3 6653 B12R1.117 COC(CN1CCC(C1)O)OC 270004a_100011215560_100000752162 [0,1,0,1,0,0|1,0,0]=3 6654 B12R1.117 COC(CN1CC[C@@H](C1)F)OC 2230a_100015203821_100000751394 [0,1,0,1,0,0|1,0,0]=3 6655 B12R1.117 COC(CN1CC[C@@H](C1)F)OC 270004a_100015203821_100000752162 [0,1,0,1,0,0|1,0,0]=3 6656 B12R1.117 COC(CN1CC[C@@H](C1)F)OC 34a_100015203821_100000211822 [0,1,0,1,0,0|1,0,0]=3 6657 B12R1.117 COC(CN1CC[C@H](C1)C)OC 2230a_100016987628_100000751394 [0,1,0,1,0,0|1,0,0]=3 6658 B12R1.117 COC(CN1CC[C@H](C1)C)OC 270004a_100016987628_100000752162 [0,1,0,1,0,0|1,0,0]=3 6659 B12R1.117 COC(CN1CC[C@H](C1)C)OC 34a_100016987628_100000211822 [0,1,0,1,0,0|1,0,0]=3 6660 B12R1.244 CCC(CC)CNCCC1CC1 2230a_100102946423_100000694398 [0,1,0,1,0,0|2,0,0]=4 6661 B12R1.244 CCC(CC)CNCCC1CC1 269862a_100000764129_100000211137 [0,1,0,1,0,0|2,0,0]=4 6662 B12R1.244 CCC(CC)CNCCC1CC1 270004a_100000764129_100000211137 [0,1,0,1,0,0|2,0,0]=4 6663 B12R1.244 CCC(CC)CNCCC1CC1 34a_100000764129_100011215472 [0,1,0,1,0,0|2,0,0]=4 6664 B12R1.244 CCC(CC)COCCC1CC1 34a_100000754188_100011215472 [0,1,0,1,0,0|2,0,0]=4 6665 B12R1.244 CCC(CC)COCCC1CC1 7a_100000703878_100000764125 [0,1,0,1,0,0|2,0,0]=4 6666 B12R1.244 CCC(CC)COCCC1CC1 7a_100000754188_100011215472 [0,1,0,1,0,0|2,0,0]=4 6667 B12R1.244 CCC(CC)CSCCC1CC1 62a_100000764125_100011215472 [0,1,0,1,0,0|2,0,0]=4 6668 B12R1.244 CCC(CC)CSCCC1CC1 62a_100011215472_100000764125 [0,1,0,1,0,0|2,0,0]=4 6669 B12R1.244 CCC(COCCC1CC1)OC 34a_100011934954_100000694398 [0,1,0,1,0,0|1,0,0]=3 6670 B12R1.244 CCC(COCCC1CC1)OC 7a_100011934954_100000764125 [0,1,0,1,0,0|1,0,0]=3 6671 B12R1.244 CCC(COCCC1CO1)OC 34a_100011934954_100000732470 [0,1,0,1,0,0|2,0,0]=4 6672 B12R1.244 CCC(COCCC1CO1)OC 7a_100011934954_100000732470 [0,1,0,1,0,0|2,0,0]=4 6673 B12R1.244 COC(C=NNCC1CC1)OC 4a_100000736359_100000752162 [0,1,0,1,0,0|1,0,1]=4 6674 B12R1.244 COC(CCCNC1CC1)OC 34a_100000212008_100000069011 [0,1,0,1,0,0|0,0,0]=2 6675 B12R1.244 COC(CCCSC1CC1)OC 62a_100000069011_100000211595 [0,1,0,1,0,0|0,0,0]=2 6676 B12R1.244 COC(CCNCC1CC1)OC 2230a_100000735609_100009813347 [0,1,0,1,0,0|0,0,0]=2 6677 B12R1.244 COC(CCNCC1CC1)OC 34a_100000735609_100000139399 [0,1,0,1,0,0|0,0,0]=2 6678 B12R1.244 COC(CCOCC1CC1)OC 34a_100000211283_100000139399 [0,1,0,1,0,0|0,0,0]=2 6679 B12R1.244 COC(CCOC[C@@H]1CO1)OC 34a_100000757423_100000139399 [0,1,0,1,0,0|1,0,0]=3 6680 B12R1.244 COC(CCSCC1CC1)OC 62a_100000139399_100000742324 [0,1,0,1,0,0|0,0,0]=2 6681 B12R1.244 COC(CCSCC1CC1)OC 62a_100000756562_100000139399 [0,1,0,1,0,0|0,0,0]=2 6682 B12R1.244 COC(CCSCC1CO1)OC 62a_100000139399_102125554688 [0,1,0,1,0,0|1,0,0]=3 6683 B12R1.244 COC(CCSCC1CO1)OC 62a_102125554688_100000139399 [0,1,0,1,0,0|1,0,0]=3 6684 B12R1.244 COC(CCSCC1CS1)OC 62a_100000031435_100000139399 [0,1,0,1,0,0|1,0,0]=3 6685 B12R1.244 COC(CCSCC1CS1)OC 62a_100000139399_100000031435 [0,1,0,1,0,0|1,0,0]=3 6686 B12R1.244 COC(CCSC[C@@H]1CO1)OC 62a_100000139399_100000745022 [0,1,0,1,0,0|1,0,0]=3 6687 B12R1.244 COC(CCSC[C@@H]1CO1)OC 62a_100000745022_100000139399 [0,1,0,1,0,0|1,0,0]=3 6688 B12R1.244 COC(CNCCC1CC1)OC 270004a_100000764129_100000752162 [0,1,0,1,0,0|0,0,0]=2 6689 B12R1.244 COC(CNCCC1CC1)OC 34a_100000764129_100000211822 [0,1,0,1,0,0|0,0,0]=2 6690 B12R1.244 COC(COCCC1CC1)OC 34a_100000754188_100000211822 [0,1,0,1,0,0|0,0,0]=2 6691 B12R1.244 COC(COCCC1CC1)OC 34a_100011216393_100000694398 [0,1,0,1,0,0|0,0,0]=2 6692 B12R1.244 COC(COCCC1CC1)OC 7a_100000754188_100000751394 [0,1,0,1,0,0|0,0,0]=2 6693 B12R1.244 COC(COCCC1CO1)OC 34a_100011216393_100000732470 [0,1,0,1,0,0|1,0,0]=3 6694 B12R1.244 COC(COCC[C@@H]1CO1)OC 34a_100009820653_100000211822 [0,1,0,1,0,0|1,0,0]=3 6695 B12R1.244 COC(CSCCC1CC1)OC 62a_100000751394_100000764125 [0,1,0,1,0,0|0,0,0]=2 6696 B12R1.244 COC(CSCCC1CC1)OC 62a_100000764125_100000751394 [0,1,0,1,0,0|0,0,0]=2 6697 B12R1.244 COC(CSCCC1CO1)OC 62a_100000732470_100000751394 [0,1,0,1,0,0|1,0,0]=3 6698 B12R1.244 COC(CSCCC1CO1)OC 62a_100000751394_100000732470 [0,1,0,1,0,0|1,0,0]=3 6699 B12R1.255 C=C(C)CCNCC1OCCO1 2230a_100000036311_100000730704 [0,1,0,1,0,0|1,0,1]=4 6700 B12R1.255 C=C(C)CCNCC1OCCO1 34a_100000036311_100000730704 [0,1,0,1,0,0|1,0,1]=4 6701 B12R1.255 C=C(C)CCOCC1OCCO1 34a_100000087154_100000730704 [0,1,0,1,0,0|1,0,1]=4 6702 B12R1.255 C=C(C)CCOCC1OCCO1 34a_100000764851_100000755774 [0,1,0,1,0,0|1,0,1]=4 6703 B12R1.255 C=C(C)CCSCC1OCCO1 62a_100000730704_100000755774 [0,1,0,1,0,0|1,0,1]=4 6704 B12R1.255 C=C(C)CCSCC1OCCO1 62a_100000755774_100000730704 [0,1,0,1,0,0|1,0,1]=4 6705 B12R1.255 C=C(C)CNCCC1OCCO1 2230a_100000034215_100000748629 [0,1,0,1,0,0|1,0,1]=4 6706 B12R1.255 C=C(C)CNCCC1OCCO1 34a_100000034215_100000748629 [0,1,0,1,0,0|1,0,1]=4 6707 B12R1.255 C=C(C)COCCC1OCCO1 34a_100000210245_100000740749 [0,1,0,1,0,0|1,0,1]=4 6708 B12R1.255 C=C(C)CSCCC1OCCO1 62a_100000748629_100000740749 [0,1,0,1,0,0|1,0,1]=4 6709 B12R1.255 CC(=O)CCCCC1OCCO1 1458a_100000070787_100000034956 [0,1,0,1,0,0|0,0,1]=3 6710 B12R1.255 CC(=O)CCOCC1OCCO1 34a_100000759926_100000755774 [0,1,0,1,0,0|1,0,1]=4 6711 B12R1.255 CC(=O)CCOCC1OCCO1 7a_100000759926_100000755774 [0,1,0,1,0,0|1,0,1]=4 6712 B12R1.255 CC(=O)CCSCC1OCCO1 62a_100000053229_100000755774 [0,1,0,1,0,0|1,0,1]=4 6713 B12R1.255 CC(=O)CCSCC1OCCO1 62a_100000755774_100000053229 [0,1,0,1,0,0|1,0,1]=4 6714 B12R1.255 CC(=O)COCCC1OCCO1 34a_100000211253_100000740749 [0,1,0,1,0,0|1,0,1]=4 6715 B12R1.255 CC(Br)CCOCC1OCCO1 34a_100009893172_100000755774 [0,1,0,1,0,0|1,0,0]=3 6716 B12R1.255 CC(Br)COCCC1OCCO1 34a_100012180447_100000740749 [0,1,0,1,0,0|1,0,0]=3 6717 B12R1.255 CC(C)CCCOC1CCCO1 34a_100000085407_100011214892 [0,1,0,1,0,0|2,0,0]=4 6718 B12R1.255 CC(C)CCNCC1OCCO1 2230a_100000036311_100000210312 [0,1,0,1,0,0|1,0,0]=3 6719 B12R1.255 CC(C)CCNCC1OCCO1 34a_100000036311_100000210312 [0,1,0,1,0,0|1,0,0]=3 6720 B12R1.255 CC(C)CCNC[C@@H]1CCCO1 2230a_100020590478_100000210312 [0,1,0,1,0,0|2,0,0]=4 6721 B12R1.255 CC(C)CCNC[C@@H]1CCCO1 269862a_100020590478_100000185833 [0,1,0,1,0,0|2,0,0]=4 6722 B12R1.255 CC(C)CCNC[C@@H]1CCCO1 34a_100020590478_100000210312 [0,1,0,1,0,0|2,0,0]=4 6723 B12R1.255 CC(C)CCOCC1CCCO1 34a_100000210270_100000210312 [0,1,0,1,0,0|2,0,0]=4 6724 B12R1.255 CC(C)CCOCC1CCCO1 7a_100000210254_100000203698 [0,1,0,1,0,0|2,0,0]=4 6725 B12R1.255 CC(C)CCOCC1CCCO1 7a_100000210270_100000210626 [0,1,0,1,0,0|2,0,0]=4 6726 B12R1.255 CC(C)CCOCC1OCCO1 34a_100000087154_100000210312 [0,1,0,1,0,0|1,0,0]=3 6727 B12R1.255 CC(C)CCOCC1OCCO1 34a_100000210254_100000755774 [0,1,0,1,0,0|1,0,0]=3 6728 B12R1.255 CC(C)CCOCC1OCCO1 7a_100000210254_100000755774 [0,1,0,1,0,0|1,0,0]=3 6729 B12R1.255 CC(C)CCSCC1CCCO1 62a_100000203698_100000210312 [0,1,0,1,0,0|2,0,0]=4 6730 B12R1.255 CC(C)CCSCC1CCCO1 62a_100000210312_100000203698 [0,1,0,1,0,0|2,0,0]=4 6731 B12R1.255 CC(C)CCSCC1OCCO1 62a_100000210312_100000755774 [0,1,0,1,0,0|1,0,0]=3 6732 B12R1.255 CC(C)CCSCC1OCCO1 62a_100000755774_100000210312 [0,1,0,1,0,0|1,0,0]=3 6733 B12R1.255 CC(C)CNCCC1OCCO1 2230a_100000034215_100000210760 [0,1,0,1,0,0|1,0,0]=3 6734 B12R1.255 CC(C)CNCCC1OCCO1 2230a_100000210953_100000740749 [0,1,0,1,0,0|1,0,0]=3 6735 B12R1.255 CC(C)CNCCC1OCCO1 270004a_100000034215_100000210432 [0,1,0,1,0,0|1,0,0]=3 6736 B12R1.255 CC(C)CNCCC1OCCO1 34a_100000034215_100000210624 [0,1,0,1,0,0|1,0,0]=3 6737 B12R1.255 CC(C)CNCCC1OCCO1 34a_100000210953_100000740749 [0,1,0,1,0,0|1,0,0]=3 6738 B12R1.255 CC(C)COCCC1OCCO1 34a_100000210257_100000740749 [0,1,0,1,0,0|1,0,0]=3 6739 B12R1.255 CC(C)CSCCC1OCCO1 62a_100000210624_100000740749 [0,1,0,1,0,0|1,0,0]=3 6740 B12R1.255 CC(C)NCCCC1OCCO1 2230a_100138425928_100000042513 [0,1,0,1,0,0|1,0,0]=3 6741 B12R1.255 CC(C)NCCCC1OCCO1 34a_100138425928_100009861162 [0,1,0,1,0,0|1,0,0]=3 6742 B12R1.255 CC(C)OCCCC1OCCO1 34a_100000212225_100009861162 [0,1,0,1,0,0|1,0,0]=3 6743 B12R1.255 CC(C)OCCCC1OCCO1 34a_100009871617_100000210206 [0,1,0,1,0,0|1,0,0]=3 6744 B12R1.255 CC(C)OCCCC1OCCO1 7a_100009871617_100000210206 [0,1,0,1,0,0|1,0,0]=3 6745 B12R1.255 CC(C)OCNCC1OCCO1 2230a_100000036311_100000709892 [0,1,0,1,0,0|2,0,0]=4 6746 B12R1.255 CC(C)OCNCC1OCCO1 34a_100000036311_100000709892 [0,1,0,1,0,0|2,0,0]=4 6747 B12R1.255 CC(C)OCOCC1OCCO1 34a_100000087154_100000709892 [0,1,0,1,0,0|2,0,0]=4 6748 B12R1.255 CC(C)OCSCC1OCCO1 62a_100000709892_100000755774 [0,1,0,1,0,0|2,0,0]=4 6749 B12R1.255 CC(C)OCSCC1OCCO1 62a_100000755774_100000709892 [0,1,0,1,0,0|2,0,0]=4 6750 B12R1.255 CC(C)SCCCC1OCCO1 62a_100000210206_100000042513 [0,1,0,1,0,0|1,0,0]=3 6751 B12R1.255 CC(F)COCCC1OCCO1 34a_100015925927_100000740749 [0,1,0,1,0,0|1,0,0]=3 6752 B12R1.255 CC(O)CCCOC1CCCO1 34a_100000085407_200000718107 [0,1,0,1,0,0|2,0,0]=4 6753 B12R1.255 CC(O)CCNCC1CCCO1 2230a_200000755665_100000203698 [0,1,0,1,0,0|2,0,0]=4 6754 B12R1.255 CC(O)CCNCC1OCCO1 2230a_100000036311_100012276601 [0,1,0,1,0,0|1,0,0]=3 6755 B12R1.255 CC(O)CCNCC1OCCO1 2230a_200000755665_100000755774 [0,1,0,1,0,0|1,0,0]=3 6756 B12R1.255 CC(O)CCNCC1OCCO1 34a_100000036311_100012276601 [0,1,0,1,0,0|1,0,0]=3 6757 B12R1.255 CC(O)CCNC[C@@H]1CCCO1 2230a_100020590478_100012276601 [0,1,0,1,0,0|2,0,0]=4 6758 B12R1.255 CC(O)CCNC[C@@H]1CCCO1 34a_100020590478_100012276601 [0,1,0,1,0,0|2,0,0]=4 6759 B12R1.255 CC(O)CCOCC1CCCO1 34a_100000210270_100012276601 [0,1,0,1,0,0|2,0,0]=4 6760 B12R1.255 CC(O)CCOCC1CCCO1 7a_100000210270_100012276601 [0,1,0,1,0,0|2,0,0]=4 6761 B12R1.255 CC(O)CCOCC1OCCO1 34a_100000087154_100012276601 [0,1,0,1,0,0|1,0,0]=3 6762 B12R1.255 CC(O)CCSCC1CCCO1 62a_100000203698_100012276601 [0,1,0,1,0,0|2,0,0]=4 6763 B12R1.255 CC(O)CCSCC1CCCO1 62a_100012276601_100000203698 [0,1,0,1,0,0|2,0,0]=4 6764 B12R1.255 CC(O)CCSCC1OCCO1 62a_100000755774_100012276601 [0,1,0,1,0,0|1,0,0]=3 6765 B12R1.255 CC(O)CCSCC1OCCO1 62a_100012276601_100000755774 [0,1,0,1,0,0|1,0,0]=3 6766 B12R1.255 CC(O)CNCCC1OCCO1 2230a_100000034215_100011218427 [0,1,0,1,0,0|1,0,0]=3 6767 B12R1.255 CC(O)CNCCC1OCCO1 2230a_100000210904_100000740749 [0,1,0,1,0,0|1,0,0]=3 6768 B12R1.255 CC(O)CNCCC1OCCO1 34a_100000034215_100011218427 [0,1,0,1,0,0|1,0,0]=3 6769 B12R1.255 CC(O)CNCCC1OCCO1 34a_100000210904_100000740749 [0,1,0,1,0,0|1,0,0]=3 6770 B12R1.255 CC(O)CSCCC1OCCO1 62a_100011218427_100000740749 [0,1,0,1,0,0|1,0,0]=3 6771 B12R1.255 CN(C)CCCCC1OCCO1 2230a_100102631434_100000034956 [0,1,0,1,0,0|1,0,0]=3 6772 B12R1.255 CN(C)CCCCC1OCCO1 269982a_100102631434_100000034956 [0,1,0,1,0,0|1,0,0]=3 6773 B12R1.255 CN(C)CCSCC1OCCO1 62a_100000755774_100000755713 [0,1,0,1,0,0|2,0,0]=4 6774 B12R1.255 C[C@@H](Cl)COCCC1OCCO1 34a_100016084084_100000740749 [0,1,0,1,0,0|1,0,0]=3 6775 B12R1.255 C[C@@H](N)CCOCC1OCCO1 34a_100000706166_100000755774 [0,1,0,1,0,0|1,0,0]=3 6776 B12R1.255 C[C@@H](N)COCCC1OCCO1 34a_100000737577_100000740749 [0,1,0,1,0,0|1,0,0]=3 6777 B12R1.255 C[C@@H](O)CNCCC1OCCO1 2230a_100000034215_100009817552 [0,1,0,1,0,0|1,0,0]=3 6778 B12R1.255 C[C@@H](O)CNCCC1OCCO1 34a_100000034215_100009817552 [0,1,0,1,0,0|1,0,0]=3 6779 B12R1.255 C[C@@H](O)CSCCC1OCCO1 62a_100009817552_100000740749 [0,1,0,1,0,0|1,0,0]=3 6780 B12R1.255 FC(F)CCOCC1OCCO1 34a_100103093639_100000755774 [0,1,0,1,0,0|2,0,0]=4 6781 B12R1.255 FC(F)CNCCC1OCCO1 2230a_100000034215_100011934356 [0,1,0,1,0,0|2,0,0]=4 6782 B12R1.255 FC(F)CNCCC1OCCO1 34a_100000034215_100011934356 [0,1,0,1,0,0|2,0,0]=4 6783 B12R1.255 FC(F)CNCCC1OCCO1 34a_100000765723_100000740749 [0,1,0,1,0,0|2,0,0]=4 6784 B12R1.255 FC(F)COCCC1OCCO1 34a_100000743014_100000740749 [0,1,0,1,0,0|2,0,0]=4 6785 B12R1.255 FC(F)CSCCC1OCCO1 62a_100011934356_100000740749 [0,1,0,1,0,0|2,0,0]=4 6786 B12R1.671 CCC1(CO1)COCCC(C)Br 34a_100009893172_200000139556 [0,1,0,1,0,0|2,0,0]=4 6787 B12R1.671 CCC1(CO1)COCCC(C)C 34a_100000210254_200000139556 [0,1,0,1,0,0|2,0,0]=4 6788 B12R1.671 CCC1(CO1)COCCC(C)C 7a_100000210254_200000139556 [0,1,0,1,0,0|2,0,0]=4 6789 B12R1.671 CCC1(CO1)COCC[C@@H](C)N 34a_100000706166_200000139556 [0,1,0,1,0,0|2,0,0]=4 6790 B12R1.671 CCC1(CO1)CSCCC(C)C 62a_100000210312_200000139556 [0,1,0,1,0,0|2,0,0]=4 6791 B12R1.671 CCC1(CO1)CSCCC(C)C 62a_200000139556_100000210312 [0,1,0,1,0,0|2,0,0]=4 6792 B12R1.671 CCC1(CO1)CSCCC(C)O 62a_100012276601_200000139556 [0,1,0,1,0,0|2,0,0]=4 6793 B12R1.671 CCC1(CO1)CSCCC(C)O 62a_200000139556_100012276601 [0,1,0,1,0,0|2,0,0]=4 6794 B12R1.1293 COC(CNC1CC1(F)F)OC 2230a_100020610826_100000751394 [0,1,0,1,0,0|2,0,0]=4 6795 B12R1.1293 COC(CNC1CC1(F)F)OC 34a_100020610826_100000211822 [0,1,0,1,0,0|2,0,0]=4 6796 B12R1.1533 CCC(CC)COCC1CC1C 34a_100000744939_100011215472 [0,1,0,1,0,0|2,0,0]=4 6797 B12R1.1533 CCC(CC)COCC1CC1C 7a_100000744939_100011215472 [0,1,0,1,0,0|2,0,0]=4 6798 B12R1.1533 COC(CCN[C@@H]1C[C@@H]1F)OC 2230a_100015190264_100009813347 [0,1,0,1,0,0|1,0,0]=3 6799 B12R1.1533 COC(CCN[C@@H]1C[C@H]1F)OC 2230a_100025746932_100009813347 [0,1,0,1,0,0|1,0,0]=3 6800 B12R1.1533 COC(CCN[C@@H]1C[C@H]1F)OC 34a_100025746932_100000139399 [0,1,0,1,0,0|1,0,0]=3 6801 B12R1.1533 COC(COCC1CC1C)OC 34a_100000744939_100000211822 [0,1,0,1,0,0|0,0,0]=2 6802 B12R1.1533 COC(COCC1CC1C)OC 7a_100000744939_100000751394 [0,1,0,1,0,0|0,0,0]=2 6803 B12R1.1891 COC1CCCN(CC1)C(C)C 2230a_100016993962_100000210206 [0,1,0,1,0,0|2,0,0]=4 6804 B12R1.1891 COC1CCCN(CC1)C(C)C 269982a_100016993962_100000210206 [0,1,0,1,0,0|2,0,0]=4 6805 B12R1.1891 COC1CCCN(CC1)C(C)C 34a_100016993962_100000210206 [0,1,0,1,0,0|2,0,0]=4 6806 B12R1.53 CCCCC(=O)CC1CCCO1 1458a_100000210183_100000203698 [0,1,0,1,0,0|1,0,1]=4 6807 B12R1.53 CCCCC(=O)CC1OCCO1 1458a_100000210183_100000755774 [0,1,0,1,0,0|0,0,1]=3 6808 B12R1.53 CCCCC(C)OC1CCCO1 34a_100000085407_200011215066 [0,1,0,1,0,0|2,0,0]=4 6809 B12R1.53 CCCCN(C)CC1CCCO1 2230a_100000207549_100000203698 [0,1,0,1,0,0|2,0,0]=4 6810 B12R1.53 CCCCN(C)CC1CCCO1 2230a_100102946541_100000210211 [0,1,0,1,0,0|2,0,0]=4 6811 B12R1.53 CCCCN(C)CC1CCCO1 269982a_100000207549_100000183445 [0,1,0,1,0,0|2,0,0]=4 6812 B12R1.53 CCCCN(C)CC1CCCO1 269982a_100102946541_100000210211 [0,1,0,1,0,0|2,0,0]=4 6813 B12R1.53 CCCCN(C)CC1CCCO1 34a_100102946541_100000210210 [0,1,0,1,0,0|2,0,0]=4 6814 B12R1.53 CCCCN(C)CC1OCCO1 2230a_100000207549_100000755774 [0,1,0,1,0,0|1,0,0]=3 6815 B12R1.53 CCCCN(C)CC1OCCO1 2230a_200000032744_100000210211 [0,1,0,1,0,0|1,0,0]=3 6816 B12R1.53 CCCCN(C)CC1OCCO1 269982a_100000207549_100000755774 [0,1,0,1,0,0|1,0,0]=3 6817 B12R1.53 CCCCN(C)CC1OCCO1 269982a_200000032744_100000210211 [0,1,0,1,0,0|1,0,0]=3 6818 B12R1.53 CCCCN(C)CC1OCCO1 34a_200000032744_100000210210 [0,1,0,1,0,0|1,0,0]=3 6819 B12R1.53 CCOCC(=O)CC1OCCO1 1458a_100000211967_100000755774 [0,1,0,1,0,0|1,0,1]=4 6820 B12R1.53 CCOCN(C)CC1OCCO1 269982a_200000032744_100000739092 [0,1,0,1,0,0|2,0,0]=4 6821 B12R1.53 CCSCC(=O)CC1OCCO1 1458a_100000230394_100000755774 [0,1,0,1,0,0|1,0,1]=4 6822 B12R1.53 CN(CCCF)CC1OCCO1 2230a_200000032744_100011934791 [0,1,0,1,0,0|2,0,0]=4 6823 B12R1.53 CN(CCCF)CC1OCCO1 269982a_200000032744_100011934791 [0,1,0,1,0,0|2,0,0]=4 6824 B12R1.53 CN(CCCF)CC1OCCO1 34a_200000032744_100011934791 [0,1,0,1,0,0|2,0,0]=4 6825 B12R1.53 CN(CCCO)CC1OCCO1 2230a_100000213112_100000755774 [0,1,0,1,0,0|2,0,0]=4 6826 B12R1.53 CN(CCCO)CC1OCCO1 2230a_200000032744_100000230001 [0,1,0,1,0,0|2,0,0]=4 6827 B12R1.53 CN(CCCO)CC1OCCO1 269982a_100000213112_100000755774 [0,1,0,1,0,0|2,0,0]=4 6828 B12R1.53 CN(CCCO)CC1OCCO1 269982a_200000032744_100011215043 [0,1,0,1,0,0|2,0,0]=4 6829 B12R1.53 CN(CCCO)CC1OCCO1 34a_200000032744_100000230001 [0,1,0,1,0,0|2,0,0]=4 6830 B12R1.53 COCCC(=O)CC1OCCO1 1458a_100000749529_100000755774 [0,1,0,1,0,0|1,0,1]=4 6831 B12R1.53 COCCN(C)CC1OCCO1 2230a_100000743101_100000755774 [0,1,0,1,0,0|2,0,0]=4 6832 B12R1.53 COCCN(C)CC1OCCO1 2230a_200000032744_100011201679 [0,1,0,1,0,0|2,0,0]=4 6833 B12R1.53 COCCN(C)CC1OCCO1 269982a_100000743101_100000755774 [0,1,0,1,0,0|2,0,0]=4 6834 B12R1.53 COCCN(C)CC1OCCO1 269982a_200000032744_100000233755 [0,1,0,1,0,0|2,0,0]=4 6835 B12R1.53 COCCN(C)CC1OCCO1 34a_200000032744_100011201679 [0,1,0,1,0,0|2,0,0]=4 6836 B12R1.53 CSCCC(=O)CC1OCCO1 1458a_100000174002_100000755774 [0,1,0,1,0,0|1,0,1]=4 6837 B12R1.53 CSCCN(C)CC1OCCO1 2230a_100000686725_100000755774 [0,1,0,1,0,0|2,0,0]=4 6838 B12R1.53 CSCCN(C)CC1OCCO1 2230a_200000032744_100000751147 [0,1,0,1,0,0|2,0,0]=4 6839 B12R1.53 CSCCN(C)CC1OCCO1 269982a_100000686725_100000755774 [0,1,0,1,0,0|2,0,0]=4 6840 B12R1.53 CSCCN(C)CC1OCCO1 269982a_200000032744_100000212216 [0,1,0,1,0,0|2,0,0]=4 6841 B12R1.53 CSCCN(C)CC1OCCO1 34a_200000032744_100000212216 [0,1,0,1,0,0|2,0,0]=4 6842 B12R1.118 CCC(CC)NC1CCCCC1 270004a_100000182618_100000210860 [0,1,0,1,0,0|2,0,0]=4 6843 B12R1.118 CCC(CC)NC1CCCCC1 270004a_100000199018_100000210434 [0,1,0,1,0,0|2,0,0]=4 6844 B12R1.118 CCC(CC)OC1CCCCC1 7a_100000210231_100000210505 [0,1,0,1,0,0|2,0,0]=4 6845 B12R1.118 CCC(CC)OC1CCCCC1 7a_100000688536_100000210327 [0,1,0,1,0,0|2,0,0]=4 6846 B12R1.118 CCC(CC)SC1CCCCC1 62a_100000210327_100000210505 [0,1,0,1,0,0|2,0,0]=4 6847 B12R1.118 CCC(CC)SC1CCCCC1 62a_100000210505_100000210327 [0,1,0,1,0,0|2,0,0]=4 6848 B12R1.118 COC(CN1CC=CCC1)OC 2230a_100000698166_100000751394 [0,1,0,1,0,0|0,0,2]=4 6849 B12R1.118 COC(CN1CC=CCC1)OC 270004a_100000698166_100000752162 [0,1,0,1,0,0|0,0,2]=4 6850 B12R1.118 COC(CN1CC=CCC1)OC 34a_100000698166_100000211822 [0,1,0,1,0,0|0,0,2]=4 6851 B12R1.118 COC(CN1CCCOC1)OC 2230a_100000131196_100000751394 [0,1,0,1,0,0|1,0,0]=3 6852 B12R1.118 COC(CN1CCCOC1)OC 270004a_100000131196_100000752162 [0,1,0,1,0,0|1,0,0]=3 6853 B12R1.118 COC(CN1CCCOC1)OC 34a_100000131196_100000211822 [0,1,0,1,0,0|1,0,0]=3 6854 B12R1.118 COC(CN1CCOCC1)OC 2230a_100015191051_100000751394 [0,1,0,1,0,0|1,0,0]=3 6855 B12R1.118 COC(CN1CCOCC1)OC 270004a_100015191051_100000752162 [0,1,0,1,0,0|1,0,0]=3 6856 B12R1.118 COC(CN1CCOCC1)OC 34a_100015191051_100000211822 [0,1,0,1,0,0|1,0,0]=3 6857 B12R1.118 COC(CN1CCSCC1)OC 2230a_100000737611_100000751394 [0,1,0,1,0,0|1,0,0]=3 6858 B12R1.118 COC(CN1CCSCC1)OC 270004a_100000737611_100000752162 [0,1,0,1,0,0|1,0,0]=3 6859 B12R1.243 CCC(CC)N1CCCCC1C 269982a_100000211376_100000210505 [0,1,0,1,0,0|2,0,0]=4 6860 B12R1.243 CCC(CC)N1CCCCC1C 270004a_100000211376_100000210860 [0,1,0,1,0,0|2,0,0]=4 6861 B12R1.382 CCCCN1CCCC(C1)OC 2230a_100000695604_100000210211 [0,1,0,1,0,0|2,0,0]=4 6862 B12R1.382 CCCCN1CCCC(C1)OC 269982a_100000695604_100000210211 [0,1,0,1,0,0|2,0,0]=4 6863 B12R1.382 CCCCN1CCCC(C1)OC 34a_100000695604_100000210210 [0,1,0,1,0,0|2,0,0]=4 6864 B12R1.382 CCCCN1CCOC(C1)CC 2230a_100000736320_100000210211 [0,1,0,1,0,0|2,0,0]=4 6865 B12R1.382 CCCCN1CCOC(C1)CC 269982a_100000736320_100000210211 [0,1,0,1,0,0|2,0,0]=4 6866 B12R1.382 CCCCN1CCOC(C1)CC 34a_100000736320_100000210210 [0,1,0,1,0,0|2,0,0]=4 6867 B12R1.432 CCC1CN(C1)CC(OC)OC 2230a_100015205115_100000751394 [0,1,0,1,0,0|1,0,0]=3 6868 B12R1.432 CCC1CN(C1)CC(OC)OC 270004a_100015205115_100000752162 [0,1,0,1,0,0|1,0,0]=3 6869 B12R1.432 COC(CN1CC(C1)CF)OC 34a_100010363649_100000211822 [0,1,0,1,0,0|2,0,0]=4 6870 B12R1.432 COC(CN1CC(C1)CO)OC 34a_100016987283_100000211822 [0,1,0,1,0,0|2,0,0]=4 6871 B12R1.432 COC(CN1CC(C1)SC)OC 270004a_100016990038_100000752162 [0,1,0,1,0,0|2,0,0]=4 6872 B12R1.586 COC(CC(=O)C1CCC1)OC 1458a_100000082724_100000749161 [0,1,0,1,0,0|0,0,1]=3 6873 B12R1.586 COC(CC(=O)C1CCC1)OC 1458a_100000209988_100000751394 [0,1,0,1,0,0|0,0,1]=3 6874 B12R1.586 COC(CC(=O)C1CCO1)OC 1458a_100000089072_100000751394 [0,1,0,1,0,0|1,0,1]=4 6875 B12R1.586 COC(CC(=O)C1COC1)OC 1458a_100000082724_100000687716 [0,1,0,1,0,0|1,0,1]=4 6876 B12R1.586 COC(CC(=O)C1COC1)OC 1458a_100000758290_100000751394 [0,1,0,1,0,0|1,0,1]=4 6877 B12R1.586 COC(CC(=O)N1CCC1)OC 11a_100000754969_100000082724 [0,1,0,1,0,0|1,0,1]=4 6878 B12R1.586 COC(CC(=O)N1CCC1)OC 240690a_100000754969_100000082724 [0,1,0,1,0,0|1,0,1]=4 6879 B12R1.586 COC(CC(=O)N1CCC1)OC 527a_100000754969_100000082724 [0,1,0,1,0,0|1,0,1]=4 6880 B12R1.586 COC(CN(C)C1CCC1)OC 2230a_100000758072_100000751394 [0,1,0,1,0,0|1,0,0]=3 6881 B12R1.586 COC(CN(C)C1CCC1)OC 269982a_100000225562_100000749161 [0,1,0,1,0,0|1,0,0]=3 6882 B12R1.586 COC(CN(C)C1CCC1)OC 270004a_100000225562_100000241760 [0,1,0,1,0,0|1,0,0]=3 6883 B12R1.586 COC(CN(C)C1CCC1)OC 270004a_100000758072_100000752162 [0,1,0,1,0,0|1,0,0]=3 6884 B12R1.586 COC(CN(C)C1CCC1)OC 34a_100000758072_100000211822 [0,1,0,1,0,0|1,0,0]=3 6885 B12R1.586 COC(CN(C)C1COC1)OC 2230a_100102693430_100000751394 [0,1,0,1,0,0|2,0,0]=4 6886 B12R1.586 COC(CN(C)C1COC1)OC 269982a_100000225562_100000687716 [0,1,0,1,0,0|2,0,0]=4 6887 B12R1.586 COC(CN(C)C1COC1)OC 270004a_100102693430_100000752162 [0,1,0,1,0,0|2,0,0]=4 6888 B12R1.588 COC(CC(=O)CC1CC1)OC 1458a_100000082724_100000742324 [0,1,0,1,0,0|0,0,1]=3 6889 B12R1.588 COC(CC(=O)CC1CC1)OC 1458a_100000738066_100000751394 [0,1,0,1,0,0|0,0,1]=3 6890 B12R1.588 COC(CC(=O)CC1CO1)OC 1458a_100000082724_100011216344 [0,1,0,1,0,0|1,0,1]=4 6891 B12R1.588 COC(CC(=O)CC1CS1)OC 1458a_100000082724_100000031435 [0,1,0,1,0,0|1,0,1]=4 6892 B12R1.588 COC(CC(=O)C[C@@H]1CO1)OC 1458a_100000082724_100000745022 [0,1,0,1,0,0|1,0,1]=4 6893 B12R1.588 COC(CC(=O)NC1CC1)OC 1626a_100000212008_100000082724 [0,1,0,1,0,0|1,0,1]=4 6894 B12R1.588 COC(CC(=O)NC1CC1)OC 240690a_100000212008_100000082724 [0,1,0,1,0,0|1,0,1]=4 6895 B12R1.588 COC(CC(=O)NC1CC1)OC 527a_100000212008_100000082724 [0,1,0,1,0,0|1,0,1]=4 6896 B12R1.588 COC(CN(C)CC1CC1)OC 2230a_100000741881_100000751394 [0,1,0,1,0,0|1,0,0]=3 6897 B12R1.588 COC(CN(C)CC1CC1)OC 269982a_100000225562_100000756562 [0,1,0,1,0,0|1,0,0]=3 6898 B12R1.588 COC(CN(C)CC1CC1)OC 270004a_100000741881_100000752162 [0,1,0,1,0,0|1,0,0]=3 6899 B12R1.588 COC(CN(C)CC1CO1)OC 269982a_100000225562_102125554688 [0,1,0,1,0,0|2,0,0]=4 6900 B12R1.588 COC(CN(C)CC1CS1)OC 269982a_100000225562_100000031435 [0,1,0,1,0,0|2,0,0]=4 6901 B12R1.588 COC(CN(C)C[C@@H]1CO1)OC 269982a_100000225562_100000745022 [0,1,0,1,0,0|2,0,0]=4 6902 B12R1.2284 CCNCC1CC(C1)(OC)OC 2230a_100015525214_100010742979 [0,1,0,1,0,0|1,0,0]=3 6903 B12R1.2284 CCOCC1CC(C1)(OC)OC 34a_100121572206_100010742979 [0,1,0,1,0,0|1,0,0]=3 6904 B12R1.2284 CCSCC1CC(C1)(OC)OC 62a_100000210202_100010742979 [0,1,0,1,0,0|1,0,0]=3 6905 B12R1.2284 CCSCC1CC(C1)(OC)OC 62a_100010742979_100000210202 [0,1,0,1,0,0|1,0,0]=3 6906 B12R1.2284 COC1(CC(C1)CSCF)OC 62a_100010742979_100015361967 [0,1,0,1,0,0|2,0,0]=4 6907 B12R1.2284 COC1(CC(C1)CSCF)OC 62a_100015361967_100010742979 [0,1,0,1,0,0|2,0,0]=4 6908 B12R1.3079 COC(CC(=O)C1CC1C)OC 1458a_100000211227_100000751394 [0,1,0,1,0,0|0,0,1]=3 6909 B12R1.3079 COC(CC(=O)[C@@H]1C[C@@H]1F)OC 1458a_100015396687_100000751394 [0,1,0,1,0,0|1,0,1]=4 6910 B12R1.3687 CCCCC(=O)CC1(CO1)CC 1458a_100000210183_200000139556 [0,1,0,1,0,0|1,0,1]=4 6911 B12R1.3687 CCCCN(C)CC1(CO1)CC 269982a_100000207549_200000139556 [0,1,0,1,0,0|2,0,0]=4 6912 B12R1.113 CCCC1CCC(CC1)N(C)C 270004a_100102631434_100000185488 [0,1,0,1,0,0|2,0,0]=4 6913 B12R1.113 CCC[C@H]1CC[C@@H](CC1)C(=O)C 1458a_100009815004_200000210301 [0,1,0,1,0,0|2,0,0]=4 6914 B12R1.113 CCC[C@H]1CC[C@@H](CC1)C(=O)[13CH3] 1458a_100009815004_200025704644 [0,1,0,1,0,0|2,0,0]=4 6915 B12R1.1335 CN(C)C1CCCCCCCC1 270004a_100102631434_100000038600 [0,1,0,1,0,0|2,0,0]=4 6916 B12R1.37 BrCCCCOCC1OCCO1 34a_100011216708_100000755774 [0,1,0,1,0,0|1,0,0]=3 6917 B12R1.37 BrCCCOCCC1OCCO1 34a_100011217188_100000740749 [0,1,0,1,0,0|1,0,0]=3 6918 B12R1.37 BrCCOCCCC1OCCO1 34a_100000211926_100009861162 [0,1,0,1,0,0|1,0,0]=3 6919 B12R1.37 C#CCCCNCC1OCCO1 2230a_100000036311_100000731252 [0,1,0,1,0,0|0,0,2]=4 6920 B12R1.37 C#CCCCNCC1OCCO1 34a_100000036311_100000695029 [0,1,0,1,0,0|0,0,2]=4 6921 B12R1.37 C#CCCCNCC1OCCO1 34a_100000718082_100000755774 [0,1,0,1,0,0|0,0,2]=4 6922 B12R1.37 C#CCCCOCC1OCCO1 34a_100000087154_100000695029 [0,1,0,1,0,0|0,0,2]=4 6923 B12R1.37 C#CCCCOCC1OCCO1 34a_100000215630_100000755774 [0,1,0,1,0,0|0,0,2]=4 6924 B12R1.37 C#CCCCOCC1OCCO1 7a_100000215630_100000755774 [0,1,0,1,0,0|0,0,2]=4 6925 B12R1.37 C#CCCCSCC1OCCO1 62a_100000755774_100011215417 [0,1,0,1,0,0|0,0,2]=4 6926 B12R1.37 C#CCCCSCC1OCCO1 62a_100011215417_100000755774 [0,1,0,1,0,0|0,0,2]=4 6927 B12R1.37 C#CCCNCCC1OCCO1 2230a_100000034215_100000688953 [0,1,0,1,0,0|0,0,2]=4 6928 B12R1.37 C#CCCNCCC1OCCO1 34a_100000034215_100000688953 [0,1,0,1,0,0|0,0,2]=4 6929 B12R1.37 C#CCCNCCC1OCCO1 34a_100000755551_100000740749 [0,1,0,1,0,0|0,0,2]=4 6930 B12R1.37 C#CCCOCCC1OCCO1 34a_100011215631_100000740749 [0,1,0,1,0,0|0,0,2]=4 6931 B12R1.37 C#CCCSCCC1OCCO1 62a_100000688953_100000740749 [0,1,0,1,0,0|0,0,2]=4 6932 B12R1.37 C#CCNCCCC1OCCO1 34a_100000212058_100009861162 [0,1,0,1,0,0|0,0,2]=4 6933 B12R1.37 C#CCOCCCC1OCCO1 34a_100000210247_100009861162 [0,1,0,1,0,0|0,0,2]=4 6934 B12R1.37 C#CCOCCCC1OCCO1 34a_100009871617_100000184674 [0,1,0,1,0,0|0,0,2]=4 6935 B12R1.37 C#CCOCCCC1OCCO1 7a_100009871617_100000038162 [0,1,0,1,0,0|0,0,2]=4 6936 B12R1.37 C#CCSCCCC1OCCO1 62a_100000038162_100000042513 [0,1,0,1,0,0|0,0,2]=4 6937 B12R1.37 C/C=C/CCOCC1OCCO1 34a_100016278192_100000755774 [0,1,0,1,0,0|0,0,2]=4 6938 B12R1.37 C/C=C/CNCCC1OCCO1 34a_100000034215_100102629194 [0,1,0,1,0,0|0,0,2]=4 6939 B12R1.37 C/C=C/COCCC1OCCO1 34a_100016270725_100000740749 [0,1,0,1,0,0|0,0,2]=4 6940 B12R1.37 C/C=C/CSCCC1OCCO1 62a_100102629194_100000740749 [0,1,0,1,0,0|0,0,2]=4 6941 B12R1.37 C=CCCCNCC1OCCO1 2230a_100000036311_100011713584 [0,1,0,1,0,0|0,0,2]=4 6942 B12R1.37 C=CCCCNCC1OCCO1 2230a_100000700776_100000755774 [0,1,0,1,0,0|0,0,2]=4 6943 B12R1.37 C=CCCCNCC1OCCO1 34a_100000036311_100000757094 [0,1,0,1,0,0|0,0,2]=4 6944 B12R1.37 C=CCCCNCC1OCCO1 34a_100000700776_100000755774 [0,1,0,1,0,0|0,0,2]=4 6945 B12R1.37 C=CCCCOCC1OCCO1 34a_100000087154_100000757094 [0,1,0,1,0,0|0,0,2]=4 6946 B12R1.37 C=CCCCOCC1OCCO1 34a_100000758997_100000755774 [0,1,0,1,0,0|0,0,2]=4 6947 B12R1.37 C=CCCCOCC1OCCO1 7a_100000758997_100000755774 [0,1,0,1,0,0|0,0,2]=4 6948 B12R1.37 C=CCCCSCC1OCCO1 62a_100000755774_100000757094 [0,1,0,1,0,0|0,0,2]=4 6949 B12R1.37 C=CCCCSCC1OCCO1 62a_100011713584_100000755774 [0,1,0,1,0,0|0,0,2]=4 6950 B12R1.37 C=CCCNCCC1OCCO1 2230a_100000034215_100000754431 [0,1,0,1,0,0|0,0,2]=4 6951 B12R1.37 C=CCCNCCC1OCCO1 2230a_100015191253_100000740749 [0,1,0,1,0,0|0,0,2]=4 6952 B12R1.37 C=CCCNCCC1OCCO1 34a_100000034215_100000754431 [0,1,0,1,0,0|0,0,2]=4 6953 B12R1.37 C=CCCOCCC1OCCO1 34a_100011205117_100000740749 [0,1,0,1,0,0|0,0,2]=4 6954 B12R1.37 C=CCCSCCC1OCCO1 62a_100000754431_100000740749 [0,1,0,1,0,0|0,0,2]=4 6955 B12R1.37 C=CCNCCCC1OCCO1 2230a_100020586998_100000042513 [0,1,0,1,0,0|0,0,2]=4 6956 B12R1.37 C=CCOCCCC1OCCO1 34a_100009871617_100015514636 [0,1,0,1,0,0|0,0,2]=4 6957 B12R1.37 C=CCOCCCC1OCCO1 34a_200000210373_100009861162 [0,1,0,1,0,0|0,0,2]=4 6958 B12R1.37 C=CCOCCCC1OCCO1 7a_100009871617_100015514636 [0,1,0,1,0,0|0,0,2]=4 6959 B12R1.37 C=CCSCCCC1OCCO1 62a_100000210623_100000042513 [0,1,0,1,0,0|0,0,2]=4 6960 B12R1.37 CC#CCCOCC1OCCO1 34a_100000750427_100000755774 [0,1,0,1,0,0|0,0,2]=4 6961 B12R1.37 CC#CCNCCC1OCCO1 2230a_100000034215_100000748600 [0,1,0,1,0,0|0,0,2]=4 6962 B12R1.37 CC#CCNCCC1OCCO1 2230a_100000685387_100000740749 [0,1,0,1,0,0|0,0,2]=4 6963 B12R1.37 CC#CCNCCC1OCCO1 34a_100000034215_100000748600 [0,1,0,1,0,0|0,0,2]=4 6964 B12R1.37 CC#CCNCCC1OCCO1 34a_100000685387_100000740749 [0,1,0,1,0,0|0,0,2]=4 6965 B12R1.37 CC#CCOCCC1OCCO1 34a_100000761923_100000740749 [0,1,0,1,0,0|0,0,2]=4 6966 B12R1.37 CC#CCSCCC1OCCO1 62a_100000748600_100000740749 [0,1,0,1,0,0|0,0,2]=4 6967 B12R1.37 CC/C=C\CNCC1OCCO1 2230a_100000036311_100103147603 [0,1,0,1,0,0|0,0,2]=4 6968 B12R1.37 CC/C=C\CNCC1OCCO1 34a_100000036311_100103147603 [0,1,0,1,0,0|0,0,2]=4 6969 B12R1.37 CC/C=C\COCC1OCCO1 34a_100000087154_100103147603 [0,1,0,1,0,0|0,0,2]=4 6970 B12R1.37 CC/C=C\COCC1OCCO1 34a_100016268518_100000755774 [0,1,0,1,0,0|0,0,2]=4 6971 B12R1.37 CC/C=C\CSCC1OCCO1 62a_100000755774_100103147603 [0,1,0,1,0,0|0,0,2]=4 6972 B12R1.37 CC/C=C\CSCC1OCCO1 62a_100103147603_100000755774 [0,1,0,1,0,0|0,0,2]=4 6973 B12R1.37 CC=CCNCCC1OCCO1 2230a_100000034215_100000070051 [0,1,0,1,0,0|0,0,2]=4 6974 B12R1.37 CC=CCNCCC1OCCO1 34a_100000034215_100000070051 [0,1,0,1,0,0|0,0,2]=4 6975 B12R1.37 CC=CCSCCC1OCCO1 62a_100000070051_100000740749 [0,1,0,1,0,0|0,0,2]=4 6976 B12R1.37 CCC#CCNCC1OCCO1 2230a_100000036311_100009813939 [0,1,0,1,0,0|0,0,2]=4 6977 B12R1.37 CCC#CCNCC1OCCO1 34a_100000036311_100009813939 [0,1,0,1,0,0|0,0,2]=4 6978 B12R1.37 CCC#CCOCC1OCCO1 34a_100000032950_100000755774 [0,1,0,1,0,0|0,0,2]=4 6979 B12R1.37 CCC#CCOCC1OCCO1 34a_100000087154_100009813939 [0,1,0,1,0,0|0,0,2]=4 6980 B12R1.37 CCC#CCSCC1OCCO1 62a_100000755774_100009813939 [0,1,0,1,0,0|0,0,2]=4 6981 B12R1.37 CCC#CCSCC1OCCO1 62a_100009813939_100000755774 [0,1,0,1,0,0|0,0,2]=4 6982 B12R1.37 CCCCCCNC1CCCC1 2230a_100000210581_100000179811 [0,1,0,1,0,0|2,0,0]=4 6983 B12R1.37 CCCCCCNC1CCCC1 2230a_100000211070_100000210314 [0,1,0,1,0,0|2,0,0]=4 6984 B12R1.37 CCCCCCNC1CCCC1 270004a_100000210581_100000210133 [0,1,0,1,0,0|2,0,0]=4 6985 B12R1.37 CCCCCCNC1CCCC1 34a_100000211070_100000210314 [0,1,0,1,0,0|2,0,0]=4 6986 B12R1.37 CCCCCCOC1CCCC1 34a_100000210259_100000179811 [0,1,0,1,0,0|2,0,0]=4 6987 B12R1.37 CCCCCCOC1CCCC1 34a_100000210269_100000210314 [0,1,0,1,0,0|2,0,0]=4 6988 B12R1.37 CCCCCCOC1CCCC1 7a_100000210259_100000179811 [0,1,0,1,0,0|2,0,0]=4 6989 B12R1.37 CCCCCCOC1CCCC1 7a_100000210269_100000210314 [0,1,0,1,0,0|2,0,0]=4 6990 B12R1.37 CCCCCCOC1CCCO1 34a_100000085407_100000210314 [0,1,0,1,0,0|1,0,0]=3 6991 B12R1.37 CCCCCCSC1CCCC1 62a_100000210314_100000179811 [0,1,0,1,0,0|2,0,0]=4 6992 B12R1.37 CCCCCCSC1CCCC1 62a_100011217020_100000210757 [0,1,0,1,0,0|2,0,0]=4 6993 B12R1.37 CCCCCNCC1CCCC1 2230a_100000209983_100000740388 [0,1,0,1,0,0|2,0,0]=4 6994 B12R1.37 CCCCCNCC1CCCC1 2230a_100000737975_100000210326 [0,1,0,1,0,0|2,0,0]=4 6995 B12R1.37 CCCCCNCC1CCCC1 269862a_100000209983_100000746403 [0,1,0,1,0,0|2,0,0]=4 6996 B12R1.37 CCCCCNCC1CCCC1 34a_100000737975_100000718602 [0,1,0,1,0,0|2,0,0]=4 6997 B12R1.37 CCCCCNCC1CCCO1 2230a_100000209983_100000203698 [0,1,0,1,0,0|1,0,0]=3 6998 B12R1.37 CCCCCNCC1OCCO1 2230a_100000036311_100000210326 [0,1,0,1,0,0|0,0,0]=2 6999 B12R1.37 CCCCCNCC1OCCO1 2230a_100000209983_100000755774 [0,1,0,1,0,0|0,0,0]=2 7000 B12R1.37 CCCCCNCC1OCCO1 34a_100000036311_100000718602 [0,1,0,1,0,0|0,0,0]=2 7001 B12R1.37 CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210326 [0,1,0,1,0,0|1,0,0]=3 7002 B12R1.37 CCCCCNC[C@@H]1CCCO1 34a_100020590478_100000718602 [0,1,0,1,0,0|1,0,0]=3 7003 B12R1.37 CCCCCOCC1CCCC1 34a_100000210253_100000740388 [0,1,0,1,0,0|2,0,0]=4 7004 B12R1.37 CCCCCOCC1CCCC1 34a_100000742336_100000718602 [0,1,0,1,0,0|2,0,0]=4 7005 B12R1.37 CCCCCOCC1CCCC1 7a_100000210253_100000740388 [0,1,0,1,0,0|2,0,0]=4 7006 B12R1.37 CCCCCOCC1CCCC1 7a_100000742336_100000210326 [0,1,0,1,0,0|2,0,0]=4 7007 B12R1.37 CCCCCOCC1CCCO1 34a_100000210270_100000718602 [0,1,0,1,0,0|1,0,0]=3 7008 B12R1.37 CCCCCOCC1CCCO1 7a_100000210253_100000203698 [0,1,0,1,0,0|1,0,0]=3 7009 B12R1.37 CCCCCOCC1CCCO1 7a_100000210270_100000210326 [0,1,0,1,0,0|1,0,0]=3 7010 B12R1.37 CCCCCOCC1COCO1 34a_100011216627_100000718602 [0,1,0,1,0,0|2,0,0]=4 7011 B12R1.37 CCCCCOCC1OCCO1 34a_100000087154_100000718602 [0,1,0,1,0,0|0,0,0]=2 7012 B12R1.37 CCCCCOCC1OCCO1 34a_100000210253_100000755774 [0,1,0,1,0,0|0,0,0]=2 7013 B12R1.37 CCCCCOCC1OCCO1 7a_100000210253_100000755774 [0,1,0,1,0,0|0,0,0]=2 7014 B12R1.37 CCCCCOC[C@H]1CCCN1 34a_100000745186_100000718602 [0,1,0,1,0,0|2,0,0]=4 7015 B12R1.37 CCCCCSCC1CCCC1 62a_100000210326_100000740388 [0,1,0,1,0,0|2,0,0]=4 7016 B12R1.37 CCCCCSCC1CCCC1 62a_100000740388_100000210326 [0,1,0,1,0,0|2,0,0]=4 7017 B12R1.37 CCCCCSCC1CCCO1 62a_100000203698_100000210326 [0,1,0,1,0,0|1,0,0]=3 7018 B12R1.37 CCCCCSCC1CCCO1 62a_100000210326_100000203698 [0,1,0,1,0,0|1,0,0]=3 7019 B12R1.37 CCCCCSCC1OCCO1 62a_100000210326_100000755774 [0,1,0,1,0,0|0,0,0]=2 7020 B12R1.37 CCCCCSCC1OCCO1 62a_100000755774_100000210326 [0,1,0,1,0,0|0,0,0]=2 7021 B12R1.37 CCCCNCCC1CCCC1 2230a_100000102301_100000760354 [0,1,0,1,0,0|2,0,0]=4 7022 B12R1.37 CCCCNCCC1CCCC1 2230a_100000739158_100000210211 [0,1,0,1,0,0|2,0,0]=4 7023 B12R1.37 CCCCNCCC1CCCC1 34a_100000739158_100000210210 [0,1,0,1,0,0|2,0,0]=4 7024 B12R1.37 CCCCNCCC1CCCC1 7a_106832991798_100000760354 [0,1,0,1,0,0|2,0,0]=4 7025 B12R1.37 CCCCNCCC1OCCO1 2230a_100000034215_100000210211 [0,1,0,1,0,0|0,0,0]=2 7026 B12R1.37 CCCCNCCC1OCCO1 2230a_100000102301_100000740749 [0,1,0,1,0,0|0,0,0]=2 7027 B12R1.37 CCCCNCCC1OCCO1 34a_100000034215_100000210210 [0,1,0,1,0,0|0,0,0]=2 7028 B12R1.37 CCCCNCCC1OCCO1 7a_106832991798_100000740749 [0,1,0,1,0,0|0,0,0]=2 7029 B12R1.37 CCCCOCCC1CCCC1 34a_100000210227_100000760354 [0,1,0,1,0,0|2,0,0]=4 7030 B12R1.37 CCCCOCCC1CCCC1 34a_100000749090_100000210210 [0,1,0,1,0,0|2,0,0]=4 7031 B12R1.37 CCCCOCCC1CCCC1 7a_100000210227_100000760354 [0,1,0,1,0,0|2,0,0]=4 7032 B12R1.37 CCCCOCCC1CCCC1 7a_100000749090_100000210211 [0,1,0,1,0,0|2,0,0]=4 7033 B12R1.37 CCCCOCCC1OCCO1 34a_100000210227_100000740749 [0,1,0,1,0,0|0,0,0]=2 7034 B12R1.37 CCCCOCCC1OCCO1 7a_100000210227_100000740749 [0,1,0,1,0,0|0,0,0]=2 7035 B12R1.37 CCCCOCOC1CCCO1 34a_100000085407_100011995733 [0,1,0,1,0,0|2,0,0]=4 7036 B12R1.37 CCCCSCCC1CCCC1 62a_100000210211_100000760354 [0,1,0,1,0,0|2,0,0]=4 7037 B12R1.37 CCCCSCCC1CCCC1 62a_100000760354_100000210210 [0,1,0,1,0,0|2,0,0]=4 7038 B12R1.37 CCCCSCCC1OCCO1 62a_100000210211_100000740749 [0,1,0,1,0,0|0,0,0]=2 7039 B12R1.37 CCCNCCCC1CCCC1 2230a_100000736752_100000210303 [0,1,0,1,0,0|2,0,0]=4 7040 B12R1.37 CCCNCCCC1CCCC1 34a_100000736752_100000210303 [0,1,0,1,0,0|2,0,0]=4 7041 B12R1.37 CCCOCCCC1CCCC1 34a_100000210258_100011713738 [0,1,0,1,0,0|2,0,0]=4 7042 B12R1.37 CCCOCCCC1CCCC1 34a_100011215328_100000210303 [0,1,0,1,0,0|2,0,0]=4 7043 B12R1.37 CCCOCCCC1CCCC1 7a_100011215328_100000210303 [0,1,0,1,0,0|2,0,0]=4 7044 B12R1.37 CCCOCCCC1OCCO1 34a_100000210258_100009861162 [0,1,0,1,0,0|0,0,0]=2 7045 B12R1.37 CCCOCCCC1OCCO1 34a_100009871617_100000210303 [0,1,0,1,0,0|0,0,0]=2 7046 B12R1.37 CCCOCCCC1OCCO1 7a_100009871617_100000210303 [0,1,0,1,0,0|0,0,0]=2 7047 B12R1.37 CCCOCCOC1CCCO1 34a_100000085407_100011215938 [0,1,0,1,0,0|2,0,0]=4 7048 B12R1.37 CCCSCCCC1CCCC1 62a_100000210303_100011713738 [0,1,0,1,0,0|2,0,0]=4 7049 B12R1.37 CCCSCCCC1CCCC1 62a_100011713738_100000210303 [0,1,0,1,0,0|2,0,0]=4 7050 B12R1.37 CCCSCCCC1OCCO1 62a_100000210303_100000042513 [0,1,0,1,0,0|0,0,0]=2 7051 B12R1.37 CCNCCCCC1OCCO1 2230a_100015525214_100000034956 [0,1,0,1,0,0|0,0,0]=2 7052 B12R1.37 CCOCCCCC1OCCO1 34a_100121572206_200009813554 [0,1,0,1,0,0|0,0,0]=2 7053 B12R1.37 CCOCCCOC1CCCO1 34a_100000085407_100012232248 [0,1,0,1,0,0|2,0,0]=4 7054 B12R1.37 CCOCCNCC1CCCO1 2230a_102516460346_100000203698 [0,1,0,1,0,0|2,0,0]=4 7055 B12R1.37 CCOCCNCC1OCCO1 2230a_100000036311_100011215890 [0,1,0,1,0,0|1,0,0]=3 7056 B12R1.37 CCOCCNCC1OCCO1 2230a_102516460346_100000755774 [0,1,0,1,0,0|1,0,0]=3 7057 B12R1.37 CCOCCNCC1OCCO1 34a_100000036311_100000210147 [0,1,0,1,0,0|1,0,0]=3 7058 B12R1.37 CCOCCNCC1OCCO1 34a_102516460346_100000755774 [0,1,0,1,0,0|1,0,0]=3 7059 B12R1.37 CCOCCNC[C@@H]1CCCO1 2230a_100020590478_100011215890 [0,1,0,1,0,0|2,0,0]=4 7060 B12R1.37 CCOCCNC[C@@H]1CCCO1 34a_100020590478_100000210147 [0,1,0,1,0,0|2,0,0]=4 7061 B12R1.37 CCOCCOCC1CCCO1 34a_100000210270_100000210147 [0,1,0,1,0,0|2,0,0]=4 7062 B12R1.37 CCOCCOCC1CCCO1 7a_100000210136_100000203698 [0,1,0,1,0,0|2,0,0]=4 7063 B12R1.37 CCOCCOCC1CCCO1 7a_100000210270_100011215890 [0,1,0,1,0,0|2,0,0]=4 7064 B12R1.37 CCOCCOCC1OCCO1 34a_100000087154_100000210147 [0,1,0,1,0,0|1,0,0]=3 7065 B12R1.37 CCOCCOCC1OCCO1 34a_100000210136_100000755774 [0,1,0,1,0,0|1,0,0]=3 7066 B12R1.37 CCOCCOCC1OCCO1 7a_100000210136_100000755774 [0,1,0,1,0,0|1,0,0]=3 7067 B12R1.37 CCOCCSCC1CCCO1 62a_100000203698_100011215890 [0,1,0,1,0,0|2,0,0]=4 7068 B12R1.37 CCOCCSCC1CCCO1 62a_100000210147_100000203698 [0,1,0,1,0,0|2,0,0]=4 7069 B12R1.37 CCOCCSCC1OCCO1 62a_100000210147_100000755774 [0,1,0,1,0,0|1,0,0]=3 7070 B12R1.37 CCOCCSCC1OCCO1 62a_100000755774_100011215890 [0,1,0,1,0,0|1,0,0]=3 7071 B12R1.37 CCOCSCCC1OCCO1 62a_100000739092_100000740749 [0,1,0,1,0,0|1,0,0]=3 7072 B12R1.37 CCSCCCCC1OCCO1 62a_100000210202_100000034956 [0,1,0,1,0,0|0,0,0]=2 7073 B12R1.37 CCSCCNCC1CCCO1 2230a_100000106463_100000203698 [0,1,0,1,0,0|2,0,0]=4 7074 B12R1.37 CCSCCNCC1OCCO1 2230a_100000036311_100000757381 [0,1,0,1,0,0|1,0,0]=3 7075 B12R1.37 CCSCCNCC1OCCO1 2230a_100000106463_100000755774 [0,1,0,1,0,0|1,0,0]=3 7076 B12R1.37 CCSCCNCC1OCCO1 34a_100000036311_100000757381 [0,1,0,1,0,0|1,0,0]=3 7077 B12R1.37 CCSCCNC[C@@H]1CCCO1 2230a_100020590478_100000757381 [0,1,0,1,0,0|2,0,0]=4 7078 B12R1.37 CCSCCNC[C@@H]1CCCO1 34a_100020590478_100000757381 [0,1,0,1,0,0|2,0,0]=4 7079 B12R1.37 CCSCCOCC1CCCO1 34a_100000210270_100000757381 [0,1,0,1,0,0|2,0,0]=4 7080 B12R1.37 CCSCCOCC1CCCO1 7a_100000210270_100000757381 [0,1,0,1,0,0|2,0,0]=4 7081 B12R1.37 CCSCCOCC1CCCO1 7a_100000212035_100000203698 [0,1,0,1,0,0|2,0,0]=4 7082 B12R1.37 CCSCCOCC1OCCO1 34a_100000087154_100000757381 [0,1,0,1,0,0|1,0,0]=3 7083 B12R1.37 CCSCCOCC1OCCO1 34a_100000212035_100000755774 [0,1,0,1,0,0|1,0,0]=3 7084 B12R1.37 CCSCCOCC1OCCO1 7a_100000212035_100000755774 [0,1,0,1,0,0|1,0,0]=3 7085 B12R1.37 CCSCCSCC1CCCO1 62a_100000203698_100000757381 [0,1,0,1,0,0|2,0,0]=4 7086 B12R1.37 CCSCCSCC1CCCO1 62a_100000757381_100000203698 [0,1,0,1,0,0|2,0,0]=4 7087 B12R1.37 CCSCCSCC1OCCO1 62a_100000755774_100000757381 [0,1,0,1,0,0|1,0,0]=3 7088 B12R1.37 CCSCCSCC1OCCO1 62a_100000757381_100000755774 [0,1,0,1,0,0|1,0,0]=3 7089 B12R1.37 CNCCCOCC1OCCO1 34a_100000213112_100000755774 [0,1,0,1,0,0|1,0,0]=3 7090 B12R1.37 COCCCCOC1CCCO1 34a_100000085407_100000755781 [0,1,0,1,0,0|2,0,0]=4 7091 B12R1.37 COCCCCOC1CCCO1 34a_100011018183_200000210301 [0,1,0,1,0,0|2,0,0]=4 7092 B12R1.37 COCCCCOC1CCCO1 7a_100011018183_200000210301 [0,1,0,1,0,0|2,0,0]=4 7093 B12R1.37 COCCCNCC1OCCO1 2230a_100000036311_100000740836 [0,1,0,1,0,0|1,0,0]=3 7094 B12R1.37 COCCCNCC1OCCO1 34a_100000036311_100000740836 [0,1,0,1,0,0|1,0,0]=3 7095 B12R1.37 COCCCNCC1OCCO1 34a_100150723488_100000755774 [0,1,0,1,0,0|1,0,0]=3 7096 B12R1.37 COCCCNC[C@@H]1CCCO1 2230a_100020590478_100000740836 [0,1,0,1,0,0|2,0,0]=4 7097 B12R1.37 COCCCNC[C@@H]1CCCO1 34a_100020590478_100000740836 [0,1,0,1,0,0|2,0,0]=4 7098 B12R1.37 COCCCOCC1CCCO1 34a_100000210270_100000740836 [0,1,0,1,0,0|2,0,0]=4 7099 B12R1.37 COCCCOCC1CCCO1 7a_100000210270_100000740836 [0,1,0,1,0,0|2,0,0]=4 7100 B12R1.37 COCCCOCC1OCCO1 34a_100000087154_100000740836 [0,1,0,1,0,0|1,0,0]=3 7101 B12R1.37 COCCCOCC1OCCO1 34a_100000740835_100000755774 [0,1,0,1,0,0|1,0,0]=3 7102 B12R1.37 COCCCSCC1CCCO1 62a_100000203698_100000709357 [0,1,0,1,0,0|2,0,0]=4 7103 B12R1.37 COCCCSCC1CCCO1 62a_100000709357_100000203698 [0,1,0,1,0,0|2,0,0]=4 7104 B12R1.37 COCCCSCC1OCCO1 62a_100000709357_100000755774 [0,1,0,1,0,0|1,0,0]=3 7105 B12R1.37 COCCCSCC1OCCO1 62a_100000755774_100000709357 [0,1,0,1,0,0|1,0,0]=3 7106 B12R1.37 COCCNCCC1OCCO1 2230a_100000034215_100011201679 [0,1,0,1,0,0|1,0,0]=3 7107 B12R1.37 COCCNCCC1OCCO1 2230a_100000209980_100000740749 [0,1,0,1,0,0|1,0,0]=3 7108 B12R1.37 COCCNCCC1OCCO1 34a_100000034215_100011201679 [0,1,0,1,0,0|1,0,0]=3 7109 B12R1.37 COCCOCCC1OCCO1 34a_100000210237_100000740749 [0,1,0,1,0,0|1,0,0]=3 7110 B12R1.37 COCCSCCC1OCCO1 62a_100000233755_100000740749 [0,1,0,1,0,0|1,0,0]=3 7111 B12R1.37 COCSCCCC1OCCO1 62a_100000766300_100000042513 [0,1,0,1,0,0|1,0,0]=3 7112 B12R1.37 CSCCCNCC1CCCO1 2230a_100000749238_100000203698 [0,1,0,1,0,0|2,0,0]=4 7113 B12R1.37 CSCCCNCC1OCCO1 2230a_100000749238_100000755774 [0,1,0,1,0,0|1,0,0]=3 7114 B12R1.37 CSCCCOCC1CCCO1 7a_100000690336_100000203698 [0,1,0,1,0,0|2,0,0]=4 7115 B12R1.37 CSCCCOCC1OCCO1 34a_100000690336_100000755774 [0,1,0,1,0,0|1,0,0]=3 7116 B12R1.37 CSCCCOCC1OCCO1 7a_100000690336_100000755774 [0,1,0,1,0,0|1,0,0]=3 7117 B12R1.37 CSCCNCCC1OCCO1 2230a_100000034215_100000751147 [0,1,0,1,0,0|1,0,0]=3 7118 B12R1.37 CSCCNCCC1OCCO1 2230a_100020590264_100000740749 [0,1,0,1,0,0|1,0,0]=3 7119 B12R1.37 CSCCNCCC1OCCO1 34a_100000034215_100000212216 [0,1,0,1,0,0|1,0,0]=3 7120 B12R1.37 CSCCOCCC1OCCO1 34a_100000230434_100000740749 [0,1,0,1,0,0|1,0,0]=3 7121 B12R1.37 CSCCOCCC1OCCO1 7a_100000230434_100000740749 [0,1,0,1,0,0|1,0,0]=3 7122 B12R1.37 CSCCSCCC1OCCO1 62a_100000212216_100000740749 [0,1,0,1,0,0|1,0,0]=3 7123 B12R1.37 CSCOCCCC1OCCO1 34a_100009871617_100011218213 [0,1,0,1,0,0|1,0,0]=3 7124 B12R1.37 CSCSCCCC1OCCO1 62a_100011218213_100000042513 [0,1,0,1,0,0|1,0,0]=3 7125 B12R1.37 ClCCCCOCC1CCCO1 7a_100000210776_100000203698 [0,1,0,1,0,0|2,0,0]=4 7126 B12R1.37 ClCCCCOCC1OCCO1 34a_100000210776_100000755774 [0,1,0,1,0,0|1,0,0]=3 7127 B12R1.37 ClCCCCOCC1OCCO1 7a_100000210776_100000755774 [0,1,0,1,0,0|1,0,0]=3 7128 B12R1.37 ClCCCOCCC1OCCO1 34a_100000230001_100000740749 [0,1,0,1,0,0|1,0,0]=3 7129 B12R1.37 FCCCCCOC1CCCO1 34a_100000085407_100000729378 [0,1,0,1,0,0|2,0,0]=4 7130 B12R1.37 FCCCCNCC1OCCO1 2230a_100000036311_100000729493 [0,1,0,1,0,0|1,0,0]=3 7131 B12R1.37 FCCCCNCC1OCCO1 34a_100000036311_100000729493 [0,1,0,1,0,0|1,0,0]=3 7132 B12R1.37 FCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000729493 [0,1,0,1,0,0|2,0,0]=4 7133 B12R1.37 FCCCCNC[C@@H]1CCCO1 34a_100020590478_100000729493 [0,1,0,1,0,0|2,0,0]=4 7134 B12R1.37 FCCCCOCC1CCCO1 34a_100000210270_100000729493 [0,1,0,1,0,0|2,0,0]=4 7135 B12R1.37 FCCCCOCC1CCCO1 7a_100000210270_100000729493 [0,1,0,1,0,0|2,0,0]=4 7136 B12R1.37 FCCCCOCC1CCCO1 7a_100011995726_100000203698 [0,1,0,1,0,0|2,0,0]=4 7137 B12R1.37 FCCCCOCC1OCCO1 34a_100000087154_100000729493 [0,1,0,1,0,0|1,0,0]=3 7138 B12R1.37 FCCCCOCC1OCCO1 34a_100011995726_100000755774 [0,1,0,1,0,0|1,0,0]=3 7139 B12R1.37 FCCCCOCC1OCCO1 7a_100011995726_100000755774 [0,1,0,1,0,0|1,0,0]=3 7140 B12R1.37 FCCCCSCC1CCCO1 62a_100000203698_100000729493 [0,1,0,1,0,0|2,0,0]=4 7141 B12R1.37 FCCCCSCC1CCCO1 62a_100000729493_100000203698 [0,1,0,1,0,0|2,0,0]=4 7142 B12R1.37 FCCCCSCC1OCCO1 62a_100000729493_100000755774 [0,1,0,1,0,0|1,0,0]=3 7143 B12R1.37 FCCCCSCC1OCCO1 62a_100000755774_100000729493 [0,1,0,1,0,0|1,0,0]=3 7144 B12R1.37 FCCCNCCC1OCCO1 2230a_100000034215_100011934791 [0,1,0,1,0,0|1,0,0]=3 7145 B12R1.37 FCCCNCCC1OCCO1 2230a_100015189416_100000740749 [0,1,0,1,0,0|1,0,0]=3 7146 B12R1.37 FCCCNCCC1OCCO1 34a_100000034215_100011934791 [0,1,0,1,0,0|1,0,0]=3 7147 B12R1.37 FCCCNCCC1OCCO1 34a_100015189416_100000740749 [0,1,0,1,0,0|1,0,0]=3 7148 B12R1.37 FCCCOCCC1OCCO1 34a_100000759539_100000740749 [0,1,0,1,0,0|1,0,0]=3 7149 B12R1.37 FCCCSCCC1OCCO1 62a_100011934791_100000740749 [0,1,0,1,0,0|1,0,0]=3 7150 B12R1.37 FCCNCCCC1OCCO1 34a_100000724931_100009861162 [0,1,0,1,0,0|1,0,0]=3 7151 B12R1.37 FCCOCCCC1OCCO1 34a_100009871617_100011217306 [0,1,0,1,0,0|1,0,0]=3 7152 B12R1.37 FCCOCCCC1OCCO1 7a_100009871617_100011217306 [0,1,0,1,0,0|1,0,0]=3 7153 B12R1.37 FCCSCCCC1OCCO1 62a_100011217306_100000042513 [0,1,0,1,0,0|1,0,0]=3 7154 B12R1.37 FCSCCCCC1OCCO1 62a_100015361967_100000034956 [0,1,0,1,0,0|1,0,0]=3 7155 B12R1.37 ICCCCOCC1OCCO1 34a_200012148704_100000755774 [0,1,0,1,0,0|1,0,0]=3 7156 B12R1.37 N#CCCCNCC1OCCO1 2230a_100000036311_100000687738 [0,1,0,1,0,0|1,0,1]=4 7157 B12R1.37 N#CCCCSCC1OCCO1 62a_100000687738_100000755774 [0,1,0,1,0,0|1,0,1]=4 7158 B12R1.37 N#CCCCSCC1OCCO1 62a_100000755774_100000687738 [0,1,0,1,0,0|1,0,1]=4 7159 B12R1.37 N#CCCNCCC1OCCO1 2230a_100000034215_100011215226 [0,1,0,1,0,0|1,0,1]=4 7160 B12R1.37 N#CCCSCCC1OCCO1 62a_100011215226_100000740749 [0,1,0,1,0,0|1,0,1]=4 7161 B12R1.37 N#CCOCCCC1OCCO1 7a_100009871617_100011215382 [0,1,0,1,0,0|1,0,1]=4 7162 B12R1.37 N#CCSCCCC1OCCO1 62a_100011215382_100000042513 [0,1,0,1,0,0|1,0,1]=4 7163 B12R1.37 NCCCCOCC1OCCO1 34a_100000750430_100000755774 [0,1,0,1,0,0|1,0,0]=3 7164 B12R1.37 NCCCOCCC1OCCO1 34a_100000182051_100000740749 [0,1,0,1,0,0|1,0,0]=3 7165 B12R1.37 NCCOCCCC1OCCO1 34a_100000210304_100009861162 [0,1,0,1,0,0|1,0,0]=3 7166 B12R1.37 NOCCOCCC1OCCO1 34a_100000700252_100000740749 [0,1,0,1,0,0|2,0,0]=4 7167 B12R1.37 O=CCCCNCC1OCCO1 2230a_100000036311_200011292268 [0,1,0,1,0,0|1,0,1]=4 7168 B12R1.37 O=CCCCSCC1OCCO1 62a_100000755774_200011292268 [0,1,0,1,0,0|1,0,1]=4 7169 B12R1.37 O=CCCCSCC1OCCO1 62a_200011292268_100000755774 [0,1,0,1,0,0|1,0,1]=4 7170 B12R1.37 O=CCOCCCC1OCCO1 34a_100009871617_200009817547 [0,1,0,1,0,0|1,0,1]=4 7171 B12R1.37 O=CCOCCCC1OCCO1 7a_100009871617_200015260668 [0,1,0,1,0,0|1,0,1]=4 7172 B12R1.37 O=CCSCCCC1OCCO1 62a_200015260668_100000042513 [0,1,0,1,0,0|1,0,1]=4 7173 B12R1.37 OCCCCCOC1CCCO1 34a_100000085407_100000746330 [0,1,0,1,0,0|2,0,0]=4 7174 B12R1.37 OCCCCNCC1CCCO1 2230a_100000750430_100000203698 [0,1,0,1,0,0|2,0,0]=4 7175 B12R1.37 OCCCCNCC1OCCO1 2230a_100000036311_100000210776 [0,1,0,1,0,0|1,0,0]=3 7176 B12R1.37 OCCCCNCC1OCCO1 2230a_100000750430_100000755774 [0,1,0,1,0,0|1,0,0]=3 7177 B12R1.37 OCCCCNCC1OCCO1 34a_100000036311_100011216708 [0,1,0,1,0,0|1,0,0]=3 7178 B12R1.37 OCCCCNCC1OCCO1 34a_100000750430_100000755774 [0,1,0,1,0,0|1,0,0]=3 7179 B12R1.37 OCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210776 [0,1,0,1,0,0|2,0,0]=4 7180 B12R1.37 OCCCCNC[C@@H]1CCCO1 34a_100020590478_100011216708 [0,1,0,1,0,0|2,0,0]=4 7181 B12R1.37 OCCCCOCC1CCCO1 34a_100000210270_100011216708 [0,1,0,1,0,0|2,0,0]=4 7182 B12R1.37 OCCCCOCC1CCCO1 7a_100000210270_100000210776 [0,1,0,1,0,0|2,0,0]=4 7183 B12R1.37 OCCCCOCC1OCCO1 34a_100000087154_100011216708 [0,1,0,1,0,0|1,0,0]=3 7184 B12R1.37 OCCCCSCC1CCCO1 62a_100000203698_100000210776 [0,1,0,1,0,0|2,0,0]=4 7185 B12R1.37 OCCCCSCC1CCCO1 62a_100000210776_100000203698 [0,1,0,1,0,0|2,0,0]=4 7186 B12R1.37 OCCCCSCC1OCCO1 62a_100000210776_100000755774 [0,1,0,1,0,0|1,0,0]=3 7187 B12R1.37 OCCCCSCC1OCCO1 62a_100000755774_100000210776 [0,1,0,1,0,0|1,0,0]=3 7188 B12R1.37 OCCCNCCC1OCCO1 2230a_100000034215_100000230001 [0,1,0,1,0,0|1,0,0]=3 7189 B12R1.37 OCCCNCCC1OCCO1 34a_100000034215_100000230001 [0,1,0,1,0,0|1,0,0]=3 7190 B12R1.37 OCCCSCCC1OCCO1 62a_100011215043_100000740749 [0,1,0,1,0,0|1,0,0]=3 7191 B12R1.37 OCCNCCCC1OCCO1 2230a_100016997473_100000042513 [0,1,0,1,0,0|1,0,0]=3 7192 B12R1.37 OCCNCCCC1OCCO1 34a_100016990907_100009861162 [0,1,0,1,0,0|1,0,0]=3 7193 B12R1.37 OCCOCCCC1OCCO1 34a_100009871617_100000211926 [0,1,0,1,0,0|1,0,0]=3 7194 B12R1.37 OCCOCCCC1OCCO1 7a_100009871617_100000211926 [0,1,0,1,0,0|1,0,0]=3 7195 B12R1.37 OCCSCCCC1OCCO1 62a_100000211926_100000042513 [0,1,0,1,0,0|1,0,0]=3 7196 B12R1.37 [13CH3]OCCCCOC1CCCO1 34a_100011018183_200025704644 [0,1,0,1,0,0|2,0,0]=4 7197 B12R1.37 [13CH3]OCCCCOC1CCCO1 7a_100011018183_200025704644 [0,1,0,1,0,0|2,0,0]=4 7198 B12R1.71 CCCCC1CCC(CC1)NC 2230a_100000745173_200000210301 [0,1,0,1,0,0|2,0,0]=4 7199 B12R1.71 CCCCC1CCC(CC1)NC 34a_100000745173_200000210301 [0,1,0,1,0,0|2,0,0]=4 7200 B12R1.71 CCCCC1CCC(CC1)N[13CH3] 2230a_100000745173_200025704644 [0,1,0,1,0,0|2,0,0]=4 7201 B12R1.71 CCCCC1CCC(CC1)N[13CH3] 34a_100000745173_200025704644 [0,1,0,1,0,0|2,0,0]=4 7202 B12R1.71 CCCCC1CCC(CC1)OC 34a_200000035503_200000210301 [0,1,0,1,0,0|1,0,0]=3 7203 B12R1.71 CCCCC1CCC(CC1)OC 7a_200000035503_200000210301 [0,1,0,1,0,0|1,0,0]=3 7204 B12R1.71 CCCCC1CCC(CC1)O[13CH3] 34a_200000035503_200025704644 [0,1,0,1,0,0|1,0,0]=3 7205 B12R1.71 CCCCC1CCC(CC1)O[13CH3] 7a_200000035503_200025704644 [0,1,0,1,0,0|1,0,0]=3 7206 B12R1.71 CCCCN1CCC(CC1)CC 2230a_100000754474_100000210211 [0,1,0,1,0,0|2,0,0]=4 7207 B12R1.71 CCCCN1CCC(CC1)CC 269982a_100000754474_100000210211 [0,1,0,1,0,0|2,0,0]=4 7208 B12R1.71 CCCCN1CCC(CC1)CC 34a_100000754474_100000210210 [0,1,0,1,0,0|2,0,0]=4 7209 B12R1.71 CCCCN1CCC(CC1)NC 2230a_100000746687_200000210301 [0,1,0,1,0,0|2,0,0]=4 7210 B12R1.71 CCCCN1CCC(CC1)NC 270004a_106832991635_100000228144 [0,1,0,1,0,0|2,0,0]=4 7211 B12R1.71 CCCCN1CCC(CC1)N[13CH3] 2230a_100000746687_200025704644 [0,1,0,1,0,0|2,0,0]=4 7212 B12R1.71 CCCCN1CCC(CC1)OC 2230a_100000234800_100000210211 [0,1,0,1,0,0|1,0,0]=3 7213 B12R1.71 CCCCN1CCC(CC1)OC 269982a_100000234800_100000210211 [0,1,0,1,0,0|1,0,0]=3 7214 B12R1.71 CCCCN1CCC(CC1)OC 34a_100000234800_100000210210 [0,1,0,1,0,0|1,0,0]=3 7215 B12R1.71 CCCCN1CCC(CC1)SC 2230a_100015202541_100000210211 [0,1,0,1,0,0|1,1,0]=4 7216 B12R1.71 CCCCN1CCC(CC1)SC 269982a_100015202541_100000210211 [0,1,0,1,0,0|1,1,0]=4 7217 B12R1.71 CCCCN1CCC(CC1)SC 34a_100015202541_100000210210 [0,1,0,1,0,0|1,1,0]=4 7218 B12R1.71 CCCNC1CCC(CC1)CC 2230a_100011194317_100000210303 [0,1,0,1,0,0|2,0,0]=4 7219 B12R1.71 CCCNC1CCC(CC1)CC 270004a_100020643023_100000210631 [0,1,0,1,0,0|2,0,0]=4 7220 B12R1.71 CCCNC1CCC(CC1)CC 34a_100011194317_100000210303 [0,1,0,1,0,0|2,0,0]=4 7221 B12R1.71 CCCNC1CCC(CC1)NC 270004a_100020643023_200016988011 [0,1,0,1,0,0|2,0,0]=4 7222 B12R1.71 CCCNC1CCC(CC1)OC 270004a_100020643023_100000747084 [0,1,0,1,0,0|1,0,0]=3 7223 B12R1.71 CCCNC1CCC(CC1)OC 34a_100015205214_100000210303 [0,1,0,1,0,0|1,0,0]=3 7224 B12R1.71 CCCOC1CCC(CC1)CC 34a_100011215326_100000210303 [0,1,0,1,0,0|2,0,0]=4 7225 B12R1.71 CCCOC1CCC(CC1)CC 7a_100011215326_100000210303 [0,1,0,1,0,0|2,0,0]=4 7226 B12R1.71 CCCOC1CCC(CC1)OC 34a_100011581665_100000210303 [0,1,0,1,0,0|1,0,0]=3 7227 B12R1.71 CCCOC1CCC(CC1)OC 7a_100011581665_100000210303 [0,1,0,1,0,0|1,0,0]=3 7228 B12R1.71 CCCO[C@H]1CC[C@H](CC1)NC 34a_100020636401_100000210303 [0,1,0,1,0,0|2,0,0]=4 7229 B12R1.71 CCNCC1CCC(CC1)OC 2230a_100015525214_100013032858 [0,1,0,1,0,0|1,0,0]=3 7230 B12R1.71 CCOCC1CCC(CC1)OC 34a_100121572206_100013032858 [0,1,0,1,0,0|1,0,0]=3 7231 B12R1.71 CCOCN1CCC(CC1)OC 269982a_100000234800_100000739092 [0,1,0,1,0,0|2,0,0]=4 7232 B12R1.71 CCOC[C@H]1CC[C@@H](CC1)NC 34a_100009831571_100000210202 [0,1,0,1,0,0|2,0,0]=4 7233 B12R1.71 CCSCC1CCC(CC1)OC 62a_100000210202_100013032858 [0,1,0,1,0,0|1,0,0]=3 7234 B12R1.71 CCSCC1CCC(CC1)OC 62a_100013032858_100000210202 [0,1,0,1,0,0|1,0,0]=3 7235 B12R1.71 CNCCC1CCC(CC1)OC 34a_100011998350_200000210301 [0,1,0,1,0,0|1,0,0]=3 7236 B12R1.71 COC1CCC(CC1)CCN[13CH3] 34a_100011998350_200025704644 [0,1,0,1,0,0|1,0,0]=3 7237 B12R1.71 COC1CCC(CC1)CSCF 62a_100013032858_100015361967 [0,1,0,1,0,0|2,0,0]=4 7238 B12R1.71 COC1CCC(CC1)CSCF 62a_100015361967_100013032858 [0,1,0,1,0,0|2,0,0]=4 7239 B12R1.71 COC1CCC(CC1)NCCF 34a_100015205214_100011217306 [0,1,0,1,0,0|2,0,0]=4 7240 B12R1.71 COC1CCC(CC1)NCCO 270004a_100000210304_100000747084 [0,1,0,1,0,0|2,0,0]=4 7241 B12R1.71 COC1CCC(CC1)NCCO 34a_100015205214_100000211926 [0,1,0,1,0,0|2,0,0]=4 7242 B12R1.71 COC1CCC(CC1)NCSC 34a_100015205214_100011218213 [0,1,0,1,0,0|2,0,0]=4 7243 B12R1.71 COC1CCC(CC1)OCCF 34a_100011581665_100011217306 [0,1,0,1,0,0|2,0,0]=4 7244 B12R1.71 COC1CCC(CC1)OCCF 7a_100011581665_100011217306 [0,1,0,1,0,0|2,0,0]=4 7245 B12R1.71 COC1CCC(CC1)OCCO 34a_100011581665_100000211926 [0,1,0,1,0,0|2,0,0]=4 7246 B12R1.71 COC1CCC(CC1)OCCO 7a_100011581665_100000211926 [0,1,0,1,0,0|2,0,0]=4 7247 B12R1.71 COC1CCC(CC1)OCSC 34a_100011581665_100011218213 [0,1,0,1,0,0|2,0,0]=4 7248 B12R1.71 COC1CCN(CC1)CCCF 2230a_100000234800_100011934791 [0,1,0,1,0,0|2,0,0]=4 7249 B12R1.71 COC1CCN(CC1)CCCF 269982a_100000234800_100011934791 [0,1,0,1,0,0|2,0,0]=4 7250 B12R1.71 COC1CCN(CC1)CCCF 34a_100000234800_100011934791 [0,1,0,1,0,0|2,0,0]=4 7251 B12R1.71 COC1CCN(CC1)CCCO 2230a_100000234800_100000230001 [0,1,0,1,0,0|2,0,0]=4 7252 B12R1.71 COC1CCN(CC1)CCCO 269982a_100000234800_100011215043 [0,1,0,1,0,0|2,0,0]=4 7253 B12R1.71 COC1CCN(CC1)CCCO 34a_100000234800_100000230001 [0,1,0,1,0,0|2,0,0]=4 7254 B12R1.71 COC1CCN(CC1)CCSC 2230a_100000234800_100000751147 [0,1,0,1,0,0|2,0,0]=4 7255 B12R1.71 COC1CCN(CC1)CCSC 269982a_100000234800_100000212216 [0,1,0,1,0,0|2,0,0]=4 7256 B12R1.71 COC1CCN(CC1)CCSC 34a_100000234800_100000212216 [0,1,0,1,0,0|2,0,0]=4 7257 B12R1.71 COCCN1CCC(CC1)OC 2230a_100000234800_100011201679 [0,1,0,1,0,0|2,0,0]=4 7258 B12R1.71 COCCN1CCC(CC1)OC 269982a_100000234800_100000233755 [0,1,0,1,0,0|2,0,0]=4 7259 B12R1.71 COCCN1CCC(CC1)OC 34a_100000234800_100011201679 [0,1,0,1,0,0|2,0,0]=4 7260 B12R1.83 CCC(CC)N1CCCC1CC 269982a_100000754278_100000210505 [0,1,0,1,0,0|2,0,0]=4 7261 B12R1.83 CCC(CC)N1CCCC1CC 270004a_100000754278_100000210860 [0,1,0,1,0,0|2,0,0]=4 7262 B12R1.245 COC(CCN1CCC1C)OC 269982a_100000755817_100000139399 [0,1,0,1,0,0|0,0,0]=2 7263 B12R1.245 COC(CCN1CCC1C)OC 34a_100000755817_100000139399 [0,1,0,1,0,0|0,0,0]=2 7264 B12R1.245 COC(COC1CCC1=O)OC 34a_100011216393_100009892977 [0,1,0,1,0,0|1,0,1]=4 7265 B12R1.245 COC(CSC1CCC1=O)OC 62a_100000751394_100009892977 [0,1,0,1,0,0|1,0,1]=4 7266 B12R1.245 COC(CSC1CCC1=O)OC 62a_100009892977_100000751394 [0,1,0,1,0,0|1,0,1]=4 7267 B12R1.249 CCC(CC)CNCC1CCC1 2230a_100000738700_100011215472 [0,1,0,1,0,0|2,0,0]=4 7268 B12R1.249 CCC(CC)CNCC1CCC1 2230a_100102946423_100000763275 [0,1,0,1,0,0|2,0,0]=4 7269 B12R1.249 CCC(CC)CNCC1CCC1 269862a_100000738700_100000211137 [0,1,0,1,0,0|2,0,0]=4 7270 B12R1.249 CCC(CC)CNCC1CCC1 269862a_100102946423_100000753134 [0,1,0,1,0,0|2,0,0]=4 7271 B12R1.249 CCC(CC)CNCC1CCC1 270004a_100000738700_100000211137 [0,1,0,1,0,0|2,0,0]=4 7272 B12R1.249 CCC(CC)CNCC1CCC1 34a_100000738700_100011215472 [0,1,0,1,0,0|2,0,0]=4 7273 B12R1.249 CCC(CC)COCC1CCC1 34a_100000760304_100011215472 [0,1,0,1,0,0|2,0,0]=4 7274 B12R1.249 CCC(CC)COCC1CCC1 7a_100000703878_100000763275 [0,1,0,1,0,0|2,0,0]=4 7275 B12R1.249 CCC(CC)CSCC1CCC1 62a_100000763275_100011215472 [0,1,0,1,0,0|2,0,0]=4 7276 B12R1.249 CCC(CC)CSCC1CCC1 62a_100011215472_100000763275 [0,1,0,1,0,0|2,0,0]=4 7277 B12R1.249 CCC(CNCC1CCC1)OC 269862a_100000731041_100000753134 [0,1,0,1,0,0|1,0,0]=3 7278 B12R1.249 CCC(COCC1CCC1)OC 34a_100011934954_100000763275 [0,1,0,1,0,0|1,0,0]=3 7279 B12R1.249 CCC(COCC1CCC1)OC 7a_100011934954_100000763275 [0,1,0,1,0,0|1,0,0]=3 7280 B12R1.249 CCC(COCC1CCO1)OC 34a_100011934954_100000103362 [0,1,0,1,0,0|2,0,0]=4 7281 B12R1.249 CCC(COCC1CCO1)OC 7a_100011934954_100000103362 [0,1,0,1,0,0|2,0,0]=4 7282 B12R1.249 CCC(COCC1COC1)OC 34a_100011934954_100010264016 [0,1,0,1,0,0|2,0,0]=4 7283 B12R1.249 CCC(COCC1COC1)OC 7a_100011934954_100010264016 [0,1,0,1,0,0|2,0,0]=4 7284 B12R1.249 COC(C=NNC1CCC1)OC 4a_100000736358_100000752162 [0,1,0,1,0,0|1,0,1]=4 7285 B12R1.249 COC(CCCN1CCC1)OC 269982a_100000754969_100000069011 [0,1,0,1,0,0|0,0,0]=2 7286 B12R1.249 COC(CCNC1CCC1)OC 2230a_100000749019_100009813347 [0,1,0,1,0,0|0,0,0]=2 7287 B12R1.249 COC(CCNC1CCC1)OC 34a_100000749019_100000139399 [0,1,0,1,0,0|0,0,0]=2 7288 B12R1.249 COC(CCNC1COC1)OC 2230a_100016991112_100009813347 [0,1,0,1,0,0|1,0,0]=3 7289 B12R1.249 COC(CCOC1CCC1)OC 34a_100000748187_100000139399 [0,1,0,1,0,0|0,0,0]=2 7290 B12R1.249 COC(CCOC1CSC1)OC 7a_100000072292_100009813347 [0,1,0,1,0,0|1,0,0]=3 7291 B12R1.249 COC(CCSC1CCC1)OC 62a_100000139399_100000749161 [0,1,0,1,0,0|0,0,0]=2 7292 B12R1.249 COC(CCSC1COC1)OC 62a_100000139399_100009818527 [0,1,0,1,0,0|1,0,0]=3 7293 B12R1.249 COC(CNCC1CCC1)OC 2230a_100000738700_100000751394 [0,1,0,1,0,0|0,0,0]=2 7294 B12R1.249 COC(CNCC1CCC1)OC 270004a_100000738700_100000752162 [0,1,0,1,0,0|0,0,0]=2 7295 B12R1.249 COC(CNCC1CCC1)OC 34a_100000738700_100000211822 [0,1,0,1,0,0|0,0,0]=2 7296 B12R1.249 COC(CNCC1COC1)OC 2230a_100015281925_100000751394 [0,1,0,1,0,0|1,0,0]=3 7297 B12R1.249 COC(CNCC1COC1)OC 270004a_100015281925_100000752162 [0,1,0,1,0,0|1,0,0]=3 7298 B12R1.249 COC(CNCC1COC1)OC 34a_100015281925_100000211822 [0,1,0,1,0,0|1,0,0]=3 7299 B12R1.249 COC(CNC[C@@H]1CCO1)OC 2230a_100020831831_100000751394 [0,1,0,1,0,0|1,0,0]=3 7300 B12R1.249 COC(CNC[C@@H]1CCO1)OC 270004a_100020831831_100000752162 [0,1,0,1,0,0|1,0,0]=3 7301 B12R1.249 COC(CNC[C@@H]1CCO1)OC 34a_100020831831_100000211822 [0,1,0,1,0,0|1,0,0]=3 7302 B12R1.249 COC(COCC1CCC1)OC 34a_100000760304_100000211822 [0,1,0,1,0,0|0,0,0]=2 7303 B12R1.249 COC(COCC1CCC1)OC 34a_100011216393_100000763275 [0,1,0,1,0,0|0,0,0]=2 7304 B12R1.249 COC(COCC1CCO1)OC 34a_100000039022_100000211822 [0,1,0,1,0,0|1,0,0]=3 7305 B12R1.249 COC(COCC1CCO1)OC 34a_100011216393_100000103362 [0,1,0,1,0,0|1,0,0]=3 7306 B12R1.249 COC(COCC1CNC1)OC 34a_100016987283_100000211822 [0,1,0,1,0,0|1,0,0]=3 7307 B12R1.249 COC(COCC1COC1)OC 34a_100000060846_100000211822 [0,1,0,1,0,0|1,0,0]=3 7308 B12R1.249 COC(COCC1COC1)OC 34a_100011216393_100010264016 [0,1,0,1,0,0|1,0,0]=3 7309 B12R1.249 COC(CSCC1CCC1)OC 62a_100000751394_100000763275 [0,1,0,1,0,0|0,0,0]=2 7310 B12R1.249 COC(CSCC1CCC1)OC 62a_100000763275_100000751394 [0,1,0,1,0,0|0,0,0]=2 7311 B12R1.249 COC(CSCC1CCO1)OC 62a_100000103362_100000751394 [0,1,0,1,0,0|1,0,0]=3 7312 B12R1.249 COC(CSCC1CCO1)OC 62a_100000751394_100000103362 [0,1,0,1,0,0|1,0,0]=3 7313 B12R1.249 COC(CSCC1COC1)OC 62a_100000751394_100010264016 [0,1,0,1,0,0|1,0,0]=3 7314 B12R1.249 COC(CSCC1COC1)OC 62a_100010264016_100000751394 [0,1,0,1,0,0|1,0,0]=3 7315 B12R1.455 CCCCCN1CC[C@H](C1)OC 2230a_100000766984_100000210326 [0,1,0,1,0,0|1,0,0]=3 7316 B12R1.455 CCCCCN1CC[C@H](C1)OC 269982a_100000766984_100000210215 [0,1,0,1,0,0|1,0,0]=3 7317 B12R1.455 CCCCNC1CCC(C1)CC 270004a_100000102301_100011218773 [0,1,0,1,0,0|2,0,0]=4 7318 B12R1.455 CCOCCN1CC[C@H](C1)OC 2230a_100000766984_100011215890 [0,1,0,1,0,0|2,0,0]=4 7319 B12R1.455 CCOCCN1CC[C@H](C1)OC 269982a_100000766984_100011215890 [0,1,0,1,0,0|2,0,0]=4 7320 B12R1.455 CCSCCN1CC[C@H](C1)OC 2230a_100000766984_100000757381 [0,1,0,1,0,0|2,0,0]=4 7321 B12R1.455 CCSCCN1CC[C@H](C1)OC 269982a_100000766984_100000757381 [0,1,0,1,0,0|2,0,0]=4 7322 B12R1.455 COCCCN1CC[C@H](C1)OC 2230a_100000766984_100000740836 [0,1,0,1,0,0|2,0,0]=4 7323 B12R1.455 COCCCN1CC[C@H](C1)OC 269982a_100000766984_100000740836 [0,1,0,1,0,0|2,0,0]=4 7324 B12R1.455 CO[C@@H]1CCN(C1)CCCCF 2230a_100000766984_100000729493 [0,1,0,1,0,0|2,0,0]=4 7325 B12R1.455 CO[C@@H]1CCN(C1)CCCCF 269982a_100000766984_100000729493 [0,1,0,1,0,0|2,0,0]=4 7326 B12R1.455 CO[C@@H]1CCN(C1)CCCCO 2230a_100000766984_100000210776 [0,1,0,1,0,0|2,0,0]=4 7327 B12R1.455 CO[C@@H]1CCN(C1)CCCCO 269982a_100000766984_100000210776 [0,1,0,1,0,0|2,0,0]=4 7328 B12R1.1287 CCC(CC)N1CCCCCC1 269982a_100000185865_100000210505 [0,1,0,1,0,0|2,0,0]=4 7329 B12R1.1287 CCC(CC)N1CCCCCC1 270004a_100000185865_100000210860 [0,1,0,1,0,0|2,0,0]=4 7330 B12R1.3670 CCC1(CO1)CNCCCCO 34a_100000750430_200000139556 [0,1,0,1,0,0|2,0,0]=4 7331 B12R1.3670 CCC1(CO1)CNCCCOC 34a_100150723488_200000139556 [0,1,0,1,0,0|2,0,0]=4 7332 B12R1.3670 CCC1(CO1)COCCCCBr 34a_100011216708_200000139556 [0,1,0,1,0,0|2,0,0]=4 7333 B12R1.3670 CCC1(CO1)COCCCCCl 34a_100000210776_200000139556 [0,1,0,1,0,0|2,0,0]=4 7334 B12R1.3670 CCC1(CO1)COCCCCCl 7a_100000210776_200000139556 [0,1,0,1,0,0|2,0,0]=4 7335 B12R1.3670 CCC1(CO1)COCCCCF 34a_100011995726_200000139556 [0,1,0,1,0,0|2,0,0]=4 7336 B12R1.3670 CCC1(CO1)COCCCCF 7a_100011995726_200000139556 [0,1,0,1,0,0|2,0,0]=4 7337 B12R1.3670 CCC1(CO1)COCCCCI 34a_200012148704_200000139556 [0,1,0,1,0,0|2,0,0]=4 7338 B12R1.3670 CCC1(CO1)COCCCCN 34a_100000750430_200000139556 [0,1,0,1,0,0|2,0,0]=4 7339 B12R1.3670 CCC1(CO1)COCCCNC 34a_100000213112_200000139556 [0,1,0,1,0,0|2,0,0]=4 7340 B12R1.3670 CCC1(CO1)COCCCOC 34a_100000740835_200000139556 [0,1,0,1,0,0|2,0,0]=4 7341 B12R1.3670 CCC1(CO1)COCCCSC 34a_100000690336_200000139556 [0,1,0,1,0,0|2,0,0]=4 7342 B12R1.3670 CCC1(CO1)COCCCSC 7a_100000690336_200000139556 [0,1,0,1,0,0|2,0,0]=4 7343 B12R1.3670 CCC1(CO1)CSCCCCF 62a_100000729493_200000139556 [0,1,0,1,0,0|2,0,0]=4 7344 B12R1.3670 CCC1(CO1)CSCCCCF 62a_200000139556_100000729493 [0,1,0,1,0,0|2,0,0]=4 7345 B12R1.3670 CCC1(CO1)CSCCCCO 62a_100000210776_200000139556 [0,1,0,1,0,0|2,0,0]=4 7346 B12R1.3670 CCC1(CO1)CSCCCCO 62a_200000139556_100000210776 [0,1,0,1,0,0|2,0,0]=4 7347 B12R1.3670 CCC1(CO1)CSCCCOC 62a_100000709357_200000139556 [0,1,0,1,0,0|2,0,0]=4 7348 B12R1.3670 CCC1(CO1)CSCCCOC 62a_200000139556_100000709357 [0,1,0,1,0,0|2,0,0]=4 7349 B12R1.3670 CCCCCCNC1(CC1)CC 2230a_100000732774_100000210314 [0,1,0,1,0,0|2,0,0]=4 7350 B12R1.3670 CCCCCOCC1(CO1)CC 34a_100000210253_200000139556 [0,1,0,1,0,0|1,0,0]=3 7351 B12R1.3670 CCCCCOCC1(CO1)CC 7a_100000210253_200000139556 [0,1,0,1,0,0|1,0,0]=3 7352 B12R1.3670 CCCCCSCC1(CO1)CC 62a_100000210326_200000139556 [0,1,0,1,0,0|1,0,0]=3 7353 B12R1.3670 CCCCCSCC1(CO1)CC 62a_200000139556_100000210326 [0,1,0,1,0,0|1,0,0]=3 7354 B12R1.3670 CCOCCNCC1(CO1)CC 34a_102516460346_200000139556 [0,1,0,1,0,0|2,0,0]=4 7355 B12R1.3670 CCOCCOCC1(CO1)CC 34a_100000210136_200000139556 [0,1,0,1,0,0|2,0,0]=4 7356 B12R1.3670 CCOCCOCC1(CO1)CC 7a_100000210136_200000139556 [0,1,0,1,0,0|2,0,0]=4 7357 B12R1.3670 CCOCCSCC1(CO1)CC 62a_100000210147_200000139556 [0,1,0,1,0,0|2,0,0]=4 7358 B12R1.3670 CCOCCSCC1(CO1)CC 62a_200000139556_100011215890 [0,1,0,1,0,0|2,0,0]=4 7359 B12R1.3670 CCSCCOCC1(CO1)CC 34a_100000212035_200000139556 [0,1,0,1,0,0|2,0,0]=4 7360 B12R1.3670 CCSCCOCC1(CO1)CC 7a_100000212035_200000139556 [0,1,0,1,0,0|2,0,0]=4 7361 B12R1.3670 CCSCCSCC1(CO1)CC 62a_100000757381_200000139556 [0,1,0,1,0,0|2,0,0]=4 7362 B12R1.3670 CCSCCSCC1(CO1)CC 62a_200000139556_100000757381 [0,1,0,1,0,0|2,0,0]=4 7363 B12R1.35 CCCCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210326 [0,1,0,1,0,0|1,0,1]=4 7364 B12R1.35 CCCCNC(C)C1CCCO1 2230a_100025754208_100000210211 [0,1,0,1,0,0|2,0,0]=4 7365 B12R1.35 CCCCNC(C)C1CCCO1 34a_100025754208_100000210210 [0,1,0,1,0,0|2,0,0]=4 7366 B12R1.45 CCCCCC1CCCC1NC 269862a_106832991636_200000198059 [0,1,0,1,0,0|2,0,0]=4 7367 B12R1.45 CCCCCC1CCCC1NC 270004a_106832991635_200000198059 [0,1,0,1,0,0|2,0,0]=4 7368 B12R1.74 CCC(OC)C(=O)C1CCCC1 1458a_100000747056_100000179811 [0,1,0,1,0,0|1,0,1]=4 7369 B12R1.74 COC(OC)C(=O)C1CCCC1 1458a_100000046285_100000179811 [0,1,0,1,0,0|0,0,1]=3 7370 B12R1.74 COC(OC)C(=O)C1CCOC1 1458a_100000046285_100000690089 [0,1,0,1,0,0|1,0,1]=4 7371 B12R1.74 COC(OC)C(=O)N1CCCC1 240690a_100000188435_100000046285 [0,1,0,1,0,0|1,0,1]=4 7372 B12R1.74 COC(OC)C(=O)N1CCCC1 527a_100000188435_100000046285 [0,1,0,1,0,0|1,0,1]=4 7373 B12R1.74 COC(OC)C(C)N1CCCC1 270004a_100000188435_100000211384 [0,1,0,1,0,0|1,0,0]=3 7374 B12R1.74 COC(OC)C(C)N1CCSC1 270004a_100011215254_100000211384 [0,1,0,1,0,0|2,0,0]=4 7375 B12R1.639 COC(OC)C(C)N[C@@H]1C[C@H]1F 34a_100025746932_100011222894 [0,1,0,1,0,0|2,0,0]=4 7376 B12R1.640 CCC(OC)C(=O)CC1CCC1 1458a_100000747056_100000763275 [0,1,0,1,0,0|1,0,1]=4 7377 B12R1.640 COC(OC)C(=O)CC1CCC1 1458a_100000046285_100000763275 [0,1,0,1,0,0|0,0,1]=3 7378 B12R1.640 COC(OC)C(=O)CC1CCO1 1458a_100000046285_100000103362 [0,1,0,1,0,0|1,0,1]=4 7379 B12R1.640 COC(OC)C(=O)CC1COC1 1458a_100000046285_100010264016 [0,1,0,1,0,0|1,0,1]=4 7380 B12R1.640 COC(OC)C(=O)NC1CCC1 11a_100000749019_100000046285 [0,1,0,1,0,0|1,0,1]=4 7381 B12R1.640 COC(OC)C(=O)NC1CCC1 240690a_100000749019_100000046285 [0,1,0,1,0,0|1,0,1]=4 7382 B12R1.640 COC(OC)C(=O)NC1CCC1 527a_100000749019_100000046285 [0,1,0,1,0,0|1,0,1]=4 7383 B12R1.640 COC(OC)C(C)NC1CCC1 34a_100000749019_100011222894 [0,1,0,1,0,0|1,0,0]=3 7384 B12R1.640 COC(OC)C(C)NC1COC1 270004a_100016991112_100000211384 [0,1,0,1,0,0|2,0,0]=4 7385 B12R1.640 COC(OC)C(C)NC1CSC1 270004a_100016994217_100000211384 [0,1,0,1,0,0|2,0,0]=4 7386 B12R1.640 COC(OC)C(C)OC1CCC1 34a_100000748187_100011222894 [0,1,0,1,0,0|1,0,0]=3 7387 B12R1.640 COC(OC)C(C)OC1CCC1 34a_100000754440_100000749161 [0,1,0,1,0,0|1,0,0]=3 7388 B12R1.640 COC(OC)C(C)OC1COC1 34a_100000754440_100009818527 [0,1,0,1,0,0|2,0,0]=4 7389 B12R1.640 COC(OC)C(C)OC1COC1 7a_100000754440_100009818527 [0,1,0,1,0,0|2,0,0]=4 7390 B12R1.640 COC(OC)C(C)SC1CCC1 62a_100011222894_100000749161 [0,1,0,1,0,0|1,0,0]=3 7391 B12R1.640 COC(OC)C(C)SC1COC1 62a_100011222894_100009818527 [0,1,0,1,0,0|2,0,0]=4 7392 B12R1.641 CCC(OC)C(=O)CCC1CC1 1458a_100000747056_100000694398 [0,1,0,1,0,0|1,0,1]=4 7393 B12R1.641 COC(OC)C(=O)CCC1CC1 1458a_100000046285_100000694398 [0,1,0,1,0,0|0,0,1]=3 7394 B12R1.641 COC(OC)C(=O)CCC1CO1 1458a_100000046285_100000732470 [0,1,0,1,0,0|1,0,1]=4 7395 B12R1.641 COC(OC)C(=O)NCC1CC1 11a_100000735609_100000046285 [0,1,0,1,0,0|1,0,1]=4 7396 B12R1.641 COC(OC)C(=O)NCC1CC1 240690a_100000735609_100000046285 [0,1,0,1,0,0|1,0,1]=4 7397 B12R1.641 COC(OC)C(=O)NCC1CC1 527a_100000735609_100000046285 [0,1,0,1,0,0|1,0,1]=4 7398 B12R1.641 COC(OC)C(C)NCC1CC1 270004a_100000735609_100000211384 [0,1,0,1,0,0|1,0,0]=3 7399 B12R1.641 COC(OC)C(C)NCC1CC1 34a_100000735609_100011222894 [0,1,0,1,0,0|1,0,0]=3 7400 B12R1.641 COC(OC)C(C)OCC1CC1 34a_100000211283_100011222894 [0,1,0,1,0,0|1,0,0]=3 7401 B12R1.641 COC(OC)C(C)OCC1CC1 34a_100000754440_100000742324 [0,1,0,1,0,0|1,0,0]=3 7402 B12R1.641 COC(OC)C(C)OCC1CC1 7a_100000754440_100000742324 [0,1,0,1,0,0|1,0,0]=3 7403 B12R1.641 COC(OC)C(C)OCC1CO1 34a_100000754440_102125554688 [0,1,0,1,0,0|2,0,0]=4 7404 B12R1.641 COC(OC)C(C)OCC1CO1 7a_100000754440_102125554688 [0,1,0,1,0,0|2,0,0]=4 7405 B12R1.641 COC(OC)C(C)OCC1CS1 7a_100000754440_100000031435 [0,1,0,1,0,0|2,0,0]=4 7406 B12R1.641 COC(OC)C(C)OC[C@@H]1CO1 34a_100000757423_100011222894 [0,1,0,1,0,0|2,0,0]=4 7407 B12R1.641 COC(OC)C(C)OC[C@@H]1CO1 7a_100000754440_100000745022 [0,1,0,1,0,0|2,0,0]=4 7408 B12R1.641 COC(OC)C(C)SCC1CC1 62a_100000756562_100011222894 [0,1,0,1,0,0|1,0,0]=3 7409 B12R1.641 COC(OC)C(C)SCC1CC1 62a_100011222894_100000742324 [0,1,0,1,0,0|1,0,0]=3 7410 B12R1.641 COC(OC)C(C)SCC1CO1 62a_100011222894_102125554688 [0,1,0,1,0,0|2,0,0]=4 7411 B12R1.641 COC(OC)C(C)SCC1CO1 62a_102125554688_100011222894 [0,1,0,1,0,0|2,0,0]=4 7412 B12R1.641 COC(OC)C(C)SCC1CS1 62a_100000031435_100011222894 [0,1,0,1,0,0|2,0,0]=4 7413 B12R1.641 COC(OC)C(C)SCC1CS1 62a_100011222894_100000031435 [0,1,0,1,0,0|2,0,0]=4 7414 B12R1.641 COC(OC)C(C)SC[C@@H]1CO1 62a_100000745022_100011222894 [0,1,0,1,0,0|2,0,0]=4 7415 B12R1.641 COC(OC)C(C)SC[C@@H]1CO1 62a_100011222894_100000745022 [0,1,0,1,0,0|2,0,0]=4 7416 B12R1.642 COC(OC)C(=O)N1CCC1C 11a_100000755817_100000046285 [0,1,0,1,0,0|1,0,1]=4 7417 B12R1.642 COC(OC)C(=O)N1CCC1C 240690a_100000755817_100000046285 [0,1,0,1,0,0|1,0,1]=4 7418 B12R1.642 COC(OC)C(=O)N1CCC1C 527a_100000755817_100000046285 [0,1,0,1,0,0|1,0,1]=4 7419 B12R1.642 COC(OC)C(C)N1CCC1C 34a_100000755817_100011222894 [0,1,0,1,0,0|1,0,0]=3 7420 B12R1.2137 CCCCCC(=O)C1(CC1)OC 1458a_100000137688_100000210326 [0,1,0,1,0,0|1,0,1]=4 7421 B12R1.3 C/C=C/C(OC)C1CCCCC1 34a_200016259495_200000210301 [0,1,0,1,0,0|1,0,0]=3 7422 B12R1.3 C/C=C/C(OC)C1CCCCC1 7a_200016259495_200000210301 [0,1,0,1,0,0|1,0,0]=3 7423 B12R1.3 C/C=C/C(O[13CH3])C1CCCCC1 34a_200016259495_200025704644 [0,1,0,1,0,0|1,0,0]=3 7424 B12R1.3 C/C=C/C(O[13CH3])C1CCCCC1 7a_200016259495_200025704644 [0,1,0,1,0,0|1,0,0]=3 7425 B12R1.3 CCC(OCF)C1CCCCC1 34a_100011215090_100015361967 [0,1,0,1,0,0|1,0,0]=3 7426 B12R1.3 CCC(OCF)C1CCCCC1 7a_100011215090_100015361967 [0,1,0,1,0,0|1,0,0]=3 7427 B12R1.3 CCC(OCF)C1CCNCC1 34a_100011935121_100015361967 [0,1,0,1,0,0|2,0,0]=4 7428 B12R1.3 CCCC(OC)C1CCCCC1 34a_100011218000_200000210301 [0,1,0,1,0,0|1,0,0]=3 7429 B12R1.3 CCCC(OC)C1CCCCC1 7a_100011218000_200000210301 [0,1,0,1,0,0|1,0,0]=3 7430 B12R1.3 CCCC(O[13CH3])C1CCCCC1 34a_100011218000_200025704644 [0,1,0,1,0,0|1,0,0]=3 7431 B12R1.3 CCCC(O[13CH3])C1CCCCC1 7a_100011218000_200025704644 [0,1,0,1,0,0|1,0,0]=3 7432 B12R1.3 CCN(COC)C1CCCCC1 2230a_100000201195_100000766300 [0,1,0,1,0,0|2,0,0]=4 7433 B12R1.3 CCN(COC)C1CCCCC1 269982a_100000201195_100000766300 [0,1,0,1,0,0|2,0,0]=4 7434 B12R1.3 CCNC(CC)C1CCCCC1 269862a_100015525214_100011216311 [0,1,0,1,0,0|2,0,0]=4 7435 B12R1.3 CCN[C@@H](CC)C1CCCCC1 2230a_100020639352_100000210202 [0,1,0,1,0,0|2,0,0]=4 7436 B12R1.3 CCN[C@@H](CC)C1CCCCC1 34a_100020639352_100000210202 [0,1,0,1,0,0|2,0,0]=4 7437 B12R1.3 CCOC(CC)C1CCCCC1 34a_100011215090_100000210202 [0,1,0,1,0,0|1,0,0]=3 7438 B12R1.3 CCOC(CC)C1CCCCC1 7a_100011215090_100000210202 [0,1,0,1,0,0|1,0,0]=3 7439 B12R1.3 CCOC(CC)C1CCNCC1 34a_100011935121_100000210202 [0,1,0,1,0,0|2,0,0]=4 7440 B12R1.3 CC[C@H](NCF)C1CCCCC1 34a_100020639352_100015361967 [0,1,0,1,0,0|2,0,0]=4 7441 B12R1.3 CNC(CCO)C1CCCCC1 2230a_200020622111_200000210301 [0,1,0,1,0,0|2,0,0]=4 7442 B12R1.3 CNC(CCO)C1CCCCC1 34a_200020622111_200000210301 [0,1,0,1,0,0|2,0,0]=4 7443 B12R1.3 [13CH3]NC(CCO)C1CCCCC1 2230a_200020622111_200025704644 [0,1,0,1,0,0|2,0,0]=4 7444 B12R1.3 [13CH3]NC(CCO)C1CCCCC1 34a_200020622111_200025704644 [0,1,0,1,0,0|2,0,0]=4 7445 B12R1.8 BrCCOCCC1OCCCO1 34a_100000211926_100000764188 [0,1,0,1,0,0|2,0,0]=4 7446 B12R1.8 CCCCCCN1CCCOC1 2230a_100000131196_100000210314 [0,1,0,1,0,0|2,0,0]=4 7447 B12R1.8 CCCCCCN1CCCOC1 269982a_100000131196_100000210757 [0,1,0,1,0,0|2,0,0]=4 7448 B12R1.8 CCCCCCN1CCCOC1 34a_100000131196_100000210314 [0,1,0,1,0,0|2,0,0]=4 7449 B12R1.8 CCCCCNC1CCCOC1 2230a_100000719290_100000210326 [0,1,0,1,0,0|2,0,0]=4 7450 B12R1.8 CCCCCNC1CCCOC1 270004a_100000209983_100000753404 [0,1,0,1,0,0|2,0,0]=4 7451 B12R1.8 CCCCCNC1CCCOC1 34a_100000719290_100000718602 [0,1,0,1,0,0|2,0,0]=4 7452 B12R1.8 CCCCCOC1CCCCO1 34a_100000033831_100000718602 [0,1,0,1,0,0|2,0,0]=4 7453 B12R1.8 CCCCCOC1CCCOC1 34a_100000210253_100000693364 [0,1,0,1,0,0|2,0,0]=4 7454 B12R1.8 CCCCCOC1CCCOC1 34a_100000754041_100000718602 [0,1,0,1,0,0|2,0,0]=4 7455 B12R1.8 CCCCCOC1CCCOC1 7a_100000210253_100000693364 [0,1,0,1,0,0|2,0,0]=4 7456 B12R1.8 CCCCCSC1CCCOC1 62a_100000210326_100000693364 [0,1,0,1,0,0|2,0,0]=4 7457 B12R1.8 CCCCNCC1CCCCO1 2230a_100000102301_100000211543 [0,1,0,1,0,0|2,0,0]=4 7458 B12R1.8 CCCCNCC1CCCCO1 2230a_100000174945_100000210211 [0,1,0,1,0,0|2,0,0]=4 7459 B12R1.8 CCCCNCC1CCCCO1 34a_100000174945_100000210210 [0,1,0,1,0,0|2,0,0]=4 7460 B12R1.8 CCCCNCC1CCCCO1 7a_106832991798_100000211543 [0,1,0,1,0,0|2,0,0]=4 7461 B12R1.8 CCCCNCC1CCCOC1 2230a_100000102301_100000741521 [0,1,0,1,0,0|2,0,0]=4 7462 B12R1.8 CCCCNCC1CCCOC1 2230a_100000720124_100000210211 [0,1,0,1,0,0|2,0,0]=4 7463 B12R1.8 CCCCNCC1CCCOC1 34a_100000720124_100000210210 [0,1,0,1,0,0|2,0,0]=4 7464 B12R1.8 CCCCNCC1CCCOC1 7a_106832991798_100000741521 [0,1,0,1,0,0|2,0,0]=4 7465 B12R1.8 CCCCNC[C@H]1COCCO1 2230a_100010981119_100000210211 [0,1,0,1,0,0|1,0,0]=3 7466 B12R1.8 CCCCNC[C@H]1COCCO1 34a_100010981119_100000210210 [0,1,0,1,0,0|1,0,0]=3 7467 B12R1.8 CCCCOCC1CCCCO1 34a_100000210227_100000211543 [0,1,0,1,0,0|2,0,0]=4 7468 B12R1.8 CCCCOCC1CCCCO1 34a_100000211370_100000210210 [0,1,0,1,0,0|2,0,0]=4 7469 B12R1.8 CCCCOCC1CCCCO1 7a_100000210227_100000211543 [0,1,0,1,0,0|2,0,0]=4 7470 B12R1.8 CCCCOCC1CCCCO1 7a_100000211370_100000210211 [0,1,0,1,0,0|2,0,0]=4 7471 B12R1.8 CCCCOCC1CCCOC1 34a_100000210227_100000741521 [0,1,0,1,0,0|2,0,0]=4 7472 B12R1.8 CCCCOCC1CCCOC1 34a_100000741520_100000210210 [0,1,0,1,0,0|2,0,0]=4 7473 B12R1.8 CCCCOCC1CCCOC1 7a_100000210227_100000741521 [0,1,0,1,0,0|2,0,0]=4 7474 B12R1.8 CCCCOC[C@@H]1CNCCO1 34a_100015189573_100000210210 [0,1,0,1,0,0|2,0,0]=4 7475 B12R1.8 CCCCOC[C@@H]1COCCN1 34a_100000717676_100000210210 [0,1,0,1,0,0|2,0,0]=4 7476 B12R1.8 CCCCOC[C@H]1COCCO1 34a_100009875890_100000210210 [0,1,0,1,0,0|1,0,0]=3 7477 B12R1.8 CCCCSCC1CCCCO1 62a_100000210211_100000211543 [0,1,0,1,0,0|2,0,0]=4 7478 B12R1.8 CCCCSCC1CCCCO1 62a_100000211543_100000210210 [0,1,0,1,0,0|2,0,0]=4 7479 B12R1.8 CCCCSCC1CCCOC1 62a_100000210211_100000741521 [0,1,0,1,0,0|2,0,0]=4 7480 B12R1.8 CCCCSCC1CCCOC1 62a_100000741521_100000210210 [0,1,0,1,0,0|2,0,0]=4 7481 B12R1.8 CCCNCCC1CCCCO1 2230a_100015183643_100000210303 [0,1,0,1,0,0|2,0,0]=4 7482 B12R1.8 CCCNCCC1CCCCO1 34a_100015183643_100000210303 [0,1,0,1,0,0|2,0,0]=4 7483 B12R1.8 CCCOCCC1OCCCO1 34a_100000210258_100000764188 [0,1,0,1,0,0|1,0,0]=3 7484 B12R1.8 CCCSCCC1OCCCO1 62a_100000210303_100000764188 [0,1,0,1,0,0|1,0,0]=3 7485 B12R1.8 CCCSCCC1OCCCO1 62a_100000764188_100000210303 [0,1,0,1,0,0|1,0,0]=3 7486 B12R1.8 COCCNC[C@H]1COCCO1 2230a_100010981119_100011201679 [0,1,0,1,0,0|2,0,0]=4 7487 B12R1.8 COCCNC[C@H]1COCCO1 34a_100010981119_100011201679 [0,1,0,1,0,0|2,0,0]=4 7488 B12R1.8 COCCOC[C@H]1COCCO1 34a_100009875890_100011201679 [0,1,0,1,0,0|2,0,0]=4 7489 B12R1.8 COCSCCC1OCCCO1 62a_100000764188_100000766300 [0,1,0,1,0,0|2,0,0]=4 7490 B12R1.8 COCSCCC1OCCCO1 62a_100000766300_100000764188 [0,1,0,1,0,0|2,0,0]=4 7491 B12R1.8 CSCCNC[C@H]1COCCO1 2230a_100010981119_100000751147 [0,1,0,1,0,0|2,0,0]=4 7492 B12R1.8 CSCCNC[C@H]1COCCO1 34a_100010981119_100000212216 [0,1,0,1,0,0|2,0,0]=4 7493 B12R1.8 CSCCOC[C@H]1COCCO1 34a_100009875890_100000212216 [0,1,0,1,0,0|2,0,0]=4 7494 B12R1.8 CSCSCCC1OCCCO1 62a_100000764188_100011218213 [0,1,0,1,0,0|2,0,0]=4 7495 B12R1.8 CSCSCCC1OCCCO1 62a_100011218213_100000764188 [0,1,0,1,0,0|2,0,0]=4 7496 B12R1.8 FCCCNC[C@H]1COCCO1 2230a_100010981119_100011934791 [0,1,0,1,0,0|2,0,0]=4 7497 B12R1.8 FCCCNC[C@H]1COCCO1 34a_100010981119_100011934791 [0,1,0,1,0,0|2,0,0]=4 7498 B12R1.8 FCCCOC[C@H]1COCCO1 34a_100009875890_100011934791 [0,1,0,1,0,0|2,0,0]=4 7499 B12R1.8 FCCNCCC1OCCCO1 34a_100000724931_100000764188 [0,1,0,1,0,0|2,0,0]=4 7500 B12R1.8 FCCSCCC1OCCCO1 62a_100000764188_100011217306 [0,1,0,1,0,0|2,0,0]=4 7501 B12R1.8 FCCSCCC1OCCCO1 62a_100011217306_100000764188 [0,1,0,1,0,0|2,0,0]=4 7502 B12R1.8 NCCOCCC1OCCCO1 34a_100000210304_100000764188 [0,1,0,1,0,0|2,0,0]=4 7503 B12R1.8 OCCCNC[C@H]1COCCO1 2230a_100010981119_100000230001 [0,1,0,1,0,0|2,0,0]=4 7504 B12R1.8 OCCCNC[C@H]1COCCO1 34a_100010981119_100000230001 [0,1,0,1,0,0|2,0,0]=4 7505 B12R1.8 OCCCOC[C@H]1COCCO1 34a_100009875890_100000230001 [0,1,0,1,0,0|2,0,0]=4 7506 B12R1.8 OCCNCCC1OCCCO1 2230a_100016997473_100000764188 [0,1,0,1,0,0|2,0,0]=4 7507 B12R1.8 OCCNCCC1OCCCO1 34a_100016990907_100000764188 [0,1,0,1,0,0|2,0,0]=4 7508 B12R1.8 OCCSCCC1OCCCO1 62a_100000211926_100000764188 [0,1,0,1,0,0|2,0,0]=4 7509 B12R1.8 OCCSCCC1OCCCO1 62a_100000764188_100000211926 [0,1,0,1,0,0|2,0,0]=4 7510 B12R1.72 CCC(COC)NC1CCCC1 2230a_100000757820_100000179811 [0,1,0,1,0,0|2,0,0]=4 7511 B12R1.72 CCC(COC)NC1CCCC1 270004a_100000211070_100000757811 [0,1,0,1,0,0|2,0,0]=4 7512 B12R1.72 CCC(COC)NC1CCCC1 270004a_100000757820_100000210133 [0,1,0,1,0,0|2,0,0]=4 7513 B12R1.72 CCC(COC)OC1CCCC1 7a_200011214946_100000179811 [0,1,0,1,0,0|2,0,0]=4 7514 B12R1.116 CCCC1CCC(CC1)NCC 2230a_100011234333_100000210202 [0,1,0,1,0,0|2,0,0]=4 7515 B12R1.116 CCCC1CCC(CC1)NCC 270004a_100015525214_100000185488 [0,1,0,1,0,0|2,0,0]=4 7516 B12R1.116 CCCC1CCC(CC1)NCC 34a_100011234333_100000210202 [0,1,0,1,0,0|2,0,0]=4 7517 B12R1.116 CCCC1CCC(CC1)NCF 34a_100011234333_100015361967 [0,1,0,1,0,0|2,0,0]=4 7518 B12R1.116 CCCC1CCC(CC1)OCC 34a_100011218949_100000210202 [0,1,0,1,0,0|1,0,0]=3 7519 B12R1.116 CCCC1CCC(CC1)OCC 7a_100011218949_100000210202 [0,1,0,1,0,0|1,0,0]=3 7520 B12R1.116 CCCC1CCC(CC1)OCF 34a_100011218949_100015361967 [0,1,0,1,0,0|1,0,0]=3 7521 B12R1.116 CCCC1CCC(CC1)OCF 7a_100011218949_100015361967 [0,1,0,1,0,0|1,0,0]=3 7522 B12R1.116 CCCC1CCN(CC1)COC 2230a_100015355601_100000766300 [0,1,0,1,0,0|2,0,0]=4 7523 B12R1.116 CCCC1CCN(CC1)COC 269982a_100015355601_100000766300 [0,1,0,1,0,0|2,0,0]=4 7524 B12R1.116 CCCN1CCC(CC1)COC 2230a_100000755097_100000210303 [0,1,0,1,0,0|2,0,0]=4 7525 B12R1.116 CCCN1CCC(CC1)COC 269982a_100000755097_100000210303 [0,1,0,1,0,0|2,0,0]=4 7526 B12R1.116 CCCN1CCC(CC1)COC 34a_100000755097_100000210303 [0,1,0,1,0,0|2,0,0]=4 7527 B12R1.116 CCCN1CCC(CC1)OCC 2230a_100016990603_100000210303 [0,1,0,1,0,0|2,0,0]=4 7528 B12R1.116 CCCN1CCC(CC1)OCC 269982a_100016990603_100000210303 [0,1,0,1,0,0|2,0,0]=4 7529 B12R1.116 CCCN1CCC(CC1)OCC 34a_100016990603_100000210303 [0,1,0,1,0,0|2,0,0]=4 7530 B12R1.116 CCNC1CCC(CC1)OCC 270004a_100015525214_100012183323 [0,1,0,1,0,0|2,0,0]=4 7531 B12R1.116 CCOC1CCC(CC1)CCN 34a_200011935226_100000210202 [0,1,0,1,0,0|2,0,0]=4 7532 B12R1.116 COCC1CCC(CC1)COC 34a_200010371891_200000210301 [0,1,0,1,0,0|2,0,0]=4 7533 B12R1.116 COCC1CCC(CC1)COC 7a_200010371891_200000210301 [0,1,0,1,0,0|2,0,0]=4 7534 B12R1.116 COCC1CCC(CC1)CO[13CH3] 34a_200010371891_200025704644 [0,1,0,1,0,0|2,0,0]=4 7535 B12R1.116 COCC1CCC(CC1)CO[13CH3] 7a_200010371891_200025704644 [0,1,0,1,0,0|2,0,0]=4 7536 B12R1.116 NCCC1CCC(CC1)OCF 34a_200011935226_100015361967 [0,1,0,1,0,0|2,0,0]=4 7537 B12R1.134 CCC(COC)N1CCC[C@@H]1C 270004a_100020605311_100000757811 [0,1,0,1,0,0|2,0,0]=4 7538 B12R1.134 CCC(COC)N1CCC[C@H]1C 270004a_100015189458_100000757811 [0,1,0,1,0,0|2,0,0]=4 7539 B12R1.137 CCC(COC)NCC1CCC1 2230a_100000757820_100000763275 [0,1,0,1,0,0|2,0,0]=4 7540 B12R1.137 CCC(COC)NCC1CCC1 269862a_100000757820_100000753134 [0,1,0,1,0,0|2,0,0]=4 7541 B12R1.137 CCC(COC)NCC1CCC1 270004a_100000738700_100000757811 [0,1,0,1,0,0|2,0,0]=4 7542 B12R1.137 CCC(COC)OCC1CCC1 7a_200011214946_100000763275 [0,1,0,1,0,0|2,0,0]=4 7543 B12R1.137 CCOC(CC)CNC1CCC1 270004a_100015183923_100000241760 [0,1,0,1,0,0|2,0,0]=4 7544 B12R1.137 CCOC(CC)CNC1CCC1 34a_100015183923_100000749161 [0,1,0,1,0,0|2,0,0]=4 7545 B12R1.138 CCC(COC)NCCC1CC1 2230a_100000757820_100000694398 [0,1,0,1,0,0|2,0,0]=4 7546 B12R1.138 CCC(COC)NCCC1CC1 270004a_100000764129_100000757811 [0,1,0,1,0,0|2,0,0]=4 7547 B12R1.138 CCC(COC)OCCC1CC1 7a_200011214946_100000764125 [0,1,0,1,0,0|2,0,0]=4 7548 B12R1.138 CCOC(CC)CNCC1CC1 2230a_100015183923_100000742324 [0,1,0,1,0,0|2,0,0]=4 7549 B12R1.138 CCOC(CC)CNCC1CC1 269862a_100015183923_100000741477 [0,1,0,1,0,0|2,0,0]=4 7550 B12R1.138 CCOC(CC)CNCC1CC1 34a_100015183923_100000742324 [0,1,0,1,0,0|2,0,0]=4 7551 B12R1.173 CCNC1CCCCCCCC1 270004a_100015525214_100000038600 [0,1,0,1,0,0|2,0,0]=4 7552 B12R1.173 COCN1CCCCCCCC1 2230a_100000039187_100000766300 [0,1,0,1,0,0|2,0,0]=4 7553 B12R1.173 COCN1CCCCCCCC1 269982a_100000039187_100000766300 [0,1,0,1,0,0|2,0,0]=4 7554 B12R1.340 CCCCN1CCC(C1)COC 2230a_100025706693_100000210211 [0,1,0,1,0,0|2,0,0]=4 7555 B12R1.340 CCCCN1CCC(C1)COC 269982a_100025706693_100000210211 [0,1,0,1,0,0|2,0,0]=4 7556 B12R1.340 CCCCN1CCC(C1)COC 34a_100025706693_100000210210 [0,1,0,1,0,0|2,0,0]=4 7557 B12R1.340 CCCCN1CC[C@@H](C1)OCC 2230a_100011787710_100000210211 [0,1,0,1,0,0|2,0,0]=4 7558 B12R1.340 CCCCN1CC[C@@H](C1)OCC 269982a_100011787710_100000210211 [0,1,0,1,0,0|2,0,0]=4 7559 B12R1.340 CCCCN1CC[C@@H](C1)OCC 34a_100011787710_100000210210 [0,1,0,1,0,0|2,0,0]=4 7560 B12R1.458 CCCCCN1CCC1COC 2230a_100015195929_100000210326 [0,1,0,1,0,0|2,0,0]=4 7561 B12R1.458 CCCCCN1CCC1COC 269982a_100015195929_100000210215 [0,1,0,1,0,0|2,0,0]=4 7562 B12R1.458 CCCCCN1CCC1COC 34a_100015195929_100000718602 [0,1,0,1,0,0|2,0,0]=4 7563 B12R1.965 CCCCCOC1(COC1)CC 7a_100010739965_100000210326 [0,1,0,1,0,0|2,0,0]=4 7564 B12R1.965 CCCCNCC1(COC1)CC 2230a_100000101356_100000210211 [0,1,0,1,0,0|2,0,0]=4 7565 B12R1.965 CCCCNCC1(COC1)CC 2230a_100000102301_200009907690 [0,1,0,1,0,0|2,0,0]=4 7566 B12R1.965 CCCCNCC1(COC1)CC 269862a_100000102301_100000687158 [0,1,0,1,0,0|2,0,0]=4 7567 B12R1.965 CCCCNCC1(COC1)CC 7a_106832991798_200009907690 [0,1,0,1,0,0|2,0,0]=4 7568 B12R1.965 CCCCOCC1(COC1)CC 34a_100000210227_200009907690 [0,1,0,1,0,0|2,0,0]=4 7569 B12R1.965 CCCCOCC1(COC1)CC 7a_100000039901_100000210211 [0,1,0,1,0,0|2,0,0]=4 7570 B12R1.965 CCCCOCC1(COC1)CC 7a_100000210227_200009907690 [0,1,0,1,0,0|2,0,0]=4 7571 B12R1.965 CCCCSCC1(COC1)CC 62a_100000210211_200009907690 [0,1,0,1,0,0|2,0,0]=4 7572 B12R1.965 CCCCSCC1(COC1)CC 62a_200009907690_100000210210 [0,1,0,1,0,0|2,0,0]=4 7573 B12R1.5 CCC(=O)C1CCC(CC1)OC 1458a_100011215563_100000210202 [0,1,0,1,0,0|1,0,1]=4 7574 B12R1.5 CCC(C)N1CCC(CC1)OC 2230a_100000234800_100000758301 [0,1,0,1,0,0|2,0,0]=4 7575 B12R1.5 CCC(C)N1CCC(CC1)OC 269982a_100000234800_100000758301 [0,1,0,1,0,0|2,0,0]=4 7576 B12R1.5 CCC(C)N1CCC(CC1)OC 34a_100000234800_100011215416 [0,1,0,1,0,0|2,0,0]=4 7577 B12R1.12 COC(OC)C1CCN(CC1)C 2230a_100000097539_200000210301 [0,1,0,1,0,0|1,0,0]=3 7578 B12R1.12 COC(OC)C1CCN(CC1)C 269982a_100000097539_200000210301 [0,1,0,1,0,0|1,0,0]=3 7579 B12R1.12 COC(OC)C1CCN(CC1)C 34a_100000097539_200000210301 [0,1,0,1,0,0|1,0,0]=3 7580 B12R1.12 COC(OC)C1CCN(CC1)[13CH3] 2230a_100000097539_200025704644 [0,1,0,1,0,0|1,0,0]=3 7581 B12R1.12 COC(OC)C1CCN(CC1)[13CH3] 269982a_100000097539_200025704644 [0,1,0,1,0,0|1,0,0]=3 7582 B12R1.12 COC(OC)C1CCN(CC1)[13CH3] 34a_100000097539_200025704644 [0,1,0,1,0,0|1,0,0]=3 7583 B12R1.61 CCC(C)CN1CC[C@H](C1)OC 2230a_100000766984_100000748023 [0,1,0,1,0,0|2,0,0]=4 7584 B12R1.61 CCC(C)CN1CC[C@H](C1)OC 269982a_100000766984_100000748023 [0,1,0,1,0,0|2,0,0]=4 7585 B12R1.61 CCC(C)CN1CC[C@H](C1)OC 270004a_100000766984_100000243153 [0,1,0,1,0,0|2,0,0]=4 7586 B12R1.61 CCC(O)CN1CC[C@H](C1)OC 2230a_100000766984_100011218378 [0,1,0,1,0,0|2,0,0]=4 7587 B12R1.61 CCC(O)CN1CC[C@H](C1)OC 269982a_100000766984_100011218378 [0,1,0,1,0,0|2,0,0]=4 7588 B12R1.61 CC[C@H](C)CN1CC[C@H](C1)OC 2230a_100000766984_100009816398 [0,1,0,1,0,0|2,0,0]=4 7589 B12R1.61 CC[C@H](C)CN1CC[C@H](C1)OC 269982a_100000766984_100009816398 [0,1,0,1,0,0|2,0,0]=4 7590 B12R1.477 CC(CF)OCCC1OCCO1 34a_100016041109_100000740749 [0,1,0,1,0,0|2,0,0]=4 7591 B12R1.477 CC(CF)OCCC1OCCO1 7a_100016041109_100000740749 [0,1,0,1,0,0|2,0,0]=4 7592 B12R1.477 CC(CN)COCC1OCCO1 34a_100000744482_100000755774 [0,1,0,1,0,0|2,0,0]=4 7593 B12R1.477 CC(CN)OCCC1OCCO1 34a_100000210904_100000740749 [0,1,0,1,0,0|2,0,0]=4 7594 B12R1.477 CC(CO)CNCC1OCCO1 34a_100000744482_100000755774 [0,1,0,1,0,0|2,0,0]=4 7595 B12R1.477 CC(CO)NCCC1OCCO1 2230a_100000034215_100012180447 [0,1,0,1,0,0|2,0,0]=4 7596 B12R1.477 CC(CO)NCCC1OCCO1 34a_100000034215_100012180447 [0,1,0,1,0,0|2,0,0]=4 7597 B12R1.477 CC(CO)SCCC1OCCO1 62a_100012180447_100000740749 [0,1,0,1,0,0|2,0,0]=4 7598 B12R1.477 CCC(=O)CCCC1OCCO1 1458a_100000210414_100000042513 [0,1,0,1,0,0|0,0,1]=3 7599 B12R1.477 CCC(=O)COCC1OCCO1 34a_100000725409_100000755774 [0,1,0,1,0,0|1,0,1]=4 7600 B12R1.477 CCC(=O)CSCC1OCCO1 62a_100000747405_100000755774 [0,1,0,1,0,0|1,0,1]=4 7601 B12R1.477 CCC(=O)CSCC1OCCO1 62a_100000755774_100000747405 [0,1,0,1,0,0|1,0,1]=4 7602 B12R1.477 CCC(=O)NCCC1OCCO1 11a_100000034215_100000210414 [0,1,0,1,0,0|1,0,1]=4 7603 B12R1.477 CCC(=O)NCCC1OCCO1 1626a_100000034215_100000210414 [0,1,0,1,0,0|1,0,1]=4 7604 B12R1.477 CCC(=O)NCCC1OCCO1 240690a_100000034215_100000210414 [0,1,0,1,0,0|1,0,1]=4 7605 B12R1.477 CCC(=O)NCCC1OCCO1 527a_100000034215_100000210414 [0,1,0,1,0,0|1,0,1]=4 7606 B12R1.477 CCC(C)CNCC1CCCO1 2230a_100020588543_100000203698 [0,1,0,1,0,0|2,0,0]=4 7607 B12R1.477 CCC(C)CNCC1OCCO1 2230a_100000036311_100000748023 [0,1,0,1,0,0|1,0,0]=3 7608 B12R1.477 CCC(C)CNCC1OCCO1 2230a_100020588543_100000755774 [0,1,0,1,0,0|1,0,0]=3 7609 B12R1.477 CCC(C)CNCC1OCCO1 270004a_100000036311_100000243153 [0,1,0,1,0,0|1,0,0]=3 7610 B12R1.477 CCC(C)CNCC1OCCO1 34a_100000036311_100000748023 [0,1,0,1,0,0|1,0,0]=3 7611 B12R1.477 CCC(C)CNC[C@@H]1CCCO1 2230a_100020590478_100000748023 [0,1,0,1,0,0|2,0,0]=4 7612 B12R1.477 CCC(C)CNC[C@@H]1CCCO1 270004a_100020590478_100000243153 [0,1,0,1,0,0|2,0,0]=4 7613 B12R1.477 CCC(C)CNC[C@@H]1CCCO1 34a_100020590478_100000748023 [0,1,0,1,0,0|2,0,0]=4 7614 B12R1.477 CCC(C)COCC1CCCO1 34a_100000210270_100000748023 [0,1,0,1,0,0|2,0,0]=4 7615 B12R1.477 CCC(C)COCC1CCCO1 7a_100000210270_100000748023 [0,1,0,1,0,0|2,0,0]=4 7616 B12R1.477 CCC(C)COCC1OCCO1 34a_100000087154_100000748023 [0,1,0,1,0,0|1,0,0]=3 7617 B12R1.477 CCC(C)CSCC1CCCO1 62a_100000203698_100000748023 [0,1,0,1,0,0|2,0,0]=4 7618 B12R1.477 CCC(C)CSCC1CCCO1 62a_100000748023_100000203698 [0,1,0,1,0,0|2,0,0]=4 7619 B12R1.477 CCC(C)CSCC1OCCO1 62a_100000748023_100000755774 [0,1,0,1,0,0|1,0,0]=3 7620 B12R1.477 CCC(C)CSCC1OCCO1 62a_100000755774_100000748023 [0,1,0,1,0,0|1,0,0]=3 7621 B12R1.477 CCC(C)NCCC1OCCO1 2230a_100000034215_100000758301 [0,1,0,1,0,0|1,0,0]=3 7622 B12R1.477 CCC(C)NCCC1OCCO1 2230a_100000209981_100000740749 [0,1,0,1,0,0|1,0,0]=3 7623 B12R1.477 CCC(C)NCCC1OCCO1 34a_100000034215_100011215416 [0,1,0,1,0,0|1,0,0]=3 7624 B12R1.477 CCC(C)OCCC1OCCO1 7a_100000210228_100000740749 [0,1,0,1,0,0|1,0,0]=3 7625 B12R1.477 CCC(C)SCCC1OCCO1 62a_100000758301_100000740749 [0,1,0,1,0,0|1,0,0]=3 7626 B12R1.477 CCC(O)CNCC1CCCO1 2230a_100011218483_100000203698 [0,1,0,1,0,0|2,0,0]=4 7627 B12R1.477 CCC(O)CNCC1OCCO1 2230a_100000036311_100011218378 [0,1,0,1,0,0|1,0,0]=3 7628 B12R1.477 CCC(O)CNCC1OCCO1 2230a_100011218483_100000755774 [0,1,0,1,0,0|1,0,0]=3 7629 B12R1.477 CCC(O)CNCC1OCCO1 34a_100000036311_100011218378 [0,1,0,1,0,0|1,0,0]=3 7630 B12R1.477 CCC(O)CNC[C@@H]1CCCO1 2230a_100020590478_100011218378 [0,1,0,1,0,0|2,0,0]=4 7631 B12R1.477 CCC(O)CNC[C@@H]1CCCO1 34a_100020590478_100011218378 [0,1,0,1,0,0|2,0,0]=4 7632 B12R1.477 CCC(O)COCC1CCCO1 34a_100000210270_100011218378 [0,1,0,1,0,0|2,0,0]=4 7633 B12R1.477 CCC(O)COCC1CCCO1 7a_100000210270_100011218378 [0,1,0,1,0,0|2,0,0]=4 7634 B12R1.477 CCC(O)COCC1OCCO1 34a_100000087154_100011218378 [0,1,0,1,0,0|1,0,0]=3 7635 B12R1.477 CCC(O)CSCC1CCCO1 62a_100000203698_100011218378 [0,1,0,1,0,0|2,0,0]=4 7636 B12R1.477 CCC(O)CSCC1CCCO1 62a_100011218378_100000203698 [0,1,0,1,0,0|2,0,0]=4 7637 B12R1.477 CCC(O)CSCC1OCCO1 62a_100000755774_100011218378 [0,1,0,1,0,0|1,0,0]=3 7638 B12R1.477 CCC(O)CSCC1OCCO1 62a_100011218378_100000755774 [0,1,0,1,0,0|1,0,0]=3 7639 B12R1.477 CCN(C)CCCC1CCCO1 2230a_100011698863_100000210202 [0,1,0,1,0,0|2,0,0]=4 7640 B12R1.477 CCN(C)CCCC1CCCO1 269982a_100011698863_100000204670 [0,1,0,1,0,0|2,0,0]=4 7641 B12R1.477 CCN(C)CCCC1CCCO1 34a_100011698863_100000210202 [0,1,0,1,0,0|2,0,0]=4 7642 B12R1.477 CCN(C)CCCC1OCCO1 2230a_100000225621_100000042513 [0,1,0,1,0,0|1,0,0]=3 7643 B12R1.477 CCN(C)CCCC1OCCO1 269982a_100000225621_100000042513 [0,1,0,1,0,0|1,0,0]=3 7644 B12R1.477 CC[C@H](C)CNCC1OCCO1 2230a_100000036311_100009816398 [0,1,0,1,0,0|1,0,0]=3 7645 B12R1.477 CC[C@H](C)CNCC1OCCO1 34a_100000036311_100009816398 [0,1,0,1,0,0|1,0,0]=3 7646 B12R1.477 CC[C@H](C)CNC[C@@H]1CCCO1 2230a_100020590478_100009816398 [0,1,0,1,0,0|2,0,0]=4 7647 B12R1.477 CC[C@H](C)CNC[C@@H]1CCCO1 34a_100020590478_100009816398 [0,1,0,1,0,0|2,0,0]=4 7648 B12R1.477 CC[C@H](C)COCC1CCCO1 34a_100000210270_100009816398 [0,1,0,1,0,0|2,0,0]=4 7649 B12R1.477 CC[C@H](C)COCC1CCCO1 7a_100000210270_100009816398 [0,1,0,1,0,0|2,0,0]=4 7650 B12R1.477 CC[C@H](C)COCC1CCCO1 7a_100009816381_100000203698 [0,1,0,1,0,0|2,0,0]=4 7651 B12R1.477 CC[C@H](C)COCC1OCCO1 34a_100000087154_100009816398 [0,1,0,1,0,0|1,0,0]=3 7652 B12R1.477 CC[C@H](C)COCC1OCCO1 7a_100009816381_100000755774 [0,1,0,1,0,0|1,0,0]=3 7653 B12R1.477 CC[C@H](C)CSCC1CCCO1 62a_100000203698_100009816398 [0,1,0,1,0,0|2,0,0]=4 7654 B12R1.477 CC[C@H](C)CSCC1CCCO1 62a_100009816398_100000203698 [0,1,0,1,0,0|2,0,0]=4 7655 B12R1.477 CC[C@H](C)CSCC1OCCO1 62a_100000755774_100009816398 [0,1,0,1,0,0|1,0,0]=3 7656 B12R1.477 CC[C@H](C)CSCC1OCCO1 62a_100009816398_100000755774 [0,1,0,1,0,0|1,0,0]=3 7657 B12R1.477 COC(C)COCC1OCCO1 34a_100000690652_100000755774 [0,1,0,1,0,0|2,0,0]=4 7658 B12R1.477 COC(C)SCCC1OCCO1 62a_100009879195_100000740749 [0,1,0,1,0,0|2,0,0]=4 7659 B12R1.477 CO[C@H](C)CNCC1OCCO1 2230a_100020591295_100000755774 [0,1,0,1,0,0|2,0,0]=4 7660 B12R1.477 C[C@@H](CO)CNCC1OCCO1 2230a_100000036311_100000059175 [0,1,0,1,0,0|2,0,0]=4 7661 B12R1.477 C[C@@H](CO)CNCC1OCCO1 34a_100000036311_100000059175 [0,1,0,1,0,0|2,0,0]=4 7662 B12R1.477 C[C@@H](CO)COCC1OCCO1 34a_100000087154_100000059175 [0,1,0,1,0,0|2,0,0]=4 7663 B12R1.477 C[C@@H](CO)CSCC1OCCO1 62a_100000059175_100000755774 [0,1,0,1,0,0|2,0,0]=4 7664 B12R1.477 C[C@@H](CO)CSCC1OCCO1 62a_100000755774_100000059175 [0,1,0,1,0,0|2,0,0]=4 7665 B12R1.477 C[C@H](CO)NCCC1OCCO1 2230a_100000737577_100000740749 [0,1,0,1,0,0|2,0,0]=4 7666 B12R1.477 C[C@H](CO)SCCC1OCCO1 62a_100016084084_100000740749 [0,1,0,1,0,0|2,0,0]=4 7667 B12R1.477 ClCC(Cl)COCC1OCCO1 34a_100000033668_100000755774 [0,1,0,1,0,0|2,0,0]=4 7668 B12R1.477 NC[C@@H](F)COCC1OCCO1 34a_100015665980_100000755774 [0,1,0,1,0,0|2,0,0]=4 7669 B12R1.477 O=C(CO)CCCC1OCCO1 1458a_100000210174_100000042513 [0,1,0,1,0,0|1,0,1]=4 7670 B12R1.477 OCC(O)CNCC1OCCO1 2230a_100000036311_100011219619 [0,1,0,1,0,0|2,0,0]=4 7671 B12R1.477 OCC(O)CNCC1OCCO1 34a_100000036311_100011219619 [0,1,0,1,0,0|2,0,0]=4 7672 B12R1.477 OCC(O)COCC1OCCO1 34a_100000087154_100011219619 [0,1,0,1,0,0|2,0,0]=4 7673 B12R1.477 OCC(O)CSCC1OCCO1 62a_100000755774_100011219619 [0,1,0,1,0,0|2,0,0]=4 7674 B12R1.477 OCC(O)CSCC1OCCO1 62a_100011219619_100000755774 [0,1,0,1,0,0|2,0,0]=4 7675 B12R1.477 OC[C@@H](O)CNCC1OCCO1 2230a_100020644852_100000755774 [0,1,0,1,0,0|2,0,0]=4 7676 B12R1.477 OC[C@H](F)CNCC1OCCO1 34a_100015665980_100000755774 [0,1,0,1,0,0|2,0,0]=4 7677 B12R1.477 OC[C@H](O)CNCC1OCCO1 2230a_100000036311_100009815848 [0,1,0,1,0,0|2,0,0]=4 7678 B12R1.477 OC[C@H](O)CNCC1OCCO1 34a_100000036311_100009815848 [0,1,0,1,0,0|2,0,0]=4 7679 B12R1.477 OC[C@H](O)COCC1OCCO1 34a_100000087154_100009815848 [0,1,0,1,0,0|2,0,0]=4 7680 B12R1.477 OC[C@H](O)CSCC1OCCO1 62a_100000755774_100009815848 [0,1,0,1,0,0|2,0,0]=4 7681 B12R1.477 OC[C@H](O)CSCC1OCCO1 62a_100009815848_100000755774 [0,1,0,1,0,0|2,0,0]=4 7682 B12R1.477 O[C@@H](CF)CNCC1OCCO1 2230a_100000036311_100015614560 [0,1,0,1,0,0|2,0,0]=4 7683 B12R1.477 O[C@@H](CF)CNCC1OCCO1 34a_100000036311_100015614560 [0,1,0,1,0,0|2,0,0]=4 7684 B12R1.477 O[C@@H](CF)COCC1OCCO1 34a_100000087154_100015614560 [0,1,0,1,0,0|2,0,0]=4 7685 B12R1.477 O[C@@H](CF)CSCC1OCCO1 62a_100000755774_100015614560 [0,1,0,1,0,0|2,0,0]=4 7686 B12R1.477 O[C@@H](CF)CSCC1OCCO1 62a_100015614560_100000755774 [0,1,0,1,0,0|2,0,0]=4 7687 B12R1.1330 COC(CN1C[C@@H]([C@@H]1C)O)OC 2230a_206633788156_100000751394 [0,1,0,1,0,0|1,0,0]=3 7688 B12R1.1330 COC(CN1C[C@@H]([C@@H]1C)O)OC 270004a_206633788156_100000752162 [0,1,0,1,0,0|1,0,0]=3 7689 B12R1.1549 COC(CCNC1(CC1)C)OC 2230a_100000757604_100009813347 [0,1,0,1,0,0|1,0,0]=3 7690 B12R1.1549 COC(CCOC1(CC1)C)OC 7a_100011725673_100009813347 [0,1,0,1,0,0|1,0,0]=3 7691 B12R1.1549 COC(CNCC1(CC1)C)OC 2230a_100000766693_100000751394 [0,1,0,1,0,0|1,0,0]=3 7692 B12R1.1549 COC(CNCC1(CC1)C)OC 270004a_100000766693_100000752162 [0,1,0,1,0,0|1,0,0]=3 7693 B12R1.1549 COC(CNCC1(CC1)O)OC 2230a_100011936951_100000751394 [0,1,0,1,0,0|1,0,0]=3 7694 B12R1.1549 COC(CNCC1(CC1)O)OC 270004a_100011936951_100000752162 [0,1,0,1,0,0|1,0,0]=3 7695 B12R1.1549 COC(COCC1(CC1)C)OC 7a_100000698024_100000751394 [0,1,0,1,0,0|1,0,0]=3 7696 B12R1.1549 COC(COCC1(CC1)F)OC 34a_200000703853_100000211822 [0,1,0,1,0,0|1,0,0]=3 7697 B12R1.1549 COC(COCC1(CC1)F)OC 7a_200000703853_100000751394 [0,1,0,1,0,0|1,0,0]=3 7698 B12R1.1549 COC(COCC1(CO1)C)OC 34a_100011216393_100000760498 [0,1,0,1,0,0|2,0,0]=4 7699 B12R1.1549 COC(CSCC1(CO1)C)OC 62a_100000751394_100000760498 [0,1,0,1,0,0|2,0,0]=4 7700 B12R1.1549 COC(CSCC1(CO1)C)OC 62a_100000760498_100000751394 [0,1,0,1,0,0|2,0,0]=4 7701 B12R1.3607 CCC(C)CSCC1(CO1)CC 62a_100000748023_200000139556 [0,1,0,1,0,0|2,0,0]=4 7702 B12R1.3607 CCC(C)CSCC1(CO1)CC 62a_200000139556_100000748023 [0,1,0,1,0,0|2,0,0]=4 7703 B12R1.3607 CCC(O)CSCC1(CO1)CC 62a_100011218378_200000139556 [0,1,0,1,0,0|2,0,0]=4 7704 B12R1.3607 CCC(O)CSCC1(CO1)CC 62a_200000139556_100011218378 [0,1,0,1,0,0|2,0,0]=4 7705 B12R1.3607 CC[C@H](C)COCC1(CO1)CC 7a_100009816381_200000139556 [0,1,0,1,0,0|2,0,0]=4 7706 B12R1.3607 CC[C@H](C)CSCC1(CO1)CC 62a_100009816398_200000139556 [0,1,0,1,0,0|2,0,0]=4 7707 B12R1.3607 CC[C@H](C)CSCC1(CO1)CC 62a_200000139556_100009816398 [0,1,0,1,0,0|2,0,0]=4 7708 B12R1.647 COC(C)(CN1CCCC1)OC 2230a_100000188435_100000064154 [0,1,0,1,0,0|1,0,0]=3 7709 B12R1.647 COC(C)(CN1CCCC1)OC 269982a_100000188435_100000766008 [0,1,0,1,0,0|1,0,0]=3 7710 B12R1.647 COC(C)(CN1CCSC1)OC 2230a_100011215254_100000064154 [0,1,0,1,0,0|2,0,0]=4 7711 B12R1.647 COC(C)(CN1CCSC1)OC 269982a_100011215254_100000766008 [0,1,0,1,0,0|2,0,0]=4 7712 B12R1.647 CO[Si](C)(CN1CCCC1)OC 269982a_100000188435_100000067953 [0,1,0,1,0,0|1,1,0]=4 7713 B12R1.848 CCCN1CCC(CC1)(C)OC 2230a_100000733821_100000210303 [0,1,0,1,0,0|2,0,0]=4 7714 B12R1.848 CCCN1CCC(CC1)(C)OC 269982a_100000733821_100000210303 [0,1,0,1,0,0|2,0,0]=4 7715 B12R1.1758 CC1(OCCO1)CCCSCF 62a_100000037737_100015361967 [0,1,0,1,0,0|2,0,0]=4 7716 B12R1.1758 CC1(OCCO1)CCCSCF 62a_100015361967_100000037737 [0,1,0,1,0,0|2,0,0]=4 7717 B12R1.1758 CC1(OCCO1)CCNCCF 2230a_100000073055_100011217306 [0,1,0,1,0,0|2,0,0]=4 7718 B12R1.1758 CC1(OCCO1)CCNCCF 34a_100000724931_100000758764 [0,1,0,1,0,0|2,0,0]=4 7719 B12R1.1758 CC1(OCCO1)CCNCCO 2230a_100000073055_100000211926 [0,1,0,1,0,0|2,0,0]=4 7720 B12R1.1758 CC1(OCCO1)CCNCCO 2230a_100016997473_100000758764 [0,1,0,1,0,0|2,0,0]=4 7721 B12R1.1758 CC1(OCCO1)CCNCCO 34a_100016990907_100000758764 [0,1,0,1,0,0|2,0,0]=4 7722 B12R1.1758 CC1(OCCO1)CCOCCBr 34a_100000211926_100000758764 [0,1,0,1,0,0|2,0,0]=4 7723 B12R1.1758 CC1(OCCO1)CCOCCF 7a_100009861814_100011217306 [0,1,0,1,0,0|2,0,0]=4 7724 B12R1.1758 CC1(OCCO1)CCOCCN 34a_100000210304_100000758764 [0,1,0,1,0,0|2,0,0]=4 7725 B12R1.1758 CC1(OCCO1)CCOCCO 7a_100009861814_100000211926 [0,1,0,1,0,0|2,0,0]=4 7726 B12R1.1758 CC1(OCCO1)CCSCCF 62a_100000758764_100011217306 [0,1,0,1,0,0|2,0,0]=4 7727 B12R1.1758 CC1(OCCO1)CCSCCF 62a_100011217306_100000758764 [0,1,0,1,0,0|2,0,0]=4 7728 B12R1.1758 CC1(OCCO1)CCSCCO 62a_100000211926_100000758764 [0,1,0,1,0,0|2,0,0]=4 7729 B12R1.1758 CC1(OCCO1)CCSCCO 62a_100000758764_100000211926 [0,1,0,1,0,0|2,0,0]=4 7730 B12R1.1758 CC1(OCCO1)CNCCCF 2230a_100000691740_100011934791 [0,1,0,1,0,0|2,0,0]=4 7731 B12R1.1758 CC1(OCCO1)CNCCCO 2230a_100000691740_100000230001 [0,1,0,1,0,0|2,0,0]=4 7732 B12R1.1758 CC1(OCCO1)CSCCCF 62a_100009818610_100011934791 [0,1,0,1,0,0|2,0,0]=4 7733 B12R1.1758 CC1(OCCO1)CSCCCF 62a_100011934791_100009818610 [0,1,0,1,0,0|2,0,0]=4 7734 B12R1.1758 CC1(OCCO1)CSCCCO 62a_100009818610_100011215043 [0,1,0,1,0,0|2,0,0]=4 7735 B12R1.1758 CC1(OCCO1)CSCCCO 62a_100011215043_100009818610 [0,1,0,1,0,0|2,0,0]=4 7736 B12R1.1758 CCCCNCC1(OCCO1)C 2230a_100000691740_100000210211 [0,1,0,1,0,0|1,0,0]=3 7737 B12R1.1758 CCCCSCC1(OCCO1)C 62a_100000210211_100009818610 [0,1,0,1,0,0|1,0,0]=3 7738 B12R1.1758 CCCCSCC1(OCCO1)C 62a_100009818610_100000210210 [0,1,0,1,0,0|1,0,0]=3 7739 B12R1.1758 CCCNCCC1(OCCO1)C 2230a_100000073055_100000210303 [0,1,0,1,0,0|1,0,0]=3 7740 B12R1.1758 CCCOCCC1(OCCO1)C 34a_100000210258_100000758764 [0,1,0,1,0,0|1,0,0]=3 7741 B12R1.1758 CCCOCCC1(OCCO1)C 7a_100009861814_100000210303 [0,1,0,1,0,0|1,0,0]=3 7742 B12R1.1758 CCCSCCC1(OCCO1)C 62a_100000210303_100000758764 [0,1,0,1,0,0|1,0,0]=3 7743 B12R1.1758 CCCSCCC1(OCCO1)C 62a_100000758764_100000210303 [0,1,0,1,0,0|1,0,0]=3 7744 B12R1.1758 CCNCCCC1(OCCO1)C 2230a_100015525214_100000037737 [0,1,0,1,0,0|1,0,0]=3 7745 B12R1.1758 CCOCCCC1(OCCO1)C 34a_100121572206_100000037737 [0,1,0,1,0,0|1,0,0]=3 7746 B12R1.1758 CCOCSCC1(OCCO1)C 62a_100000739092_100009818610 [0,1,0,1,0,0|2,0,0]=4 7747 B12R1.1758 CCOCSCC1(OCCO1)C 62a_100009818610_100000739092 [0,1,0,1,0,0|2,0,0]=4 7748 B12R1.1758 CCSCCCC1(OCCO1)C 62a_100000037737_100000210202 [0,1,0,1,0,0|1,0,0]=3 7749 B12R1.1758 CCSCCCC1(OCCO1)C 62a_100000210202_100000037737 [0,1,0,1,0,0|1,0,0]=3 7750 B12R1.1758 COCCNCC1(OCCO1)C 2230a_100000691740_100011201679 [0,1,0,1,0,0|2,0,0]=4 7751 B12R1.1758 COCCSCC1(OCCO1)C 62a_100000233755_100009818610 [0,1,0,1,0,0|2,0,0]=4 7752 B12R1.1758 COCCSCC1(OCCO1)C 62a_100009818610_100000233755 [0,1,0,1,0,0|2,0,0]=4 7753 B12R1.1758 COCNCCC1(OCCO1)C 2230a_100000073055_100000766300 [0,1,0,1,0,0|2,0,0]=4 7754 B12R1.1758 COCSCCC1(OCCO1)C 62a_100000758764_100000766300 [0,1,0,1,0,0|2,0,0]=4 7755 B12R1.1758 COCSCCC1(OCCO1)C 62a_100000766300_100000758764 [0,1,0,1,0,0|2,0,0]=4 7756 B12R1.1758 CSCCNCC1(OCCO1)C 2230a_100000691740_100000751147 [0,1,0,1,0,0|2,0,0]=4 7757 B12R1.1758 CSCCSCC1(OCCO1)C 62a_100000212216_100009818610 [0,1,0,1,0,0|2,0,0]=4 7758 B12R1.1758 CSCCSCC1(OCCO1)C 62a_100009818610_100000751147 [0,1,0,1,0,0|2,0,0]=4 7759 B12R1.1758 CSCNCCC1(OCCO1)C 2230a_100000073055_100011218213 [0,1,0,1,0,0|2,0,0]=4 7760 B12R1.1758 CSCSCCC1(OCCO1)C 62a_100000758764_100011218213 [0,1,0,1,0,0|2,0,0]=4 7761 B12R1.1758 CSCSCCC1(OCCO1)C 62a_100011218213_100000758764 [0,1,0,1,0,0|2,0,0]=4 7762 B12R1.2117 COC(C)(CNC1CCC1)OC 2230a_100000749019_100000064154 [0,1,0,1,0,0|1,0,0]=3 7763 B12R1.2117 COC(C)(CNC1CCC1)OC 34a_100000749019_100000766008 [0,1,0,1,0,0|1,0,0]=3 7764 B12R1.2117 COC(C)(CNC1COC1)OC 2230a_100016991112_100000064154 [0,1,0,1,0,0|2,0,0]=4 7765 B12R1.2117 COC(C)(COC1CCC1)OC 34a_100000748187_100000766008 [0,1,0,1,0,0|1,0,0]=3 7766 B12R1.2117 COC(C)(CSC1CCC1)OC 62a_100000766008_100000749161 [0,1,0,1,0,0|1,0,0]=3 7767 B12R1.2117 COC(C)(CSC1COC1)OC 62a_100000766008_100009818527 [0,1,0,1,0,0|2,0,0]=4 7768 B12R1.2117 COP(=O)(COC1CCC1)OC 34a_100000101693_100000749161 [0,1,0,1,0,0|2,0,0]=4 7769 B12R1.2117 CO[Si](C)(CSC1CCC1)OC 62a_100000067953_100000749161 [0,1,0,1,0,0|1,1,0]=4 7770 B12R1.2118 COC(C)(CNCC1CC1)OC 2230a_100000732740_100000742324 [0,1,0,1,0,0|1,0,0]=3 7771 B12R1.2118 COC(C)(CNCC1CC1)OC 2230a_100000735609_100000064154 [0,1,0,1,0,0|1,0,0]=3 7772 B12R1.2118 COC(C)(CNCC1CC1)OC 269862a_100000732740_100000741477 [0,1,0,1,0,0|1,0,0]=3 7773 B12R1.2118 COC(C)(CNCC1CC1)OC 34a_100000735609_100000766008 [0,1,0,1,0,0|1,0,0]=3 7774 B12R1.2118 COC(C)(CNCC1CO1)OC 2230a_100000732740_100011216344 [0,1,0,1,0,0|2,0,0]=4 7775 B12R1.2118 COC(C)(COCC1CC1)OC 34a_100000211283_100000766008 [0,1,0,1,0,0|1,0,0]=3 7776 B12R1.2118 COC(C)(COC[C@@H]1CO1)OC 34a_100000757423_100000766008 [0,1,0,1,0,0|2,0,0]=4 7777 B12R1.2118 COC(C)(CSCC1CC1)OC 62a_100000756562_100000766008 [0,1,0,1,0,0|1,0,0]=3 7778 B12R1.2118 COC(C)(CSCC1CC1)OC 62a_100000766008_100000742324 [0,1,0,1,0,0|1,0,0]=3 7779 B12R1.2118 COC(C)(CSCC1CO1)OC 62a_100000766008_102125554688 [0,1,0,1,0,0|2,0,0]=4 7780 B12R1.2118 COC(C)(CSCC1CO1)OC 62a_102125554688_100000766008 [0,1,0,1,0,0|2,0,0]=4 7781 B12R1.2118 COC(C)(CSCC1CS1)OC 62a_100000031435_100000766008 [0,1,0,1,0,0|2,0,0]=4 7782 B12R1.2118 COC(C)(CSCC1CS1)OC 62a_100000766008_100000031435 [0,1,0,1,0,0|2,0,0]=4 7783 B12R1.2118 COC(C)(CSC[C@@H]1CO1)OC 62a_100000745022_100000766008 [0,1,0,1,0,0|2,0,0]=4 7784 B12R1.2118 COC(C)(CSC[C@@H]1CO1)OC 62a_100000766008_100000745022 [0,1,0,1,0,0|2,0,0]=4 7785 B12R1.2118 COP(=O)(CCOC1CC1)OC 34a_200000043213_100000211595 [0,1,0,1,0,0|2,0,0]=4 7786 B12R1.2118 COP(=O)(COCC1CC1)OC 34a_100000101693_100000742324 [0,1,0,1,0,0|2,0,0]=4 7787 B12R1.2118 CO[Si](C)(CSCC1CC1)OC 62a_100000067953_100000742324 [0,1,0,1,0,0|1,1,0]=4 7788 B12R1.2118 CO[Si](C)(CSCC1CC1)OC 62a_100000756562_100000067953 [0,1,0,1,0,0|1,1,0]=4 7789 B12R1.2322 COC(C)(CN[C@@H]1C[C@@H]1F)OC 2230a_100015190264_100000064154 [0,1,0,1,0,0|2,0,0]=4 7790 B12R1.2322 COC(C)(CN[C@@H]1C[C@H]1F)OC 2230a_100025746932_100000064154 [0,1,0,1,0,0|2,0,0]=4 7791 B12R1.2322 COC(C)(CN[C@@H]1C[C@H]1F)OC 34a_100025746932_100000766008 [0,1,0,1,0,0|2,0,0]=4 7792 B12R1.2323 COC(C)(CN1CCC1C)OC 269982a_100000755817_100000766008 [0,1,0,1,0,0|1,0,0]=3 7793 B12R1.2323 COC(C)(CN1CCC1C)OC 34a_100000755817_100000766008 [0,1,0,1,0,0|1,0,0]=3 7794 B12R1.2323 CO[Si](C)(CN1CCC1C)OC 269982a_100000755817_100000067953 [0,1,0,1,0,0|1,1,0]=4 7795 B12R2.12 CC1CCN1CC2CCCO2 269982a_100000755817_100000183445 [0,0,0,2,0,0|2,0,0]=4 7796 B12R2.12 CC1CCN1CC2OCCO2 269982a_100000755817_100000755774 [0,0,0,2,0,0|1,0,0]=3 7797 B12R2.12 CC1CCN1CC2OCCO2 34a_100000755817_100000755774 [0,0,0,2,0,0|1,0,0]=3 7798 B12R2.20 F[C@@H]1C[C@H]1NCC2OCCO2 2230a_100025746932_100000755774 [0,0,0,2,0,0|2,0,0]=4 7799 B12R2.20 F[C@@H]1C[C@H]1NCC2OCCO2 34a_100025746932_100000755774 [0,0,0,2,0,0|2,0,0]=4 7800 B12R2.20 F[C@H]1C[C@H]1NCC2OCCO2 2230a_100015190264_100000755774 [0,0,0,2,0,0|2,0,0]=4 7801 B12R2.98 C1CCC(C1)OC2CCCO2 34a_100000085407_100000179811 [0,0,0,2,0,0|2,0,0]=4 7802 B12R2.98 C1CCN(C1)CC2OCCO2 2230a_100000188435_100000755774 [0,0,0,2,0,0|1,0,0]=3 7803 B12R2.98 C1CCN(C1)CC2OCCO2 269982a_100000188435_100000755774 [0,0,0,2,0,0|1,0,0]=3 7804 B12R2.98 C1COC(C1)CN2CCCC2 2230a_100000188435_100000203698 [0,0,0,2,0,0|2,0,0]=4 7805 B12R2.98 C1COC(C1)CN2CCCC2 269982a_100000188435_100000183445 [0,0,0,2,0,0|2,0,0]=4 7806 B12R2.98 C1COC(O1)CN2CCSC2 2230a_100011215254_100000755774 [0,0,0,2,0,0|2,0,0]=4 7807 B12R2.98 C1COC(O1)CN2CCSC2 269982a_100011215254_100000755774 [0,0,0,2,0,0|2,0,0]=4 7808 B12R2.2056 C1CC(C1)COC2CCCO2 34a_100000085407_100000763275 [0,0,0,2,0,0|2,0,0]=4 7809 B12R2.2056 C1CC(C1)NCC2CCCO2 2230a_100000749019_100000203698 [0,0,0,2,0,0|2,0,0]=4 7810 B12R2.2056 C1CC(C1)NCC2OCCO2 2230a_100000749019_100000755774 [0,0,0,2,0,0|1,0,0]=3 7811 B12R2.2056 C1CC(C1)NCC2OCCO2 270004a_100000036311_100000241760 [0,0,0,2,0,0|1,0,0]=3 7812 B12R2.2056 C1CC(C1)NCC2OCCO2 34a_100000036311_100000749161 [0,0,0,2,0,0|1,0,0]=3 7813 B12R2.2056 C1CC(C1)NCC2OCCO2 34a_100000749019_100000755774 [0,0,0,2,0,0|1,0,0]=3 7814 B12R2.2056 C1CC(C1)NC[C@@H]2CCCO2 270004a_100020590478_100000241760 [0,0,0,2,0,0|2,0,0]=4 7815 B12R2.2056 C1CC(C1)NC[C@@H]2CCCO2 34a_100020590478_100000749161 [0,0,0,2,0,0|2,0,0]=4 7816 B12R2.2056 C1CC(C1)OCC2CCCO2 34a_100000210270_100000749161 [0,0,0,2,0,0|2,0,0]=4 7817 B12R2.2056 C1CC(C1)OCC2OCCO2 34a_100000087154_100000749161 [0,0,0,2,0,0|1,0,0]=3 7818 B12R2.2056 C1CC(C1)OCC2OCCO2 34a_100000748187_100000755774 [0,0,0,2,0,0|1,0,0]=3 7819 B12R2.2056 C1CC(C1)SCC2OCCO2 62a_100000755774_100000749161 [0,0,0,2,0,0|1,0,0]=3 7820 B12R2.2056 C1CN(C1)CCC2OCCO2 269982a_100000754969_100000740749 [0,0,0,2,0,0|1,0,0]=3 7821 B12R2.2056 C1COC(C1)CSC2CCC2 62a_100000203698_100000749161 [0,0,0,2,0,0|2,0,0]=4 7822 B12R2.2056 C1COC(O1)CNC2COC2 2230a_100016991112_100000755774 [0,0,0,2,0,0|2,0,0]=4 7823 B12R2.2056 C1COC(O1)CNC2COC2 34a_100000036311_100009818527 [0,0,0,2,0,0|2,0,0]=4 7824 B12R2.2056 C1COC(O1)COC2COC2 34a_100000087154_100009818527 [0,0,0,2,0,0|2,0,0]=4 7825 B12R2.2056 C1COC(O1)COC2CSC2 7a_100000072292_100000755774 [0,0,0,2,0,0|2,0,0]=4 7826 B12R2.2056 C1COC(O1)CSC2COC2 62a_100000755774_100009818527 [0,0,0,2,0,0|2,0,0]=4 7827 B12R2.2336 CCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000210211 [0,0,0,2,0,0|2,0,0]=4 7828 B12R2.2336 CCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000210211 [0,0,0,2,0,0|2,0,0]=4 7829 B12R2.2336 CCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000210210 [0,0,0,2,0,0|2,0,0]=4 7830 B12R2.2383 C(CC1OCCO1)NC2CC2 34a_100000034215_100000211595 [0,0,0,2,0,0|1,0,0]=3 7831 B12R2.2383 C(CC1OCCO1)NC2CC2 34a_100000212008_100000740749 [0,0,0,2,0,0|1,0,0]=3 7832 B12R2.2383 C1COC(C1)CNCC2CC2 2230a_100000735609_100000203698 [0,0,0,2,0,0|2,0,0]=4 7833 B12R2.2383 C1COC(C1)COCC2CC2 34a_100000210270_100000742324 [0,0,0,2,0,0|2,0,0]=4 7834 B12R2.2383 C1COC(C1)COCC2CC2 7a_100000210270_100000742324 [0,0,0,2,0,0|2,0,0]=4 7835 B12R2.2383 C1COC(C1)CSCC2CC2 62a_100000203698_100000742324 [0,0,0,2,0,0|2,0,0]=4 7836 B12R2.2383 C1COC(C1)CSCC2CC2 62a_100000756562_100000203698 [0,0,0,2,0,0|2,0,0]=4 7837 B12R2.2383 C1COC(C1)OCCC2CC2 34a_100000085407_100000694398 [0,0,0,2,0,0|2,0,0]=4 7838 B12R2.2383 C1COC(O1)CNCC2CC2 2230a_100000036311_100000742324 [0,0,0,2,0,0|1,0,0]=3 7839 B12R2.2383 C1COC(O1)CNCC2CC2 2230a_100000735609_100000755774 [0,0,0,2,0,0|1,0,0]=3 7840 B12R2.2383 C1COC(O1)CNCC2CC2 34a_100000036311_100000742324 [0,0,0,2,0,0|1,0,0]=3 7841 B12R2.2383 C1COC(O1)CNCC2CC2 34a_100000735609_100000755774 [0,0,0,2,0,0|1,0,0]=3 7842 B12R2.2383 C1COC(O1)CNCC2CO2 2230a_100000036311_100011216344 [0,0,0,2,0,0|2,0,0]=4 7843 B12R2.2383 C1COC(O1)CNCC2CO2 34a_100000036311_102125554688 [0,0,0,2,0,0|2,0,0]=4 7844 B12R2.2383 C1COC(O1)COCC2CC2 34a_100000087154_100000742324 [0,0,0,2,0,0|1,0,0]=3 7845 B12R2.2383 C1COC(O1)COCC2CC2 34a_100000211283_100000755774 [0,0,0,2,0,0|1,0,0]=3 7846 B12R2.2383 C1COC(O1)COCC2CO2 34a_100000087154_102125554688 [0,0,0,2,0,0|2,0,0]=4 7847 B12R2.2383 C1COC(O1)COC[C@@H]2CO2 34a_100000757423_100000755774 [0,0,0,2,0,0|2,0,0]=4 7848 B12R2.2383 C1COC(O1)CSCC2CC2 62a_100000755774_100000742324 [0,0,0,2,0,0|1,0,0]=3 7849 B12R2.2383 C1COC(O1)CSCC2CC2 62a_100000756562_100000755774 [0,0,0,2,0,0|1,0,0]=3 7850 B12R2.2383 C1COC(O1)CSCC2CO2 62a_100000755774_102125554688 [0,0,0,2,0,0|2,0,0]=4 7851 B12R2.2383 C1COC(O1)CSCC2CO2 62a_102125554688_100000755774 [0,0,0,2,0,0|2,0,0]=4 7852 B12R2.2383 C1COC(O1)CSCC2CS2 62a_100000031435_100000755774 [0,0,0,2,0,0|2,0,0]=4 7853 B12R2.2383 C1COC(O1)CSCC2CS2 62a_100000755774_100000031435 [0,0,0,2,0,0|2,0,0]=4 7854 B12R2.2383 C1COC(O1)CSC[C@@H]2CO2 62a_100000745022_100000755774 [0,0,0,2,0,0|2,0,0]=4 7855 B12R2.2383 C1COC(O1)CSC[C@@H]2CO2 62a_100000755774_100000745022 [0,0,0,2,0,0|2,0,0]=4 7856 B12R2.2383 C1CO[C@@H](C1)CNCC2CC2 2230a_100020590478_100000742324 [0,0,0,2,0,0|2,0,0]=4 7857 B12R2.2383 C1CO[C@@H](C1)CNCC2CC2 269862a_100020590478_100000741477 [0,0,0,2,0,0|2,0,0]=4 7858 B12R2.2383 C1CO[C@@H](C1)CNCC2CC2 34a_100020590478_100000742324 [0,0,0,2,0,0|2,0,0]=4 7859 B12R2.9 COC1CCN(CC1)C2CC2 269982a_100000234800_100000211595 [0,0,0,2,0,0|2,0,0]=4 7860 B12R2.9 COC1CCN(CC1)C2CC2 34a_100000234800_100000211595 [0,0,0,2,0,0|2,0,0]=4 7861 B12R2.9 COC1CCN(CC1)C2CC2 34a_100011594390_200000210301 [0,0,0,2,0,0|2,0,0]=4 7862 B12R2.9 COC1CCN(CC1)C2CC2 7a_100011594390_200000210301 [0,0,0,2,0,0|2,0,0]=4 7863 B12R2.9 [13CH3]OC1CCN(CC1)C2CC2 34a_100011594390_200025704644 [0,0,0,2,0,0|2,0,0]=4 7864 B12R2.9 [13CH3]OC1CCN(CC1)C2CC2 7a_100011594390_200025704644 [0,0,0,2,0,0|2,0,0]=4 7865 B12R2.44 COC1CCC2CCCC2C1 34a_100000073670_200000210301 [0,0,0,2,0,0|1,0,0]=3 7866 B12R2.44 COC1CCC2CCCC2C1 7a_100000073670_200000210301 [0,0,0,2,0,0|1,0,0]=3 7867 B12R2.44 [13CH3]OC1CCC2CCCC2C1 34a_100000073670_200025704644 [0,0,0,2,0,0|1,0,0]=3 7868 B12R2.44 [13CH3]OC1CCC2CCCC2C1 7a_100000073670_200025704644 [0,0,0,2,0,0|1,0,0]=3 7869 B12R2.1851 COC1CCC2(CC1)COC2 34a_100021429580_200000210301 [0,0,0,2,0,0|2,0,0]=4 7870 B12R2.1851 COC1CCC2(CC1)COC2 7a_100021429580_200000210301 [0,0,0,2,0,0|2,0,0]=4 7871 B12R2.1851 [13CH3]OC1CCC2(CC1)COC2 34a_100021429580_200025704644 [0,0,0,2,0,0|2,0,0]=4 7872 B12R2.1851 [13CH3]OC1CCC2(CC1)COC2 7a_100021429580_200025704644 [0,0,0,2,0,0|2,0,0]=4 7873 B12R2.1858 COC1COC2(C1)CCCC2 7a_100011062265_200000210301 [0,0,0,2,0,0|2,0,0]=4 7874 B12R2.1858 [13CH3]OC1COC2(C1)CCCC2 7a_100011062265_200025704644 [0,0,0,2,0,0|2,0,0]=4 7875 B12R2.2132 CCC1(CO1)CN2CCCC2 269982a_100000188435_200000139556 [0,0,0,2,0,0|2,0,0]=4 7876 B12R2.2094 CO[C@@H]1CCN(C1)C2CCC2 269982a_100000766984_100000749161 [0,0,0,2,0,0|2,0,0]=4 7877 B12R2.2094 CO[C@@H]1CCN(C1)C2CCC2 270004a_100000766984_100000241760 [0,0,0,2,0,0|2,0,0]=4 7878 B12R2.4567 CCC1(CO1)CNC2CCC2 34a_100000749019_200000139556 [0,0,0,2,0,0|2,0,0]=4 7879 B12R2.4567 CCC1(CO1)COC2CCC2 34a_100000748187_200000139556 [0,0,0,2,0,0|2,0,0]=4 7880 B12R2.4567 CCC1(CO1)CSC2CCC2 62a_200000139556_100000749161 [0,0,0,2,0,0|2,0,0]=4 7881 B12R2.2093 CO[C@@H]1CCN(C1)CC2CC2 2230a_100000766984_100000742324 [0,0,0,2,0,0|2,0,0]=4 7882 B12R2.2093 CO[C@@H]1CCN(C1)CC2CC2 269982a_100000766984_100000756562 [0,0,0,2,0,0|2,0,0]=4 7883 B12R2.4709 CCC1(CO1)CNCC2CC2 34a_100000735609_200000139556 [0,0,0,2,0,0|2,0,0]=4 7884 B12R2.4709 CCC1(CO1)COCC2CC2 34a_100000211283_200000139556 [0,0,0,2,0,0|2,0,0]=4 7885 B12R2.4709 CCC1(CO1)CSCC2CC2 62a_100000756562_200000139556 [0,0,0,2,0,0|2,0,0]=4 7886 B12R2.4709 CCC1(CO1)CSCC2CC2 62a_200000139556_100000742324 [0,0,0,2,0,0|2,0,0]=4 7887 B12R2.2123 CCC1(CO1)CN2CCC2C 269982a_100000755817_200000139556 [0,0,0,2,0,0|2,0,0]=4 7888 B12R2.2123 CCC1(CO1)CN2CCC2C 34a_100000755817_200000139556 [0,0,0,2,0,0|2,0,0]=4