0 B11R1.24 C#CCOC1CCCC(=O)C1 34a_100012613340_100000184674 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.24 C=CCOC1CCCC(=O)C1 34a_100012613340_100015514636 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.24 CC1=CC(CCC1)OCCF 34a_100011218613_100011217306 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.24 CC1=CC(CCC1)OCCO 34a_100011218613_100000211926 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.24 CCCCN1CCC=C(C1)C 2230a_100000725631_100000210211 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.24 CCCCN1CCC=C(C1)C 269982a_100000725631_100000210211 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.24 CCCCN1CCC=C(C1)C 34a_100000725631_100000210210 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.24 CCCCN1CCCC(C1)F 2230a_100000697950_100000210211 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.24 CCCCN1CCCC(C1)F 269982a_100000697950_100000210211 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.24 CCCCN1CCCC(C1)F 34a_100000697950_100000210210 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.24 CCCCN1CCCC(C1)O 2230a_100000211013_100000210211 [0,0,0,0,0,0|2,0,2]=4 11 B11R1.24 CCCCN1CCCC(C1)O 269982a_100000211013_100000210211 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.24 CCCCN1CCC[C@@H](C1)C 2230a_100000717927_100000210211 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.24 CCCCN1CCC[C@@H](C1)C 269982a_100000717927_100000210211 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.24 CCCCN1CCC[C@@H](C1)C 34a_100000717927_100000210210 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.24 CCCCN1CCNC(=O)C1 2230a_100000184651_100000210211 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.24 CCCCN1CCOC(=O)C1 2230a_100000131268_100000210211 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.24 CCCNC1CCCC(C1)C 2230a_100011194320_100000210303 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.24 CCCNC1CCCC(C1)C 270004a_100020643023_100000183594 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.24 CCCNC1CCCC(C1)C 34a_100011194320_100000210303 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.24 CCCNC1CCCC(C1)O 2230a_100015190357_100000210303 [0,0,0,0,0,0|2,0,2]=4 21 B11R1.24 CCCNC1CCCC(C1)O 270004a_100020643023_100012613340 [0,0,0,0,0,0|2,0,2]=4 22 B11R1.24 CCCNC1CCNC(=O)C1 2230a_100016994916_100000210303 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.24 CCCNC1CCNC(=O)C1 34a_100016994916_100000210303 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.24 CCCOC1C=C(CCC1)C 34a_100011218613_100000210303 [0,0,0,0,0,0|3,0,0]=3 25 B11R1.24 CCCOC1CCCC(=O)C1 34a_100012613340_100000210303 [0,0,0,0,0,0|2,0,0]=2 26 B11R1.24 CCCOC1CCCC(C1)C 34a_100000211399_100000210303 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.24 CCCOC1CCCN(C1)C 2230a_100000743837_200000210301 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.24 CCCOC1CCCN(C1)C 269982a_100000743837_200000210301 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.24 CCCOC1CCCN(C1)C 34a_100000743837_200000210301 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.24 CCCOC1CCCN(C1)[13CH3] 2230a_100000743837_200025704644 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.24 CCCOC1CCCN(C1)[13CH3] 269982a_100000743837_200025704644 [0,0,0,0,0,0|4,0,0]=4 32 B11R1.24 CCCOC1CCCN(C1)[13CH3] 34a_100000743837_200025704644 [0,0,0,0,0,0|4,0,0]=4 33 B11R1.24 CCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210303 [0,0,0,0,0,0|3,0,0]=3 34 B11R1.24 CCNCC1CCCC(C1)O 2230a_100011254705_100000210202 [0,0,0,0,0,0|2,0,2]=4 35 B11R1.24 CCOCC1CCCC(=O)N1 34a_200000102386_100000210202 [0,0,0,0,0,0|2,0,0]=2 36 B11R1.24 CCOCC1CCCN(C1)C 34a_100121572206_100015183302 [0,0,0,0,0,0|4,0,0]=4 37 B11R1.24 CCOCC1CCNC(=O)C1 34a_100009886756_100000210202 [0,0,0,0,0,0|3,0,0]=3 38 B11R1.24 CCOCC1COCC(=O)N1 34a_200000101122_100000210202 [0,0,0,0,0,0|3,0,0]=3 39 B11R1.24 CCSCC1CCCN(C1)C 62a_100000210202_100000752043 [0,0,0,0,0,0|4,0,0]=4 40 B11R1.24 CCSCC1CCCN(C1)C 62a_100000752043_100000210202 [0,0,0,0,0,0|4,0,0]=4 41 B11R1.24 CN1CCCC(C1)CCCO 2230a_100150707839_200000210301 [0,0,0,0,0,0|4,0,0]=4 42 B11R1.24 CN1CCCC(C1)CCCO 269982a_100150707839_200000210301 [0,0,0,0,0,0|4,0,0]=4 43 B11R1.24 CN1CCCC(C1)CCCO 34a_100150707839_200000210301 [0,0,0,0,0,0|4,0,0]=4 44 B11R1.24 COCCC1CCCN(C1)C 2230a_100011653411_200000210301 [0,0,0,0,0,0|4,0,0]=4 45 B11R1.24 COCCC1CCCN(C1)C 269982a_100011653411_200000210301 [0,0,0,0,0,0|4,0,0]=4 46 B11R1.24 COCCC1CCCN(C1)C 34a_100011653411_200000210301 [0,0,0,0,0,0|4,0,0]=4 47 B11R1.24 COCCC1CCCN(C1)[13CH3] 2230a_100011653411_200025704644 [0,0,0,0,0,0|4,0,0]=4 48 B11R1.24 COCCC1CCCN(C1)[13CH3] 269982a_100011653411_200025704644 [0,0,0,0,0,0|4,0,0]=4 49 B11R1.24 COCCC1CCCN(C1)[13CH3] 34a_100011653411_200025704644 [0,0,0,0,0,0|4,0,0]=4 50 B11R1.24 COCCN1CCNC(=O)C1 2230a_100000184651_100011201679 [0,0,0,0,0,0|4,0,0]=4 51 B11R1.24 COCCN1CCOC(=O)C1 2230a_100000131268_100011201679 [0,0,0,0,0,0|4,0,0]=4 52 B11R1.24 COCNC1CCNC(=O)C1 2230a_100016994916_100000766300 [0,0,0,0,0,0|4,0,0]=4 53 B11R1.24 CSCCN1CCNC(=O)C1 2230a_100000184651_100000751147 [0,0,0,0,0,0|4,0,0]=4 54 B11R1.24 CSCCN1CCOC(=O)C1 2230a_100000131268_100000751147 [0,0,0,0,0,0|4,0,0]=4 55 B11R1.24 CSCNC1CCNC(=O)C1 2230a_100016994916_100011218213 [0,0,0,0,0,0|4,0,0]=4 56 B11R1.24 CSCNC1CCNC(=O)C1 34a_100016994916_100011218213 [0,0,0,0,0,0|4,0,0]=4 57 B11R1.24 CSCOC1C=C(CCC1)C 34a_100011218613_100011218213 [0,0,0,0,0,0|4,0,0]=4 58 B11R1.24 CSCOC1CCCC(=O)C1 34a_100012613340_100011218213 [0,0,0,0,0,0|3,0,0]=3 59 B11R1.24 CSCO[C@@H]1CCNC(=O)C1 34a_100015189427_100011218213 [0,0,0,0,0,0|4,0,0]=4 60 B11R1.24 O=C1CC(CCN1)COCF 34a_100009886756_100015361967 [0,0,0,0,0,0|4,0,0]=4 61 B11R1.24 O=C1CC(CCN1)NCCF 2230a_100016994916_100011217306 [0,0,0,0,0,0|4,0,0]=4 62 B11R1.24 O=C1CC(CCN1)NCCF 34a_100016994916_100011217306 [0,0,0,0,0,0|4,0,0]=4 63 B11R1.24 O=C1CC(CCN1)NCCO 2230a_100016994916_100000211926 [0,0,0,0,0,0|4,0,0]=4 64 B11R1.24 O=C1CC(CCN1)NCCO 34a_100016994916_100000211926 [0,0,0,0,0,0|4,0,0]=4 65 B11R1.24 O=C1CCCC(C1)OCCF 34a_100012613340_100011217306 [0,0,0,0,0,0|3,0,0]=3 66 B11R1.24 O=C1CCCC(C1)OCCO 34a_100012613340_100000211926 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.24 O=C1CCCC(N1)COCF 34a_200000102386_100015361967 [0,0,0,0,0,0|3,0,0]=3 68 B11R1.24 O=C1CN(CCN1)CCCF 2230a_100000184651_100011934791 [0,0,0,0,0,0|4,0,0]=4 69 B11R1.24 O=C1CN(CCN1)CCCO 2230a_100000184651_100000230001 [0,0,0,0,0,0|4,0,0]=4 70 B11R1.24 O=C1CN(CCO1)CCCF 2230a_100000131268_100011934791 [0,0,0,0,0,0|4,0,0]=4 71 B11R1.24 O=C1CN(CCO1)CCCO 2230a_100000131268_100000230001 [0,0,0,0,0,0|4,0,0]=4 72 B11R1.24 O=C1COCC(N1)COCF 34a_200000101122_100015361967 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.24 O=C1C[C@@H](CCN1)OCCF 34a_100015189427_100011217306 [0,0,0,0,0,0|4,0,0]=4 74 B11R1.24 O=C1C[C@@H](CCN1)OCCO 34a_100015189427_100000211926 [0,0,0,0,0,0|4,0,0]=4 75 B11R1.24 O=CCOC1CCCC(=O)C1 34a_100012613340_200009817547 [0,0,0,0,0,0|3,0,1]=4 76 B11R1.24 [13CH3]N1CCCC(C1)CCCO 2230a_100150707839_200025704644 [0,0,0,0,0,0|4,0,0]=4 77 B11R1.24 [13CH3]N1CCCC(C1)CCCO 269982a_100150707839_200025704644 [0,0,0,0,0,0|4,0,0]=4 78 B11R1.24 [13CH3]N1CCCC(C1)CCCO 34a_100150707839_200025704644 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.10 CCCN1CCNC(=O)C1 2230a_100000184651_100000210303 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.10 CCCN1CCOC(=O)C1 2230a_100000131268_100000210303 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.10 CCNC1CCNC(=O)C1 2230a_100016994916_100000210202 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.10 CCNC1CCNC(=O)C1 34a_100016994916_100000210202 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.10 CCOC1C=C(CCC1)C 34a_100011218613_100000210202 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.10 CCOC1CCCC(=O)C1 34a_100012613340_100000210202 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.10 CCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210202 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.10 COCC1CCCC(=O)N1 34a_200000102386_200000210301 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.10 COCC1CCNC(=O)C1 34a_100009886756_200000210301 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.10 COCC1COCC(=O)N1 34a_200000101122_200000210301 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.10 O=C1CCCC(C1)OCF 34a_100012613340_100015361967 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.10 [13CH3]OCC1CCCC(=O)N1 34a_200000102386_200025704644 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.10 [13CH3]OCC1CCNC(=O)C1 34a_100009886756_200025704644 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.10 [13CH3]OCC1COCC(=O)N1 34a_200000101122_200025704644 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.17 CCCCN1CC=CCC1 2230a_100000698166_100000210211 [1,0,0,0,0,0|2,0,1]=4 94 B10R1.17 CCCCN1CC=CCC1 269982a_100000698166_100000210211 [1,0,0,0,0,0|2,0,1]=4 95 B10R1.17 CCCCN1CC=CCC1 34a_100000698166_100000210210 [1,0,0,0,0,0|2,0,1]=4 96 B10R1.17 CCCCN1CCCOC1 2230a_100000131196_100000210211 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.17 CCCCN1CCCOC1 269982a_100000131196_100000210211 [1,0,0,0,0,0|3,0,0]=4 98 B10R1.17 CCCCN1CCCOC1 34a_100000131196_100000210210 [1,0,0,0,0,0|3,0,0]=4 99 B10R1.17 CCCNC1CCCCC1 2230a_100000182618_100000210303 [1,0,0,0,0,0|2,0,1]=4 100 B10R1.17 CCCNC1CCCCC1 270004a_100020643023_100000210434 [1,0,0,0,0,0|2,0,1]=4 101 B10R1.17 CCCNC1CCCCC1 34a_100000182618_100000210303 [1,0,0,0,0,0|2,0,1]=4 102 B10R1.17 CCCNC1CCCOC1 2230a_100000719290_100000210303 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.17 CCCNC1CCCOC1 270004a_100020643023_100000753404 [1,0,0,0,0,0|3,0,0]=4 104 B10R1.17 CCCNC1CCCOC1 34a_100000719290_100000210303 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.17 CCCNC1CCCSC1 270004a_100020643023_100000057913 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.17 CCCOC1C=CCCC1 34a_100011215024_100000210303 [1,0,0,0,0,0|2,0,0]=3 107 B10R1.17 CCCOC1CC=CCC1 34a_100000073881_100000210303 [1,0,0,0,0,0|2,0,1]=4 108 B10R1.17 CCCOC1CCCCC1 34a_100000210231_100000210303 [1,0,0,0,0,0|2,0,1]=4 109 B10R1.17 CCCOC1CCCCC1 34a_100000210258_100000210327 [1,0,0,0,0,0|2,0,1]=4 110 B10R1.17 CCCOC1CCCCC1 7a_100000210231_100000210303 [1,0,0,0,0,0|2,0,1]=4 111 B10R1.17 CCCOC1CCCCO1 34a_100000033831_100000210303 [1,0,0,0,0,0|1,0,1]=3 112 B10R1.17 CCCOC1CCCOC1 34a_100000210258_100000693364 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.17 CCCOC1CCCOC1 34a_100000754041_100000210303 [1,0,0,0,0,0|3,0,0]=4 114 B10R1.17 CCCOC1CCCSC1 7a_100015962668_100000210303 [1,0,0,0,0,0|3,0,0]=4 115 B10R1.17 CCCSC1C=CCCC1 62a_100000210303_100000751183 [1,0,0,0,0,0|2,0,0]=3 116 B10R1.17 CCCSC1C=CCCC1 62a_100000751183_100000210303 [1,0,0,0,0,0|2,0,0]=3 117 B10R1.17 CCCSC1CCCCC1 62a_100000210303_100000210327 [1,0,0,0,0,0|2,0,1]=4 118 B10R1.17 CCCSC1CCCCC1 62a_100000210327_100000210303 [1,0,0,0,0,0|2,0,1]=4 119 B10R1.17 CCCSC1CCCOC1 62a_100000210303_100000693364 [1,0,0,0,0,0|3,0,0]=4 120 B10R1.17 CCNCC1CC=CCC1 270004a_100015525214_100000189434 [1,0,0,0,0,0|2,0,1]=4 121 B10R1.17 CCNCC1CCCCC1 2230a_100000210473_100000210202 [1,0,0,0,0,0|2,0,1]=4 122 B10R1.17 CCNCC1CCCCC1 2230a_100015525214_100000211423 [1,0,0,0,0,0|2,0,1]=4 123 B10R1.17 CCNCC1CCCCC1 269862a_100015525214_100000211278 [1,0,0,0,0,0|2,0,1]=4 124 B10R1.17 CCNCC1CCCCC1 34a_100000210473_100000210202 [1,0,0,0,0,0|2,0,1]=4 125 B10R1.17 CCNCC1CCCCO1 2230a_100000174945_100000210202 [1,0,0,0,0,0|1,0,1]=3 126 B10R1.17 CCNCC1CCCCO1 2230a_100015525214_100000211543 [1,0,0,0,0,0|1,0,1]=3 127 B10R1.17 CCNCC1CCCCO1 34a_100000174945_100000210202 [1,0,0,0,0,0|1,0,1]=3 128 B10R1.17 CCNCC1CCCOC1 2230a_100000720124_100000210202 [1,0,0,0,0,0|3,0,0]=4 129 B10R1.17 CCNCC1CCCOC1 2230a_100015525214_100000741521 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.17 CCNCC1CCCOC1 34a_100000720124_100000210202 [1,0,0,0,0,0|3,0,0]=4 131 B10R1.17 CCNC[C@H]1COCCO1 2230a_100010981119_100000210202 [1,0,0,0,0,0|2,0,1]=4 132 B10R1.17 CCNC[C@H]1COCCO1 34a_100010981119_100000210202 [1,0,0,0,0,0|2,0,1]=4 133 B10R1.17 CCOCC1CC=CCC1 34a_100000210713_100000210202 [1,0,0,0,0,0|2,0,1]=4 134 B10R1.17 CCOCC1CCC=CO1 34a_100011217868_100000210202 [1,0,0,0,0,0|1,0,1]=3 135 B10R1.17 CCOCC1CCCCC1 34a_100000212181_100000210202 [1,0,0,0,0,0|2,0,1]=4 136 B10R1.17 CCOCC1CCCCC1 34a_100121572206_100000211423 [1,0,0,0,0,0|2,0,1]=4 137 B10R1.17 CCOCC1CCCCC1 7a_100000212181_100000210202 [1,0,0,0,0,0|2,0,1]=4 138 B10R1.17 CCOCC1CCCCN1 34a_100000210821_100000210202 [1,0,0,0,0,0|2,0,1]=4 139 B10R1.17 CCOCC1CCCCO1 34a_100000211370_100000210202 [1,0,0,0,0,0|1,0,1]=3 140 B10R1.17 CCOCC1CCCCO1 34a_100121572206_100000211543 [1,0,0,0,0,0|1,0,1]=3 141 B10R1.17 CCOCC1CCCCO1 7a_100000211370_100000210202 [1,0,0,0,0,0|1,0,1]=3 142 B10R1.17 CCOCC1CCCNC1 34a_100000211344_100000210202 [1,0,0,0,0,0|3,0,0]=4 143 B10R1.17 CCOCC1CCCOC1 34a_100000741520_100000210202 [1,0,0,0,0,0|3,0,0]=4 144 B10R1.17 CCOCC1CCCOC1 34a_100121572206_100000741521 [1,0,0,0,0,0|3,0,0]=4 145 B10R1.17 CCOC[C@@H]1CNCCO1 34a_100015189573_100000210202 [1,0,0,0,0,0|2,0,1]=4 146 B10R1.17 CCOC[C@H]1COCCO1 34a_100009875890_100000210202 [1,0,0,0,0,0|2,0,1]=4 147 B10R1.17 CCSCC1CCCCC1 62a_100000210202_100000211423 [1,0,0,0,0,0|2,0,1]=4 148 B10R1.17 CCSCC1CCCCC1 62a_100000211423_100000210202 [1,0,0,0,0,0|2,0,1]=4 149 B10R1.17 CCSCC1CCCCO1 62a_100000210202_100000211543 [1,0,0,0,0,0|1,0,1]=3 150 B10R1.17 CCSCC1CCCCO1 62a_100000211543_100000210202 [1,0,0,0,0,0|1,0,1]=3 151 B10R1.17 CCSCC1CCCOC1 62a_100000210202_100000741521 [1,0,0,0,0,0|3,0,0]=4 152 B10R1.17 CCSCC1CCCOC1 62a_100000741521_100000210202 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.17 CNCCC1CCCCC1 2230a_100000738074_200000210301 [1,0,0,0,0,0|2,0,1]=4 154 B10R1.17 CNCCC1CCCCC1 2230a_106832991635_100012355289 [1,0,0,0,0,0|2,0,1]=4 155 B10R1.17 CNCCC1CCCCC1 270004a_106832991635_100011713444 [1,0,0,0,0,0|2,0,1]=4 156 B10R1.17 CNCCC1CCCCC1 34a_100000738074_200000210301 [1,0,0,0,0,0|2,0,1]=4 157 B10R1.17 CNCCC1CCCCC1 34a_100102657272_100011209188 [1,0,0,0,0,0|2,0,1]=4 158 B10R1.17 CNCCC1CCCCC1 7a_106832991635_100011273959 [1,0,0,0,0,0|2,0,1]=4 159 B10R1.17 CNCCC1CCCCO1 2230a_100015183643_200000210301 [1,0,0,0,0,0|1,0,1]=3 160 B10R1.17 CNCCC1CCCCO1 34a_100015183643_200000210301 [1,0,0,0,0,0|1,0,1]=3 161 B10R1.17 CNCCC1OCCCO1 2230a_106832991635_100000764188 [1,0,0,0,0,0|2,0,1]=4 162 B10R1.17 CNCCC1OCCCO1 34a_100102657272_100000764188 [1,0,0,0,0,0|2,0,1]=4 163 B10R1.17 CNCCC1OCCCO1 7a_106832991635_100000764188 [1,0,0,0,0,0|2,0,1]=4 164 B10R1.17 COCCC1CCCCC1 34a_100011217863_200000210301 [1,0,0,0,0,0|2,0,1]=4 165 B10R1.17 COCCC1CCCCC1 34a_100138415774_100011209188 [1,0,0,0,0,0|2,0,1]=4 166 B10R1.17 COCCC1CCCCC1 7a_100011217863_200000210301 [1,0,0,0,0,0|2,0,1]=4 167 B10R1.17 COCCC1CCCCN1 34a_100000211664_200000210301 [1,0,0,0,0,0|2,0,1]=4 168 B10R1.17 COCCC1CCCNC1 34a_100000752241_200000210301 [1,0,0,0,0,0|3,0,0]=4 169 B10R1.17 COCCC1OCCCO1 34a_100138415774_100000764188 [1,0,0,0,0,0|2,0,1]=4 170 B10R1.17 COCSC1C=CCCC1 62a_100000751183_100000766300 [1,0,0,0,0,0|3,0,0]=4 171 B10R1.17 COCSC1C=CCCC1 62a_100000766300_100000751183 [1,0,0,0,0,0|3,0,0]=4 172 B10R1.17 CSCCC1CCCCC1 62a_100012355289_200000210301 [1,0,0,0,0,0|2,0,1]=4 173 B10R1.17 CSCCC1CCCCC1 62a_200000210301_100012355289 [1,0,0,0,0,0|2,0,1]=4 174 B10R1.17 CSCCC1OCCCO1 62a_100000764188_200000210301 [1,0,0,0,0,0|2,0,1]=4 175 B10R1.17 CSCCC1OCCCO1 62a_200000210301_100000764188 [1,0,0,0,0,0|2,0,1]=4 176 B10R1.17 CSCOC1C=CCCC1 34a_100011215024_100011218213 [1,0,0,0,0,0|3,0,0]=4 177 B10R1.17 CSCOC1CCCCO1 34a_100000033831_100011218213 [1,0,0,0,0,0|2,0,1]=4 178 B10R1.17 CSCSC1C=CCCC1 62a_100000751183_100011218213 [1,0,0,0,0,0|3,0,0]=4 179 B10R1.17 CSCSC1C=CCCC1 62a_100011218213_100000751183 [1,0,0,0,0,0|3,0,0]=4 180 B10R1.17 FCCOC1C=CCCC1 34a_100011215024_100011217306 [1,0,0,0,0,0|3,0,0]=4 181 B10R1.17 FCCOC1CCCCO1 34a_100000033831_100011217306 [1,0,0,0,0,0|2,0,1]=4 182 B10R1.17 FCCSC1C=CCCC1 62a_100000751183_100011217306 [1,0,0,0,0,0|3,0,0]=4 183 B10R1.17 FCCSC1C=CCCC1 62a_100011217306_100000751183 [1,0,0,0,0,0|3,0,0]=4 184 B10R1.17 FCNCC1CCCCO1 34a_100000174945_100015361967 [1,0,0,0,0,0|2,0,1]=4 185 B10R1.17 FCOCC1CCC=CO1 34a_100011217868_100015361967 [1,0,0,0,0,0|2,0,1]=4 186 B10R1.17 FCOCC1CCCCO1 34a_100000211370_100015361967 [1,0,0,0,0,0|2,0,1]=4 187 B10R1.17 FCOCC1CCCCO1 7a_100000211370_100015361967 [1,0,0,0,0,0|2,0,1]=4 188 B10R1.17 FCSCC1CCCCO1 62a_100000211543_100015361967 [1,0,0,0,0,0|2,0,1]=4 189 B10R1.17 FCSCC1CCCCO1 62a_100015361967_100000211543 [1,0,0,0,0,0|2,0,1]=4 190 B10R1.17 OCCNC1C=CCCC1 2230a_100016997473_100000751183 [1,0,0,0,0,0|3,0,0]=4 191 B10R1.17 OCCOC1C=CCCC1 34a_100011215024_100000211926 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.17 OCCOC1CCCCO1 34a_100000033831_100000211926 [1,0,0,0,0,0|2,0,1]=4 193 B10R1.17 OCCSC1C=CCCC1 62a_100000211926_100000751183 [1,0,0,0,0,0|3,0,0]=4 194 B10R1.17 OCCSC1C=CCCC1 62a_100000751183_100000211926 [1,0,0,0,0,0|3,0,0]=4 195 B10R1.17 [13CH3]NCCC1CCCCC1 2230a_100000738074_200025704644 [1,0,0,0,0,0|2,0,1]=4 196 B10R1.17 [13CH3]NCCC1CCCCC1 34a_100000738074_200025704644 [1,0,0,0,0,0|2,0,1]=4 197 B10R1.17 [13CH3]NCCC1CCCCO1 2230a_100015183643_200025704644 [1,0,0,0,0,0|1,0,1]=3 198 B10R1.17 [13CH3]NCCC1CCCCO1 34a_100015183643_200025704644 [1,0,0,0,0,0|1,0,1]=3 199 B10R1.17 [13CH3]OCCC1CCCCC1 34a_100011217863_200025704644 [1,0,0,0,0,0|2,0,1]=4 200 B10R1.17 [13CH3]OCCC1CCCCC1 7a_100011217863_200025704644 [1,0,0,0,0,0|2,0,1]=4 201 B10R1.17 [13CH3]OCCC1CCCCN1 34a_100000211664_200025704644 [1,0,0,0,0,0|2,0,1]=4 202 B10R1.17 [13CH3]OCCC1CCCNC1 34a_100000752241_200025704644 [1,0,0,0,0,0|3,0,0]=4 203 B10R1.17 [13CH3]SCCC1CCCCC1 62a_100012355289_200025704644 [1,0,0,0,0,0|2,0,1]=4 204 B10R1.17 [13CH3]SCCC1CCCCC1 62a_200025704644_100012355289 [1,0,0,0,0,0|2,0,1]=4 205 B10R1.17 [13CH3]SCCC1OCCCO1 62a_100000764188_200025704644 [1,0,0,0,0,0|2,0,1]=4 206 B10R1.17 [13CH3]SCCC1OCCCO1 62a_200025704644_100000764188 [1,0,0,0,0,0|2,0,1]=4 207 B12R1.17 CCCC(=O)C1CCNC(=O)C1 1458a_100000132800_100000210303 [0,1,0,0,0,0|2,0,1]=4 208 B12R1.17 CCCC(=O)C1CSCC(=O)N1 1458a_100000045068_100000210303 [0,1,0,0,0,0|2,0,1]=4 209 B12R1.17 CCCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000210303 [0,1,0,0,0,0|1,0,1]=3 210 B12R1.17 CCCC(C)N1CCNC(=O)C1 2230a_100000184651_100000766640 [0,1,0,0,0,0|3,0,0]=4 211 B12R1.17 CCCC(C)N1CCNC(=O)C1 270004a_100000184651_100000211909 [0,1,0,0,0,0|3,0,0]=4 212 B12R1.17 CCCC(C)N1CCOC(=O)C1 2230a_100000131268_100000766640 [0,1,0,0,0,0|3,0,0]=4 213 B12R1.17 CCCC(C)N1CCOC(=O)C1 270004a_100000131268_100000211909 [0,1,0,0,0,0|3,0,0]=4 214 B12R1.17 CCNC(=O)[C@H]1CCCC(=O)N1 240690a_100015525214_100000705292 [0,1,0,0,0,0|2,0,1]=4 215 B12R1.17 CCNC(=O)[C@H]1CCCC(=O)N1 527a_100015525214_100000705292 [0,1,0,0,0,0|2,0,1]=4 216 B12R1.17 O=C1CCC[C@@H](N1)C(=O)CCF 1458a_100000705292_100011217306 [0,1,0,0,0,0|2,0,1]=4 217 B12R1.17 O=C1CCC[C@@H](N1)C(=O)CCO 1458a_100000705292_100000211926 [0,1,0,0,0,0|2,0,1]=4 218 B12R1.25 CCCCN1CCNC(=O)C1C 2230a_100000750721_100000210211 [0,1,0,0,0,0|3,0,0]=4 219 B12R1.25 CCCCN1CCNC(=O)C1C 269982a_100000750721_100000210211 [0,1,0,0,0,0|3,0,0]=4 220 B12R1.25 CCCCN1CCNC(=O)C1C 34a_100000750721_100000210210 [0,1,0,0,0,0|3,0,0]=4 221 B12R1.25 CCNCC1CCCC(=O)N1C 2230a_200010383782_100000210202 [0,1,0,0,0,0|2,0,0]=3 222 B12R1.25 CCNCC1CCCC(=O)N1C 34a_200010383782_100000210202 [0,1,0,0,0,0|2,0,0]=3 223 B12R1.25 CN1C(=O)CCCC1CNCF 34a_200010383782_100015361967 [0,1,0,0,0,0|3,0,0]=4 224 B12R1.28 C#CCCOC1CCCC(=O)C1 34a_100012613340_100000688953 [0,1,0,0,0,0|1,0,2]=4 225 B12R1.28 C#CCOCC1CCCC(=O)N1 34a_200000102386_100000184674 [0,1,0,0,0,0|1,0,2]=4 226 B12R1.28 C/C=C/COC1CCCC(=O)C1 34a_100012613340_100102629194 [0,1,0,0,0,0|1,0,2]=4 227 B12R1.28 C=CCCOC1CCCC(=O)C1 34a_100012613340_100000754431 [0,1,0,0,0,0|1,0,2]=4 228 B12R1.28 C=CCOCC1CCCC(=O)N1 34a_200000102386_100015514636 [0,1,0,0,0,0|1,0,2]=4 229 B12R1.28 CC#CCOC1CCCC(=O)C1 34a_100012613340_100000748600 [0,1,0,0,0,0|1,0,2]=4 230 B12R1.28 CC1=CC(CCC1)OCCCF 34a_100011218613_100011934791 [0,1,0,0,0,0|3,0,0]=4 231 B12R1.28 CC1=CC(CCC1)OCCCO 34a_100011218613_100000230001 [0,1,0,0,0,0|3,0,0]=4 232 B12R1.28 CC=CCOC1CCCC(=O)C1 34a_100012613340_100000070051 [0,1,0,0,0,0|1,0,2]=4 233 B12R1.28 CCCCCN1CCNC(=O)C1 2230a_100000184651_100000210326 [0,1,0,0,0,0|3,0,0]=4 234 B12R1.28 CCCCCN1CCOC(=O)C1 2230a_100000131268_100000210326 [0,1,0,0,0,0|3,0,0]=4 235 B12R1.28 CCCCNC1CCCC(C1)C 2230a_100011194320_100000210211 [0,1,0,0,0,0|2,0,1]=4 236 B12R1.28 CCCCNC1CCCC(C1)C 270004a_100000102301_100000183594 [0,1,0,0,0,0|2,0,1]=4 237 B12R1.28 CCCCNC1CCCC(C1)C 34a_100011194320_100000210210 [0,1,0,0,0,0|2,0,1]=4 238 B12R1.28 CCCCNC1CCCC(C1)O 2230a_100015190357_100000210211 [0,1,0,0,0,0|1,0,2]=4 239 B12R1.28 CCCCNC1CCCC(C1)O 270004a_100000102301_100012613340 [0,1,0,0,0,0|1,0,2]=4 240 B12R1.28 CCCCNC1CCNC(=O)C1 2230a_100016994916_100000210211 [0,1,0,0,0,0|2,0,0]=3 241 B12R1.28 CCCCNC1CCNC(=O)C1 34a_100016994916_100000210210 [0,1,0,0,0,0|2,0,0]=3 242 B12R1.28 CCCCOC1C=C(CCC1)C 34a_100011218613_100000210210 [0,1,0,0,0,0|2,0,0]=3 243 B12R1.28 CCCCOC1CCCC(=O)C1 34a_100012613340_100000210210 [0,1,0,0,0,0|1,0,0]=2 244 B12R1.28 CCCCOC1CCCC(C1)C 34a_100000211399_100000210210 [0,1,0,0,0,0|2,0,1]=4 245 B12R1.28 CCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210210 [0,1,0,0,0,0|2,0,0]=3 246 B12R1.28 CCCNCC1CCCC(C1)O 2230a_100011254705_100000210303 [0,1,0,0,0,0|1,0,2]=4 247 B12R1.28 CCCOCC1CCCC(=O)N1 34a_200000102386_100000210303 [0,1,0,0,0,0|1,0,0]=2 248 B12R1.28 CCCOCC1CCCN(C1)C 34a_100000210258_100015183302 [0,1,0,0,0,0|3,0,0]=4 249 B12R1.28 CCCOCC1CCNC(=O)C1 34a_100009886756_100000210303 [0,1,0,0,0,0|2,0,0]=3 250 B12R1.28 CCCOCC1COCC(=O)N1 34a_200000101122_100000210303 [0,1,0,0,0,0|2,0,0]=3 251 B12R1.28 CCCSCC1CCCN(C1)C 62a_100000210303_100000752043 [0,1,0,0,0,0|3,0,0]=4 252 B12R1.28 CCCSCC1CCCN(C1)C 62a_100000752043_100000210303 [0,1,0,0,0,0|3,0,0]=4 253 B12R1.28 CCOCCN1CCNC(=O)C1 2230a_100000184651_100011215890 [0,1,0,0,0,0|3,0,0]=4 254 B12R1.28 CCOCCN1CCOC(=O)C1 2230a_100000131268_100011215890 [0,1,0,0,0,0|3,0,0]=4 255 B12R1.28 CCSCCN1CCNC(=O)C1 2230a_100000184651_100000757381 [0,1,0,0,0,0|3,0,0]=4 256 B12R1.28 CCSCCN1CCOC(=O)C1 2230a_100000131268_100000757381 [0,1,0,0,0,0|3,0,0]=4 257 B12R1.28 CNCCCN1CCNC(=O)C1 2230a_100000757908_200000210301 [0,1,0,0,0,0|3,0,0]=4 258 B12R1.28 COCCCC1CCCN(C1)C 2230a_200011934583_200000210301 [0,1,0,0,0,0|3,0,0]=4 259 B12R1.28 COCCCC1CCCN(C1)C 269982a_200011934583_200000210301 [0,1,0,0,0,0|3,0,0]=4 260 B12R1.28 COCCCC1CCCN(C1)C 34a_200011934583_200000210301 [0,1,0,0,0,0|3,0,0]=4 261 B12R1.28 COCCCC1CCCN(C1)[13CH3] 2230a_200011934583_200025704644 [0,1,0,0,0,0|3,0,0]=4 262 B12R1.28 COCCCC1CCCN(C1)[13CH3] 269982a_200011934583_200025704644 [0,1,0,0,0,0|3,0,0]=4 263 B12R1.28 COCCCC1CCCN(C1)[13CH3] 34a_200011934583_200025704644 [0,1,0,0,0,0|3,0,0]=4 264 B12R1.28 COCCCN1CCNC(=O)C1 2230a_100000184651_100000740836 [0,1,0,0,0,0|3,0,0]=4 265 B12R1.28 COCCCN1CCOC(=O)C1 2230a_100000131268_100000740836 [0,1,0,0,0,0|3,0,0]=4 266 B12R1.28 COCCNC1CCNC(=O)C1 2230a_100016994916_100011201679 [0,1,0,0,0,0|3,0,0]=4 267 B12R1.28 COCCNC1CCNC(=O)C1 34a_100016994916_100011201679 [0,1,0,0,0,0|3,0,0]=4 268 B12R1.28 COCCOC1C=C(CCC1)C 34a_100011218613_100011201679 [0,1,0,0,0,0|3,0,0]=4 269 B12R1.28 COCCOC1CCCC(=O)C1 34a_100012613340_100011201679 [0,1,0,0,0,0|2,0,0]=3 270 B12R1.28 COCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100011201679 [0,1,0,0,0,0|3,0,0]=4 271 B12R1.28 CSCCNC1CCNC(=O)C1 2230a_100016994916_100000751147 [0,1,0,0,0,0|3,0,0]=4 272 B12R1.28 CSCCNC1CCNC(=O)C1 34a_100016994916_100000212216 [0,1,0,0,0,0|3,0,0]=4 273 B12R1.28 CSCCOC1C=C(CCC1)C 34a_100011218613_100000212216 [0,1,0,0,0,0|3,0,0]=4 274 B12R1.28 CSCCOC1CCCC(=O)C1 34a_100012613340_100000212216 [0,1,0,0,0,0|2,0,0]=3 275 B12R1.28 CSCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000212216 [0,1,0,0,0,0|3,0,0]=4 276 B12R1.28 CSCOCC1CCCC(=O)N1 34a_200000102386_100011218213 [0,1,0,0,0,0|2,0,0]=3 277 B12R1.28 CSCOCC1CCNC(=O)C1 34a_100009886756_100011218213 [0,1,0,0,0,0|3,0,0]=4 278 B12R1.28 CSCOCC1COCC(=O)N1 34a_200000101122_100011218213 [0,1,0,0,0,0|3,0,0]=4 279 B12R1.28 O=C1CC(CCN1)COCCF 34a_100009886756_100011217306 [0,1,0,0,0,0|3,0,0]=4 280 B12R1.28 O=C1CC(CCN1)COCCO 34a_100009886756_100000211926 [0,1,0,0,0,0|3,0,0]=4 281 B12R1.28 O=C1CC(CCN1)NCCCF 2230a_100016994916_100011934791 [0,1,0,0,0,0|3,0,0]=4 282 B12R1.28 O=C1CC(CCN1)NCCCF 34a_100016994916_100011934791 [0,1,0,0,0,0|3,0,0]=4 283 B12R1.28 O=C1CC(CCN1)NCCCO 2230a_100016994916_100000230001 [0,1,0,0,0,0|3,0,0]=4 284 B12R1.28 O=C1CC(CCN1)NCCCO 34a_100016994916_100000230001 [0,1,0,0,0,0|3,0,0]=4 285 B12R1.28 O=C1CCCC(C1)OCCCF 34a_100012613340_100011934791 [0,1,0,0,0,0|2,0,0]=3 286 B12R1.28 O=C1CCCC(C1)OCCCO 34a_100012613340_100000230001 [0,1,0,0,0,0|2,0,0]=3 287 B12R1.28 O=C1CCCC(N1)COCCF 34a_200000102386_100011217306 [0,1,0,0,0,0|2,0,0]=3 288 B12R1.28 O=C1CCCC(N1)COCCO 34a_200000102386_100000211926 [0,1,0,0,0,0|2,0,0]=3 289 B12R1.28 O=C1CN(CCN1)CCCCF 2230a_100000184651_100000729493 [0,1,0,0,0,0|3,0,0]=4 290 B12R1.28 O=C1CN(CCN1)CCCCO 2230a_100000184651_100000210776 [0,1,0,0,0,0|3,0,0]=4 291 B12R1.28 O=C1CN(CCO1)CCCCF 2230a_100000131268_100000729493 [0,1,0,0,0,0|3,0,0]=4 292 B12R1.28 O=C1CN(CCO1)CCCCO 2230a_100000131268_100000210776 [0,1,0,0,0,0|3,0,0]=4 293 B12R1.28 O=C1COCC(N1)COCCF 34a_200000101122_100011217306 [0,1,0,0,0,0|3,0,0]=4 294 B12R1.28 O=C1COCC(N1)COCCO 34a_200000101122_100000211926 [0,1,0,0,0,0|3,0,0]=4 295 B12R1.28 O=C1C[C@@H](CCN1)OCCCF 34a_100015189427_100011934791 [0,1,0,0,0,0|3,0,0]=4 296 B12R1.28 O=C1C[C@@H](CCN1)OCCCO 34a_100015189427_100000230001 [0,1,0,0,0,0|3,0,0]=4 297 B12R1.28 O=CCOCC1CCCC(=O)N1 34a_200000102386_200009817547 [0,1,0,0,0,0|2,0,1]=4 298 B12R1.28 [13CH3]NCCCN1CCNC(=O)C1 2230a_100000757908_200025704644 [0,1,0,0,0,0|3,0,0]=4 299 B12R1.50 CC(CO)OC1CCCC(=O)C1 34a_100012613340_100012180447 [0,1,0,0,0,0|3,0,0]=4 300 B12R1.50 CCC(C)CN1CCNC(=O)C1 2230a_100000184651_100000748023 [0,1,0,0,0,0|3,0,0]=4 301 B12R1.50 CCC(C)CN1CCNC(=O)C1 270004a_100000184651_100000243153 [0,1,0,0,0,0|3,0,0]=4 302 B12R1.50 CCC(C)CN1CCOC(=O)C1 2230a_100000131268_100000748023 [0,1,0,0,0,0|3,0,0]=4 303 B12R1.50 CCC(C)CN1CCOC(=O)C1 270004a_100000131268_100000243153 [0,1,0,0,0,0|3,0,0]=4 304 B12R1.50 CCC(C)NC1CCNC(=O)C1 2230a_100016994916_100000758301 [0,1,0,0,0,0|3,0,0]=4 305 B12R1.50 CCC(C)NC1CCNC(=O)C1 34a_100016994916_100011215416 [0,1,0,0,0,0|3,0,0]=4 306 B12R1.50 CCC(C)OC1C=C(CCC1)C 34a_100011218613_100011215416 [0,1,0,0,0,0|3,0,0]=4 307 B12R1.50 CCC(C)OC1CCCC(=O)C1 34a_100012613340_100011215416 [0,1,0,0,0,0|2,0,0]=3 308 B12R1.50 CCC(C)O[C@@H]1CCNC(=O)C1 34a_100015189427_100011215416 [0,1,0,0,0,0|3,0,0]=4 309 B12R1.50 CCC(O)CN1CCNC(=O)C1 2230a_100000184651_100011218378 [0,1,0,0,0,0|3,0,0]=4 310 B12R1.50 CCC(O)CN1CCOC(=O)C1 2230a_100000131268_100011218378 [0,1,0,0,0,0|3,0,0]=4 311 B12R1.50 CC[C@H](C)CN1CCNC(=O)C1 2230a_100000184651_100009816398 [0,1,0,0,0,0|3,0,0]=4 312 B12R1.50 CC[C@H](C)CN1CCOC(=O)C1 2230a_100000131268_100009816398 [0,1,0,0,0,0|3,0,0]=4 313 B12R1.226 C=C(C)COC1CCCC(=O)C1 34a_100012613340_100000748629 [0,1,0,0,0,0|2,0,1]=4 314 B12R1.226 CC(C)CCN1CCNC(=O)C1 2230a_100000184651_100000210312 [0,1,0,0,0,0|3,0,0]=4 315 B12R1.226 CC(C)CCN1CCOC(=O)C1 2230a_100000131268_100000210312 [0,1,0,0,0,0|3,0,0]=4 316 B12R1.226 CC(C)CNC1CCNC(=O)C1 2230a_100016994916_100000210760 [0,1,0,0,0,0|3,0,0]=4 317 B12R1.226 CC(C)CNC1CCNC(=O)C1 34a_100016994916_100000210624 [0,1,0,0,0,0|3,0,0]=4 318 B12R1.226 CC(C)COC1CCCC(=O)C1 34a_100012613340_100000210624 [0,1,0,0,0,0|2,0,0]=3 319 B12R1.226 CC(C)CO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210624 [0,1,0,0,0,0|3,0,0]=4 320 B12R1.226 CC(C)OCC1CCCC(=O)N1 34a_200000102386_100000210206 [0,1,0,0,0,0|2,0,0]=3 321 B12R1.226 CC(C)OCC1CCNC(=O)C1 34a_100009886756_100000210206 [0,1,0,0,0,0|3,0,0]=4 322 B12R1.226 CC(C)OCC1COCC(=O)N1 34a_200000101122_100000210206 [0,1,0,0,0,0|3,0,0]=4 323 B12R1.226 CC(O)CCN1CCNC(=O)C1 2230a_100000184651_100012276601 [0,1,0,0,0,0|3,0,0]=4 324 B12R1.226 CC(O)CCN1CCOC(=O)C1 2230a_100000131268_100012276601 [0,1,0,0,0,0|3,0,0]=4 325 B12R1.226 CC(O)CNC1CCNC(=O)C1 2230a_100016994916_100011218427 [0,1,0,0,0,0|3,0,0]=4 326 B12R1.226 CC(O)CNC1CCNC(=O)C1 34a_100016994916_100011218427 [0,1,0,0,0,0|3,0,0]=4 327 B12R1.226 CC(O)COC1CCCC(=O)C1 34a_100012613340_100011218427 [0,1,0,0,0,0|2,0,0]=3 328 B12R1.226 CC(O)CO[C@@H]1CCNC(=O)C1 34a_100015189427_100011218427 [0,1,0,0,0,0|3,0,0]=4 329 B12R1.226 CC1=CC(CCC1)OCC(C)C 34a_100011218613_100000210624 [0,1,0,0,0,0|3,0,0]=4 330 B12R1.226 CC1=CC(CCC1)OCC(C)O 34a_100011218613_100011218427 [0,1,0,0,0,0|3,0,0]=4 331 B12R1.226 CC1=CC(CCC1)OC[C@@H](C)O 34a_100011218613_100009817552 [0,1,0,0,0,0|3,0,0]=4 332 B12R1.226 C[C@@H](O)CNC1CCNC(=O)C1 2230a_100016994916_100009817552 [0,1,0,0,0,0|3,0,0]=4 333 B12R1.226 C[C@@H](O)CNC1CCNC(=O)C1 34a_100016994916_100009817552 [0,1,0,0,0,0|3,0,0]=4 334 B12R1.226 C[C@@H](O)COC1CCCC(=O)C1 34a_100012613340_100009817552 [0,1,0,0,0,0|2,0,0]=3 335 B12R1.226 C[C@@H](O)CO[C@@H]1CCNC(=O)C1 34a_100015189427_100009817552 [0,1,0,0,0,0|3,0,0]=4 336 B12R1.226 O=C1CCCC(C1)OCC(F)F 34a_100012613340_100011934356 [0,1,0,0,0,0|3,0,0]=4 337 B12R1.385 CCCCN1CCN(C(=O)C1)C 2230a_100000187256_100000210211 [0,1,0,0,0,0|3,0,0]=4 338 B12R1.385 CCCCN1CCN(C(=O)C1)C 269982a_100000187256_100000210211 [0,1,0,0,0,0|3,0,0]=4 339 B12R1.385 CCCNC1CCN(C(=O)C1)C 2230a_100000126938_100000210303 [0,1,0,0,0,0|3,0,0]=4 340 B12R1.385 CCCNC1CCN(C(=O)C1)C 34a_100000126938_100000210303 [0,1,0,0,0,0|3,0,0]=4 341 B10R0.1 C#CCC(=O)CCCCCC 1458a_100011220946_100000210757 [0,0,1,0,0,0|1,0,2]=4 342 B10R0.1 C#CCC(=O)CCCCCC 1458a_100102632555_100000184674 [0,0,1,0,0,0|1,0,2]=4 343 B10R0.1 C#CCC(=O)NCCCCC 1626a_100000209983_100011220946 [0,0,1,0,0,0|1,0,2]=4 344 B10R0.1 C#CCC(=O)NCCCCC 527a_100000209983_100011220946 [0,0,1,0,0,0|1,0,2]=4 345 B10R0.1 C#CCCCCC(=O)CCC 1458a_100000211992_100010269958 [0,0,1,0,0,0|1,0,2]=4 346 B10R0.1 C#CCCCCC(=O)CCC 1458a_100000696528_100000210303 [0,0,1,0,0,0|1,0,2]=4 347 B10R0.1 C#CCCCNC(=O)CCC 11a_100000718082_100000211992 [0,0,1,0,0,0|1,0,2]=4 348 B10R0.1 C#CCCCNC(=O)CCC 1626a_100000718082_100000211992 [0,0,1,0,0,0|1,0,2]=4 349 B10R0.1 C#CCCCNC(=O)CCC 240690a_100000718082_100000211992 [0,0,1,0,0,0|1,0,2]=4 350 B10R0.1 C#CCCCNC(=O)CCC 527a_100000718082_100000211992 [0,0,1,0,0,0|1,0,2]=4 351 B10R0.1 C#CCNCOC(=O)CCC 34a_100000212058_100000034017 [0,0,1,0,0,0|1,0,2]=4 352 B10R0.1 C#CCOCOC(=O)CCC 34a_100000210247_100000034017 [0,0,1,0,0,0|1,0,2]=4 353 B10R0.1 C#CCSCOC(=O)CCC 62a_100000038162_100000034017 [0,0,1,0,0,0|1,0,2]=4 354 B10R0.1 C=CCC(=O)CCCCCC 1458a_100000210193_100000210757 [0,0,1,0,0,0|1,0,2]=4 355 B10R0.1 C=CCC(=O)CCCCCC 1458a_100102632555_100000210623 [0,0,1,0,0,0|1,0,2]=4 356 B10R0.1 C=CCC(=O)NCCCCC 11a_100000209983_100000210193 [0,0,1,0,0,0|1,0,2]=4 357 B10R0.1 C=CCC(=O)NCCCCC 1626a_100000209983_100000210193 [0,0,1,0,0,0|1,0,2]=4 358 B10R0.1 C=CCC(=O)NCCCCC 240690a_100000209983_100000210193 [0,0,1,0,0,0|1,0,2]=4 359 B10R0.1 C=CCC(=O)NCCCCC 527a_100000209983_100000210193 [0,0,1,0,0,0|1,0,2]=4 360 B10R0.1 C=CCCCCC(=O)CCC 1458a_100000211992_100011215482 [0,0,1,0,0,0|1,0,2]=4 361 B10R0.1 C=CCCCCC(=O)CCC 1458a_100011215552_100000210303 [0,0,1,0,0,0|1,0,2]=4 362 B10R0.1 C=CCCCNC(=O)CCC 11a_100000700776_100000211992 [0,0,1,0,0,0|1,0,2]=4 363 B10R0.1 C=CCCCNC(=O)CCC 1626a_100000700776_100000211992 [0,0,1,0,0,0|1,0,2]=4 364 B10R0.1 C=CCCCNC(=O)CCC 240690a_100000700776_100000211992 [0,0,1,0,0,0|1,0,2]=4 365 B10R0.1 C=CCCCNC(=O)CCC 527a_100000700776_100000211992 [0,0,1,0,0,0|1,0,2]=4 366 B10R0.1 C=CCNCOC(=O)CCC 2230a_100020586998_100000034017 [0,0,1,0,0,0|1,0,2]=4 367 B10R0.1 C=CCOCOC(=O)CCC 34a_200000210373_100000034017 [0,0,1,0,0,0|1,0,2]=4 368 B10R0.1 C=CCSCOC(=O)CCC 62a_100000210623_100000034017 [0,0,1,0,0,0|1,0,2]=4 369 B10R0.1 CC#CC(=O)CCCCCC 1458a_100000763181_100000210757 [0,0,1,0,0,0|1,0,2]=4 370 B10R0.1 CC/C=C\CCC(=O)CCC 1458a_100000211992_100015370543 [0,0,1,0,0,0|1,0,2]=4 371 B10R0.1 CC=CC(=O)CCCCCC 1458a_100000210699_100000210757 [0,0,1,0,0,0|1,0,2]=4 372 B10R0.1 CC=CC(=O)NCCCCC 11a_100000209983_100000210699 [0,0,1,0,0,0|1,0,2]=4 373 B10R0.1 CC=CC(=O)NCCCCC 1626a_100000209983_100000210699 [0,0,1,0,0,0|1,0,2]=4 374 B10R0.1 CC=CC(=O)NCCCCC 240690a_100000209983_100000210699 [0,0,1,0,0,0|1,0,2]=4 375 B10R0.1 CCC/C=C/CC(=O)CCC 1458a_200016266809_100000210303 [0,0,1,0,0,0|1,0,2]=4 376 B10R0.1 CCCC(=O)CCCCC#N 1458a_100000211992_100000211819 [0,0,1,0,0,0|2,0,1]=4 377 B10R0.1 CCCC(=O)CCCCCF 1458a_100000211992_100000729378 [0,0,1,0,0,0|2,0,0]=3 378 B10R0.1 CCCC(=O)CCCCCO 1458a_100000211992_100000746330 [0,0,1,0,0,0|2,0,0]=3 379 B10R0.1 CCCC(=O)CCCCCO 1458a_100102619762_100000210303 [0,0,1,0,0,0|2,0,0]=3 380 B10R0.1 CCCC(=O)CCCCOC 1458a_100000211992_100000755781 [0,0,1,0,0,0|2,0,0]=3 381 B10R0.1 CCCC(=O)CCCOCC 1458a_100000211992_100012232248 [0,0,1,0,0,0|2,0,0]=3 382 B10R0.1 CCCC(=O)CCOCCO 1458a_100000211992_100011215305 [0,0,1,0,0,0|3,0,0]=4 383 B10R0.1 CCCC(=O)CCOCCO 1458a_100011229844_100000210303 [0,0,1,0,0,0|3,0,0]=4 384 B10R0.1 CCCC(=O)CNCCCF 2230a_100015189416_100000747444 [0,0,1,0,0,0|3,0,0]=4 385 B10R0.1 CCCC(=O)CNCCOC 2230a_100000209980_100000747444 [0,0,1,0,0,0|3,0,0]=4 386 B10R0.1 CCCC(=O)CNCCSC 2230a_100020590264_100000747444 [0,0,1,0,0,0|3,0,0]=4 387 B10R0.1 CCCC(=O)COCCOC 1458a_100000211095_100000210303 [0,0,1,0,0,0|3,0,0]=4 388 B10R0.1 CCCC(=O)COCCSC 7a_100000230434_100000747444 [0,0,1,0,0,0|3,0,0]=4 389 B10R0.1 CCCC(=O)CSCCCF 62a_100000747444_100011934791 [0,0,1,0,0,0|3,0,0]=4 390 B10R0.1 CCCC(=O)CSCCCF 62a_100011934791_100000747444 [0,0,1,0,0,0|3,0,0]=4 391 B10R0.1 CCCC(=O)CSCCCO 62a_100000747444_100011215043 [0,0,1,0,0,0|3,0,0]=4 392 B10R0.1 CCCC(=O)CSCCCO 62a_100011215043_100000747444 [0,0,1,0,0,0|3,0,0]=4 393 B10R0.1 CCCC(=O)CSCCOC 62a_100000233755_100000747444 [0,0,1,0,0,0|3,0,0]=4 394 B10R0.1 CCCC(=O)CSCCOC 62a_100000747444_100000233755 [0,0,1,0,0,0|3,0,0]=4 395 B10R0.1 CCCC(=O)CSCCSC 62a_100000212216_100000747444 [0,0,1,0,0,0|3,0,0]=4 396 B10R0.1 CCCC(=O)CSCCSC 62a_100000747444_100000751147 [0,0,1,0,0,0|3,0,0]=4 397 B10R0.1 CCCC(=O)CSCOCC 62a_100000739092_100000747444 [0,0,1,0,0,0|3,0,0]=4 398 B10R0.1 CCCC(=O)CSCOCC 62a_100000747444_100000739092 [0,0,1,0,0,0|3,0,0]=4 399 B10R0.1 CCCC(=O)NCCCCO 240690a_100000750430_100000211992 [0,0,1,0,0,0|2,0,0]=3 400 B10R0.1 CCCC(=O)NCCCCO 527a_100000750430_100000211992 [0,0,1,0,0,0|2,0,0]=3 401 B10R0.1 CCCC(=O)NCCCOC 1626a_100150723488_100000211992 [0,0,1,0,0,0|2,0,0]=3 402 B10R0.1 CCCC(=O)NCCCOC 240690a_100150723488_100000211992 [0,0,1,0,0,0|2,0,0]=3 403 B10R0.1 CCCC(=O)NCCCOC 527a_100150723488_100000211992 [0,0,1,0,0,0|2,0,0]=3 404 B10R0.1 CCCC(=O)NCCCSC 11a_100000749238_100000211992 [0,0,1,0,0,0|2,0,0]=3 405 B10R0.1 CCCC(=O)NCCCSC 1626a_100000749238_100000211992 [0,0,1,0,0,0|2,0,0]=3 406 B10R0.1 CCCC(=O)NCCCSC 240690a_100000749238_100000211992 [0,0,1,0,0,0|2,0,0]=3 407 B10R0.1 CCCC(=O)NCCCSC 527a_100000749238_100000211992 [0,0,1,0,0,0|2,0,0]=3 408 B10R0.1 CCCC(=O)NCCOCC 11a_100011200944_100000211992 [0,0,1,0,0,0|2,0,0]=3 409 B10R0.1 CCCC(=O)NCCOCC 1626a_102516460346_100000211992 [0,0,1,0,0,0|2,0,0]=3 410 B10R0.1 CCCC(=O)NCCOCC 240690a_100011200944_100000211992 [0,0,1,0,0,0|2,0,0]=3 411 B10R0.1 CCCC(=O)NCCOCC 527a_100011200944_100000211992 [0,0,1,0,0,0|2,0,0]=3 412 B10R0.1 CCCC(=O)NCCSCC 11a_100000106463_100000211992 [0,0,1,0,0,0|2,0,0]=3 413 B10R0.1 CCCC(=O)NCCSCC 1626a_100000106463_100000211992 [0,0,1,0,0,0|2,0,0]=3 414 B10R0.1 CCCC(=O)NCCSCC 240690a_100000106463_100000211992 [0,0,1,0,0,0|2,0,0]=3 415 B10R0.1 CCCC(=O)NCCSCC 527a_100000106463_100000211992 [0,0,1,0,0,0|2,0,0]=3 416 B10R0.1 CCCC(=O)NNCCOC 22a_100000741390_100000211992 [0,0,1,0,0,0|3,0,0]=4 417 B10R0.1 CCCC(=O)OCNCCF 34a_100000724931_100000034017 [0,0,1,0,0,0|2,0,0]=3 418 B10R0.1 CCCC(=O)OCNCCO 2230a_100016997473_100000034017 [0,0,1,0,0,0|2,0,0]=3 419 B10R0.1 CCCC(=O)OCNCCO 34a_100016990907_100000034017 [0,0,1,0,0,0|2,0,0]=3 420 B10R0.1 CCCC(=O)OCOCCBr 34a_100000211926_100000034017 [0,0,1,0,0,0|2,0,0]=3 421 B10R0.1 CCCC(=O)OCOCCN 34a_100000210304_100000034017 [0,0,1,0,0,0|2,0,0]=3 422 B10R0.1 CCCC(=O)OCSCC#N 62a_100011215382_100000034017 [0,0,1,0,0,0|2,0,1]=4 423 B10R0.1 CCCC(=O)OCSCC=O 62a_200015260668_100000034017 [0,0,1,0,0,0|2,0,1]=4 424 B10R0.1 CCCC(=O)OCSCCF 62a_100011217306_100000034017 [0,0,1,0,0,0|2,0,0]=3 425 B10R0.1 CCCC(=O)OCSCCO 62a_100000211926_100000034017 [0,0,1,0,0,0|2,0,0]=3 426 B10R0.1 CCCC(=O)OCSCOC 62a_100000766300_100000034017 [0,0,1,0,0,0|2,0,0]=3 427 B10R0.1 CCCC(=O)OCSCSC 62a_100011218213_100000034017 [0,0,1,0,0,0|2,0,0]=3 428 B10R0.1 CCCC(C)OCCCCBr 34a_100011216708_100000766640 [0,0,1,0,0,0|2,0,1]=4 429 B10R0.1 CCCC(C)OCCCCCl 34a_100000210776_100000766640 [0,0,1,0,0,0|2,0,1]=4 430 B10R0.1 CCCC(C)OCCCCCl 7a_100000210776_100000766640 [0,0,1,0,0,0|2,0,1]=4 431 B10R0.1 CCCC(C)OCCCCF 34a_100000764384_100000729493 [0,0,1,0,0,0|2,0,1]=4 432 B10R0.1 CCCC(C)OCCCCF 34a_100011995726_100000766640 [0,0,1,0,0,0|2,0,1]=4 433 B10R0.1 CCCC(C)OCCCCF 7a_100000764384_100000729493 [0,0,1,0,0,0|2,0,1]=4 434 B10R0.1 CCCC(C)OCCCCF 7a_100011995726_100000766640 [0,0,1,0,0,0|2,0,1]=4 435 B10R0.1 CCCC(C)OCCCCI 34a_200012148704_100000766640 [0,0,1,0,0,0|2,0,1]=4 436 B10R0.1 CCCC(C)OCCCCN 34a_100000750430_100000766640 [0,0,1,0,0,0|2,0,1]=4 437 B10R0.1 CCCC(C)OCCCCO 34a_100000764384_100011216708 [0,0,1,0,0,0|2,0,1]=4 438 B10R0.1 CCCC(C)OCCCCO 7a_100000764384_100000210776 [0,0,1,0,0,0|2,0,1]=4 439 B10R0.1 CCCC(C)OCCCNC 34a_100000213112_100000766640 [0,0,1,0,0,0|2,0,1]=4 440 B10R0.1 CCCC(C)OCCCOC 34a_100000740835_100000766640 [0,0,1,0,0,0|2,0,1]=4 441 B10R0.1 CCCC(C)OCCCOC 34a_100000764384_100000740836 [0,0,1,0,0,0|2,0,1]=4 442 B10R0.1 CCCC(C)OCCCOC 7a_100000764384_100000740836 [0,0,1,0,0,0|2,0,1]=4 443 B10R0.1 CCCC(C)OCCCSC 34a_100000690336_100000766640 [0,0,1,0,0,0|2,0,1]=4 444 B10R0.1 CCCC(C)OCCCSC 7a_100000690336_100000766640 [0,0,1,0,0,0|2,0,1]=4 445 B10R0.1 CCCC(C)OCCOCC 34a_100000210136_100000766640 [0,0,1,0,0,0|2,0,1]=4 446 B10R0.1 CCCC(C)OCCOCC 34a_100000764384_100000210147 [0,0,1,0,0,0|2,0,1]=4 447 B10R0.1 CCCC(C)OCCOCC 7a_100000210136_100000766640 [0,0,1,0,0,0|2,0,1]=4 448 B10R0.1 CCCC(C)OCCOCC 7a_100000764384_100011215890 [0,0,1,0,0,0|2,0,1]=4 449 B10R0.1 CCCC(C)OCCSCC 34a_100000212035_100000766640 [0,0,1,0,0,0|2,0,1]=4 450 B10R0.1 CCCC(C)OCCSCC 34a_100000764384_100000757381 [0,0,1,0,0,0|2,0,1]=4 451 B10R0.1 CCCC(C)OCCSCC 7a_100000212035_100000766640 [0,0,1,0,0,0|2,0,1]=4 452 B10R0.1 CCCC(C)OCCSCC 7a_100000764384_100000757381 [0,0,1,0,0,0|2,0,1]=4 453 B10R0.1 CCCC=NNC(=O)CCC 4a_100000189770_100000185831 [0,0,1,0,0,0|2,0,1]=4 454 B10R0.1 CCCCC=CC(=O)CCC 1458a_100016266645_100000210303 [0,0,1,0,0,0|1,0,1]=3 455 B10R0.1 CCCCC=CC(=O)CCF 1458a_100016266645_100011217306 [0,0,1,0,0,0|2,0,1]=4 456 B10R0.1 CCCCC=CC(=O)CCO 1458a_100016266645_100000211926 [0,0,1,0,0,0|2,0,1]=4 457 B10R0.1 CCCCC=CC(=O)NCC 11a_100015525214_100016266645 [0,0,1,0,0,0|2,0,1]=4 458 B10R0.1 CCCCC=CC(=O)NCC 240690a_100015525214_100016266645 [0,0,1,0,0,0|2,0,1]=4 459 B10R0.1 CCCCCCC(=O)CC#N 1458a_100051588842_100000210757 [0,0,1,0,0,0|2,0,1]=4 460 B10R0.1 CCCCCCC(=O)CC#N 1458a_100102632555_100011214920 [0,0,1,0,0,0|2,0,1]=4 461 B10R0.1 CCCCCCC(=O)CCC 1458a_100000211992_100000210757 [0,0,1,0,0,0|1,0,0]=2 462 B10R0.1 CCCCCCC(=O)CCC 1458a_100102632555_100000210303 [0,0,1,0,0,0|1,0,0]=2 463 B10R0.1 CCCCCCC(=O)CCF 1458a_100102632555_100011217306 [0,0,1,0,0,0|2,0,0]=3 464 B10R0.1 CCCCCCC(=O)CCO 1458a_100011216618_100000210757 [0,0,1,0,0,0|2,0,0]=3 465 B10R0.1 CCCCCCC(=O)CCO 1458a_100102632555_100000211926 [0,0,1,0,0,0|2,0,0]=3 466 B10R0.1 CCCCCCC(=O)COC 1458a_100000210968_100000210757 [0,0,1,0,0,0|2,0,0]=3 467 B10R0.1 CCCCCCC(=O)CSC 1458a_100000184570_100000210757 [0,0,1,0,0,0|2,0,0]=3 468 B10R0.1 CCCCCCC(=O)NCC 11a_100015525214_100102632555 [0,0,1,0,0,0|2,0,0]=3 469 B10R0.1 CCCCCCC(=O)NCC 240690a_100015525214_100102632555 [0,0,1,0,0,0|2,0,0]=3 470 B10R0.1 CCCCCCC(=O)NCC 527a_100015525214_100102632555 [0,0,1,0,0,0|2,0,0]=3 471 B10R0.1 CCCCCCC(=O)NNC 22a_100016993582_100102632555 [0,0,1,0,0,0|3,0,0]=4 472 B10R0.1 CCCCCCN(C)CCC 2230a_100000747261_100000210314 [0,0,1,0,0,0|3,0,0]=4 473 B10R0.1 CCCCCCN(C)CCC 2230a_106256046315_100000210303 [0,0,1,0,0,0|3,0,0]=4 474 B10R0.1 CCCCCCN(C)CCC 269982a_100000747261_100000210757 [0,0,1,0,0,0|3,0,0]=4 475 B10R0.1 CCCCCCN(C)CCC 269982a_106256046315_100000210303 [0,0,1,0,0,0|3,0,0]=4 476 B10R0.1 CCCCCNC(=O)CC#N 1626a_100000209983_100051588842 [0,0,1,0,0,0|2,0,1]=4 477 B10R0.1 CCCCCNC(=O)CC#N 240690a_100000209983_100051588842 [0,0,1,0,0,0|2,0,1]=4 478 B10R0.1 CCCCCNC(=O)CCC 11a_100000209983_100000211992 [0,0,1,0,0,0|1,0,0]=2 479 B10R0.1 CCCCCNC(=O)CCC 1626a_100000209983_100000211992 [0,0,1,0,0,0|1,0,0]=2 480 B10R0.1 CCCCCNC(=O)CCC 240690a_100000209983_100000211992 [0,0,1,0,0,0|1,0,0]=2 481 B10R0.1 CCCCCNC(=O)CCC 527a_100000209983_100000211992 [0,0,1,0,0,0|1,0,0]=2 482 B10R0.1 CCCCCNC(=O)CCO 240690a_100000209983_100011216618 [0,0,1,0,0,0|2,0,0]=3 483 B10R0.1 CCCCCNC(=O)CNC 2230a_106832991635_100000230301 [0,0,1,0,0,0|2,0,0]=3 484 B10R0.1 CCCCCNC(=O)CNC 34a_100102657272_100000230301 [0,0,1,0,0,0|2,0,0]=3 485 B10R0.1 CCCCCNC(=O)CNC 7a_106832991635_100000230301 [0,0,1,0,0,0|2,0,0]=3 486 B10R0.1 CCCCCNC(=O)COC 11a_100000209983_100000210968 [0,0,1,0,0,0|2,0,0]=3 487 B10R0.1 CCCCCNC(=O)COC 1626a_100000209983_100000210968 [0,0,1,0,0,0|2,0,0]=3 488 B10R0.1 CCCCCNC(=O)COC 240690a_100000209983_100000210968 [0,0,1,0,0,0|2,0,0]=3 489 B10R0.1 CCCCCNC(=O)COC 34a_100138415774_100000230301 [0,0,1,0,0,0|2,0,0]=3 490 B10R0.1 CCCCCNC(=O)COC 527a_100000209983_100000210968 [0,0,1,0,0,0|2,0,0]=3 491 B10R0.1 CCCCCNC(=O)CSC 11a_100000209983_100000184570 [0,0,1,0,0,0|2,0,0]=3 492 B10R0.1 CCCCCNC(=O)CSC 1626a_100000209983_100000184570 [0,0,1,0,0,0|2,0,0]=3 493 B10R0.1 CCCCCNC(=O)CSC 240690a_100000209983_100000184570 [0,0,1,0,0,0|2,0,0]=3 494 B10R0.1 CCCCCNC(=O)CSC 527a_100000209983_100000184570 [0,0,1,0,0,0|2,0,0]=3 495 B10R0.1 CCCCCNC(=O)CSC 62a_100000230301_200000210301 [0,0,1,0,0,0|2,0,0]=3 496 B10R0.1 CCCCCNC(=O)CSC 62a_200000210301_100000230301 [0,0,1,0,0,0|2,0,0]=3 497 B10R0.1 CCCCCNC(=O)CS[13CH3] 62a_100000230301_200025704644 [0,0,1,0,0,0|2,0,0]=3 498 B10R0.1 CCCCCNC(=O)CS[13CH3] 62a_200025704644_100000230301 [0,0,1,0,0,0|2,0,0]=3 499 B10R0.1 CCCCCNC(=O)NCC 2708a_100000209983_100015525214 [0,0,1,0,0,0|2,0,0]=3 500 B10R0.1 CCCCCNC(=O)NCC 2708a_100015525214_100000209983 [0,0,1,0,0,0|2,0,0]=3 501 B10R0.1 CCCCCNC(=O)NCC 273464a_100000209983_100015525214 [0,0,1,0,0,0|2,0,0]=3 502 B10R0.1 CCCCCNC(=O)NCC 273464a_100015525214_100000209983 [0,0,1,0,0,0|2,0,0]=3 503 B10R0.1 CCCCCNC(=O)NCC 512a_100000209983_100015525214 [0,0,1,0,0,0|2,0,0]=3 504 B10R0.1 CCCCCNC(=O)NCC 512a_100015525214_100000209983 [0,0,1,0,0,0|2,0,0]=3 505 B10R0.1 CCCCCNC(=O)NNC 273464a_100000209983_100016993582 [0,0,1,0,0,0|3,0,0]=4 506 B10R0.1 CCCCCNC(=O)NNC 512a_100000209983_100016993582 [0,0,1,0,0,0|3,0,0]=4 507 B10R0.1 CCCCCNC(=O)NNC 512a_100016993582_100000209983 [0,0,1,0,0,0|3,0,0]=4 508 B10R0.1 CCCCCNC(C)CCC 2230a_100000209983_100000766640 [0,0,1,0,0,0|2,0,1]=4 509 B10R0.1 CCCCCNC(C)CCC 2230a_100000741246_100000210326 [0,0,1,0,0,0|2,0,1]=4 510 B10R0.1 CCCCCNC(C)CCC 270004a_100000209983_100000211909 [0,0,1,0,0,0|2,0,1]=4 511 B10R0.1 CCCCCOC(C)CCBr 34a_100012276601_100000718602 [0,0,1,0,0,0|2,0,1]=4 512 B10R0.1 CCCCCOC(C)CCC 34a_100000210253_100000766640 [0,0,1,0,0,0|1,0,1]=3 513 B10R0.1 CCCCCOC(C)CCC 34a_100000764384_100000718602 [0,0,1,0,0,0|1,0,1]=3 514 B10R0.1 CCCCCOC(C)CCC 7a_100000210253_100000766640 [0,0,1,0,0,0|1,0,1]=3 515 B10R0.1 CCCCCOC(C)CCC 7a_100000764384_100000210326 [0,0,1,0,0,0|1,0,1]=3 516 B10R0.1 CCCCCOC(C)CCO 34a_100000210253_100009893172 [0,0,1,0,0,0|2,0,1]=4 517 B10R0.1 CCCCCOC(C)CCO 7a_100000210253_100009893172 [0,0,1,0,0,0|2,0,1]=4 518 B10R0.1 CCCCCOC(C)COC 34a_100000210253_100000765312 [0,0,1,0,0,0|2,0,1]=4 519 B10R0.1 CCCCCOC(C)COC 7a_100000210253_100000765312 [0,0,1,0,0,0|2,0,1]=4 520 B10R0.1 CCCCCO[C@H](C)COC 34a_100011934205_100000718602 [0,0,1,0,0,0|2,0,1]=4 521 B10R0.1 CCCCCSC(C)CCC 62a_100000210326_100000766640 [0,0,1,0,0,0|1,1,1]=4 522 B10R0.1 CCCCCSC(C)CCC 62a_100000766640_100000210326 [0,0,1,0,0,0|1,1,1]=4 523 B10R0.1 CCCCNCC(=O)CCC 2230a_100000102301_100000747444 [0,0,1,0,0,0|2,0,0]=3 524 B10R0.1 CCCCNCC(=O)CCC 7a_106832991798_100000747444 [0,0,1,0,0,0|2,0,0]=3 525 B10R0.1 CCCCNCC(=O)NCC 2230a_100000102301_100000183381 [0,0,1,0,0,0|3,0,0]=4 526 B10R0.1 CCCCNCC(=O)NCC 2230a_100016988866_100000210211 [0,0,1,0,0,0|3,0,0]=4 527 B10R0.1 CCCCNCC(=O)NCC 7a_106832991798_100000183381 [0,0,1,0,0,0|3,0,0]=4 528 B10R0.1 CCCCNCC(=O)OCC 2230a_100000102301_100000188475 [0,0,1,0,0,0|3,0,0]=4 529 B10R0.1 CCCCNCC(=O)OCC 7a_106832991798_100000188475 [0,0,1,0,0,0|3,0,0]=4 530 B10R0.1 CCCCNN=C(C)CCC 4a_100025702795_100000211909 [0,0,1,0,0,0|3,0,0]=4 531 B10R0.1 CCCCNNC(=O)CCC 22a_100025702795_100000211992 [0,0,1,0,0,0|2,0,0]=3 532 B10R0.1 CCCCNNC(=O)CCO 22a_100025702795_100011216618 [0,0,1,0,0,0|3,0,0]=4 533 B10R0.1 CCCCNNC(=O)COC 22a_100025702795_100000210968 [0,0,1,0,0,0|3,0,0]=4 534 B10R0.1 CCCCNNC(=O)CSC 22a_100025702795_100000184570 [0,0,1,0,0,0|3,0,0]=4 535 B10R0.1 CCCCNNC(=O)NCC 273464a_100015525214_100025702795 [0,0,1,0,0,0|3,0,0]=4 536 B10R0.1 CCCCNNC(=O)NCC 512a_100015525214_100025702795 [0,0,1,0,0,0|3,0,0]=4 537 B10R0.1 CCCCNNC(=O)NCC 512a_100025702795_100015525214 [0,0,1,0,0,0|3,0,0]=4 538 B10R0.1 CCCCOCC(=O)CCC 1458a_100000211992_100011995733 [0,0,1,0,0,0|2,0,0]=3 539 B10R0.1 CCCCOCC(=O)CCC 1458a_100000757543_100000210303 [0,0,1,0,0,0|2,0,0]=3 540 B10R0.1 CCCCOCC(=O)CCC 7a_100000210227_100000747444 [0,0,1,0,0,0|2,0,0]=3 541 B10R0.1 CCCCOCC(=O)CCF 1458a_100000757543_100011217306 [0,0,1,0,0,0|3,0,0]=4 542 B10R0.1 CCCCOCC(=O)CCO 1458a_100000757543_100000211926 [0,0,1,0,0,0|3,0,0]=4 543 B10R0.1 CCCCOCC(=O)CCO 1458a_100011216618_100011995733 [0,0,1,0,0,0|3,0,0]=4 544 B10R0.1 CCCCOCC(=O)COC 1458a_100000210968_100011995733 [0,0,1,0,0,0|3,0,0]=4 545 B10R0.1 CCCCOCC(=O)CSC 1458a_100000184570_100011995733 [0,0,1,0,0,0|3,0,0]=4 546 B10R0.1 CCCCOCC(=O)NCC 11a_100015525214_100000757543 [0,0,1,0,0,0|3,0,0]=4 547 B10R0.1 CCCCOCC(=O)NCC 240690a_100015525214_100000757543 [0,0,1,0,0,0|3,0,0]=4 548 B10R0.1 CCCCOCC(=O)NCC 34a_100000210227_100000183381 [0,0,1,0,0,0|3,0,0]=4 549 B10R0.1 CCCCOCC(=O)NCC 527a_100015525214_100000757543 [0,0,1,0,0,0|3,0,0]=4 550 B10R0.1 CCCCOCC(=O)NCC 7a_100000210227_100000183381 [0,0,1,0,0,0|3,0,0]=4 551 B10R0.1 CCCCOCC(=O)OCC 34a_100000210227_100000188475 [0,0,1,0,0,0|3,0,0]=4 552 B10R0.1 CCCCOCC(=O)OCC 7a_100000210227_100000188475 [0,0,1,0,0,0|3,0,0]=4 553 B10R0.1 CCCCSCC(=O)CCC 1458a_100000191162_100000210303 [0,0,1,0,0,0|2,0,0]=3 554 B10R0.1 CCCCSCC(=O)CCC 62a_100000210211_100000747444 [0,0,1,0,0,0|2,0,0]=3 555 B10R0.1 CCCCSCC(=O)CCC 62a_100000747444_100000210210 [0,0,1,0,0,0|2,0,0]=3 556 B10R0.1 CCCCSCC(=O)CCF 1458a_100000191162_100011217306 [0,0,1,0,0,0|3,0,0]=4 557 B10R0.1 CCCCSCC(=O)CCO 1458a_100000191162_100000211926 [0,0,1,0,0,0|3,0,0]=4 558 B10R0.1 CCCCSCC(=O)NCC 11a_100015525214_100000191162 [0,0,1,0,0,0|3,0,0]=4 559 B10R0.1 CCCCSCC(=O)NCC 240690a_100015525214_100000191162 [0,0,1,0,0,0|3,0,0]=4 560 B10R0.1 CCCCSCC(=O)NCC 527a_100015525214_100000191162 [0,0,1,0,0,0|3,0,0]=4 561 B10R0.1 CCCCSCC(=O)NCC 62a_100000183381_100000210210 [0,0,1,0,0,0|3,0,0]=4 562 B10R0.1 CCCCSCC(=O)NCC 62a_100000210211_100000183381 [0,0,1,0,0,0|3,0,0]=4 563 B10R0.1 CCCCSCC(=O)OCC 62a_100000188475_100000210210 [0,0,1,0,0,0|3,0,0]=4 564 B10R0.1 CCCCSCC(=O)OCC 62a_100000210211_100000188475 [0,0,1,0,0,0|3,0,0]=4 565 B10R0.1 CCCNCCC(=O)NCC 34a_100025743525_100000210303 [0,0,1,0,0,0|3,0,0]=4 566 B10R0.1 CCCOCCC(=O)CCC 1458a_100000211992_100011215938 [0,0,1,0,0,0|2,0,0]=3 567 B10R0.1 CCCOCCC(=O)CCO 1458a_100011216618_100011215938 [0,0,1,0,0,0|3,0,0]=4 568 B10R0.1 CCCOCCC(=O)COC 1458a_100000210968_100011215938 [0,0,1,0,0,0|3,0,0]=4 569 B10R0.1 CCCOCCC(=O)CSC 1458a_100000184570_100011215938 [0,0,1,0,0,0|3,0,0]=4 570 B10R0.1 CCCOCCC(=O)OCC 34a_100000210258_100000765890 [0,0,1,0,0,0|3,0,0]=4 571 B10R0.1 CCCOCOC(=O)CCC 34a_100000210258_100000034017 [0,0,1,0,0,0|1,0,0]=2 572 B10R0.1 CCCSCCC(=O)NCC 62a_100000210303_100000737597 [0,0,1,0,0,0|3,0,0]=4 573 B10R0.1 CCCSCCC(=O)NCC 62a_100000737597_100000210303 [0,0,1,0,0,0|3,0,0]=4 574 B10R0.1 CCCSCCC(=O)OCC 62a_100000210303_100000765890 [0,0,1,0,0,0|3,0,0]=4 575 B10R0.1 CCCSCCC(=O)OCC 62a_100000765890_100000210303 [0,0,1,0,0,0|3,0,0]=4 576 B10R0.1 CCCSCOC(=O)CCC 62a_100000210303_100000034017 [0,0,1,0,0,0|1,0,0]=2 577 B10R0.1 CCCSCOC(=O)OCC 62a_100000210303_100000075025 [0,0,1,0,0,0|2,0,0]=3 578 B10R0.1 CCNC(=O)CCCCCO 240690a_100015525214_100102619762 [0,0,1,0,0,0|3,0,0]=4 579 B10R0.1 CCNC(=O)NCCCCO 2708a_100000750430_100015525214 [0,0,1,0,0,0|3,0,0]=4 580 B10R0.1 CCNC(=O)NCCCCO 2708a_100015525214_100000750430 [0,0,1,0,0,0|3,0,0]=4 581 B10R0.1 CCNC(=O)NCCCCO 273464a_100000750430_100015525214 [0,0,1,0,0,0|3,0,0]=4 582 B10R0.1 CCNC(=O)NCCCCO 273464a_100015525214_100000750430 [0,0,1,0,0,0|3,0,0]=4 583 B10R0.1 CCNC(=O)NCCCCO 512a_100000750430_100015525214 [0,0,1,0,0,0|3,0,0]=4 584 B10R0.1 CCNC(=O)NCCCCO 512a_100015525214_100000750430 [0,0,1,0,0,0|3,0,0]=4 585 B10R0.1 CCNC(=O)NCCCOC 2708a_100015525214_100150723488 [0,0,1,0,0,0|3,0,0]=4 586 B10R0.1 CCNC(=O)NCCCOC 2708a_100150723488_100015525214 [0,0,1,0,0,0|3,0,0]=4 587 B10R0.1 CCNC(=O)NCCCOC 273464a_100015525214_100150723488 [0,0,1,0,0,0|3,0,0]=4 588 B10R0.1 CCNC(=O)NCCCOC 273464a_100150723488_100015525214 [0,0,1,0,0,0|3,0,0]=4 589 B10R0.1 CCNC(=O)NCCCOC 512a_100015525214_100150723488 [0,0,1,0,0,0|3,0,0]=4 590 B10R0.1 CCNC(=O)NCCCSC 2708a_100000749238_100015525214 [0,0,1,0,0,0|3,0,0]=4 591 B10R0.1 CCNC(=O)NCCCSC 2708a_100015525214_100000749238 [0,0,1,0,0,0|3,0,0]=4 592 B10R0.1 CCNC(=O)NCCCSC 273464a_100000749238_100015525214 [0,0,1,0,0,0|3,0,0]=4 593 B10R0.1 CCNC(=O)NCCCSC 273464a_100015525214_100000749238 [0,0,1,0,0,0|3,0,0]=4 594 B10R0.1 CCNC(=O)NCCCSC 512a_100000749238_100015525214 [0,0,1,0,0,0|3,0,0]=4 595 B10R0.1 CCNC(=O)NCCCSC 512a_100015525214_100000749238 [0,0,1,0,0,0|3,0,0]=4 596 B10R0.1 CCNC(=O)NCCOCC 2708a_100011200944_100015525214 [0,0,1,0,0,0|3,0,0]=4 597 B10R0.1 CCNC(=O)NCCOCC 2708a_100015525214_100011200944 [0,0,1,0,0,0|3,0,0]=4 598 B10R0.1 CCNC(=O)NCCOCC 273464a_100015525214_102516460346 [0,0,1,0,0,0|3,0,0]=4 599 B10R0.1 CCNC(=O)NCCOCC 273464a_102516460346_100015525214 [0,0,1,0,0,0|3,0,0]=4 600 B10R0.1 CCNC(=O)NCCOCC 512a_100011200944_100015525214 [0,0,1,0,0,0|3,0,0]=4 601 B10R0.1 CCNC(=O)NCCOCC 512a_100015525214_100011200944 [0,0,1,0,0,0|3,0,0]=4 602 B10R0.1 CCNC(=O)NCCSCC 2708a_100000106463_100015525214 [0,0,1,0,0,0|3,0,0]=4 603 B10R0.1 CCNC(=O)NCCSCC 2708a_100015525214_100000106463 [0,0,1,0,0,0|3,0,0]=4 604 B10R0.1 CCNC(=O)NCCSCC 273464a_100000106463_100015525214 [0,0,1,0,0,0|3,0,0]=4 605 B10R0.1 CCNC(=O)NCCSCC 273464a_100015525214_100000106463 [0,0,1,0,0,0|3,0,0]=4 606 B10R0.1 CCNC(=O)NCCSCC 512a_100000106463_100015525214 [0,0,1,0,0,0|3,0,0]=4 607 B10R0.1 CCNC(=O)NCCSCC 512a_100015525214_100000106463 [0,0,1,0,0,0|3,0,0]=4 608 B10R0.1 CCNCCCC(=O)OCC 2230a_100015525214_100009991533 [0,0,1,0,0,0|3,0,0]=4 609 B10R0.1 CCOC(=O)CCCCNC 2230a_106832991635_100000750268 [0,0,1,0,0,0|3,0,0]=4 610 B10R0.1 CCOC(=O)CCCCNC 34a_100102657272_100000750268 [0,0,1,0,0,0|3,0,0]=4 611 B10R0.1 CCOC(=O)CCCCNC 7a_106832991635_100000750268 [0,0,1,0,0,0|3,0,0]=4 612 B10R0.1 CCOC(=O)CCCCOC 34a_100138415774_100000750268 [0,0,1,0,0,0|3,0,0]=4 613 B10R0.1 CCOC(=O)CCCCSC 62a_100000750268_200000210301 [0,0,1,0,0,0|3,0,0]=4 614 B10R0.1 CCOC(=O)CCCCSC 62a_200000210301_100000750268 [0,0,1,0,0,0|3,0,0]=4 615 B10R0.1 CCOC(=O)CCCCS[13CH3] 62a_100000750268_200025704644 [0,0,1,0,0,0|3,0,0]=4 616 B10R0.1 CCOC(=O)CCCCS[13CH3] 62a_200025704644_100000750268 [0,0,1,0,0,0|3,0,0]=4 617 B10R0.1 CCOC(=O)CCCSCC 62a_100000210202_100009991533 [0,0,1,0,0,0|3,0,0]=4 618 B10R0.1 CCOC(=O)CCCSCC 62a_100009991533_100000210202 [0,0,1,0,0,0|3,0,0]=4 619 B10R0.1 CCOC(=O)NCCSCC 62a_100000210202_200011445536 [0,0,1,0,0,0|3,0,0]=4 620 B10R0.1 CCOC(=O)OCSCCF 62a_100011217306_100000075025 [0,0,1,0,0,0|3,0,0]=4 621 B10R0.1 CCOC(=O)OCSCCO 62a_100000211926_100000075025 [0,0,1,0,0,0|3,0,0]=4 622 B10R0.1 CCOC(=O)OCSCOC 62a_100000766300_100000075025 [0,0,1,0,0,0|3,0,0]=4 623 B10R0.1 CCOC(=O)OCSCSC 62a_100011218213_100000075025 [0,0,1,0,0,0|3,0,0]=4 624 B10R0.1 CCOCCCC(=O)CCO 1458a_100011216618_100012232248 [0,0,1,0,0,0|3,0,0]=4 625 B10R0.1 CCOCCCC(=O)COC 1458a_100000210968_100012232248 [0,0,1,0,0,0|3,0,0]=4 626 B10R0.1 CCOCCCC(=O)CSC 1458a_100000184570_100012232248 [0,0,1,0,0,0|3,0,0]=4 627 B10R0.1 CCOCCCC(=O)OCC 34a_100121572206_100009991533 [0,0,1,0,0,0|3,0,0]=4 628 B10R0.1 CCOCCCC(=O)OCC 7a_100012001163_100000210202 [0,0,1,0,0,0|3,0,0]=4 629 B10R0.1 CCOCCNC(=O)CCO 240690a_100011200944_100011216618 [0,0,1,0,0,0|3,0,0]=4 630 B10R0.1 CCOCCNC(=O)COC 11a_100011200944_100000210968 [0,0,1,0,0,0|3,0,0]=4 631 B10R0.1 CCOCCNC(=O)COC 1626a_102516460346_100000210968 [0,0,1,0,0,0|3,0,0]=4 632 B10R0.1 CCOCCNC(=O)COC 240690a_100011200944_100000210968 [0,0,1,0,0,0|3,0,0]=4 633 B10R0.1 CCOCCNC(=O)COC 527a_100011200944_100000210968 [0,0,1,0,0,0|3,0,0]=4 634 B10R0.1 CCOCCNC(=O)CSC 11a_100011200944_100000184570 [0,0,1,0,0,0|3,0,0]=4 635 B10R0.1 CCOCCNC(=O)CSC 1626a_102516460346_100000184570 [0,0,1,0,0,0|3,0,0]=4 636 B10R0.1 CCOCCNC(=O)CSC 240690a_100011200944_100000184570 [0,0,1,0,0,0|3,0,0]=4 637 B10R0.1 CCOCCNC(=O)CSC 527a_100011200944_100000184570 [0,0,1,0,0,0|3,0,0]=4 638 B10R0.1 CCOCCNC(=O)OCC 34a_100000158857_100000210202 [0,0,1,0,0,0|3,0,0]=4 639 B10R0.1 CCOCCOC(=O)CNC 2230a_106832991635_200000101388 [0,0,1,0,0,0|2,0,0]=3 640 B10R0.1 CCOCCOC(=O)CNC 34a_100102657272_200000101388 [0,0,1,0,0,0|2,0,0]=3 641 B10R0.1 CCOCCOC(=O)CNC 7a_106832991635_200000101388 [0,0,1,0,0,0|2,0,0]=3 642 B10R0.1 CCOCCOC(=O)COC 34a_100138415774_200000101388 [0,0,1,0,0,0|2,0,0]=3 643 B10R0.1 CCOCCOC(=O)CSC 62a_200000101388_200000210301 [0,0,1,0,0,0|2,0,0]=3 644 B10R0.1 CCOCCOC(=O)CSC 62a_200000210301_200000101388 [0,0,1,0,0,0|2,0,0]=3 645 B10R0.1 CCOCCOC(=O)CS[13CH3] 62a_200000101388_200025704644 [0,0,1,0,0,0|2,0,0]=3 646 B10R0.1 CCOCCOC(=O)CS[13CH3] 62a_200025704644_200000101388 [0,0,1,0,0,0|2,0,0]=3 647 B10R0.1 CCSCCNC(=O)CCO 240690a_100000106463_100011216618 [0,0,1,0,0,0|3,0,0]=4 648 B10R0.1 CCSCCNC(=O)COC 11a_100000106463_100000210968 [0,0,1,0,0,0|3,0,0]=4 649 B10R0.1 CCSCCNC(=O)COC 1626a_100000106463_100000210968 [0,0,1,0,0,0|3,0,0]=4 650 B10R0.1 CCSCCNC(=O)COC 240690a_100000106463_100000210968 [0,0,1,0,0,0|3,0,0]=4 651 B10R0.1 CCSCCNC(=O)COC 527a_100000106463_100000210968 [0,0,1,0,0,0|3,0,0]=4 652 B10R0.1 CCSCCNC(=O)CSC 11a_100000106463_100000184570 [0,0,1,0,0,0|3,0,0]=4 653 B10R0.1 CCSCCNC(=O)CSC 1626a_100000106463_100000184570 [0,0,1,0,0,0|3,0,0]=4 654 B10R0.1 CCSCCNC(=O)CSC 240690a_100000106463_100000184570 [0,0,1,0,0,0|3,0,0]=4 655 B10R0.1 CCSCCNC(=O)CSC 527a_100000106463_100000184570 [0,0,1,0,0,0|3,0,0]=4 656 B10R0.1 CNCC(=O)NCCCOC 2230a_106832991635_100000183178 [0,0,1,0,0,0|3,0,0]=4 657 B10R0.1 CNCC(=O)NCCCOC 34a_100102657272_100000183178 [0,0,1,0,0,0|3,0,0]=4 658 B10R0.1 CNCC(=O)NCCCOC 7a_106832991635_100000183178 [0,0,1,0,0,0|3,0,0]=4 659 B10R0.1 COCC(=O)CCCCCF 1458a_100000210968_100000729378 [0,0,1,0,0,0|3,0,0]=4 660 B10R0.1 COCC(=O)CCCCCO 1458a_100000210968_100000746330 [0,0,1,0,0,0|3,0,0]=4 661 B10R0.1 COCC(=O)NCCCCO 240690a_100000750430_100000210968 [0,0,1,0,0,0|3,0,0]=4 662 B10R0.1 COCC(=O)NCCCCO 527a_100000750430_100000210968 [0,0,1,0,0,0|3,0,0]=4 663 B10R0.1 COCC(=O)NCCCSC 11a_100000749238_100000210968 [0,0,1,0,0,0|3,0,0]=4 664 B10R0.1 COCC(=O)NCCCSC 1626a_100000749238_100000210968 [0,0,1,0,0,0|3,0,0]=4 665 B10R0.1 COCC(=O)NCCCSC 240690a_100000749238_100000210968 [0,0,1,0,0,0|3,0,0]=4 666 B10R0.1 COCC(=O)NCCCSC 527a_100000749238_100000210968 [0,0,1,0,0,0|3,0,0]=4 667 B10R0.1 COCCCCC(=O)CCO 1458a_100011216618_100000755781 [0,0,1,0,0,0|3,0,0]=4 668 B10R0.1 COCCCCC(=O)COC 1458a_100000210968_100000755781 [0,0,1,0,0,0|3,0,0]=4 669 B10R0.1 COCCCCC(=O)CSC 1458a_100000184570_100000755781 [0,0,1,0,0,0|3,0,0]=4 670 B10R0.1 COCCCNC(=O)CCO 240690a_100150723488_100011216618 [0,0,1,0,0,0|3,0,0]=4 671 B10R0.1 COCCCNC(=O)COC 1626a_100150723488_100000210968 [0,0,1,0,0,0|3,0,0]=4 672 B10R0.1 COCCCNC(=O)COC 240690a_100150723488_100000210968 [0,0,1,0,0,0|3,0,0]=4 673 B10R0.1 COCCCNC(=O)COC 34a_100138415774_100000183178 [0,0,1,0,0,0|3,0,0]=4 674 B10R0.1 COCCCNC(=O)COC 527a_100150723488_100000210968 [0,0,1,0,0,0|3,0,0]=4 675 B10R0.1 COCCCNC(=O)CSC 1626a_100150723488_100000184570 [0,0,1,0,0,0|3,0,0]=4 676 B10R0.1 COCCCNC(=O)CSC 240690a_100150723488_100000184570 [0,0,1,0,0,0|3,0,0]=4 677 B10R0.1 COCCCNC(=O)CSC 527a_100150723488_100000184570 [0,0,1,0,0,0|3,0,0]=4 678 B10R0.1 COCCCNC(=O)CSC 62a_100000183178_200000210301 [0,0,1,0,0,0|3,0,0]=4 679 B10R0.1 COCCCNC(=O)CS[13CH3] 62a_100000183178_200025704644 [0,0,1,0,0,0|3,0,0]=4 680 B10R0.1 CSCC(=O)CCCCCF 1458a_100000184570_100000729378 [0,0,1,0,0,0|3,0,0]=4 681 B10R0.1 CSCC(=O)CCCCCO 1458a_100000184570_100000746330 [0,0,1,0,0,0|3,0,0]=4 682 B10R0.1 CSCC(=O)NCCCCO 240690a_100000750430_100000184570 [0,0,1,0,0,0|3,0,0]=4 683 B10R0.1 CSCC(=O)NCCCCO 527a_100000750430_100000184570 [0,0,1,0,0,0|3,0,0]=4 684 B10R0.1 CSCCCNC(=O)CCO 240690a_100000749238_100011216618 [0,0,1,0,0,0|3,0,0]=4 685 B10R0.1 CSCCCNC(=O)CSC 11a_100000749238_100000184570 [0,0,1,0,0,0|3,0,0]=4 686 B10R0.1 CSCCCNC(=O)CSC 1626a_100000749238_100000184570 [0,0,1,0,0,0|3,0,0]=4 687 B10R0.1 CSCCCNC(=O)CSC 240690a_100000749238_100000184570 [0,0,1,0,0,0|3,0,0]=4 688 B10R0.1 CSCCCNC(=O)CSC 527a_100000749238_100000184570 [0,0,1,0,0,0|3,0,0]=4 689 B10R0.1 O=C(CCF)CCCCCO 1458a_100102619762_100011217306 [0,0,1,0,0,0|3,0,0]=4 690 B10R0.1 O=C(CCO)CCCCCF 1458a_100011216618_100000729378 [0,0,1,0,0,0|3,0,0]=4 691 B10R0.1 O=C(CCO)CCCCCO 1458a_100011216618_100000746330 [0,0,1,0,0,0|3,0,0]=4 692 B10R0.1 O=C(CCO)CCCCCO 1458a_100102619762_100000211926 [0,0,1,0,0,0|3,0,0]=4 693 B10R0.1 O=C(CCO)NCCCCO 240690a_100000750430_100011216618 [0,0,1,0,0,0|3,0,0]=4 694 B10R0.4 C#CCCCCCCC(=O)C 1458a_100000034748_200000210301 [0,0,1,0,0,0|1,0,2]=4 695 B10R0.4 C#CCCCCCCC(=O)C 1458a_100000070787_100012276617 [0,0,1,0,0,0|1,0,2]=4 696 B10R0.4 C#CCCCCCCC(=O)[13CH3] 1458a_100000034748_200025704644 [0,0,1,0,0,0|1,0,2]=4 697 B10R0.4 C#CCCCCNCC(=O)O 269956a_100016091260_100010269958 [0,0,1,0,0,0|1,0,2]=4 698 B10R0.4 C=C(Br)CCOCCCCC 34a_100009813270_100000718602 [0,0,1,0,0,0|3,0,0]=4 699 B10R0.4 C=C(C)CCNCCCCC 2230a_100000209983_100000730704 [0,0,1,0,0,0|3,0,0]=4 700 B10R0.4 C=C(C)CCOCCCCC 34a_100000210253_100000730704 [0,0,1,0,0,0|3,0,0]=4 701 B10R0.4 C=C(C)CCOCCCCC 34a_100000764851_100000718602 [0,0,1,0,0,0|3,0,0]=4 702 B10R0.4 C=C(C)CCOCCCCC 7a_100000210253_100000730704 [0,0,1,0,0,0|3,0,0]=4 703 B10R0.4 C=C(C)CCSCCCCC 62a_100000210326_100000730704 [0,0,1,0,0,0|3,0,0]=4 704 B10R0.4 C=C(C)CCSCCCCC 62a_100000730704_100000210326 [0,0,1,0,0,0|3,0,0]=4 705 B10R0.4 C=C(C)CNCCCCCC 2230a_100000210581_100000748629 [0,0,1,0,0,0|3,0,0]=4 706 B10R0.4 C=C(C)COCCCCCC 34a_100000210245_100000210314 [0,0,1,0,0,0|3,0,0]=4 707 B10R0.4 C=C(C)COCCCCCC 34a_100000210259_100000748629 [0,0,1,0,0,0|3,0,0]=4 708 B10R0.4 C=C(C)COCCCCCC 7a_100000210259_100000748629 [0,0,1,0,0,0|3,0,0]=4 709 B10R0.4 C=C(C)CSCCCCCC 62a_100000210314_100000211660 [0,0,1,0,0,0|3,0,0]=4 710 B10R0.4 C=C(C)CSCCCCCC 62a_100000748629_100000210757 [0,0,1,0,0,0|3,0,0]=4 711 B10R0.4 C=C(F)CNCCCCCC 2230a_100000210581_100009893438 [0,0,1,0,0,0|3,0,0]=4 712 B10R0.4 C=C(F)COCCCCCC 34a_100000210259_100009893438 [0,0,1,0,0,0|3,0,0]=4 713 B10R0.4 C=C(F)COCCCCCC 34a_200010262243_100000210314 [0,0,1,0,0,0|3,0,0]=4 714 B10R0.4 C=C(F)COCCCCCC 7a_100000210259_100000042424 [0,0,1,0,0,0|3,0,0]=4 715 B10R0.4 C=C(F)CSCCCCCC 62a_100000042424_100000210757 [0,0,1,0,0,0|3,0,0]=4 716 B10R0.4 C=C(F)CSCCCCCC 62a_100000210314_100000042424 [0,0,1,0,0,0|3,0,0]=4 717 B10R0.4 C=CCCCCCCC(=O)C 1458a_100000070787_100011215473 [0,0,1,0,0,0|1,0,2]=4 718 B10R0.4 C=CCCCCCCC(=O)C 1458a_100011809334_200000210301 [0,0,1,0,0,0|1,0,2]=4 719 B10R0.4 C=CCCCCCCC(=O)[13CH3] 1458a_100011809334_200025704644 [0,0,1,0,0,0|1,0,2]=4 720 B10R0.4 C=CCCCCNCC(=O)O 269956a_100016091260_100011215482 [0,0,1,0,0,0|1,0,2]=4 721 B10R0.4 CC(=O)CCCCCCC#N 1458a_100000070787_100009813337 [0,0,1,0,0,0|2,0,1]=4 722 B10R0.4 CC(=O)CCCCCCCO 1458a_100000070787_100000760002 [0,0,1,0,0,0|2,0,0]=3 723 B10R0.4 CC(=O)CCCCCCCO 1458a_100011219782_200000210301 [0,0,1,0,0,0|2,0,0]=3 724 B10R0.4 CC(=O)CCCCNCCF 34a_100000724931_100009817362 [0,0,1,0,0,0|3,0,0]=4 725 B10R0.4 CC(=O)CCCCNCCO 34a_100016990907_100009817362 [0,0,1,0,0,0|3,0,0]=4 726 B10R0.4 CC(=O)CCCCOCCBr 34a_100000211926_100009817362 [0,0,1,0,0,0|3,0,0]=4 727 B10R0.4 CC(=O)CCCCOCCN 34a_100000210304_100009817362 [0,0,1,0,0,0|3,0,0]=4 728 B10R0.4 CC(=O)CCCCSCCF 62a_100000735457_100011217306 [0,0,1,0,0,0|3,0,0]=4 729 B10R0.4 CC(=O)CCCCSCCF 62a_100011217306_100000735457 [0,0,1,0,0,0|3,0,0]=4 730 B10R0.4 CC(=O)CCCCSCCO 62a_100000211926_100000735457 [0,0,1,0,0,0|3,0,0]=4 731 B10R0.4 CC(=O)CCCCSCCO 62a_100000735457_100000211926 [0,0,1,0,0,0|3,0,0]=4 732 B10R0.4 CC(=O)CCCNCCCF 34a_100015189416_100000685027 [0,0,1,0,0,0|3,0,0]=4 733 B10R0.4 CC(=O)CCCOCCCBr 34a_100011217188_100000685027 [0,0,1,0,0,0|3,0,0]=4 734 B10R0.4 CC(=O)CCCOCCCCl 34a_100000230001_100000685027 [0,0,1,0,0,0|3,0,0]=4 735 B10R0.4 CC(=O)CCCOCCCF 34a_100000759063_100011934791 [0,0,1,0,0,0|3,0,0]=4 736 B10R0.4 CC(=O)CCCOCCCF 34a_100000759539_100000685027 [0,0,1,0,0,0|3,0,0]=4 737 B10R0.4 CC(=O)CCCOCCCF 7a_100000759063_100011934791 [0,0,1,0,0,0|3,0,0]=4 738 B10R0.4 CC(=O)CCCOCCCN 34a_100000182051_100000685027 [0,0,1,0,0,0|3,0,0]=4 739 B10R0.4 CC(=O)CCCOCCCO 34a_100000759063_100000230001 [0,0,1,0,0,0|3,0,0]=4 740 B10R0.4 CC(=O)CCCOCCCO 7a_100000759063_100011215043 [0,0,1,0,0,0|3,0,0]=4 741 B10R0.4 CC(=O)CCCSCCCF 62a_100011215641_100011934791 [0,0,1,0,0,0|3,0,0]=4 742 B10R0.4 CC(=O)CCCSCCCF 62a_100011934791_100011215641 [0,0,1,0,0,0|3,0,0]=4 743 B10R0.4 CC(=O)CCCSCCCO 62a_100011215043_100011215641 [0,0,1,0,0,0|3,0,0]=4 744 B10R0.4 CC(=O)CCCSCCCO 62a_100011215641_100011215043 [0,0,1,0,0,0|3,0,0]=4 745 B10R0.4 CC(=O)CCOCCCCCl 7a_100000210776_100000053229 [0,0,1,0,0,0|3,0,0]=4 746 B10R0.4 CC(=O)CCOCCCCF 34a_100000759926_100000729493 [0,0,1,0,0,0|3,0,0]=4 747 B10R0.4 CC(=O)CCOCCCCF 7a_100000759926_100000729493 [0,0,1,0,0,0|3,0,0]=4 748 B10R0.4 CC(=O)CCOCCCCF 7a_100011995726_100000053229 [0,0,1,0,0,0|3,0,0]=4 749 B10R0.4 CC(=O)CCOCCCCO 34a_100000759926_100011216708 [0,0,1,0,0,0|3,0,0]=4 750 B10R0.4 CC(=O)CCOCCCCO 7a_100000759926_100000210776 [0,0,1,0,0,0|3,0,0]=4 751 B10R0.4 CC(=O)CCSCCCCF 62a_100000053229_100000729493 [0,0,1,0,0,0|3,0,0]=4 752 B10R0.4 CC(=O)CCSCCCCF 62a_100000729493_100000053229 [0,0,1,0,0,0|3,0,0]=4 753 B10R0.4 CC(=O)CCSCCCCO 62a_100000053229_100000210776 [0,0,1,0,0,0|3,0,0]=4 754 B10R0.4 CC(=O)CCSCCCCO 62a_100000210776_100000053229 [0,0,1,0,0,0|3,0,0]=4 755 B10R0.4 CC(=O)COCCCCCF 34a_100000211253_100000729378 [0,0,1,0,0,0|3,0,0]=4 756 B10R0.4 CC(=O)COCCCCCO 34a_100000211253_100000746330 [0,0,1,0,0,0|3,0,0]=4 757 B10R0.4 CC(=O)NCCCCCCO 240690a_100000686447_100015343762 [0,0,1,0,0,0|3,0,0]=4 758 B10R0.4 CC(=O)NCCCCCCO 527a_100000686447_100103153847 [0,0,1,0,0,0|3,0,0]=4 759 B10R0.4 CC(=O)NCCCCCN[13CH3] 2230a_200012022750_200025704644 [0,0,1,0,0,0|3,0,0]=4 760 B10R0.4 CC(=O)NCCCCCN[13CH3] 34a_200012022750_200025704644 [0,0,1,0,0,0|3,0,0]=4 761 B10R0.4 CC(=O)OCCCCCS[13CH3] 62a_100000033007_200025704644 [0,0,1,0,0,0|3,0,0]=4 762 B10R0.4 CC(=O)OCCCCCS[13CH3] 62a_200025704644_100000033007 [0,0,1,0,0,0|3,0,0]=4 763 B10R0.4 CC/C=C\CCNCC(=O)O 269956a_100016091260_100015370543 [0,0,1,0,0,0|1,0,2]=4 764 B10R0.4 CCCCC/C=C/CC(=O)C 1458a_100020675968_200000210301 [0,0,1,0,0,0|1,0,2]=4 765 B10R0.4 CCCCC/C=C/CC(=O)[13CH3] 1458a_100020675968_200025704644 [0,0,1,0,0,0|1,0,2]=4 766 B10R0.4 CCCCCC#CCC(=O)C 1458a_100000070787_100009816472 [0,0,1,0,0,0|1,0,2]=4 767 B10R0.4 CCCCCCC=CC(=O)C 1458a_200015324643_200000210301 [0,0,1,0,0,0|1,0,2]=4 768 B10R0.4 CCCCCCC=CC(=O)[13CH3] 1458a_200015324643_200025704644 [0,0,1,0,0,0|1,0,2]=4 769 B10R0.4 CCCCCCCCC(=O)C 1458a_100000070787_100000210759 [0,0,1,0,0,0|1,0,0]=2 770 B10R0.4 CCCCCCCCC(=O)C 1458a_100000210188_200000210301 [0,0,1,0,0,0|1,0,0]=2 771 B10R0.4 CCCCCCCCC(=O)[13CH3] 1458a_100000210188_200025704644 [0,0,1,0,0,0|1,0,0]=2 772 B10R0.4 CCCCCCCCN(C)C 2230a_100000207567_200000210301 [0,0,1,0,0,0|3,0,0]=4 773 B10R0.4 CCCCCCCCN(C)C 2230a_100102631434_100000210759 [0,0,1,0,0,0|3,0,0]=4 774 B10R0.4 CCCCCCCCN(C)C 269982a_100000207567_200000210301 [0,0,1,0,0,0|3,0,0]=4 775 B10R0.4 CCCCCCCCN(C)C 269982a_100102631434_100000210759 [0,0,1,0,0,0|3,0,0]=4 776 B10R0.4 CCCCCCCCN(C)[13CH3] 2230a_100000207567_200025704644 [0,0,1,0,0,0|3,0,0]=4 777 B10R0.4 CCCCCCCCN(C)[13CH3] 269982a_100000207567_200025704644 [0,0,1,0,0,0|3,0,0]=4 778 B10R0.4 CCCCCCCNC(=O)C 11a_100000229938_100015343762 [0,0,1,0,0,0|2,0,0]=3 779 B10R0.4 CCCCCCCNC(=O)C 1626a_100000229938_100015343762 [0,0,1,0,0,0|2,0,0]=3 780 B10R0.4 CCCCCCCNC(=O)C 240690a_100000229938_100015343762 [0,0,1,0,0,0|2,0,0]=3 781 B10R0.4 CCCCCCCNC(=O)C 527a_100000229938_100103153847 [0,0,1,0,0,0|2,0,0]=3 782 B10R0.4 CCCCCCNCC(=O)N 2230a_100000210581_100000747473 [0,0,1,0,0,0|2,0,0]=3 783 B10R0.4 CCCCCCNCC(=O)N 2230a_100000711301_100000210314 [0,0,1,0,0,0|2,0,0]=3 784 B10R0.4 CCCCCCNCC(=O)O 269956a_100016091260_100000210757 [0,0,1,0,0,0|1,0,0]=2 785 B10R0.4 CCCCCCNCC(C)O 2230a_100000210581_100011218427 [0,0,1,0,0,0|2,0,1]=4 786 B10R0.4 CCCCCCNCC(C)O 2230a_100000210904_100000210314 [0,0,1,0,0,0|2,0,1]=4 787 B10R0.4 CCCCCCNCC(C)O 34a_100000210904_100000210314 [0,0,1,0,0,0|2,0,1]=4 788 B10R0.4 CCCCCCNC[C@@H](C)O 2230a_100000210581_100009817552 [0,0,1,0,0,0|2,0,1]=4 789 B10R0.4 CCCCCCOCC(=O)C 34a_100000211253_100000210314 [0,0,1,0,0,0|2,0,0]=3 790 B10R0.4 CCCCCCOCC(=O)N 34a_100000210259_100000187820 [0,0,1,0,0,0|2,0,0]=3 791 B10R0.4 CCCCCCOCC(=O)N 7a_100000210259_100000187820 [0,0,1,0,0,0|2,0,0]=3 792 B10R0.4 CCCCCCOCC(=O)[O-] 34a_100000210259_100020667443 [0,0,1,0,0,0|1,0,1]=3 793 B10R0.4 CCCCCCOCC(C)O 34a_100000210259_100011218427 [0,0,1,0,0,0|2,0,1]=4 794 B10R0.4 CCCCCCOCC(C)O 7a_100000210259_100011218427 [0,0,1,0,0,0|2,0,1]=4 795 B10R0.4 CCCCCCOC[C@@H](C)O 34a_100000210259_100009817552 [0,0,1,0,0,0|2,0,1]=4 796 B10R0.4 CCCCCCOC[C@@H](C)O 7a_100000210259_100009817552 [0,0,1,0,0,0|2,0,1]=4 797 B10R0.4 CCCCCCOC[N+](=O)[O-] 34a_100000210259_100000761209 [0,0,1,0,0,0|2,0,1]=4 798 B10R0.4 CCCCCCSCC(=O)N 62a_100000210314_100000747473 [0,0,1,0,0,0|2,0,0]=3 799 B10R0.4 CCCCCCSCC(=O)N 62a_100000747473_100000210757 [0,0,1,0,0,0|2,0,0]=3 800 B10R0.4 CCCCCCSCC(=O)[O-] 62a_100000210314_100020667443 [0,0,1,0,0,0|1,0,1]=3 801 B10R0.4 CCCCCCSCC(=O)[O-] 62a_100020667443_100000210757 [0,0,1,0,0,0|1,0,1]=3 802 B10R0.4 CCCCCCSCC(C)O 62a_100000210314_100011218427 [0,0,1,0,0,0|2,0,1]=4 803 B10R0.4 CCCCCCSCC(C)O 62a_100011218427_100000210757 [0,0,1,0,0,0|2,0,1]=4 804 B10R0.4 CCCCCCSC[C@@H](C)O 62a_100000210314_100009817552 [0,0,1,0,0,0|2,0,1]=4 805 B10R0.4 CCCCCCSC[C@@H](C)O 62a_100009817552_100000210757 [0,0,1,0,0,0|2,0,1]=4 806 B10R0.4 CCCCCCSC[N+](=O)[O-] 62a_100000210314_100000761209 [0,0,1,0,0,0|2,0,1]=4 807 B10R0.4 CCCCCNCCC(=O)N 2230a_100000209983_100000744528 [0,0,1,0,0,0|2,0,0]=3 808 B10R0.4 CCCCCNCCC(C)O 2230a_100000209983_100012276601 [0,0,1,0,0,0|2,0,1]=4 809 B10R0.4 CCCCCNCCC(C)O 2230a_200000755665_100000210326 [0,0,1,0,0,0|2,0,1]=4 810 B10R0.4 CCCCCNOCC(=O)O 269956a_100000106656_100000210326 [0,0,1,0,0,0|2,0,0]=3 811 B10R0.4 CCCCCOCCC(=O)C 34a_100000759926_100000718602 [0,0,1,0,0,0|2,0,0]=3 812 B10R0.4 CCCCCOCCC(=O)C 7a_100000210253_100000053229 [0,0,1,0,0,0|2,0,0]=3 813 B10R0.4 CCCCCOCCC(=O)C 7a_100000759926_100000210326 [0,0,1,0,0,0|2,0,0]=3 814 B10R0.4 CCCCCOCCC(=O)N 34a_100000210253_100000731001 [0,0,1,0,0,0|2,0,0]=3 815 B10R0.4 CCCCCOCCC(=O)N 34a_100000757172_100000718602 [0,0,1,0,0,0|2,0,0]=3 816 B10R0.4 CCCCCOCCC(=O)N 7a_100000210253_100000744528 [0,0,1,0,0,0|2,0,0]=3 817 B10R0.4 CCCCCOCCC(=O)N 7a_100000757172_100000210326 [0,0,1,0,0,0|2,0,0]=3 818 B10R0.4 CCCCCOCCC(C)O 34a_100000210253_100012276601 [0,0,1,0,0,0|2,0,1]=4 819 B10R0.4 CCCCCOCCC(C)O 7a_100000210253_100012276601 [0,0,1,0,0,0|2,0,1]=4 820 B10R0.4 CCCCCOCOC(=O)C 34a_100000210253_100009813279 [0,0,1,0,0,0|3,0,0]=4 821 B10R0.4 CCCCCSCCC(=O)C 62a_100000053229_100000210326 [0,0,1,0,0,0|2,0,0]=3 822 B10R0.4 CCCCCSCCC(=O)C 62a_100000210326_100000053229 [0,0,1,0,0,0|2,0,0]=3 823 B10R0.4 CCCCCSCCC(=O)N 62a_100000210326_100000744528 [0,0,1,0,0,0|2,0,0]=3 824 B10R0.4 CCCCCSCCC(=O)N 62a_100000744528_100000210326 [0,0,1,0,0,0|2,0,0]=3 825 B10R0.4 CCCCCSCCC(C)O 62a_100000210326_100012276601 [0,0,1,0,0,0|2,0,1]=4 826 B10R0.4 CCCCCSCCC(C)O 62a_100012276601_100000210326 [0,0,1,0,0,0|2,0,1]=4 827 B10R0.4 CCCCCSCOC(=O)C 62a_100000076356_100000210326 [0,0,1,0,0,0|3,0,0]=4 828 B10R0.4 CCCCCSCOC(=O)C 62a_100000210326_100000076356 [0,0,1,0,0,0|3,0,0]=4 829 B10R0.4 CCCCNCCCC(=O)C 7a_106832991798_100011215641 [0,0,1,0,0,0|2,0,0]=3 830 B10R0.4 CCCCNCCCC(=O)N 34a_100000739312_100000210210 [0,0,1,0,0,0|2,0,0]=3 831 B10R0.4 CCCCNCCCC(=O)N 7a_106832991798_100102525003 [0,0,1,0,0,0|2,0,0]=3 832 B10R0.4 CCCCNCCCC(C)O 2230a_100000102301_200000718107 [0,0,1,0,0,0|2,0,1]=4 833 B10R0.4 CCCCNCCCC(C)O 7a_106832991798_200000718107 [0,0,1,0,0,0|2,0,1]=4 834 B10R0.4 CCCCNCCCS(=O)C 2230a_200000753449_100000210211 [0,0,1,0,0,0|3,0,0]=4 835 B10R0.4 CCCCNCCNC(=O)C 2230a_100000102301_100000189650 [0,0,1,0,0,0|3,0,0]=4 836 B10R0.4 CCCCNCCNC(=O)C 2230a_100000209853_100000210211 [0,0,1,0,0,0|3,0,0]=4 837 B10R0.4 CCCCNCCNC(=O)C 7a_106832991798_100000189650 [0,0,1,0,0,0|3,0,0]=4 838 B10R0.4 CCCCNCCNC(=O)N 2230a_100000102301_200000034859 [0,0,1,0,0,0|3,0,0]=4 839 B10R0.4 CCCCNCCNC(=O)N 34a_100020590234_100000210210 [0,0,1,0,0,0|3,0,0]=4 840 B10R0.4 CCCCNCCNC(=O)N 7a_106832991798_200000034859 [0,0,1,0,0,0|3,0,0]=4 841 B10R0.4 CCCCNCCOC(=O)C 7a_106832991798_100009814007 [0,0,1,0,0,0|3,0,0]=4 842 B10R0.4 CCCCNCCOC(=O)N 7a_106832991798_200011214921 [0,0,1,0,0,0|3,0,0]=4 843 B10R0.4 CCCCOCCCC(=O)C 34a_100000210227_100000685027 [0,0,1,0,0,0|2,0,0]=3 844 B10R0.4 CCCCOCCCC(=O)C 34a_100000759063_100000210210 [0,0,1,0,0,0|2,0,0]=3 845 B10R0.4 CCCCOCCCC(=O)C 7a_100000210227_100011215641 [0,0,1,0,0,0|2,0,0]=3 846 B10R0.4 CCCCOCCCC(=O)C 7a_100000759063_100000210211 [0,0,1,0,0,0|2,0,0]=3 847 B10R0.4 CCCCOCCCC(=O)N 34a_100000210227_100102525003 [0,0,1,0,0,0|2,0,0]=3 848 B10R0.4 CCCCOCCCC(=O)N 7a_100000210227_100102525003 [0,0,1,0,0,0|2,0,0]=3 849 B10R0.4 CCCCOCCCC(C)O 34a_100000210227_200000718107 [0,0,1,0,0,0|2,0,1]=4 850 B10R0.4 CCCCOCCCC(C)O 7a_100000210227_200000718107 [0,0,1,0,0,0|2,0,1]=4 851 B10R0.4 CCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210210 [0,0,1,0,0,0|2,0,1]=4 852 B10R0.4 CCCCOCCNC(=O)C 34a_100000158858_100000210210 [0,0,1,0,0,0|3,0,0]=4 853 B10R0.4 CCCCOCCNC(=O)C 7a_100000210227_100000189650 [0,0,1,0,0,0|3,0,0]=4 854 B10R0.4 CCCCOCCNC(=O)N 34a_100000181757_100000210210 [0,0,1,0,0,0|3,0,0]=4 855 B10R0.4 CCCCOCCNC(=O)N 7a_100000210227_200000034859 [0,0,1,0,0,0|3,0,0]=4 856 B10R0.4 CCCCOCCOC(=O)C 34a_100000210227_100009814007 [0,0,1,0,0,0|3,0,0]=4 857 B10R0.4 CCCCOCCOC(=O)C 7a_100000210227_100009814007 [0,0,1,0,0,0|3,0,0]=4 858 B10R0.4 CCCCOCCOC(=O)N 34a_100000210227_200011214921 [0,0,1,0,0,0|3,0,0]=4 859 B10R0.4 CCCCOCCOC(=O)N 7a_100000210227_200011214921 [0,0,1,0,0,0|3,0,0]=4 860 B10R0.4 CCCCOCCOC(=O)N 7a_100000766696_100000210211 [0,0,1,0,0,0|3,0,0]=4 861 B10R0.4 CCCCOCNCC(=O)N 2230a_100000711301_100011995733 [0,0,1,0,0,0|3,0,0]=4 862 B10R0.4 CCCCOCNCC(=O)O 269956a_100016091260_100011995733 [0,0,1,0,0,0|2,0,0]=3 863 B10R0.4 CCCCOCOCC(=O)C 34a_100000211253_100011995733 [0,0,1,0,0,0|3,0,0]=4 864 B10R0.4 CCCCOCSCC(=O)N 62a_100000747473_100011995733 [0,0,1,0,0,0|3,0,0]=4 865 B10R0.4 CCCCOCSCC(=O)N 62a_100011995733_100000747473 [0,0,1,0,0,0|3,0,0]=4 866 B10R0.4 CCCCOCSCC(=O)[O-] 62a_100011995733_100020667443 [0,0,1,0,0,0|2,0,1]=4 867 B10R0.4 CCCCOCSCC(=O)[O-] 62a_100020667443_100011995733 [0,0,1,0,0,0|2,0,1]=4 868 B10R0.4 CCCCSCCCC(=O)C 62a_100000210211_100011215641 [0,0,1,0,0,0|2,0,0]=3 869 B10R0.4 CCCCSCCCC(=O)C 62a_100011215641_100000210210 [0,0,1,0,0,0|2,0,0]=3 870 B10R0.4 CCCCSCCCC(=O)N 62a_100000210211_100102525003 [0,0,1,0,0,0|2,0,0]=3 871 B10R0.4 CCCCSCCCC(=O)N 62a_100102525003_100000210210 [0,0,1,0,0,0|2,0,0]=3 872 B10R0.4 CCCCSCCCC(C)O 62a_100000210211_200000718107 [0,0,1,0,0,0|2,0,1]=4 873 B10R0.4 CCCCSCCCC(C)O 62a_200000718107_100000210210 [0,0,1,0,0,0|2,0,1]=4 874 B10R0.4 CCCCSCCNC(=O)C 11a_100025743550_100015343762 [0,0,1,0,0,0|3,0,0]=4 875 B10R0.4 CCCCSCCNC(=O)C 1626a_100025743550_100015343762 [0,0,1,0,0,0|3,0,0]=4 876 B10R0.4 CCCCSCCNC(=O)C 240690a_100025743550_100015343762 [0,0,1,0,0,0|3,0,0]=4 877 B10R0.4 CCCCSCCNC(=O)C 527a_100025743550_100103153847 [0,0,1,0,0,0|3,0,0]=4 878 B10R0.4 CCCCSCCNC(=O)C 62a_100000189650_100000210210 [0,0,1,0,0,0|3,0,0]=4 879 B10R0.4 CCCCSCCNC(=O)C 62a_100000210211_100000189650 [0,0,1,0,0,0|3,0,0]=4 880 B10R0.4 CCCCSCCNC(=O)N 62a_100000210211_200000034859 [0,0,1,0,0,0|3,0,0]=4 881 B10R0.4 CCCCSCCNC(=O)N 62a_200000034859_100000210210 [0,0,1,0,0,0|3,0,0]=4 882 B10R0.4 CCCCSCCOC(=O)C 62a_100000210211_100009814007 [0,0,1,0,0,0|3,0,0]=4 883 B10R0.4 CCCCSCCOC(=O)C 62a_100009814007_100000210210 [0,0,1,0,0,0|3,0,0]=4 884 B10R0.4 CCCCSCCOC(=O)N 62a_100000210211_200011214921 [0,0,1,0,0,0|3,0,0]=4 885 B10R0.4 CCCCSCCOC(=O)N 62a_200011214921_100000210210 [0,0,1,0,0,0|3,0,0]=4 886 B10R0.4 CCCNCCCCC(=O)N 34a_100000696515_100000210303 [0,0,1,0,0,0|2,0,0]=3 887 B10R0.4 CCCNCCCNC(=O)C 34a_100000736810_100000210303 [0,0,1,0,0,0|3,0,0]=4 888 B10R0.4 CCCNCCOCC(=O)O 269956a_100000700818_100000210207 [0,0,1,0,0,0|2,0,0]=3 889 B10R0.4 CCCOCCCCB(O)O 34a_100000210258_200009817182 [0,0,1,0,0,0|2,0,1]=4 890 B10R0.4 CCCOCCCCC(=O)C 34a_100000210258_100009817362 [0,0,1,0,0,0|2,0,0]=3 891 B10R0.4 CCCOCCCCC(=O)N 34a_100012022536_100000210303 [0,0,1,0,0,0|2,0,0]=3 892 B10R0.4 CCCOCCCCC(=O)N 7a_100012022536_100000210303 [0,0,1,0,0,0|2,0,0]=3 893 B10R0.4 CCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210303 [0,0,1,0,0,0|2,0,1]=4 894 B10R0.4 CCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210303 [0,0,1,0,0,0|2,0,1]=4 895 B10R0.4 CCCOCCCNC(=O)C 1626a_100011217757_100015343762 [0,0,1,0,0,0|3,0,0]=4 896 B10R0.4 CCCOCCCNC(=O)C 240690a_100011217757_100015343762 [0,0,1,0,0,0|3,0,0]=4 897 B10R0.4 CCCOCCCNC(=O)C 34a_100000752032_100000210303 [0,0,1,0,0,0|3,0,0]=4 898 B10R0.4 CCCOCCCNC(=O)C 527a_100011217757_100103153847 [0,0,1,0,0,0|3,0,0]=4 899 B10R0.4 CCCOCCCOC(=O)C 34a_100000210258_100000042594 [0,0,1,0,0,0|3,0,0]=4 900 B10R0.4 CCCOCCCSC(=O)C 34a_100000210258_100000038929 [0,0,1,0,0,0|3,0,0]=4 901 B10R0.4 CCCOCCNCC(=O)N 2230a_100000711301_100011215938 [0,0,1,0,0,0|3,0,0]=4 902 B10R0.4 CCCOCCNCC(=O)N 2230a_100161115042_100000747473 [0,0,1,0,0,0|3,0,0]=4 903 B10R0.4 CCCOCCNCC(=O)N 34a_100161115042_100000187820 [0,0,1,0,0,0|3,0,0]=4 904 B10R0.4 CCCOCCNCC(=O)O 269956a_100016091260_100011215938 [0,0,1,0,0,0|2,0,0]=3 905 B10R0.4 CCCOCCNCC(=O)[O-] 34a_100161115042_100020667443 [0,0,1,0,0,0|2,0,1]=4 906 B10R0.4 CCCOCCOCC(=O)C 34a_100000211253_100011215938 [0,0,1,0,0,0|3,0,0]=4 907 B10R0.4 CCCOCCOCC(=O)N 34a_100000210258_100000076697 [0,0,1,0,0,0|3,0,0]=4 908 B10R0.4 CCCOCCOCC(=O)N 34a_100000752267_100000187820 [0,0,1,0,0,0|3,0,0]=4 909 B10R0.4 CCCOCCOCC(=O)N 7a_100000752267_100000187820 [0,0,1,0,0,0|3,0,0]=4 910 B10R0.4 CCCOCCOCC(=O)[O-] 34a_100000752267_100020667443 [0,0,1,0,0,0|2,0,1]=4 911 B10R0.4 CCCOCCSCC(=O)N 62a_100000747473_100011215938 [0,0,1,0,0,0|3,0,0]=4 912 B10R0.4 CCCOCCSCC(=O)N 62a_100011215938_100000747473 [0,0,1,0,0,0|3,0,0]=4 913 B10R0.4 CCCOCCSCC(=O)[O-] 62a_100011215938_100020667443 [0,0,1,0,0,0|2,0,1]=4 914 B10R0.4 CCCOCCSCC(=O)[O-] 62a_100020667443_100011215938 [0,0,1,0,0,0|2,0,1]=4 915 B10R0.4 CCCSCCCCB(O)O 62a_100000210303_200009817182 [0,0,1,0,0,0|2,0,1]=4 916 B10R0.4 CCCSCCCCB(O)O 62a_200009817182_100000210303 [0,0,1,0,0,0|2,0,1]=4 917 B10R0.4 CCCSCCCCC(=O)C 62a_100000210303_100000735457 [0,0,1,0,0,0|2,0,0]=3 918 B10R0.4 CCCSCCCCC(=O)C 62a_100000735457_100000210303 [0,0,1,0,0,0|2,0,0]=3 919 B10R0.4 CCCSCCCOC(=O)C 62a_100000042594_100000210303 [0,0,1,0,0,0|3,0,0]=4 920 B10R0.4 CCCSCCCOC(=O)C 62a_100000210303_100000042594 [0,0,1,0,0,0|3,0,0]=4 921 B10R0.4 CCCSCCCSC(=O)C 62a_100000038929_100000210303 [0,0,1,0,0,0|3,0,0]=4 922 B10R0.4 CCCSCCCSC(=O)C 62a_100000210303_100000038929 [0,0,1,0,0,0|3,0,0]=4 923 B10R0.4 CCCSCCNCC(=O)N 2230a_100020603323_100000747473 [0,0,1,0,0,0|3,0,0]=4 924 B10R0.4 CCCSCCOCC(=O)N 34a_200000230433_100000187820 [0,0,1,0,0,0|3,0,0]=4 925 B10R0.4 CCCSCCOCC(=O)N 62a_100000076697_100000210303 [0,0,1,0,0,0|3,0,0]=4 926 B10R0.4 CCCSCCOCC(=O)N 62a_100000210303_100000076697 [0,0,1,0,0,0|3,0,0]=4 927 B10R0.4 CCCSCCOCC(=O)N 7a_200000230433_100000187820 [0,0,1,0,0,0|3,0,0]=4 928 B10R0.4 CCCSCCOCC(=O)[O-] 34a_200000230433_100020667443 [0,0,1,0,0,0|2,0,1]=4 929 B10R0.4 CCNCCCCCB(O)O 2230a_100015525214_200009817188 [0,0,1,0,0,0|2,0,1]=4 930 B10R0.4 CCNCCCCCC(=O)N 2230a_100015525214_100009817443 [0,0,1,0,0,0|2,0,0]=3 931 B10R0.4 CCNCCCCNC(=O)C 2230a_200011368371_100000210202 [0,0,1,0,0,0|3,0,0]=4 932 B10R0.4 CCNCCCCNC(=O)C 34a_200011368371_100000210202 [0,0,1,0,0,0|3,0,0]=4 933 B10R0.4 CCNCCCCSC(=O)C 2230a_100015525214_200010402107 [0,0,1,0,0,0|3,0,0]=4 934 B10R0.4 CCOCCCCCB(O)O 34a_100121572206_200009817188 [0,0,1,0,0,0|2,0,1]=4 935 B10R0.4 CCOCCCCCC(=O)N 34a_100000123541_100000210202 [0,0,1,0,0,0|2,0,0]=3 936 B10R0.4 CCOCCCCCC(=O)N 34a_100121572206_100009817443 [0,0,1,0,0,0|2,0,0]=3 937 B10R0.4 CCOCCCCCC(=O)N 7a_100000123541_100000210202 [0,0,1,0,0,0|2,0,0]=3 938 B10R0.4 CCOCCCCCC(=O)[O-] 7a_100102619762_100000210202 [0,0,1,0,0,0|1,0,1]=3 939 B10R0.4 CCOCCCCOC(=O)C 34a_100000073216_100000210202 [0,0,1,0,0,0|3,0,0]=4 940 B10R0.4 CCOCCCCOC(=O)C 34a_100121572206_100000033659 [0,0,1,0,0,0|3,0,0]=4 941 B10R0.4 CCOCCCCOC(=O)C 7a_100000073216_100000210202 [0,0,1,0,0,0|3,0,0]=4 942 B10R0.4 CCOCCCCSC(=O)C 34a_100121572206_200010402107 [0,0,1,0,0,0|3,0,0]=4 943 B10R0.4 CCOCCCNCC(=O)N 2230a_100000210961_100000747473 [0,0,1,0,0,0|3,0,0]=4 944 B10R0.4 CCOCCCNCC(=O)N 2230a_100000711301_100012232248 [0,0,1,0,0,0|3,0,0]=4 945 B10R0.4 CCOCCCNCC(=O)N 34a_100000210961_100000187820 [0,0,1,0,0,0|3,0,0]=4 946 B10R0.4 CCOCCCNCC(=O)O 269956a_100016091260_100012232248 [0,0,1,0,0,0|2,0,0]=3 947 B10R0.4 CCOCCCNCC(=O)[O-] 34a_100000210961_100020667443 [0,0,1,0,0,0|2,0,1]=4 948 B10R0.4 CCOCCCOCC(=O)C 34a_100000211253_100012232248 [0,0,1,0,0,0|3,0,0]=4 949 B10R0.4 CCOCCCOCC(=O)N 34a_100000757476_100000187820 [0,0,1,0,0,0|3,0,0]=4 950 B10R0.4 CCOCCCOCC(=O)N 7a_100000757476_100000187820 [0,0,1,0,0,0|3,0,0]=4 951 B10R0.4 CCOCCCOCC(=O)[O-] 34a_100000757476_100020667443 [0,0,1,0,0,0|2,0,1]=4 952 B10R0.4 CCOCCCSCC(=O)N 62a_100000747473_100012232248 [0,0,1,0,0,0|3,0,0]=4 953 B10R0.4 CCOCCCSCC(=O)N 62a_100012232248_100000747473 [0,0,1,0,0,0|3,0,0]=4 954 B10R0.4 CCOCCCSCC(=O)[O-] 62a_100012232248_100020667443 [0,0,1,0,0,0|2,0,1]=4 955 B10R0.4 CCOCCCSCC(=O)[O-] 62a_100020667443_100012232248 [0,0,1,0,0,0|2,0,1]=4 956 B10R0.4 CCOCCNCCC(=O)N 2230a_102516460346_100000744528 [0,0,1,0,0,0|3,0,0]=4 957 B10R0.4 CCOCCNCCC(=O)N 34a_102516460346_100000731001 [0,0,1,0,0,0|3,0,0]=4 958 B10R0.4 CCOCCNOCC(=O)O 269956a_100000106656_100000210147 [0,0,1,0,0,0|3,0,0]=4 959 B10R0.4 CCOCCOCCC(=O)C 1458a_100000070787_100011211534 [0,0,1,0,0,0|3,0,0]=4 960 B10R0.4 CCOCCOCCC(=O)C 34a_100000759926_100000210147 [0,0,1,0,0,0|3,0,0]=4 961 B10R0.4 CCOCCOCCC(=O)C 7a_100000210136_100000053229 [0,0,1,0,0,0|3,0,0]=4 962 B10R0.4 CCOCCOCCC(=O)C 7a_100000759926_100011215890 [0,0,1,0,0,0|3,0,0]=4 963 B10R0.4 CCOCCOCCC(=O)N 34a_100000210136_100000731001 [0,0,1,0,0,0|3,0,0]=4 964 B10R0.4 CCOCCOCCC(=O)N 34a_100000757172_100000210147 [0,0,1,0,0,0|3,0,0]=4 965 B10R0.4 CCOCCOCCC(=O)N 7a_100000210136_100000744528 [0,0,1,0,0,0|3,0,0]=4 966 B10R0.4 CCOCCOCCC(=O)N 7a_100000757172_100011215890 [0,0,1,0,0,0|3,0,0]=4 967 B10R0.4 CCOCCSCCC(=O)C 62a_100000053229_100011215890 [0,0,1,0,0,0|3,0,0]=4 968 B10R0.4 CCOCCSCCC(=O)C 62a_100000210147_100000053229 [0,0,1,0,0,0|3,0,0]=4 969 B10R0.4 CCOCCSCCC(=O)N 62a_100000210147_100000744528 [0,0,1,0,0,0|3,0,0]=4 970 B10R0.4 CCOCCSCCC(=O)N 62a_100000744528_100011215890 [0,0,1,0,0,0|3,0,0]=4 971 B10R0.4 CCOCSCCCC(=O)C 62a_100000739092_100011215641 [0,0,1,0,0,0|3,0,0]=4 972 B10R0.4 CCOCSCCCC(=O)C 62a_100011215641_100000739092 [0,0,1,0,0,0|3,0,0]=4 973 B10R0.4 CCOCSCCCC(=O)N 62a_100000739092_100102525003 [0,0,1,0,0,0|3,0,0]=4 974 B10R0.4 CCOCSCCCC(=O)N 62a_100102525003_100000739092 [0,0,1,0,0,0|3,0,0]=4 975 B10R0.4 CCSCCCCCB(O)O 62a_100000210202_200009817188 [0,0,1,0,0,0|2,0,1]=4 976 B10R0.4 CCSCCCCCB(O)O 62a_200009817188_100000210202 [0,0,1,0,0,0|2,0,1]=4 977 B10R0.4 CCSCCCCCC(=O)N 62a_100000210202_100009817443 [0,0,1,0,0,0|2,0,0]=3 978 B10R0.4 CCSCCCCCC(=O)N 62a_100009817443_100000210202 [0,0,1,0,0,0|2,0,0]=3 979 B10R0.4 CCSCCCCOC(=O)C 62a_100000033659_100000210202 [0,0,1,0,0,0|3,0,0]=4 980 B10R0.4 CCSCCCCOC(=O)C 62a_100000210202_100000033659 [0,0,1,0,0,0|3,0,0]=4 981 B10R0.4 CCSCCCCSC(=O)C 62a_100000210202_200010402107 [0,0,1,0,0,0|3,0,0]=4 982 B10R0.4 CCSCCCCSC(=O)C 62a_200010402107_100000210202 [0,0,1,0,0,0|3,0,0]=4 983 B10R0.4 CCSCCCOCC(=O)N 34a_100011216438_100000187820 [0,0,1,0,0,0|3,0,0]=4 984 B10R0.4 CCSCCCOCC(=O)N 7a_100011216438_100000187820 [0,0,1,0,0,0|3,0,0]=4 985 B10R0.4 CCSCCCOCC(=O)[O-] 34a_100011216438_100020667443 [0,0,1,0,0,0|2,0,1]=4 986 B10R0.4 CCSCCNCCC(=O)N 2230a_100000106463_100000744528 [0,0,1,0,0,0|3,0,0]=4 987 B10R0.4 CCSCCNOCC(=O)O 269956a_100000106656_100000757381 [0,0,1,0,0,0|3,0,0]=4 988 B10R0.4 CCSCCOCCC(=O)C 34a_100000759926_100000757381 [0,0,1,0,0,0|3,0,0]=4 989 B10R0.4 CCSCCOCCC(=O)C 7a_100000212035_100000053229 [0,0,1,0,0,0|3,0,0]=4 990 B10R0.4 CCSCCOCCC(=O)C 7a_100000759926_100000757381 [0,0,1,0,0,0|3,0,0]=4 991 B10R0.4 CCSCCOCCC(=O)N 34a_100000212035_100000731001 [0,0,1,0,0,0|3,0,0]=4 992 B10R0.4 CCSCCOCCC(=O)N 34a_100000757172_100000757381 [0,0,1,0,0,0|3,0,0]=4 993 B10R0.4 CCSCCOCCC(=O)N 7a_100000212035_100000744528 [0,0,1,0,0,0|3,0,0]=4 994 B10R0.4 CCSCCOCCC(=O)N 7a_100000757172_100000757381 [0,0,1,0,0,0|3,0,0]=4 995 B10R0.4 CCSCCSCCC(=O)C 62a_100000053229_100000757381 [0,0,1,0,0,0|3,0,0]=4 996 B10R0.4 CCSCCSCCC(=O)C 62a_100000757381_100000053229 [0,0,1,0,0,0|3,0,0]=4 997 B10R0.4 CCSCCSCCC(=O)N 62a_100000744528_100000757381 [0,0,1,0,0,0|3,0,0]=4 998 B10R0.4 CCSCCSCCC(=O)N 62a_100000757381_100000744528 [0,0,1,0,0,0|3,0,0]=4 999 B10R0.4 CNCCCCCCB(O)O 2230a_106832991635_100009817187 [0,0,1,0,0,0|2,0,1]=4 1000 B10R0.4 CNCCCCCCB(O)O 34a_100102657272_100009817187 [0,0,1,0,0,0|2,0,1]=4 1001 B10R0.4 CNCCCCCCB(O)O 7a_106832991635_100009817187 [0,0,1,0,0,0|2,0,1]=4 1002 B10R0.4 CNCCCCCNC(=O)C 2230a_200012022750_200000210301 [0,0,1,0,0,0|3,0,0]=4 1003 B10R0.4 CNCCCCCNC(=O)C 34a_200012022750_200000210301 [0,0,1,0,0,0|3,0,0]=4 1004 B10R0.4 CNCCCCCOC(=O)C 2230a_106832991635_100009813381 [0,0,1,0,0,0|3,0,0]=4 1005 B10R0.4 CNCCCCCOC(=O)C 34a_100102657272_100000033007 [0,0,1,0,0,0|3,0,0]=4 1006 B10R0.4 CNCCCCCOC(=O)C 7a_106832991635_100000033007 [0,0,1,0,0,0|3,0,0]=4 1007 B10R0.4 CNCCCOCCC(=O)N 34a_100000213112_100000731001 [0,0,1,0,0,0|3,0,0]=4 1008 B10R0.4 COCCCCCCB(O)O 34a_100138415774_100009817187 [0,0,1,0,0,0|2,0,1]=4 1009 B10R0.4 COCCCCCCC(=O)C 1458a_100000070787_100011998445 [0,0,1,0,0,0|2,0,0]=3 1010 B10R0.4 COCCCCCNC(=O)C 11a_100000747528_100015343762 [0,0,1,0,0,0|3,0,0]=4 1011 B10R0.4 COCCCCCNC(=O)C 1626a_100000747528_100015343762 [0,0,1,0,0,0|3,0,0]=4 1012 B10R0.4 COCCCCCNC(=O)C 240690a_100000747528_100015343762 [0,0,1,0,0,0|3,0,0]=4 1013 B10R0.4 COCCCCCNC(=O)C 527a_100000747528_100103153847 [0,0,1,0,0,0|3,0,0]=4 1014 B10R0.4 COCCCCCOC(=O)C 34a_100138415774_100000033007 [0,0,1,0,0,0|3,0,0]=4 1015 B10R0.4 COCCCCNCC(=O)N 2230a_100000711301_100000730899 [0,0,1,0,0,0|3,0,0]=4 1016 B10R0.4 COCCCCNCC(=O)O 269956a_100016091260_100000730899 [0,0,1,0,0,0|2,0,0]=3 1017 B10R0.4 COCCCCOCC(=O)C 34a_100000211253_100000755781 [0,0,1,0,0,0|3,0,0]=4 1018 B10R0.4 COCCCCOCC(=O)N 34a_100000740925_100000187820 [0,0,1,0,0,0|3,0,0]=4 1019 B10R0.4 COCCCCOCC(=O)[O-] 34a_100000740925_100020667443 [0,0,1,0,0,0|2,0,1]=4 1020 B10R0.4 COCCCCSCC(=O)N 62a_100000730899_100000747473 [0,0,1,0,0,0|3,0,0]=4 1021 B10R0.4 COCCCCSCC(=O)N 62a_100000747473_100000730899 [0,0,1,0,0,0|3,0,0]=4 1022 B10R0.4 COCCCCSCC(=O)[O-] 62a_100000730899_100020667443 [0,0,1,0,0,0|2,0,1]=4 1023 B10R0.4 COCCCCSCC(=O)[O-] 62a_100020667443_100000730899 [0,0,1,0,0,0|2,0,1]=4 1024 B10R0.4 COCCCNCCC(=O)N 34a_100150723488_100000731001 [0,0,1,0,0,0|3,0,0]=4 1025 B10R0.4 COCCCNOCC(=O)O 269956a_100000106656_100000740836 [0,0,1,0,0,0|3,0,0]=4 1026 B10R0.4 COCCCOCCC(=O)C 34a_100000759926_100000740836 [0,0,1,0,0,0|3,0,0]=4 1027 B10R0.4 COCCCOCCC(=O)C 7a_100000759926_100000740836 [0,0,1,0,0,0|3,0,0]=4 1028 B10R0.4 COCCCOCCC(=O)N 34a_100000740835_100000731001 [0,0,1,0,0,0|3,0,0]=4 1029 B10R0.4 COCCCOCCC(=O)N 34a_100000757172_100000740836 [0,0,1,0,0,0|3,0,0]=4 1030 B10R0.4 COCCCOCCC(=O)N 7a_100000757172_100000740836 [0,0,1,0,0,0|3,0,0]=4 1031 B10R0.4 COCCCSCCC(=O)C 62a_100000053229_100000709357 [0,0,1,0,0,0|3,0,0]=4 1032 B10R0.4 COCCCSCCC(=O)C 62a_100000709357_100000053229 [0,0,1,0,0,0|3,0,0]=4 1033 B10R0.4 COCCCSCCC(=O)N 62a_100000709357_100000744528 [0,0,1,0,0,0|3,0,0]=4 1034 B10R0.4 COCCCSCCC(=O)N 62a_100000744528_100000709357 [0,0,1,0,0,0|3,0,0]=4 1035 B10R0.4 COCCNCCCC(=O)N 34a_100000739312_100011201679 [0,0,1,0,0,0|3,0,0]=4 1036 B10R0.4 COCCOCCCC(=O)C 1458a_100000070787_100011216529 [0,0,1,0,0,0|3,0,0]=4 1037 B10R0.4 COCCOCCCC(=O)C 34a_100000210237_100000685027 [0,0,1,0,0,0|3,0,0]=4 1038 B10R0.4 COCCOCCCC(=O)C 34a_100000759063_100011201679 [0,0,1,0,0,0|3,0,0]=4 1039 B10R0.4 COCCOCCCC(=O)C 7a_100000759063_100000233755 [0,0,1,0,0,0|3,0,0]=4 1040 B10R0.4 COCCOCCCC(=O)N 34a_100000210237_100102525003 [0,0,1,0,0,0|3,0,0]=4 1041 B10R0.4 COCCOCNCC(=O)O 269956a_100016091260_100000231047 [0,0,1,0,0,0|3,0,0]=4 1042 B10R0.4 COCCSCCCC(=O)C 62a_100000233755_100011215641 [0,0,1,0,0,0|3,0,0]=4 1043 B10R0.4 COCCSCCCC(=O)C 62a_100011215641_100000233755 [0,0,1,0,0,0|3,0,0]=4 1044 B10R0.4 COCCSCCCC(=O)N 62a_100000233755_100102525003 [0,0,1,0,0,0|3,0,0]=4 1045 B10R0.4 COCCSCCCC(=O)N 62a_100102525003_100000233755 [0,0,1,0,0,0|3,0,0]=4 1046 B10R0.4 COCNCCOCC(=O)O 269956a_100000700818_100000766300 [0,0,1,0,0,0|3,0,0]=4 1047 B10R0.4 COCSCCCCC(=O)C 62a_100000735457_100000766300 [0,0,1,0,0,0|3,0,0]=4 1048 B10R0.4 COCSCCCCC(=O)C 62a_100000766300_100000735457 [0,0,1,0,0,0|3,0,0]=4 1049 B10R0.4 CSCCCCCCB(O)O 62a_100009817187_200000210301 [0,0,1,0,0,0|2,0,1]=4 1050 B10R0.4 CSCCCCCCB(O)O 62a_200000210301_100009817187 [0,0,1,0,0,0|2,0,1]=4 1051 B10R0.4 CSCCCCCOC(=O)C 62a_100000033007_200000210301 [0,0,1,0,0,0|3,0,0]=4 1052 B10R0.4 CSCCCCCOC(=O)C 62a_200000210301_100000033007 [0,0,1,0,0,0|3,0,0]=4 1053 B10R0.4 CSCCCCOCC(=O)N 34a_100011217163_100000187820 [0,0,1,0,0,0|3,0,0]=4 1054 B10R0.4 CSCCCCOCC(=O)N 7a_100011217163_100000187820 [0,0,1,0,0,0|3,0,0]=4 1055 B10R0.4 CSCCCCOCC(=O)[O-] 34a_100011217163_100020667443 [0,0,1,0,0,0|2,0,1]=4 1056 B10R0.4 CSCCCNCCC(=O)N 2230a_100000749238_100000744528 [0,0,1,0,0,0|3,0,0]=4 1057 B10R0.4 CSCCCOCCC(=O)C 7a_100000690336_100000053229 [0,0,1,0,0,0|3,0,0]=4 1058 B10R0.4 CSCCCOCCC(=O)N 34a_100000690336_100000731001 [0,0,1,0,0,0|3,0,0]=4 1059 B10R0.4 CSCCCOCCC(=O)N 7a_100000690336_100000744528 [0,0,1,0,0,0|3,0,0]=4 1060 B10R0.4 CSCCNCCCC(=O)N 34a_100000739312_100000212216 [0,0,1,0,0,0|3,0,0]=4 1061 B10R0.4 CSCCOCCCC(=O)C 34a_100000230434_100000685027 [0,0,1,0,0,0|3,0,0]=4 1062 B10R0.4 CSCCOCCCC(=O)C 34a_100000759063_100000212216 [0,0,1,0,0,0|3,0,0]=4 1063 B10R0.4 CSCCOCCCC(=O)C 7a_100000230434_100011215641 [0,0,1,0,0,0|3,0,0]=4 1064 B10R0.4 CSCCOCCCC(=O)C 7a_100000759063_100000212216 [0,0,1,0,0,0|3,0,0]=4 1065 B10R0.4 CSCCOCCCC(=O)N 34a_100000230434_100102525003 [0,0,1,0,0,0|3,0,0]=4 1066 B10R0.4 CSCCOCCCC(=O)N 7a_100000230434_100102525003 [0,0,1,0,0,0|3,0,0]=4 1067 B10R0.4 CSCCSCCCC(=O)C 62a_100000212216_100011215641 [0,0,1,0,0,0|3,0,0]=4 1068 B10R0.4 CSCCSCCCC(=O)C 62a_100011215641_100000751147 [0,0,1,0,0,0|3,0,0]=4 1069 B10R0.4 CSCCSCCCC(=O)N 62a_100000212216_100102525003 [0,0,1,0,0,0|3,0,0]=4 1070 B10R0.4 CSCCSCCCC(=O)N 62a_100102525003_100000751147 [0,0,1,0,0,0|3,0,0]=4 1071 B10R0.4 CSCNCCCCC(=O)N 34a_100000696515_100011218213 [0,0,1,0,0,0|3,0,0]=4 1072 B10R0.4 CSCNCCOCC(=O)O 269956a_100000700818_100011218213 [0,0,1,0,0,0|3,0,0]=4 1073 B10R0.4 CSCOCCCCC(=O)N 34a_100012022536_100011218213 [0,0,1,0,0,0|3,0,0]=4 1074 B10R0.4 CSCSCCCCC(=O)C 62a_100000735457_100011218213 [0,0,1,0,0,0|3,0,0]=4 1075 B10R0.4 CSCSCCCCC(=O)C 62a_100011218213_100000735457 [0,0,1,0,0,0|3,0,0]=4 1076 B10R0.4 N#CCCCCNCC(=O)O 269956a_100016091260_100011219923 [0,0,1,0,0,0|2,0,1]=4 1077 B10R0.4 NC(=O)CCCCCOCF 34a_100000123541_100015361967 [0,0,1,0,0,0|3,0,0]=4 1078 B10R0.4 NC(=O)CCCCCOCF 7a_100000123541_100015361967 [0,0,1,0,0,0|3,0,0]=4 1079 B10R0.4 NC(=O)CCCCCSCF 62a_100009817443_100015361967 [0,0,1,0,0,0|3,0,0]=4 1080 B10R0.4 NC(=O)CCCCCSCF 62a_100015361967_100009817443 [0,0,1,0,0,0|3,0,0]=4 1081 B10R0.4 NC(=O)CCCCNCCF 34a_100000696515_100011217306 [0,0,1,0,0,0|3,0,0]=4 1082 B10R0.4 NC(=O)CCCCNCCO 34a_100000696515_100000211926 [0,0,1,0,0,0|3,0,0]=4 1083 B10R0.4 NC(=O)CCCCOCCF 34a_100012022536_100011217306 [0,0,1,0,0,0|3,0,0]=4 1084 B10R0.4 NC(=O)CCCCOCCF 7a_100012022536_100011217306 [0,0,1,0,0,0|3,0,0]=4 1085 B10R0.4 NC(=O)CCCCOCCO 34a_100012022536_100000211926 [0,0,1,0,0,0|3,0,0]=4 1086 B10R0.4 NC(=O)CCCCOCCO 7a_100012022536_100000211926 [0,0,1,0,0,0|3,0,0]=4 1087 B10R0.4 NC(=O)CCCNCCCF 34a_100000739312_100011934791 [0,0,1,0,0,0|3,0,0]=4 1088 B10R0.4 NC(=O)CCCNCCCF 34a_100015189416_100102525003 [0,0,1,0,0,0|3,0,0]=4 1089 B10R0.4 NC(=O)CCCNCCCO 34a_100000739312_100000230001 [0,0,1,0,0,0|3,0,0]=4 1090 B10R0.4 NC(=O)CCCOCCCBr 34a_100011217188_100102525003 [0,0,1,0,0,0|3,0,0]=4 1091 B10R0.4 NC(=O)CCCOCCCCl 34a_100000230001_100102525003 [0,0,1,0,0,0|3,0,0]=4 1092 B10R0.4 NC(=O)CCCOCCCF 34a_100000759539_100102525003 [0,0,1,0,0,0|3,0,0]=4 1093 B10R0.4 NC(=O)CCCSCCCF 62a_100011934791_100102525003 [0,0,1,0,0,0|3,0,0]=4 1094 B10R0.4 NC(=O)CCCSCCCF 62a_100102525003_100011934791 [0,0,1,0,0,0|3,0,0]=4 1095 B10R0.4 NC(=O)CCCSCCCO 62a_100011215043_100102525003 [0,0,1,0,0,0|3,0,0]=4 1096 B10R0.4 NC(=O)CCCSCCCO 62a_100102525003_100011215043 [0,0,1,0,0,0|3,0,0]=4 1097 B10R0.4 NC(=O)CCNCCCCO 2230a_100000750430_100000744528 [0,0,1,0,0,0|3,0,0]=4 1098 B10R0.4 NC(=O)CCNCCCCO 34a_100000750430_100000731001 [0,0,1,0,0,0|3,0,0]=4 1099 B10R0.4 NC(=O)CCOCCCCBr 34a_100011216708_100000731001 [0,0,1,0,0,0|3,0,0]=4 1100 B10R0.4 NC(=O)CCOCCCCCl 34a_100000210776_100000731001 [0,0,1,0,0,0|3,0,0]=4 1101 B10R0.4 NC(=O)CCOCCCCCl 7a_100000210776_100000744528 [0,0,1,0,0,0|3,0,0]=4 1102 B10R0.4 NC(=O)CCOCCCCF 34a_100000757172_100000729493 [0,0,1,0,0,0|3,0,0]=4 1103 B10R0.4 NC(=O)CCOCCCCF 34a_100011995726_100000731001 [0,0,1,0,0,0|3,0,0]=4 1104 B10R0.4 NC(=O)CCOCCCCF 7a_100000757172_100000729493 [0,0,1,0,0,0|3,0,0]=4 1105 B10R0.4 NC(=O)CCOCCCCF 7a_100011995726_100000744528 [0,0,1,0,0,0|3,0,0]=4 1106 B10R0.4 NC(=O)CCOCCCCI 34a_200012148704_100000731001 [0,0,1,0,0,0|3,0,0]=4 1107 B10R0.4 NC(=O)CCOCCCCO 34a_100000757172_100011216708 [0,0,1,0,0,0|3,0,0]=4 1108 B10R0.4 NC(=O)CCOCCCCO 7a_100000757172_100000210776 [0,0,1,0,0,0|3,0,0]=4 1109 B10R0.4 NC(=O)CCSCCCCF 62a_100000729493_100000744528 [0,0,1,0,0,0|3,0,0]=4 1110 B10R0.4 NC(=O)CCSCCCCF 62a_100000744528_100000729493 [0,0,1,0,0,0|3,0,0]=4 1111 B10R0.4 NC(=O)CCSCCCCO 62a_100000210776_100000744528 [0,0,1,0,0,0|3,0,0]=4 1112 B10R0.4 NC(=O)CCSCCCCO 62a_100000744528_100000210776 [0,0,1,0,0,0|3,0,0]=4 1113 B10R0.4 NC(=O)CNCCCCCF 2230a_100000711301_100000729378 [0,0,1,0,0,0|3,0,0]=4 1114 B10R0.4 NC(=O)CNCCCCCO 2230a_100000711301_100000746330 [0,0,1,0,0,0|3,0,0]=4 1115 B10R0.4 NC(=O)CNCCCCCO 2230a_100000762737_100000747473 [0,0,1,0,0,0|3,0,0]=4 1116 B10R0.4 NC(=O)CNCCCCCO 34a_100000762737_100000187820 [0,0,1,0,0,0|3,0,0]=4 1117 B10R0.4 NC(=O)COCCCCCBr 34a_100000746331_100000187820 [0,0,1,0,0,0|3,0,0]=4 1118 B10R0.4 NC(=O)COCCCCCBr 7a_100000746331_100000187820 [0,0,1,0,0,0|3,0,0]=4 1119 B10R0.4 NC(=O)COCCCCCCl 34a_100000746330_100000187820 [0,0,1,0,0,0|3,0,0]=4 1120 B10R0.4 NC(=O)COCCCCCCl 7a_100000746330_100000187820 [0,0,1,0,0,0|3,0,0]=4 1121 B10R0.4 NC(=O)COCCCCCI 34a_200012148887_100000187820 [0,0,1,0,0,0|3,0,0]=4 1122 B10R0.4 NC(=O)COCCCCCI 7a_200012148887_100000187820 [0,0,1,0,0,0|3,0,0]=4 1123 B10R0.4 NC(=O)CSCCCCCF 62a_100000729378_100000747473 [0,0,1,0,0,0|3,0,0]=4 1124 B10R0.4 NC(=O)CSCCCCCF 62a_100000747473_100000729378 [0,0,1,0,0,0|3,0,0]=4 1125 B10R0.4 NC(=O)CSCCCCCO 62a_100000746330_100000747473 [0,0,1,0,0,0|3,0,0]=4 1126 B10R0.4 NC(=O)CSCCCCCO 62a_100000747473_100000746330 [0,0,1,0,0,0|3,0,0]=4 1127 B10R0.4 NCCCCCOCC(=O)N 34a_100000762737_100000187820 [0,0,1,0,0,0|3,0,0]=4 1128 B10R0.4 NCCCCCOCC(=O)[O-] 34a_100000762737_100020667443 [0,0,1,0,0,0|2,0,1]=4 1129 B10R0.4 NCCCCOCCC(=O)N 34a_100000750430_100000731001 [0,0,1,0,0,0|3,0,0]=4 1130 B10R0.4 NCCCOCCCC(=O)N 34a_100000182051_100102525003 [0,0,1,0,0,0|3,0,0]=4 1131 B10R0.4 O=C(O)CNCCCCCF 269956a_100016091260_100000729378 [0,0,1,0,0,0|2,0,0]=3 1132 B10R0.4 O=C(O)CNCCCCCO 269956a_100016091260_100000746330 [0,0,1,0,0,0|2,0,0]=3 1133 B10R0.4 O=C(O)CNCCOCCO 269956a_100016091260_100011215305 [0,0,1,0,0,0|3,0,0]=4 1134 B10R0.4 O=C(O)COCCNCCF 269956a_100000700818_100011217306 [0,0,1,0,0,0|3,0,0]=4 1135 B10R0.4 O=C(O)COCCNCCO 269956a_100000700818_100000211926 [0,0,1,0,0,0|3,0,0]=4 1136 B10R0.4 O=C(O)CONCCCCF 269956a_100000106656_100000729493 [0,0,1,0,0,0|3,0,0]=4 1137 B10R0.4 O=C(O)CONCCCCO 269956a_100000106656_100000210776 [0,0,1,0,0,0|3,0,0]=4 1138 B10R0.4 O=C([O-])CCCCCOCF 7a_100102619762_100015361967 [0,0,1,0,0,0|2,0,1]=4 1139 B10R0.4 O=C([O-])CNCCCCCO 34a_100000762737_100020667443 [0,0,1,0,0,0|2,0,1]=4 1140 B10R0.4 O=C([O-])COCCCCCBr 34a_100000746331_100020667443 [0,0,1,0,0,0|2,0,1]=4 1141 B10R0.4 O=C([O-])COCCCCCCl 34a_100000746330_100020667443 [0,0,1,0,0,0|2,0,1]=4 1142 B10R0.4 O=C([O-])COCCCCCI 34a_200012148887_100020667443 [0,0,1,0,0,0|2,0,1]=4 1143 B10R0.4 O=C([O-])CSCCCCCF 62a_100000729378_100020667443 [0,0,1,0,0,0|2,0,1]=4 1144 B10R0.4 O=C([O-])CSCCCCCF 62a_100020667443_100000729378 [0,0,1,0,0,0|2,0,1]=4 1145 B10R0.4 O=C([O-])CSCCCCCO 62a_100000746330_100020667443 [0,0,1,0,0,0|2,0,1]=4 1146 B10R0.4 O=C([O-])CSCCCCCO 62a_100020667443_100000746330 [0,0,1,0,0,0|2,0,1]=4 1147 B10R0.4 O=CCCCCNCC(=O)O 269956a_100016091260_100000139335 [0,0,1,0,0,0|2,0,1]=4 1148 B10R0.4 [13CH3]C(=O)CCCCCCCO 1458a_100011219782_200025704644 [0,0,1,0,0,0|2,0,0]=3 1149 B10R0.4 [13CH3]SCCCCCCB(O)O 62a_100009817187_200025704644 [0,0,1,0,0,0|2,0,1]=4 1150 B10R0.4 [13CH3]SCCCCCCB(O)O 62a_200025704644_100009817187 [0,0,1,0,0,0|2,0,1]=4 1151 B10R0.18 C=CC(=O)NC(C)CCCC 1626a_100000126638_100000185746 [0,0,1,0,0,0|1,0,2]=4 1152 B10R0.18 C=CC(=O)NC(C)CCCC 240690a_100000126638_200121576911 [0,0,1,0,0,0|1,0,2]=4 1153 B10R0.18 CCC(=O)CN(C)CCCO 269982a_100000213112_100000747405 [0,0,1,0,0,0|3,0,0]=4 1154 B10R0.18 CCC(=O)CN(C)CCOC 269982a_100000743101_100000747405 [0,0,1,0,0,0|3,0,0]=4 1155 B10R0.18 CCC(=O)CN(C)CCSC 269982a_100000686725_100000747405 [0,0,1,0,0,0|3,0,0]=4 1156 B10R0.18 CCC(C)OC(C)CCCCl 34a_200000718107_100011215416 [0,0,1,0,0,0|2,0,1]=4 1157 B10R0.18 CCC(C)OC(C)CCCCl 7a_200000718107_100000758301 [0,0,1,0,0,0|2,0,1]=4 1158 B10R0.18 CCCCC(=O)CC(=O)CC 1458a_100000210183_100000747405 [0,0,1,0,0,0|2,0,1]=4 1159 B10R0.18 CCCCC(C)NC(=O)CC 11a_100000126638_100000210414 [0,0,1,0,0,0|1,0,0]=2 1160 B10R0.18 CCCCC(C)NC(=O)CC 1626a_100000126638_100000210414 [0,0,1,0,0,0|1,0,0]=2 1161 B10R0.18 CCCCC(C)NC(=O)CC 240690a_100000126638_100000210414 [0,0,1,0,0,0|1,0,0]=2 1162 B10R0.18 CCCCC(C)NC(=O)CC 527a_100000126638_100000210414 [0,0,1,0,0,0|1,0,0]=2 1163 B10R0.18 CCCCC(C)NC(=O)CO 240690a_100000126638_100000210174 [0,0,1,0,0,0|2,0,0]=3 1164 B10R0.18 CCCCC(C)NC(=O)CO 527a_100000126638_100000210174 [0,0,1,0,0,0|2,0,0]=3 1165 B10R0.18 CCCCC(C)NC(=O)NC 2708a_100000126638_106832991635 [0,0,1,0,0,0|2,0,0]=3 1166 B10R0.18 CCCCC(C)NC(=O)NC 2708a_100102657272_100000126638 [0,0,1,0,0,0|2,0,0]=3 1167 B10R0.18 CCCCC(C)NC(=O)NC 273464a_100000126638_100102657272 [0,0,1,0,0,0|2,0,0]=3 1168 B10R0.18 CCCCC(C)NC(=O)NC 273464a_100102657272_100000126638 [0,0,1,0,0,0|2,0,0]=3 1169 B10R0.18 CCCCC(C)NC(=O)NC 512a_100000126638_100102657272 [0,0,1,0,0,0|2,0,0]=3 1170 B10R0.18 CCCCC(C)NC(=O)NC 512a_106832991638_100000126638 [0,0,1,0,0,0|2,0,0]=3 1171 B10R0.18 CCCCC(C)NC(C)CC 2230a_100000126638_100000758301 [0,0,1,0,0,0|2,0,1]=4 1172 B10R0.18 CCCCC(C)NC(C)CC 2230a_100000209981_200011215066 [0,0,1,0,0,0|2,0,1]=4 1173 B10R0.18 CCCCC(C)NC(C)CC 270004a_100000209981_100000210087 [0,0,1,0,0,0|2,0,1]=4 1174 B10R0.18 CCCCC(C)OC(C)CC 34a_100000687866_100011215416 [0,0,1,0,0,0|1,0,1]=3 1175 B10R0.18 CCCCC(C)OC(C)CC 7a_100000210228_200011215066 [0,0,1,0,0,0|1,0,1]=3 1176 B10R0.18 CCCCC(C)OC(C)CC 7a_100000687866_100000758301 [0,0,1,0,0,0|1,0,1]=3 1177 B10R0.18 CCCCC(C)OC(C)CF 34a_100016041109_200011215066 [0,0,1,0,0,0|2,0,1]=4 1178 B10R0.18 CCCCC(C)OC(C)CF 7a_100016041109_200011215066 [0,0,1,0,0,0|2,0,1]=4 1179 B10R0.18 CCCCC(C)OC(C)CN 34a_100000210904_200011215066 [0,0,1,0,0,0|2,0,1]=4 1180 B10R0.18 CCCCC(C)OC(C)CO 34a_100000687866_100012180447 [0,0,1,0,0,0|2,0,1]=4 1181 B10R0.18 CCCCC(C)OC(C)CO 7a_100000687866_100012180447 [0,0,1,0,0,0|2,0,1]=4 1182 B10R0.18 CCCCC(C)SC(C)CC 62a_100000758301_200011215066 [0,0,1,0,0,0|1,1,1]=4 1183 B10R0.18 CCCCC(C)SC(C)CC 62a_200011215066_100000758301 [0,0,1,0,0,0|1,1,1]=4 1184 B10R0.18 CCCCN(C)CC(=O)CC 269982a_100000207549_100000747405 [0,0,1,0,0,0|2,0,0]=3 1185 B10R0.18 CCCCN(C)CC(=O)NC 2230a_100000189611_100000210211 [0,0,1,0,0,0|3,0,0]=4 1186 B10R0.18 CCCCN(C)CC(=O)NC 2230a_100000207549_100000183359 [0,0,1,0,0,0|3,0,0]=4 1187 B10R0.18 CCCCN(C)CC(=O)NC 269982a_100000207549_100000183359 [0,0,1,0,0,0|3,0,0]=4 1188 B10R0.18 CCCCN(C)CC(=O)OC 2230a_100000198492_100000210211 [0,0,1,0,0,0|3,0,0]=4 1189 B10R0.18 CCCCN(C)CC(=O)OC 2230a_100000207549_100000747449 [0,0,1,0,0,0|3,0,0]=4 1190 B10R0.18 CCCCN(C)CC(=O)OC 269982a_100000207549_100000747449 [0,0,1,0,0,0|3,0,0]=4 1191 B10R0.18 CCCOC(C)CC(=O)OC 34a_100000210258_100009817358 [0,0,1,0,0,0|3,0,0]=4 1192 B10R0.18 CCCSC(C)CC(=O)OC 62a_100000210303_100009817358 [0,0,1,0,0,0|3,0,0]=4 1193 B10R0.18 CCCSC(C)CC(=O)OC 62a_100009817358_100000210303 [0,0,1,0,0,0|3,0,0]=4 1194 B10R0.18 CCOCC(C)OC(C)CC 34a_100000718985_100011215416 [0,0,1,0,0,0|2,0,1]=4 1195 B10R0.18 CCOCC(C)OC(C)CC 7a_100000718985_100000758301 [0,0,1,0,0,0|2,0,1]=4 1196 B10R0.87 C=C(C)CN(CC)CCCC 2230a_100000207695_100000748629 [0,0,1,0,0,0|3,0,0]=4 1197 B10R0.87 C=C(C)CN(CC)CCCC 2230a_100000211296_100000210211 [0,0,1,0,0,0|3,0,0]=4 1198 B10R0.87 C=C(C)CN(CC)CCCC 269982a_100000207695_100000748629 [0,0,1,0,0,0|3,0,0]=4 1199 B10R0.87 C=C(C)CN(CC)CCCC 269982a_100000211296_100000210211 [0,0,1,0,0,0|3,0,0]=4 1200 B10R0.87 CCCCC(CC)CC(=O)C 1458a_100000070787_100000211942 [0,0,1,0,0,0|1,0,0]=2 1201 B10R0.87 CCCCC(CC)CN(C)C 2230a_100102631434_100000211942 [0,0,1,0,0,0|3,0,0]=4 1202 B10R0.87 CCCCC(CC)CN(C)C 269982a_100102631434_100000211942 [0,0,1,0,0,0|3,0,0]=4 1203 B10R0.87 CCCCC(CC)CN(C)C 270004a_100102631434_100011219736 [0,0,1,0,0,0|3,0,0]=4 1204 B10R0.87 CCCCC(CC)NC(C)C 34a_100138425928_200011216223 [0,0,1,0,0,0|2,0,1]=4 1205 B10R0.87 CCCCC(CC)OC(C)C 34a_100000212225_200011216223 [0,0,1,0,0,0|1,0,1]=3 1206 B10R0.87 CCCCC(CC)OC(C)C 34a_100011215227_100000210206 [0,0,1,0,0,0|1,0,1]=3 1207 B10R0.87 CCCCC(CC)OC(C)C 7a_100011215227_100000210206 [0,0,1,0,0,0|1,0,1]=3 1208 B10R0.87 CCCCC(CC)SC(C)C 62a_100000210206_200011216223 [0,0,1,0,0,0|1,1,1]=4 1209 B10R0.87 CCCCC(CC)SC(C)C 62a_200011216223_100000210206 [0,0,1,0,0,0|1,1,1]=4 1210 B10R0.87 CCCCN(CC)CC(=O)N 2230a_100000207695_100000747473 [0,0,1,0,0,0|3,0,0]=4 1211 B10R0.87 CCCCN(CC)CC(=O)N 269982a_100000207695_100000187820 [0,0,1,0,0,0|3,0,0]=4 1212 B10R0.87 CCCCN(CC)CC(=O)O 269956a_100000746405_100000210211 [0,0,1,0,0,0|3,0,0]=4 1213 B10R0.87 CCCCN(CC)CC(=O)[O-] 269982a_100000207695_100020667443 [0,0,1,0,0,0|3,0,0]=4 1214 B10R0.87 CCCC[C@@H](CO)NC(=O)C 240690a_100011934283_100015343762 [0,0,1,0,0,0|2,0,0]=3 1215 B10R0.87 CCCC[C@@H](CO)NC(=O)C 527a_100011934283_100103153847 [0,0,1,0,0,0|2,0,0]=3 1216 B10R0.87 CCCN[C@H](CC)CC(=O)O 269956a_100016995926_100000210207 [0,0,1,0,0,0|3,0,0]=4 1217 B10R0.87 CSCC[C@@H](CO)NC(=O)C 240690a_100011827619_100015343762 [0,0,1,0,0,0|3,0,0]=4 1218 B10R0.87 CSCC[C@@H](CO)NC(=O)C 527a_100011827619_100103153847 [0,0,1,0,0,0|3,0,0]=4 1219 B10R0.90 C/C=C/C(CCC)OCCC 34a_200016264281_100000210303 [0,0,1,0,0,0|3,0,0]=4 1220 B10R0.90 C/C=C/C(CCC)OCCC 7a_200016264281_100000210303 [0,0,1,0,0,0|3,0,0]=4 1221 B10R0.90 C=CCC(CCC)OCCC 34a_100011215139_100000210303 [0,0,1,0,0,0|3,0,0]=4 1222 B10R0.90 C=CCC(CCC)OCCC 7a_100011215139_100000210303 [0,0,1,0,0,0|3,0,0]=4 1223 B10R0.90 C=CCC(CCCC)OCC 34a_200011216941_100000210202 [0,0,1,0,0,0|3,0,0]=4 1224 B10R0.90 C=CCC(CCCC)OCC 7a_200011216941_100000210202 [0,0,1,0,0,0|3,0,0]=4 1225 B10R0.90 C=CCN(CCC)CCCC 2230a_200000207744_100000210623 [0,0,1,0,0,0|3,0,0]=4 1226 B10R0.90 C=CCN(CCC)CCCC 269982a_200000207744_100000210623 [0,0,1,0,0,0|3,0,0]=4 1227 B10R0.90 CCCCC(CCC)OCC 34a_100011215800_100000210202 [0,0,1,0,0,0|1,0,1]=3 1228 B10R0.90 CCCCC(CCC)OCC 34a_100121572206_100000211913 [0,0,1,0,0,0|1,0,1]=3 1229 B10R0.90 CCCCC(CCC)OCC 7a_100011215800_100000210202 [0,0,1,0,0,0|1,0,1]=3 1230 B10R0.90 CCCCC(CCC)OCF 34a_100011215800_100015361967 [0,0,1,0,0,0|1,0,1]=3 1231 B10R0.90 CCCCC(CCC)OCF 7a_100011215800_100015361967 [0,0,1,0,0,0|1,0,1]=3 1232 B10R0.90 CCCCC(CCC)SCC 62a_100000210202_100000211913 [0,0,1,0,0,0|1,1,1]=4 1233 B10R0.90 CCCCC(CCC)SCC 62a_100000211913_100000210202 [0,0,1,0,0,0|1,1,1]=4 1234 B10R0.90 CCCCC(CCC)SCF 62a_100000211913_100015361967 [0,0,1,0,0,0|1,1,1]=4 1235 B10R0.90 CCCCC(CCC)SCF 62a_100015361967_100000211913 [0,0,1,0,0,0|1,1,1]=4 1236 B10R0.90 CCCCN(CC=O)CCC 2230a_200000207744_200015260668 [0,0,1,0,0,0|2,0,0]=3 1237 B10R0.90 CCCCN(CC=O)CCC 269982a_200000207744_200015260668 [0,0,1,0,0,0|2,0,0]=3 1238 B10R0.90 CCCCN(CC=O)CCO 2230a_100000198060_200015260668 [0,0,1,0,0,0|3,0,0]=4 1239 B10R0.90 CCCCN(CC=O)CCO 269982a_100000198060_200015260668 [0,0,1,0,0,0|3,0,0]=4 1240 B10R0.90 CCCN(CC=O)CCOC 2230a_200011192371_200015260668 [0,0,1,0,0,0|3,0,0]=4 1241 B10R0.90 CCCN(CC=O)CCOC 269982a_200011192371_200015260668 [0,0,1,0,0,0|3,0,0]=4 1242 B10R0.91 C=CCCCC(=O)CCCC 1458a_100000210183_100000757094 [0,0,1,0,0,0|1,0,2]=4 1243 B10R0.91 C=CCCCC(=O)CCCC 1458a_100000766728_100000210211 [0,0,1,0,0,0|1,0,2]=4 1244 B10R0.91 C=CCCCN(C)CCCC 2230a_100000207549_100011713584 [0,0,1,0,0,0|3,0,0]=4 1245 B10R0.91 C=CCCCN(C)CCCC 269982a_100000207549_100000757094 [0,0,1,0,0,0|3,0,0]=4 1246 B10R0.91 C=CCCNC(C)CCCC 2230a_100000126638_100000754431 [0,0,1,0,0,0|3,0,0]=4 1247 B10R0.91 C=CCCNC(C)CCCC 2230a_100015191253_200011215066 [0,0,1,0,0,0|3,0,0]=4 1248 B10R0.91 C=CCCNC(C)CCCC 270004a_100015191253_100000210087 [0,0,1,0,0,0|3,0,0]=4 1249 B10R0.91 C=CCCOC(C)CCCC 34a_100000687866_100000754431 [0,0,1,0,0,0|3,0,0]=4 1250 B10R0.91 C=CCCOC(C)CCCC 34a_100011205117_200011215066 [0,0,1,0,0,0|3,0,0]=4 1251 B10R0.91 C=CCCOC(C)CCCC 7a_100000687866_100000754431 [0,0,1,0,0,0|3,0,0]=4 1252 B10R0.91 C=CCCSC(C)CCCC 62a_100000754431_200011215066 [0,0,1,0,0,0|3,0,0]=4 1253 B10R0.91 C=CCCSC(C)CCCC 62a_200011215066_100000754431 [0,0,1,0,0,0|3,0,0]=4 1254 B10R0.91 C=CCNCC(O)COCC 2230a_102515437182_100000210623 [0,0,1,0,0,0|3,0,0]=4 1255 B10R0.91 C=CCNCC(O)COCC 34a_102515437182_100015514636 [0,0,1,0,0,0|3,0,0]=4 1256 B10R0.91 C=CCOCC(C)CCCC 34a_100011995851_100015514636 [0,0,1,0,0,0|3,0,0]=4 1257 B10R0.91 C=CCOCC(C)CCCC 7a_100011995851_100015514636 [0,0,1,0,0,0|3,0,0]=4 1258 B10R0.91 C=CCOC[C@@H](N)CCCC 34a_100011934283_100015514636 [0,0,1,0,0,0|3,0,0]=4 1259 B10R0.91 CCCCC(C)COCC=O 34a_100011995851_200009817547 [0,0,1,0,0,0|2,0,0]=3 1260 B10R0.91 CCCCC(C)COCC=O 7a_100011995851_200015260668 [0,0,1,0,0,0|2,0,0]=3 1261 B10R0.91 CCCCN(C)CCCC=O 2230a_100000207549_200011292268 [0,0,1,0,0,0|2,0,0]=3 1262 B10R0.91 CCCCN(C)CCCC=O 269982a_100000207549_200011292268 [0,0,1,0,0,0|2,0,0]=3 1263 B10R0.91 CCCC[C@H](N)COCC=O 34a_100011934283_200009817547 [0,0,1,0,0,0|2,0,0]=3 1264 B10R0.91 CCCOC(C)CNCC=O 2230a_100015185124_200015260668 [0,0,1,0,0,0|3,0,0]=4 1265 B10R0.91 CCCOC(C)CNCC=O 34a_100015185124_200009817547 [0,0,1,0,0,0|3,0,0]=4 1266 B10R0.91 CCOCC(O)CNCC=O 2230a_102515437182_200015260668 [0,0,1,0,0,0|2,0,0]=3 1267 B10R0.91 CCOCC(O)CNCC=O 34a_102515437182_200009817547 [0,0,1,0,0,0|2,0,0]=3 1268 B10R0.91 CN(CCCO)CCCC=O 2230a_100000213112_200011292268 [0,0,1,0,0,0|3,0,0]=4 1269 B10R0.91 CN(CCCO)CCCC=O 269982a_100000213112_200011292268 [0,0,1,0,0,0|3,0,0]=4 1270 B10R0.91 COCCN(C)CCCC=O 2230a_100000743101_200011292268 [0,0,1,0,0,0|3,0,0]=4 1271 B10R0.91 COCCN(C)CCCC=O 269982a_100000743101_200011292268 [0,0,1,0,0,0|3,0,0]=4 1272 B10R0.91 CSCCN(C)CCCC=O 2230a_100000686725_200011292268 [0,0,1,0,0,0|3,0,0]=4 1273 B10R0.91 CSCCN(C)CCCC=O 269982a_100000686725_200011292268 [0,0,1,0,0,0|3,0,0]=4 1274 B10R0.91 CSCC[C@H](N)COCC=O 34a_100011827619_200009817547 [0,0,1,0,0,0|3,0,0]=4 1275 B10R0.91 C[C@H](CCCO)CNCC=O 2230a_100160569302_200015260668 [0,0,1,0,0,0|3,0,0]=4 1276 B10R0.91 C[C@H](CCCO)CNCC=O 34a_100160569302_200009817547 [0,0,1,0,0,0|3,0,0]=4 1277 B12R2.24 CN1CCC2CCCCC2C1 2230a_100000211783_200000210301 [0,0,0,1,0,0|3,0,0]=4 1278 B12R2.24 CN1CCC2CCCCC2C1 269982a_100000211783_200000210301 [0,0,0,1,0,0|3,0,0]=4 1279 B12R2.24 CN1CCC2CCCCC2C1 34a_100000211783_200000210301 [0,0,0,1,0,0|3,0,0]=4 1280 B12R2.24 [13CH3]N1CCC2CCCCC2C1 2230a_100000211783_200025704644 [0,0,0,1,0,0|3,0,0]=4 1281 B12R2.24 [13CH3]N1CCC2CCCCC2C1 269982a_100000211783_200025704644 [0,0,0,1,0,0|3,0,0]=4 1282 B12R2.24 [13CH3]N1CCC2CCCCC2C1 34a_100000211783_200025704644 [0,0,0,1,0,0|3,0,0]=4 1283 B12R2.1081 CN1CCCC2C1CCCC2 2230a_100000211887_200000210301 [0,0,0,1,0,0|3,0,0]=4 1284 B12R2.1081 CN1CCCC2C1CCCC2 269982a_100000211887_200000210301 [0,0,0,1,0,0|3,0,0]=4 1285 B12R2.1081 CN1CCCC2C1CCCC2 34a_100000211887_200000210301 [0,0,0,1,0,0|3,0,0]=4 1286 B12R2.1081 [13CH3]N1CCCC2C1CCCC2 2230a_100000211887_200025704644 [0,0,0,1,0,0|3,0,0]=4 1287 B12R2.1081 [13CH3]N1CCCC2C1CCCC2 269982a_100000211887_200025704644 [0,0,0,1,0,0|3,0,0]=4 1288 B12R2.1081 [13CH3]N1CCCC2C1CCCC2 34a_100000211887_200025704644 [0,0,0,1,0,0|3,0,0]=4 1289 B12R2.1286 CC1=CC(CCC1)OC2CC2 34a_100011218613_100000211595 [0,0,0,1,0,0|3,0,0]=4 1290 B12R2.1286 O=C1CC(CCN1)NC2CC2 34a_100016994916_100000211595 [0,0,0,1,0,0|3,0,0]=4 1291 B12R2.1286 O=C1CCCC(C1)OC2CC2 34a_100012613340_100000211595 [0,0,0,1,0,0|2,0,0]=3 1292 B12R2.1286 O=C1CN(CCN1)CC2CC2 2230a_100000184651_100000742324 [0,0,0,1,0,0|3,0,0]=4 1293 B12R2.1286 O=C1CN(CCO1)CC2CC2 2230a_100000131268_100000742324 [0,0,0,1,0,0|3,0,0]=4 1294 B12R2.1286 O=C1C[C@@H](CCN1)OC2CC2 34a_100015189427_100000211595 [0,0,0,1,0,0|3,0,0]=4 1295 B12R2.2313 O=C1CN(CCN1)C2CCC2 270004a_100000184651_100000241760 [0,0,0,1,0,0|3,0,0]=4 1296 B12R2.2313 O=C1CN(CCO1)C2CCC2 270004a_100000131268_100000241760 [0,0,0,1,0,0|3,0,0]=4 1297 B10R1.16 CCCCN1CNC(=O)C1 2230a_200000708111_100000210211 [0,0,0,0,1,0|3,0,0]=4 1298 B10R1.16 CCCNC1CNC(=O)C1 2230a_100000697751_100000210303 [0,0,0,0,1,0|3,0,0]=4 1299 B10R1.16 CCCOC1CCC(=O)C1 34a_100012614533_100000210303 [0,0,0,0,1,0|2,0,0]=3 1300 B10R1.16 CCCOC1CNC(=O)C1 34a_100000690082_100000210303 [0,0,0,0,1,0|3,0,0]=4 1301 B10R1.16 CCCOC1COC(=O)O1 34a_100000210258_100000032252 [0,0,0,0,1,0|2,0,0]=3 1302 B10R1.16 CCCSC1COC(=O)O1 62a_100000210303_100000032252 [0,0,0,0,1,0|2,0,0]=3 1303 B10R1.16 CCNCC1CNC(=O)C1 2230a_100016993742_100000210202 [0,0,0,0,1,0|3,0,0]=4 1304 B10R1.16 CCNCC1CNC(=O)C1 34a_100016993742_100000210202 [0,0,0,0,1,0|3,0,0]=4 1305 B10R1.16 CCNCC1CNC(=O)O1 2230a_100015525214_100000181169 [0,0,0,0,1,0|2,0,0]=3 1306 B10R1.16 CCNC[C@@H]1CCC(=O)N1 2230a_100015525214_100015189358 [0,0,0,0,1,0|2,0,0]=3 1307 B10R1.16 CCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210202 [0,0,0,0,1,0|2,0,0]=3 1308 B10R1.16 CCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210202 [0,0,0,0,1,0|2,0,0]=3 1309 B10R1.16 CCNC[C@H]1COC(=O)N1 2230a_100015525214_100015307671 [0,0,0,0,1,0|3,0,0]=4 1310 B10R1.16 CCOCC1CCC(=O)N1 34a_100000737831_100000210202 [0,0,0,0,1,0|2,0,0]=3 1311 B10R1.16 CCOCC1CNC(=O)C1 34a_100016041077_100000210202 [0,0,0,0,1,0|3,0,0]=4 1312 B10R1.16 CCOCC1CNC(=O)O1 34a_100011315639_100000210202 [0,0,0,0,1,0|2,0,0]=3 1313 B10R1.16 CCOCC1CNC(=O)O1 34a_100121572206_100000181169 [0,0,0,0,1,0|2,0,0]=3 1314 B10R1.16 CCOCC1COC(=O)O1 34a_100121572206_100000073702 [0,0,0,0,1,0|2,0,0]=3 1315 B10R1.16 CCOC[C@H]1COC(=O)N1 34a_100121572206_100015307671 [0,0,0,0,1,0|3,0,0]=4 1316 B10R1.16 CCSCC1CNC(=O)O1 62a_100000181169_100000210202 [0,0,0,0,1,0|2,0,0]=3 1317 B10R1.16 CCSCC1CNC(=O)O1 62a_100000210202_100000181169 [0,0,0,0,1,0|2,0,0]=3 1318 B10R1.16 CCSCC1COC(=O)O1 62a_100000073702_100000210202 [0,0,0,0,1,0|2,0,0]=3 1319 B10R1.16 CCSCC1COC(=O)O1 62a_100000210202_100000073702 [0,0,0,0,1,0|2,0,0]=3 1320 B10R1.16 CCSC[C@@H]1CCC(=O)N1 62a_100000210202_100015189358 [0,0,0,0,1,0|2,0,0]=3 1321 B10R1.16 CCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210202 [0,0,0,0,1,0|2,0,0]=3 1322 B10R1.16 CCSC[C@H]1COC(=O)N1 62a_100000210202_100015307671 [0,0,0,0,1,0|3,0,0]=4 1323 B10R1.16 CCSC[C@H]1COC(=O)N1 62a_100015307671_100000210202 [0,0,0,0,1,0|3,0,0]=4 1324 B10R1.16 CNCCC1COS(=O)O1 7a_106832991635_100009840081 [0,0,0,0,1,0|3,0,0]=4 1325 B10R1.16 COCSC1COC(=O)O1 62a_100000766300_100000032252 [0,0,0,0,1,0|3,0,0]=4 1326 B10R1.16 CSCCC1COS(=O)O1 62a_200000210301_100009840081 [0,0,0,0,1,0|3,0,0]=4 1327 B10R1.16 CSCOC1CCC(=O)C1 34a_100012614533_100011218213 [0,0,0,0,1,0|3,0,0]=4 1328 B10R1.16 CSCSC1COC(=O)O1 62a_100011218213_100000032252 [0,0,0,0,1,0|3,0,0]=4 1329 B10R1.16 NCCOC1COC(=O)O1 34a_100000210304_100000032252 [0,0,0,0,1,0|3,0,0]=4 1330 B10R1.16 O=C1CCC(C1)OCCF 34a_100012614533_100011217306 [0,0,0,0,1,0|3,0,0]=4 1331 B10R1.16 O=C1CCC(C1)OCCO 34a_100012614533_100000211926 [0,0,0,0,1,0|3,0,0]=4 1332 B10R1.16 O=C1CCC(N1)COCF 34a_100000737831_100015361967 [0,0,0,0,1,0|3,0,0]=4 1333 B10R1.16 O=C1CC[C@@H](N1)CNCF 34a_100015423886_100015361967 [0,0,0,0,1,0|3,0,0]=4 1334 B10R1.16 O=C1CC[C@H](N1)CSCF 62a_100015189358_100015361967 [0,0,0,0,1,0|3,0,0]=4 1335 B10R1.16 O=C1CC[C@H](N1)CSCF 62a_100015361967_100015189358 [0,0,0,0,1,0|3,0,0]=4 1336 B10R1.16 O=C1NCC(O1)COCF 34a_100011315639_100015361967 [0,0,0,0,1,0|3,0,0]=4 1337 B10R1.16 O=C1NCC(O1)CSCF 62a_100000181169_100015361967 [0,0,0,0,1,0|3,0,0]=4 1338 B10R1.16 O=C1NCC(O1)CSCF 62a_100015361967_100000181169 [0,0,0,0,1,0|3,0,0]=4 1339 B10R1.16 O=C1OCC(O1)CSCF 62a_100000073702_100015361967 [0,0,0,0,1,0|3,0,0]=4 1340 B10R1.16 O=C1OCC(O1)CSCF 62a_100015361967_100000073702 [0,0,0,0,1,0|3,0,0]=4 1341 B10R1.16 O=C1OCC(O1)NCCF 34a_100000724931_100000032252 [0,0,0,0,1,0|3,0,0]=4 1342 B10R1.16 O=C1OCC(O1)NCCO 34a_100016990907_100000032252 [0,0,0,0,1,0|3,0,0]=4 1343 B10R1.16 O=C1OCC(O1)OCCBr 34a_100000211926_100000032252 [0,0,0,0,1,0|3,0,0]=4 1344 B10R1.16 O=C1OCC(O1)SCCF 62a_100011217306_100000032252 [0,0,0,0,1,0|3,0,0]=4 1345 B10R1.16 O=C1OCC(O1)SCCO 62a_100000211926_100000032252 [0,0,0,0,1,0|3,0,0]=4 1346 B10R1.16 [13CH3]SCCC1COS(=O)O1 62a_200025704644_100009840081 [0,0,0,0,1,0|3,0,0]=4 1347 B10R1.29 C#CCNC1CCCC1=O 34a_100000212058_100000709159 [0,0,0,0,1,0|1,0,2]=4 1348 B10R1.29 C#CCOC1CCCC1=O 34a_100000210247_100000709159 [0,0,0,0,1,0|1,0,2]=4 1349 B10R1.29 C#CCOC1CCCC1=O 34a_200000719330_100000184674 [0,0,0,0,1,0|1,0,2]=4 1350 B10R1.29 C#CCSC1CCCC1=O 62a_100000038162_100000211823 [0,0,0,0,1,0|1,0,2]=4 1351 B10R1.29 C=CCNC1CCCC1=O 2230a_100020586998_100000211823 [0,0,0,0,1,0|1,0,2]=4 1352 B10R1.29 C=CCOC1CCCC1=O 34a_200000210373_100000709159 [0,0,0,0,1,0|1,0,2]=4 1353 B10R1.29 C=CCOC1CCCC1=O 34a_200000719330_100015514636 [0,0,0,0,1,0|1,0,2]=4 1354 B10R1.29 C=CCSC1CCCC1=O 62a_100000210623_100000211823 [0,0,0,0,1,0|1,0,2]=4 1355 B10R1.29 C=CCSC1CCCC1=O 62a_100000211823_100000210623 [0,0,0,0,1,0|1,0,2]=4 1356 B10R1.29 CCCCN1CCC[C@@H]1C 2230a_100020605311_100000210211 [0,0,0,0,1,0|2,0,1]=4 1357 B10R1.29 CCCCN1CCC[C@@H]1C 269982a_100020605311_100000210211 [0,0,0,0,1,0|2,0,1]=4 1358 B10R1.29 CCCCN1CCC[C@H]1C 2230a_100015189458_100000210211 [0,0,0,0,1,0|2,0,1]=4 1359 B10R1.29 CCCCN1CCC[C@H]1C 269982a_100015189458_100000210211 [0,0,0,0,1,0|2,0,1]=4 1360 B10R1.29 CCCCN1CCC[C@H]1C 34a_100015189458_100000210210 [0,0,0,0,1,0|2,0,1]=4 1361 B10R1.29 CCCNC1CCCC1C 269862a_100020643023_100000752053 [0,0,0,0,1,0|2,0,1]=4 1362 B10R1.29 CCCNC1CCNC1=O 2230a_100016995588_100000210303 [0,0,0,0,1,0|2,0,0]=3 1363 B10R1.29 CCCNC1CCNC1=O 34a_100016995588_100000210303 [0,0,0,0,1,0|2,0,0]=3 1364 B10R1.29 CCCN[C@@H]1CONC1=O 2230a_100000765999_100000210303 [0,0,0,0,1,0|3,0,0]=4 1365 B10R1.29 CCCN[C@@H]1CONC1=O 34a_100000765999_100000210303 [0,0,0,0,1,0|3,0,0]=4 1366 B10R1.29 CCCOC1CCCC1=O 34a_100000210258_100000709159 [0,0,0,0,1,0|1,0,0]=2 1367 B10R1.29 CCCOC1CCCC1=O 34a_200000719330_100000210303 [0,0,0,0,1,0|1,0,0]=2 1368 B10R1.29 CCCOC1CCCC1C 34a_100011216460_100000210303 [0,0,0,0,1,0|2,0,1]=4 1369 B10R1.29 CCCOC1CCCC1C 7a_100011216460_100000210303 [0,0,0,0,1,0|2,0,1]=4 1370 B10R1.29 CCCOC1CCOC1=O 34a_100000210258_100000211211 [0,0,0,0,1,0|2,0,0]=3 1371 B10R1.29 CCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000210303 [0,0,0,0,1,0|2,0,1]=4 1372 B10R1.29 CCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210303 [0,0,0,0,1,0|2,0,1]=4 1373 B10R1.29 CCCO[C@H]1CCNC1=O 34a_100000688343_100000210303 [0,0,0,0,1,0|2,0,0]=3 1374 B10R1.29 CCCSC1CCCC1=O 62a_100000210303_100000211823 [0,0,0,0,1,0|1,0,0]=2 1375 B10R1.29 CCCSC1CCCC1=O 62a_100000211823_100000210303 [0,0,0,0,1,0|1,0,0]=2 1376 B10R1.29 CCCSC1CCOC1=O 62a_100000210303_100000211211 [0,0,0,0,1,0|2,0,0]=3 1377 B10R1.29 CCCSC1CCOC1=O 62a_100000211211_100000210303 [0,0,0,0,1,0|2,0,0]=3 1378 B10R1.29 CCCS[C@@H]1CCC[C@H]1O 62a_100000210303_200016002552 [0,0,0,0,1,0|1,0,2]=4 1379 B10R1.29 CCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210303 [0,0,0,0,1,0|1,0,2]=4 1380 B10R1.29 CCOCC1=CCCC1=O 34a_100000087531_100000210202 [0,0,0,0,1,0|1,0,2]=4 1381 B10R1.29 CCOCC1CCCN1C 34a_100000743107_100000210202 [0,0,0,0,1,0|3,0,0]=4 1382 B10R1.29 CCOCC1CCNC1=O 34a_100000133458_100000210202 [0,0,0,0,1,0|2,0,0]=3 1383 B10R1.29 CCSCN1CCCC1=O 62a_100000026320_100000210202 [0,0,0,0,1,0|2,0,0]=3 1384 B10R1.29 CCSCN1CCCC1=O 62a_100000210202_100000026320 [0,0,0,0,1,0|2,0,0]=3 1385 B10R1.29 CN1CCCC1CCO[13CH3] 34a_100011215177_200025704644 [0,0,0,0,1,0|3,0,0]=4 1386 B10R1.29 CN1CCCC1CCO[13CH3] 7a_100011215177_200025704644 [0,0,0,0,1,0|3,0,0]=4 1387 B10R1.29 CN1CCCC1CCS[13CH3] 62a_100000005710_200025704644 [0,0,0,0,1,0|3,0,0]=4 1388 B10R1.29 CN1CCCC1CCS[13CH3] 62a_200025704644_100000005710 [0,0,0,0,1,0|3,0,0]=4 1389 B10R1.29 CNCCC1CCCN1C 2230a_106832991635_100000005710 [0,0,0,0,1,0|3,0,0]=4 1390 B10R1.29 CNCCC1CCCN1C 34a_100102657272_100000005710 [0,0,0,0,1,0|3,0,0]=4 1391 B10R1.29 CNCCC1CCCN1C 7a_106832991635_100000005710 [0,0,0,0,1,0|3,0,0]=4 1392 B10R1.29 CNCCN1CCCC1=O 2230a_100011200922_200000210301 [0,0,0,0,1,0|2,0,0]=3 1393 B10R1.29 CNCCN1CCCC1=O 2230a_106832991635_100000739059 [0,0,0,0,1,0|2,0,0]=3 1394 B10R1.29 CNCCN1CCCC1=O 34a_100102657272_100000739059 [0,0,0,0,1,0|2,0,0]=3 1395 B10R1.29 CNCCN1CCCC1=O 7a_106832991635_100000739059 [0,0,0,0,1,0|2,0,0]=3 1396 B10R1.29 CNCCN1CCNC1=O 2230a_100011207550_200000210301 [0,0,0,0,1,0|3,0,0]=4 1397 B10R1.29 CNCCN1CCNC1=O 2230a_106832991635_100000090651 [0,0,0,0,1,0|3,0,0]=4 1398 B10R1.29 CNCCN1CCNC1=O 7a_106832991635_100000090651 [0,0,0,0,1,0|3,0,0]=4 1399 B10R1.29 COCCC1CCCN1C 34a_100011215177_200000210301 [0,0,0,0,1,0|3,0,0]=4 1400 B10R1.29 COCCC1CCCN1C 34a_100138415774_100000005710 [0,0,0,0,1,0|3,0,0]=4 1401 B10R1.29 COCCC1CCCN1C 7a_100011215177_200000210301 [0,0,0,0,1,0|3,0,0]=4 1402 B10R1.29 COCCN1CCCC1=O 34a_100000211209_200000210301 [0,0,0,0,1,0|2,0,0]=3 1403 B10R1.29 COCCN1CCCC1=O 34a_100138415774_100000739059 [0,0,0,0,1,0|2,0,0]=3 1404 B10R1.29 COCCN1CCCC1=O 7a_100000211209_200000210301 [0,0,0,0,1,0|2,0,0]=3 1405 B10R1.29 COCCN1CCNC1=O 34a_100000216532_200000210301 [0,0,0,0,1,0|3,0,0]=4 1406 B10R1.29 COCNC1CCNC1=O 2230a_100016995588_100000766300 [0,0,0,0,1,0|3,0,0]=4 1407 B10R1.29 COCSC1CCCC1=O 62a_100000211823_100000766300 [0,0,0,0,1,0|2,0,0]=3 1408 B10R1.29 COCSC1CCCC1=O 62a_100000766300_100000211823 [0,0,0,0,1,0|2,0,0]=3 1409 B10R1.29 COCSC1CCOC1=O 62a_100000211211_100000766300 [0,0,0,0,1,0|3,0,0]=4 1410 B10R1.29 COCSC1CCOC1=O 62a_100000766300_100000211211 [0,0,0,0,1,0|3,0,0]=4 1411 B10R1.29 CSCCC1CCCN1C 62a_100000005710_200000210301 [0,0,0,0,1,0|3,0,0]=4 1412 B10R1.29 CSCCC1CCCN1C 62a_200000210301_100000005710 [0,0,0,0,1,0|3,0,0]=4 1413 B10R1.29 CSCCN1CCCC1=O 62a_100000739059_200000210301 [0,0,0,0,1,0|2,0,0]=3 1414 B10R1.29 CSCCN1CCCC1=O 62a_200000210301_100000739059 [0,0,0,0,1,0|2,0,0]=3 1415 B10R1.29 CSCCN1CCNC1=O 62a_100000090651_200000210301 [0,0,0,0,1,0|3,0,0]=4 1416 B10R1.29 CSCCN1CCNC1=O 62a_200000210301_100000090651 [0,0,0,0,1,0|3,0,0]=4 1417 B10R1.29 CSCNC1CCNC1=O 2230a_100016995588_100011218213 [0,0,0,0,1,0|3,0,0]=4 1418 B10R1.29 CSCNC1CCNC1=O 34a_100016995588_100011218213 [0,0,0,0,1,0|3,0,0]=4 1419 B10R1.29 CSCOC1CCCC1=O 34a_200000719330_100011218213 [0,0,0,0,1,0|2,0,0]=3 1420 B10R1.29 CSCO[C@H]1CCNC1=O 34a_100000688343_100011218213 [0,0,0,0,1,0|3,0,0]=4 1421 B10R1.29 CSCSC1CCCC1=O 62a_100000211823_100011218213 [0,0,0,0,1,0|2,0,0]=3 1422 B10R1.29 CSCSC1CCCC1=O 62a_100011218213_100000211823 [0,0,0,0,1,0|2,0,0]=3 1423 B10R1.29 CSCSC1CCOC1=O 62a_100000211211_100011218213 [0,0,0,0,1,0|3,0,0]=4 1424 B10R1.29 CSCSC1CCOC1=O 62a_100011218213_100000211211 [0,0,0,0,1,0|3,0,0]=4 1425 B10R1.29 N#CCSC1CCCC1=O 62a_100000211823_100011215382 [0,0,0,0,1,0|2,0,1]=4 1426 B10R1.29 N#CCSC1CCCC1=O 62a_100011215382_100000211823 [0,0,0,0,1,0|2,0,1]=4 1427 B10R1.29 NCCOC1CCCC1=O 34a_100000210304_100000709159 [0,0,0,0,1,0|2,0,0]=3 1428 B10R1.29 NCCOC1CCOC1=O 34a_100000210304_100000211211 [0,0,0,0,1,0|3,0,0]=4 1429 B10R1.29 O=C1CCCC1NCCF 34a_100000724931_100000709159 [0,0,0,0,1,0|2,0,0]=3 1430 B10R1.29 O=C1CCCC1NCCO 2230a_100016997473_100000211823 [0,0,0,0,1,0|2,0,0]=3 1431 B10R1.29 O=C1CCCC1NCCO 34a_100016990907_100000709159 [0,0,0,0,1,0|2,0,0]=3 1432 B10R1.29 O=C1CCCC1OCCBr 34a_100000211926_100000709159 [0,0,0,0,1,0|2,0,0]=3 1433 B10R1.29 O=C1CCCC1OCCF 34a_200000719330_100011217306 [0,0,0,0,1,0|2,0,0]=3 1434 B10R1.29 O=C1CCCC1OCCO 34a_200000719330_100000211926 [0,0,0,0,1,0|2,0,0]=3 1435 B10R1.29 O=C1CCCC1SCCF 62a_100000211823_100011217306 [0,0,0,0,1,0|2,0,0]=3 1436 B10R1.29 O=C1CCCC1SCCF 62a_100011217306_100000211823 [0,0,0,0,1,0|2,0,0]=3 1437 B10R1.29 O=C1CCCC1SCCO 62a_100000211823_100000211926 [0,0,0,0,1,0|2,0,0]=3 1438 B10R1.29 O=C1CCCC1SCCO 62a_100000211926_100000211823 [0,0,0,0,1,0|2,0,0]=3 1439 B10R1.29 O=C1CCCN1CSCF 62a_100000026320_100015361967 [0,0,0,0,1,0|3,0,0]=4 1440 B10R1.29 O=C1CCCN1CSCF 62a_100015361967_100000026320 [0,0,0,0,1,0|3,0,0]=4 1441 B10R1.29 O=C1NCCC1COCF 34a_100000133458_100015361967 [0,0,0,0,1,0|3,0,0]=4 1442 B10R1.29 O=C1NCCC1NCCF 2230a_100016995588_100011217306 [0,0,0,0,1,0|3,0,0]=4 1443 B10R1.29 O=C1NCCC1NCCF 34a_100016995588_100011217306 [0,0,0,0,1,0|3,0,0]=4 1444 B10R1.29 O=C1NCCC1NCCO 2230a_100016995588_100000211926 [0,0,0,0,1,0|3,0,0]=4 1445 B10R1.29 O=C1NCCC1NCCO 34a_100016995588_100000211926 [0,0,0,0,1,0|3,0,0]=4 1446 B10R1.29 O=C1NCC[C@@H]1OCCF 34a_100000688343_100011217306 [0,0,0,0,1,0|3,0,0]=4 1447 B10R1.29 O=C1NCC[C@@H]1OCCO 34a_100000688343_100000211926 [0,0,0,0,1,0|3,0,0]=4 1448 B10R1.29 O=C1OCCC1NCCF 34a_100000724931_100000211211 [0,0,0,0,1,0|3,0,0]=4 1449 B10R1.29 O=C1OCCC1NCCO 2230a_100016997473_100000211211 [0,0,0,0,1,0|3,0,0]=4 1450 B10R1.29 O=C1OCCC1NCCO 34a_100016990907_100000211211 [0,0,0,0,1,0|3,0,0]=4 1451 B10R1.29 O=C1OCCC1OCCBr 34a_100000211926_100000211211 [0,0,0,0,1,0|3,0,0]=4 1452 B10R1.29 O=C1OCCC1SCCF 62a_100000211211_100011217306 [0,0,0,0,1,0|3,0,0]=4 1453 B10R1.29 O=C1OCCC1SCCF 62a_100011217306_100000211211 [0,0,0,0,1,0|3,0,0]=4 1454 B10R1.29 O=C1OCCC1SCCO 62a_100000211211_100000211926 [0,0,0,0,1,0|3,0,0]=4 1455 B10R1.29 O=C1OCCC1SCCO 62a_100000211926_100000211211 [0,0,0,0,1,0|3,0,0]=4 1456 B10R1.29 O=CCOC1CCCC1=O 34a_200000719330_200009817547 [0,0,0,0,1,0|2,0,1]=4 1457 B10R1.29 O=CCSC1CCCC1=O 62a_100000211823_200015260668 [0,0,0,0,1,0|2,0,1]=4 1458 B10R1.29 O=CCSC1CCCC1=O 62a_200015260668_100000211823 [0,0,0,0,1,0|2,0,1]=4 1459 B10R1.29 [13CH3]NCCN1CCCC1=O 2230a_100011200922_200025704644 [0,0,0,0,1,0|2,0,0]=3 1460 B10R1.29 [13CH3]NCCN1CCNC1=O 2230a_100011207550_200025704644 [0,0,0,0,1,0|3,0,0]=4 1461 B10R1.29 [13CH3]OCCN1CCCC1=O 34a_100000211209_200025704644 [0,0,0,0,1,0|2,0,0]=3 1462 B10R1.29 [13CH3]OCCN1CCCC1=O 7a_100000211209_200025704644 [0,0,0,0,1,0|2,0,0]=3 1463 B10R1.29 [13CH3]OCCN1CCNC1=O 34a_100000216532_200025704644 [0,0,0,0,1,0|3,0,0]=4 1464 B10R1.29 [13CH3]SCCN1CCCC1=O 62a_100000739059_200025704644 [0,0,0,0,1,0|2,0,0]=3 1465 B10R1.29 [13CH3]SCCN1CCCC1=O 62a_200025704644_100000739059 [0,0,0,0,1,0|2,0,0]=3 1466 B10R1.29 [13CH3]SCCN1CCNC1=O 62a_100000090651_200025704644 [0,0,0,0,1,0|3,0,0]=4 1467 B10R1.29 [13CH3]SCCN1CCNC1=O 62a_200025704644_100000090651 [0,0,0,0,1,0|3,0,0]=4 1468 B12R1.321 CCCCN1CCCNC(=O)C1 2230a_100015190381_100000210211 [0,0,0,0,0,1|2,0,0]=3 1469 B12R1.321 COCCN1CCCNC(=O)C1 2230a_100015190381_100011201679 [0,0,0,0,0,1|3,0,0]=4 1470 B12R1.321 CSCCN1CCCNC(=O)C1 2230a_100015190381_100000751147 [0,0,0,0,0,1|3,0,0]=4 1471 B12R1.321 O=C1CN(CCCN1)CCCF 2230a_100015190381_100011934791 [0,0,0,0,0,1|3,0,0]=4 1472 B12R1.321 O=C1CN(CCCN1)CCCO 2230a_100015190381_100000230001 [0,0,0,0,0,1|3,0,0]=4 1473 B12R1.348 CCCCN1CCNC(=O)CC1 2230a_100000698595_100000210211 [0,0,0,0,0,1|3,0,0]=4 1474 B12R1.348 CCCCN1CCNC(=O)CC1 269982a_100000698595_100000210211 [0,0,0,0,0,1|3,0,0]=4 1475 B9R0.5 C#CCC(=O)CCCCC 1458a_100000212188_100000184674 [1,0,1,0,0,0|0,0,2]=4 1476 B9R0.5 C#CCC(=O)CCCCC 1458a_100011220946_100000210326 [1,0,1,0,0,0|0,0,2]=4 1477 B9R0.5 C#CCCCC(=O)CCC 1458a_100000211992_100000731252 [1,0,1,0,0,0|0,0,2]=4 1478 B9R0.5 C#CCCCC(=O)CCC 1458a_100000690238_100000210303 [1,0,1,0,0,0|0,0,2]=4 1479 B9R0.5 C=CCC(=O)CCCCC 1458a_100000210193_100000210326 [1,0,1,0,0,0|0,0,2]=4 1480 B9R0.5 C=CCC(=O)CCCCC 1458a_100000212188_100000210623 [1,0,1,0,0,0|0,0,2]=4 1481 B9R0.5 C=CCCCC(=O)CCC 1458a_100000211992_100000757094 [1,0,1,0,0,0|0,0,2]=4 1482 B9R0.5 C=CCCCC(=O)CCC 1458a_100000766728_100000210303 [1,0,1,0,0,0|0,0,2]=4 1483 B9R0.5 CC#CC(=O)CCCCC 1458a_100000763181_100000210326 [1,0,1,0,0,0|0,0,2]=4 1484 B9R0.5 CC/C=C/CC(=O)CCC 1458a_100016274230_100000210303 [1,0,1,0,0,0|0,0,2]=4 1485 B9R0.5 CC/C=C\CC(=O)CCC 1458a_100000211992_100103147603 [1,0,1,0,0,0|0,0,2]=4 1486 B9R0.5 CC=CC(=O)CCCCC 1458a_100000210699_100000210326 [1,0,1,0,0,0|0,0,2]=4 1487 B9R0.5 CCC#CCC(=O)CCC 1458a_100000211992_100009813939 [1,0,1,0,0,0|0,0,2]=4 1488 B9R0.5 CCCC#CC(=O)CCC 1458a_200011218047_100000210303 [1,0,1,0,0,0|0,0,2]=4 1489 B9R0.5 CCCC(=O)CCCC#N 1458a_100000075515_100000210303 [1,0,1,0,0,0|1,0,1]=4 1490 B9R0.5 CCCC(=O)CCCC#N 1458a_100000211992_100000211468 [1,0,1,0,0,0|1,0,1]=4 1491 B9R0.5 CCCC(=O)CCCCF 1458a_100000211992_100000729493 [1,0,1,0,0,0|1,0,0]=3 1492 B9R0.5 CCCC(=O)CCCCO 1458a_100000211992_100000210776 [1,0,1,0,0,0|1,0,0]=3 1493 B9R0.5 CCCC(=O)CCCCO 1458a_100000695505_100000210303 [1,0,1,0,0,0|1,0,0]=3 1494 B9R0.5 CCCC(=O)CCCOC 1458a_100000211992_100000740836 [1,0,1,0,0,0|1,0,0]=3 1495 B9R0.5 CCCC(=O)CCCOC 1458a_100000741012_100000210303 [1,0,1,0,0,0|1,0,0]=3 1496 B9R0.5 CCCC(=O)CCCSC 1458a_100000173376_100000210303 [1,0,1,0,0,0|1,0,0]=3 1497 B9R0.5 CCCC(=O)CCOCC 1458a_100000211992_100011215890 [1,0,1,0,0,0|1,0,0]=3 1498 B9R0.5 CCCC(=O)CCOCC 1458a_100000749530_100000210303 [1,0,1,0,0,0|1,0,0]=3 1499 B9R0.5 CCCC(=O)CCSCC 1458a_100000211992_100000757381 [1,0,1,0,0,0|1,0,0]=3 1500 B9R0.5 CCCC(=O)CCSCC 1458a_100000230768_100000210303 [1,0,1,0,0,0|1,0,0]=3 1501 B9R0.5 CCCC(=O)CNCCO 2230a_100016997473_100000747444 [1,0,1,0,0,0|2,0,0]=4 1502 B9R0.5 CCCC(=O)COCCO 1458a_100000708028_100000210303 [1,0,1,0,0,0|2,0,0]=4 1503 B9R0.5 CCCC(=O)CSCCF 62a_100000747444_100011217306 [1,0,1,0,0,0|2,0,0]=4 1504 B9R0.5 CCCC(=O)CSCCF 62a_100011217306_100000747444 [1,0,1,0,0,0|2,0,0]=4 1505 B9R0.5 CCCC(=O)CSCCO 62a_100000211926_100000747444 [1,0,1,0,0,0|2,0,0]=4 1506 B9R0.5 CCCC(=O)CSCCO 62a_100000747444_100000211926 [1,0,1,0,0,0|2,0,0]=4 1507 B9R0.5 CCCC(=O)CSCOC 62a_100000747444_100000766300 [1,0,1,0,0,0|2,0,0]=4 1508 B9R0.5 CCCC(=O)CSCOC 62a_100000766300_100000747444 [1,0,1,0,0,0|2,0,0]=4 1509 B9R0.5 CCCC(=O)CSCSC 62a_100000747444_100011218213 [1,0,1,0,0,0|2,0,0]=4 1510 B9R0.5 CCCC(=O)CSCSC 62a_100011218213_100000747444 [1,0,1,0,0,0|2,0,0]=4 1511 B9R0.5 CCCC(=O)NCCCF 11a_100015189416_100000211992 [1,0,1,0,0,0|2,0,0]=4 1512 B9R0.5 CCCC(=O)NCCCF 1626a_100015189416_100000211992 [1,0,1,0,0,0|2,0,0]=4 1513 B9R0.5 CCCC(=O)NCCCF 240690a_100015189416_100000211992 [1,0,1,0,0,0|2,0,0]=4 1514 B9R0.5 CCCC(=O)NCCCF 527a_100015189416_100000211992 [1,0,1,0,0,0|2,0,0]=4 1515 B9R0.5 CCCC(=O)NCCCO 240690a_100000182051_100000211992 [1,0,1,0,0,0|2,0,0]=4 1516 B9R0.5 CCCC(=O)NCCCO 527a_100000182051_100000211992 [1,0,1,0,0,0|2,0,0]=4 1517 B9R0.5 CCCC(=O)NCCOC 1626a_100000209980_100000211992 [1,0,1,0,0,0|2,0,0]=4 1518 B9R0.5 CCCC(=O)NCCOC 240690a_100000209980_100000211992 [1,0,1,0,0,0|2,0,0]=4 1519 B9R0.5 CCCC(=O)NCCOC 527a_100000209980_100000211992 [1,0,1,0,0,0|2,0,0]=4 1520 B9R0.5 CCCC(=O)NCCSC 11a_100020590264_100000211992 [1,0,1,0,0,0|2,0,0]=4 1521 B9R0.5 CCCC(=O)NCCSC 1626a_100020590264_100000211992 [1,0,1,0,0,0|2,0,0]=4 1522 B9R0.5 CCCC(=O)NCCSC 240690a_100020590264_100000211992 [1,0,1,0,0,0|2,0,0]=4 1523 B9R0.5 CCCC(=O)NCCSC 527a_100020590264_100000211992 [1,0,1,0,0,0|2,0,0]=4 1524 B9R0.5 CCCC(=O)OCNCC 2230a_100015525214_100000034017 [1,0,1,0,0,0|1,0,0]=3 1525 B9R0.5 CCCC(=O)OCOCC 34a_100121572206_100000034017 [1,0,1,0,0,0|1,0,0]=3 1526 B9R0.5 CCCC(=O)OCSCC 62a_100000210202_100000034017 [1,0,1,0,0,0|1,0,0]=3 1527 B9R0.5 CCCC(=O)OCSCF 62a_100015361967_100000034017 [1,0,1,0,0,0|2,0,0]=4 1528 B9R0.5 CCCC(C)COCC=O 34a_100000688023_200009817547 [1,0,1,0,0,0|2,0,0]=4 1529 B9R0.5 CCCC(C)COCC=O 7a_100000688023_200015260668 [1,0,1,0,0,0|2,0,0]=4 1530 B9R0.5 CCCC(C)CSCC=O 62a_100011216630_200015260668 [1,0,1,0,0,0|2,0,0]=4 1531 B9R0.5 CCCC(C)CSCC=O 62a_200015260668_100011216630 [1,0,1,0,0,0|2,0,0]=4 1532 B9R0.5 CCCC=CC(=O)CCC 1458a_100000212230_100000210303 [1,0,1,0,0,0|0,0,2]=4 1533 B9R0.5 CCCCCC(=O)CC#N 1458a_100000212188_100011214920 [1,0,1,0,0,0|1,0,1]=4 1534 B9R0.5 CCCCCC(=O)CC#N 1458a_100051588842_100000210326 [1,0,1,0,0,0|1,0,1]=4 1535 B9R0.5 CCCCCC(=O)CCC 1458a_100000211992_100000210326 [1,0,1,0,0,0|0,0,0]=2 1536 B9R0.5 CCCCCC(=O)CCC 1458a_100000212188_100000210303 [1,0,1,0,0,0|0,0,0]=2 1537 B9R0.5 CCCCCC(=O)CCF 1458a_100000212188_100011217306 [1,0,1,0,0,0|1,0,0]=3 1538 B9R0.5 CCCCCC(=O)CCO 1458a_100000212188_100000211926 [1,0,1,0,0,0|1,0,0]=3 1539 B9R0.5 CCCCCC(=O)CCO 1458a_100011216618_100000210326 [1,0,1,0,0,0|1,0,0]=3 1540 B9R0.5 CCCCCC(=O)CNC 2230a_106832991635_200012276598 [1,0,1,0,0,0|1,0,0]=3 1541 B9R0.5 CCCCCC(=O)CNC 34a_100102657272_200012276598 [1,0,1,0,0,0|1,0,0]=3 1542 B9R0.5 CCCCCC(=O)CNC 7a_106832991635_200012276598 [1,0,1,0,0,0|1,0,0]=3 1543 B9R0.5 CCCCCC(=O)COC 1458a_100000210968_100000210326 [1,0,1,0,0,0|1,0,0]=3 1544 B9R0.5 CCCCCC(=O)COC 34a_100138415774_200012276598 [1,0,1,0,0,0|1,0,0]=3 1545 B9R0.5 CCCCCC(=O)CSC 1458a_100000184570_100000210326 [1,0,1,0,0,0|1,0,0]=3 1546 B9R0.5 CCCCCC(=O)CSC 62a_200000210301_200012276598 [1,0,1,0,0,0|1,0,0]=3 1547 B9R0.5 CCCCCC(=O)CSC 62a_200012276598_200000210301 [1,0,1,0,0,0|1,0,0]=3 1548 B9R0.5 CCCCCC(=O)CS[13CH3] 62a_200012276598_200025704644 [1,0,1,0,0,0|1,0,0]=3 1549 B9R0.5 CCCCCC(=O)CS[13CH3] 62a_200025704644_200012276598 [1,0,1,0,0,0|1,0,0]=3 1550 B9R0.5 CCCCCC(=O)NCC 11a_100015525214_100000212188 [1,0,1,0,0,0|1,0,0]=3 1551 B9R0.5 CCCCCC(=O)NCC 240690a_100015525214_100000212188 [1,0,1,0,0,0|1,0,0]=3 1552 B9R0.5 CCCCCC(=O)NCC 527a_100015525214_100000212188 [1,0,1,0,0,0|1,0,0]=3 1553 B9R0.5 CCCCCC(=O)NNC 22a_100016993582_100000212188 [1,0,1,0,0,0|2,0,0]=4 1554 B9R0.5 CCCCCN(C)CCC 2230a_100000223495_100000210303 [1,0,1,0,0,0|2,0,0]=4 1555 B9R0.5 CCCCCN(C)CCC 2230a_100000747261_100000210326 [1,0,1,0,0,0|2,0,0]=4 1556 B9R0.5 CCCCCN(C)CCC 2230a_200000226819_200000210301 [1,0,1,0,0,0|2,0,0]=4 1557 B9R0.5 CCCCCN(C)CCC 269982a_100000223495_100000210303 [1,0,1,0,0,0|2,0,0]=4 1558 B9R0.5 CCCCCN(C)CCC 269982a_100000747261_100000210215 [1,0,1,0,0,0|2,0,0]=4 1559 B9R0.5 CCCCCN(C)CCC 269982a_200000226819_200000210301 [1,0,1,0,0,0|2,0,0]=4 1560 B9R0.5 CCCCCN([13CH3])CCC 2230a_200000226819_200025704644 [1,0,1,0,0,0|2,0,0]=4 1561 B9R0.5 CCCCCN([13CH3])CCC 269982a_200000226819_200025704644 [1,0,1,0,0,0|2,0,0]=4 1562 B9R0.5 CCCCNC(=O)CCC 11a_100000102301_100000211992 [1,0,1,0,0,0|1,0,0]=3 1563 B9R0.5 CCCCNC(=O)CCC 1626a_100000102301_100000211992 [1,0,1,0,0,0|1,0,0]=3 1564 B9R0.5 CCCCNC(=O)CCC 240690a_100000102301_100000211992 [1,0,1,0,0,0|1,0,0]=3 1565 B9R0.5 CCCCNC(=O)CCC 527a_100000102301_100000211992 [1,0,1,0,0,0|1,0,0]=3 1566 B9R0.5 CCCCNC(=O)CCO 240690a_100000102301_100011216618 [1,0,1,0,0,0|2,0,0]=4 1567 B9R0.5 CCCCNC(=O)CNC 2230a_106832991635_100000182744 [1,0,1,0,0,0|2,0,0]=4 1568 B9R0.5 CCCCNC(=O)CNC 34a_100102657272_100000182744 [1,0,1,0,0,0|2,0,0]=4 1569 B9R0.5 CCCCNC(=O)CNC 7a_106832991635_100000182744 [1,0,1,0,0,0|2,0,0]=4 1570 B9R0.5 CCCCNC(=O)COC 11a_100000102301_100000210968 [1,0,1,0,0,0|2,0,0]=4 1571 B9R0.5 CCCCNC(=O)COC 1626a_100000102301_100000210968 [1,0,1,0,0,0|2,0,0]=4 1572 B9R0.5 CCCCNC(=O)COC 240690a_100000102301_100000210968 [1,0,1,0,0,0|2,0,0]=4 1573 B9R0.5 CCCCNC(=O)COC 34a_100138415774_100000182744 [1,0,1,0,0,0|2,0,0]=4 1574 B9R0.5 CCCCNC(=O)COC 527a_100000102301_100000210968 [1,0,1,0,0,0|2,0,0]=4 1575 B9R0.5 CCCCNC(=O)CSC 11a_100000102301_100000184570 [1,0,1,0,0,0|2,0,0]=4 1576 B9R0.5 CCCCNC(=O)CSC 1626a_100000102301_100000184570 [1,0,1,0,0,0|2,0,0]=4 1577 B9R0.5 CCCCNC(=O)CSC 240690a_100000102301_100000184570 [1,0,1,0,0,0|2,0,0]=4 1578 B9R0.5 CCCCNC(=O)CSC 527a_100000102301_100000184570 [1,0,1,0,0,0|2,0,0]=4 1579 B9R0.5 CCCCNC(=O)CSC 62a_100000182744_200000210301 [1,0,1,0,0,0|2,0,0]=4 1580 B9R0.5 CCCCNC(=O)CSC 62a_200000210301_100000182744 [1,0,1,0,0,0|2,0,0]=4 1581 B9R0.5 CCCCNC(=O)CS[13CH3] 62a_100000182744_200025704644 [1,0,1,0,0,0|2,0,0]=4 1582 B9R0.5 CCCCNC(=O)CS[13CH3] 62a_200025704644_100000182744 [1,0,1,0,0,0|2,0,0]=4 1583 B9R0.5 CCCCNC(=O)NCC 2708a_100000102301_100015525214 [1,0,1,0,0,0|2,0,0]=4 1584 B9R0.5 CCCCNC(=O)NCC 2708a_100015525214_100000102301 [1,0,1,0,0,0|2,0,0]=4 1585 B9R0.5 CCCCNC(=O)NCC 273464a_100000102301_100015525214 [1,0,1,0,0,0|2,0,0]=4 1586 B9R0.5 CCCCNC(=O)NCC 273464a_100015525214_100000102301 [1,0,1,0,0,0|2,0,0]=4 1587 B9R0.5 CCCCNC(=O)NCC 512a_100000102301_100015525214 [1,0,1,0,0,0|2,0,0]=4 1588 B9R0.5 CCCCNC(=O)NCC 512a_100015525214_100000102301 [1,0,1,0,0,0|2,0,0]=4 1589 B9R0.5 CCCCOC(=O)CNC 2230a_106832991635_100000211628 [1,0,1,0,0,0|1,0,0]=3 1590 B9R0.5 CCCCOC(=O)CNC 34a_100102657272_100000211628 [1,0,1,0,0,0|1,0,0]=3 1591 B9R0.5 CCCCOC(=O)CNC 7a_106832991635_100000211628 [1,0,1,0,0,0|1,0,0]=3 1592 B9R0.5 CCCCOC(=O)COC 34a_100138415774_100000211628 [1,0,1,0,0,0|1,0,0]=3 1593 B9R0.5 CCCCOC(=O)CSC 62a_100000211628_200000210301 [1,0,1,0,0,0|1,0,0]=3 1594 B9R0.5 CCCCOC(=O)CSC 62a_200000210301_100000211628 [1,0,1,0,0,0|1,0,0]=3 1595 B9R0.5 CCCCOC(=O)CS[13CH3] 62a_100000211628_200025704644 [1,0,1,0,0,0|1,0,0]=3 1596 B9R0.5 CCCCOC(=O)CS[13CH3] 62a_200025704644_100000211628 [1,0,1,0,0,0|1,0,0]=3 1597 B9R0.5 CCCCOC(C)CCC 34a_100000210227_100000766640 [1,0,1,0,0,0|1,0,1]=4 1598 B9R0.5 CCCCOC(C)CCC 34a_100000764384_100000210210 [1,0,1,0,0,0|1,0,1]=4 1599 B9R0.5 CCCCOC(C)CCC 7a_100000210227_100000766640 [1,0,1,0,0,0|1,0,1]=4 1600 B9R0.5 CCCCOC(C)CCC 7a_100000764384_100000210211 [1,0,1,0,0,0|1,0,1]=4 1601 B9R0.5 CCCN(C)CCCC=O 2230a_100000747261_200011292268 [1,0,1,0,0,0|2,0,0]=4 1602 B9R0.5 CCCN(C)CCCC=O 269982a_100000747261_200011292268 [1,0,1,0,0,0|2,0,0]=4 1603 B9R0.5 CCCNCC(=O)NCC 2230a_100016988866_100000210303 [1,0,1,0,0,0|2,0,0]=4 1604 B9R0.5 CCCNNC(=O)CCC 22a_100000740057_100000211992 [1,0,1,0,0,0|2,0,0]=4 1605 B9R0.5 CCCOCC(=O)CCC 1458a_100000745993_100000210303 [1,0,1,0,0,0|1,0,0]=3 1606 B9R0.5 CCCOCC(=O)CCF 1458a_100000745993_100011217306 [1,0,1,0,0,0|2,0,0]=4 1607 B9R0.5 CCCOCC(=O)CCO 1458a_100000745993_100000211926 [1,0,1,0,0,0|2,0,0]=4 1608 B9R0.5 CCCOCC(=O)NCC 11a_100015525214_100000745993 [1,0,1,0,0,0|2,0,0]=4 1609 B9R0.5 CCCOCC(=O)NCC 240690a_100015525214_100000745993 [1,0,1,0,0,0|2,0,0]=4 1610 B9R0.5 CCCOCC(=O)NCC 34a_100000210258_100000183381 [1,0,1,0,0,0|2,0,0]=4 1611 B9R0.5 CCCOCC(=O)NCC 527a_100015525214_100000745993 [1,0,1,0,0,0|2,0,0]=4 1612 B9R0.5 CCCOCC(=O)OCC 34a_100000210258_100000188475 [1,0,1,0,0,0|2,0,0]=4 1613 B9R0.5 CCCSCC(=O)CCC 1458a_100000217233_100000210303 [1,0,1,0,0,0|1,0,0]=3 1614 B9R0.5 CCCSCC(=O)CCC 62a_100000210303_100000747444 [1,0,1,0,0,0|1,0,0]=3 1615 B9R0.5 CCCSCC(=O)CCC 62a_100000747444_100000210303 [1,0,1,0,0,0|1,0,0]=3 1616 B9R0.5 CCCSCC(=O)CCF 1458a_100000217233_100011217306 [1,0,1,0,0,0|2,0,0]=4 1617 B9R0.5 CCCSCC(=O)CCO 1458a_100000217233_100000211926 [1,0,1,0,0,0|2,0,0]=4 1618 B9R0.5 CCCSCC(=O)NCC 11a_100015525214_100000217233 [1,0,1,0,0,0|2,0,0]=4 1619 B9R0.5 CCCSCC(=O)NCC 240690a_100015525214_100000217233 [1,0,1,0,0,0|2,0,0]=4 1620 B9R0.5 CCCSCC(=O)NCC 527a_100015525214_100000217233 [1,0,1,0,0,0|2,0,0]=4 1621 B9R0.5 CCCSCC(=O)NCC 62a_100000183381_100000210303 [1,0,1,0,0,0|2,0,0]=4 1622 B9R0.5 CCCSCC(=O)NCC 62a_100000210303_100000183381 [1,0,1,0,0,0|2,0,0]=4 1623 B9R0.5 CCCSCC(=O)OCC 62a_100000188475_100000210303 [1,0,1,0,0,0|2,0,0]=4 1624 B9R0.5 CCCSCC(=O)OCC 62a_100000210303_100000188475 [1,0,1,0,0,0|2,0,0]=4 1625 B9R0.5 CCC[C@H](N)COCC=O 34a_100000732646_200009817547 [1,0,1,0,0,0|2,0,0]=4 1626 B9R0.5 CCNC(=O)CCCOC 11a_100015525214_100000741012 [1,0,1,0,0,0|2,0,0]=4 1627 B9R0.5 CCNC(=O)CCCOC 240690a_100015525214_100000741012 [1,0,1,0,0,0|2,0,0]=4 1628 B9R0.5 CCNC(=O)CCCOC 527a_100015525214_100000741012 [1,0,1,0,0,0|2,0,0]=4 1629 B9R0.5 CCNC(=O)CCCSC 11a_100015525214_100000173376 [1,0,1,0,0,0|2,0,0]=4 1630 B9R0.5 CCNC(=O)CCCSC 240690a_100015525214_100000173376 [1,0,1,0,0,0|2,0,0]=4 1631 B9R0.5 CCNC(=O)CCCSC 527a_100015525214_100000173376 [1,0,1,0,0,0|2,0,0]=4 1632 B9R0.5 CCNC(=O)CCOCC 11a_100015525214_100000749530 [1,0,1,0,0,0|2,0,0]=4 1633 B9R0.5 CCNC(=O)CCOCC 240690a_100015525214_100000749530 [1,0,1,0,0,0|2,0,0]=4 1634 B9R0.5 CCNC(=O)CCOCC 527a_100015525214_100000749530 [1,0,1,0,0,0|2,0,0]=4 1635 B9R0.5 CCNC(=O)CCSCC 11a_100015525214_100000230768 [1,0,1,0,0,0|2,0,0]=4 1636 B9R0.5 CCNC(=O)CCSCC 240690a_100015525214_100000230768 [1,0,1,0,0,0|2,0,0]=4 1637 B9R0.5 CCNC(=O)CCSCC 527a_100015525214_100000230768 [1,0,1,0,0,0|2,0,0]=4 1638 B9R0.5 CCNC(=O)CCSCC 62a_100000210202_100000737597 [1,0,1,0,0,0|2,0,0]=4 1639 B9R0.5 CCNC(=O)CCSCC 62a_100000737597_100000210202 [1,0,1,0,0,0|2,0,0]=4 1640 B9R0.5 CCNCCC(=O)NCC 2230a_100015525214_100000737597 [1,0,1,0,0,0|2,0,0]=4 1641 B9R0.5 CCNCCC(=O)NCC 34a_100025743525_100000210202 [1,0,1,0,0,0|2,0,0]=4 1642 B9R0.5 CCNCCC(=O)OCC 2230a_100015525214_100011206558 [1,0,1,0,0,0|2,0,0]=4 1643 B9R0.5 CCOC(=O)CCCNC 2230a_106832991635_100009991533 [1,0,1,0,0,0|2,0,0]=4 1644 B9R0.5 CCOC(=O)CCCNC 34a_100102657272_100009991533 [1,0,1,0,0,0|2,0,0]=4 1645 B9R0.5 CCOC(=O)CCCNC 7a_106832991635_100011215271 [1,0,1,0,0,0|2,0,0]=4 1646 B9R0.5 CCOC(=O)CCCOC 34a_100138415774_100009991533 [1,0,1,0,0,0|2,0,0]=4 1647 B9R0.5 CCOC(=O)CCCOC 7a_100012001163_200000210301 [1,0,1,0,0,0|2,0,0]=4 1648 B9R0.5 CCOC(=O)CCCO[13CH3] 7a_100012001163_200025704644 [1,0,1,0,0,0|2,0,0]=4 1649 B9R0.5 CCOC(=O)CCCSC 62a_100009991533_200000210301 [1,0,1,0,0,0|2,0,0]=4 1650 B9R0.5 CCOC(=O)CCCSC 62a_200000210301_100009991533 [1,0,1,0,0,0|2,0,0]=4 1651 B9R0.5 CCOC(=O)CCCS[13CH3] 62a_100009991533_200025704644 [1,0,1,0,0,0|2,0,0]=4 1652 B9R0.5 CCOC(=O)CCCS[13CH3] 62a_200025704644_100009991533 [1,0,1,0,0,0|2,0,0]=4 1653 B9R0.5 CCOC(=O)CCSCC 62a_100000210202_100000765890 [1,0,1,0,0,0|2,0,0]=4 1654 B9R0.5 CCOC(=O)CCSCC 62a_100000765890_100000210202 [1,0,1,0,0,0|2,0,0]=4 1655 B9R0.5 CCOC(=O)OCSCC 62a_100000210202_100000075025 [1,0,1,0,0,0|2,0,0]=4 1656 B9R0.5 CCOCCC(=O)CCF 1458a_100000749530_100011217306 [1,0,1,0,0,0|2,0,0]=4 1657 B9R0.5 CCOCCC(=O)CCO 1458a_100000749530_100000211926 [1,0,1,0,0,0|2,0,0]=4 1658 B9R0.5 CCOCCC(=O)CCO 1458a_100011216618_100011215890 [1,0,1,0,0,0|2,0,0]=4 1659 B9R0.5 CCOCCC(=O)COC 1458a_100000210968_100011215890 [1,0,1,0,0,0|2,0,0]=4 1660 B9R0.5 CCOCCC(=O)CSC 1458a_100000184570_100011215890 [1,0,1,0,0,0|2,0,0]=4 1661 B9R0.5 CCOCCC(=O)OCC 34a_100121572206_100000765890 [1,0,1,0,0,0|2,0,0]=4 1662 B9R0.5 CCSCCC(=O)CCF 1458a_100000230768_100011217306 [1,0,1,0,0,0|2,0,0]=4 1663 B9R0.5 CCSCCC(=O)CCO 1458a_100000230768_100000211926 [1,0,1,0,0,0|2,0,0]=4 1664 B9R0.5 CCSCCC(=O)CCO 1458a_100011216618_100000757381 [1,0,1,0,0,0|2,0,0]=4 1665 B9R0.5 CCSCCC(=O)COC 1458a_100000210968_100000757381 [1,0,1,0,0,0|2,0,0]=4 1666 B9R0.5 CCSCCC(=O)CSC 1458a_100000184570_100000757381 [1,0,1,0,0,0|2,0,0]=4 1667 B9R0.5 CNCC(=O)OCCOC 2230a_106832991635_200000040189 [1,0,1,0,0,0|2,0,0]=4 1668 B9R0.5 CNCC(=O)OCCOC 34a_100102657272_200000040189 [1,0,1,0,0,0|2,0,0]=4 1669 B9R0.5 CNCC(=O)OCCOC 7a_106832991635_200000040189 [1,0,1,0,0,0|2,0,0]=4 1670 B9R0.5 COCC(=O)CCCCF 1458a_100000210968_100000729493 [1,0,1,0,0,0|2,0,0]=4 1671 B9R0.5 COCC(=O)CCCCO 1458a_100000210968_100000210776 [1,0,1,0,0,0|2,0,0]=4 1672 B9R0.5 COCC(O)CNCC=O 2230a_100000756049_200015260668 [1,0,1,0,0,0|2,0,0]=4 1673 B9R0.5 COCC(O)CNCC=O 34a_100000756049_200009817547 [1,0,1,0,0,0|2,0,0]=4 1674 B9R0.5 COCC(O)CSCC=O 62a_100011215053_200015260668 [1,0,1,0,0,0|2,0,0]=4 1675 B9R0.5 COCC(O)CSCC=O 62a_200015260668_100011215053 [1,0,1,0,0,0|2,0,0]=4 1676 B9R0.5 COCCCC(=O)CCF 1458a_100000741012_100011217306 [1,0,1,0,0,0|2,0,0]=4 1677 B9R0.5 COCCCC(=O)CCO 1458a_100000741012_100000211926 [1,0,1,0,0,0|2,0,0]=4 1678 B9R0.5 COCCCC(=O)CCO 1458a_100011216618_100000740836 [1,0,1,0,0,0|2,0,0]=4 1679 B9R0.5 COCCCC(=O)COC 1458a_100000210968_100000740836 [1,0,1,0,0,0|2,0,0]=4 1680 B9R0.5 COCCCC(=O)CSC 1458a_100000184570_100000740836 [1,0,1,0,0,0|2,0,0]=4 1681 B9R0.5 COCCOC(=O)COC 34a_100138415774_200000040189 [1,0,1,0,0,0|2,0,0]=4 1682 B9R0.5 COCCOC(=O)CSC 62a_200000040189_200000210301 [1,0,1,0,0,0|2,0,0]=4 1683 B9R0.5 COCCOC(=O)CSC 62a_200000210301_200000040189 [1,0,1,0,0,0|2,0,0]=4 1684 B9R0.5 COCCOC(=O)CS[13CH3] 62a_200000040189_200025704644 [1,0,1,0,0,0|2,0,0]=4 1685 B9R0.5 COCCOC(=O)CS[13CH3] 62a_200025704644_200000040189 [1,0,1,0,0,0|2,0,0]=4 1686 B9R0.5 CSCC(=O)CCCCF 1458a_100000184570_100000729493 [1,0,1,0,0,0|2,0,0]=4 1687 B9R0.5 CSCC(=O)CCCCO 1458a_100000184570_100000210776 [1,0,1,0,0,0|2,0,0]=4 1688 B9R0.5 CSCCCC(=O)CCF 1458a_100000173376_100011217306 [1,0,1,0,0,0|2,0,0]=4 1689 B9R0.5 CSCCCC(=O)CCO 1458a_100000173376_100000211926 [1,0,1,0,0,0|2,0,0]=4 1690 B9R0.5 O=C(CCF)CCCCO 1458a_100000695505_100011217306 [1,0,1,0,0,0|2,0,0]=4 1691 B9R0.5 O=C(CCO)CCCCF 1458a_100011216618_100000729493 [1,0,1,0,0,0|2,0,0]=4 1692 B9R0.5 O=C(CCO)CCCCO 1458a_100000695505_100000211926 [1,0,1,0,0,0|2,0,0]=4 1693 B9R0.5 O=C(CCO)CCCCO 1458a_100011216618_100000210776 [1,0,1,0,0,0|2,0,0]=4 1694 B9R0.45 C=CCCCCCCNC 2230a_106832991635_100011215473 [1,0,1,0,0,0|2,0,0]=4 1695 B9R0.45 C=CCCCCCCNC 34a_100102657272_100011215473 [1,0,1,0,0,0|2,0,0]=4 1696 B9R0.45 C=CCCCCCCNC 7a_106832991635_100011215473 [1,0,1,0,0,0|2,0,0]=4 1697 B9R0.45 C=CCCCCCCOC 34a_100138415774_100011215473 [1,0,1,0,0,0|2,0,0]=4 1698 B9R0.45 C=CCCCCCCOC 34a_200011216477_200000210301 [1,0,1,0,0,0|2,0,0]=4 1699 B9R0.45 C=CCCCCCCOC 7a_200011216477_200000210301 [1,0,1,0,0,0|2,0,0]=4 1700 B9R0.45 C=CCCCCCCO[13CH3] 34a_200011216477_200025704644 [1,0,1,0,0,0|2,0,0]=4 1701 B9R0.45 C=CCCCCCCO[13CH3] 7a_200011216477_200025704644 [1,0,1,0,0,0|2,0,0]=4 1702 B9R0.45 C=CCCCCCCSC 62a_100011215473_200000210301 [1,0,1,0,0,0|2,0,0]=4 1703 B9R0.45 C=CCCCCCCSC 62a_200000210301_100011215473 [1,0,1,0,0,0|2,0,0]=4 1704 B9R0.45 C=CCCCCCCS[13CH3] 62a_100011215473_200025704644 [1,0,1,0,0,0|2,0,0]=4 1705 B9R0.45 C=CCCCCCCS[13CH3] 62a_200025704644_100011215473 [1,0,1,0,0,0|2,0,0]=4 1706 B9R0.45 C=CCCCCCNCC 2230a_100015525214_100000700193 [1,0,1,0,0,0|2,0,0]=4 1707 B9R0.45 C=CCCCCCOCC 34a_100011216702_100000210202 [1,0,1,0,0,0|2,0,0]=4 1708 B9R0.45 C=CCCCCCOCC 34a_100121572206_100000700193 [1,0,1,0,0,0|2,0,0]=4 1709 B9R0.45 C=CCCCCCOCC 7a_100011216702_100000210202 [1,0,1,0,0,0|2,0,0]=4 1710 B9R0.45 C=CCCCCCSCC 62a_100000210202_100000700193 [1,0,1,0,0,0|2,0,0]=4 1711 B9R0.45 C=CCCCCCSCC 62a_100000700193_100000210202 [1,0,1,0,0,0|2,0,0]=4 1712 B9R0.45 C=CCCCCNCCC 2230a_100000703577_100000210303 [1,0,1,0,0,0|2,0,0]=4 1713 B9R0.45 C=CCCCCNCCC 34a_100000703577_100000210303 [1,0,1,0,0,0|2,0,0]=4 1714 B9R0.45 C=CCCCCOCCC 34a_100000210258_100011215482 [1,0,1,0,0,0|2,0,0]=4 1715 B9R0.45 C=CCCCCOCCC 34a_100000766645_100000210303 [1,0,1,0,0,0|2,0,0]=4 1716 B9R0.45 C=CCCCCOCCC 7a_100000766645_100000210303 [1,0,1,0,0,0|2,0,0]=4 1717 B9R0.45 C=CCCCCSCCC 62a_100000210303_100011215482 [1,0,1,0,0,0|2,0,0]=4 1718 B9R0.45 C=CCCCCSCCC 62a_100011215482_100000210303 [1,0,1,0,0,0|2,0,0]=4 1719 B9R0.45 C=CCCCNCCCC 2230a_100000102301_100011713584 [1,0,1,0,0,0|2,0,0]=4 1720 B9R0.45 C=CCCCNCCCC 2230a_100000700776_100000210211 [1,0,1,0,0,0|2,0,0]=4 1721 B9R0.45 C=CCCCNCCCC 34a_100000700776_100000210210 [1,0,1,0,0,0|2,0,0]=4 1722 B9R0.45 C=CCCCNCCCC 7a_106832991798_100000757094 [1,0,1,0,0,0|2,0,0]=4 1723 B9R0.45 C=CCCCOCCCC 34a_100000210227_100000757094 [1,0,1,0,0,0|2,0,0]=4 1724 B9R0.45 C=CCCCOCCCC 34a_100000758997_100000210210 [1,0,1,0,0,0|2,0,0]=4 1725 B9R0.45 C=CCCCOCCCC 7a_100000210227_100000757094 [1,0,1,0,0,0|2,0,0]=4 1726 B9R0.45 C=CCCCOCCCC 7a_100000758997_100000210211 [1,0,1,0,0,0|2,0,0]=4 1727 B9R0.45 C=CCCCSCCCC 62a_100000210211_100000757094 [1,0,1,0,0,0|2,0,0]=4 1728 B9R0.45 C=CCCCSCCCC 62a_100011713584_100000210210 [1,0,1,0,0,0|2,0,0]=4 1729 B9R0.45 C=CCCNCCCCC 2230a_100000209983_100000754431 [1,0,1,0,0,0|2,0,0]=4 1730 B9R0.45 C=CCCNCCCCC 2230a_100015191253_100000210326 [1,0,1,0,0,0|2,0,0]=4 1731 B9R0.45 C=CCCOCCCCC 34a_100000210253_100000754431 [1,0,1,0,0,0|2,0,0]=4 1732 B9R0.45 C=CCCOCCCCC 34a_100011205117_100000718602 [1,0,1,0,0,0|2,0,0]=4 1733 B9R0.45 C=CCCOCCCCC 7a_100000210253_100000754431 [1,0,1,0,0,0|2,0,0]=4 1734 B9R0.45 C=CCCSCCCCC 62a_100000210326_100000754431 [1,0,1,0,0,0|2,0,0]=4 1735 B9R0.45 C=CCCSCCCCC 62a_100000754431_100000210326 [1,0,1,0,0,0|2,0,0]=4 1736 B9R0.45 C=CCNCCCCCC 2230a_100000210581_100000210623 [1,0,1,0,0,0|2,0,0]=4 1737 B9R0.45 C=CCNCCCCCC 2230a_100020586998_100000210314 [1,0,1,0,0,0|2,0,0]=4 1738 B9R0.45 C=CCOCCCCCC 34a_100000210259_100015514636 [1,0,1,0,0,0|2,0,0]=4 1739 B9R0.45 C=CCOCCCCCC 34a_200000210373_100000210314 [1,0,1,0,0,0|2,0,0]=4 1740 B9R0.45 C=CCOCCCCCC 7a_100000210259_100015514636 [1,0,1,0,0,0|2,0,0]=4 1741 B9R0.45 C=CCSCCCCCC 62a_100000210314_100000210623 [1,0,1,0,0,0|2,0,0]=4 1742 B9R0.45 C=CCSCCCCCC 62a_100000210623_100000210757 [1,0,1,0,0,0|2,0,0]=4 1743 B9R0.45 CCC/C=C/COCCC 34a_100016278788_100000210303 [1,0,1,0,0,0|2,0,0]=4 1744 B9R0.45 CCC/C=C/COCCC 7a_100016278788_100000210303 [1,0,1,0,0,0|2,0,0]=4 1745 B9R0.45 CCCC=NNCCCC 4a_100025702795_100000185831 [1,0,1,0,0,0|2,0,0]=4 1746 B9R0.45 CCCCC/C=C/COC 34a_100016258190_200000210301 [1,0,1,0,0,0|2,0,0]=4 1747 B9R0.45 CCCCC/C=C/COC 7a_100016258190_200000210301 [1,0,1,0,0,0|2,0,0]=4 1748 B9R0.45 CCCCC/C=C/CO[13CH3] 34a_100016258190_200025704644 [1,0,1,0,0,0|2,0,0]=4 1749 B9R0.45 CCCCC/C=C/CO[13CH3] 7a_100016258190_200025704644 [1,0,1,0,0,0|2,0,0]=4 1750 B9R0.45 CCCCCCCCNC 2230a_100000229939_200000210301 [1,0,1,0,0,0|2,0,0]=4 1751 B9R0.45 CCCCCCCCNC 2230a_106832991635_100000210759 [1,0,1,0,0,0|2,0,0]=4 1752 B9R0.45 CCCCCCCCNC 34a_100000229939_200000210301 [1,0,1,0,0,0|2,0,0]=4 1753 B9R0.45 CCCCCCCCNC 34a_100102657272_100000210759 [1,0,1,0,0,0|2,0,0]=4 1754 B9R0.45 CCCCCCCCNC 7a_106832991635_100000210759 [1,0,1,0,0,0|2,0,0]=4 1755 B9R0.45 CCCCCCCCN[13CH3] 2230a_100000229939_200025704644 [1,0,1,0,0,0|2,0,0]=4 1756 B9R0.45 CCCCCCCCN[13CH3] 34a_100000229939_200025704644 [1,0,1,0,0,0|2,0,0]=4 1757 B9R0.45 CCCCCCCCOC 34a_100000210232_200000210301 [1,0,1,0,0,0|2,0,0]=4 1758 B9R0.45 CCCCCCCCOC 34a_100138415774_100000210759 [1,0,1,0,0,0|2,0,0]=4 1759 B9R0.45 CCCCCCCCOC 7a_100000210232_200000210301 [1,0,1,0,0,0|2,0,0]=4 1760 B9R0.45 CCCCCCCCO[13CH3] 34a_100000210232_200025704644 [1,0,1,0,0,0|2,0,0]=4 1761 B9R0.45 CCCCCCCCO[13CH3] 7a_100000210232_200025704644 [1,0,1,0,0,0|2,0,0]=4 1762 B9R0.45 CCCCCCCCSC 62a_100000210759_200000210301 [1,0,1,0,0,0|2,0,0]=4 1763 B9R0.45 CCCCCCCCSC 62a_200000210301_100000210317 [1,0,1,0,0,0|2,0,0]=4 1764 B9R0.45 CCCCCCCCS[13CH3] 62a_100000210759_200025704644 [1,0,1,0,0,0|2,0,0]=4 1765 B9R0.45 CCCCCCCCS[13CH3] 62a_200025704644_100000210317 [1,0,1,0,0,0|2,0,0]=4 1766 B9R0.45 CCCCCCNCC=O 2230a_100000210581_200015260668 [1,0,1,0,0,0|1,0,0]=3 1767 B9R0.45 CCCCCCNCCC 2230a_100000210581_100000210303 [1,0,1,0,0,0|2,0,0]=4 1768 B9R0.45 CCCCCCNCCO 2230a_100000210581_100000211926 [1,0,1,0,0,0|1,0,1]=4 1769 B9R0.45 CCCCCCNCCO 2230a_100016997473_100000210314 [1,0,1,0,0,0|1,0,1]=4 1770 B9R0.45 CCCCCCNCCO 34a_100016990907_100000210314 [1,0,1,0,0,0|1,0,1]=4 1771 B9R0.45 CCCCCCOCC=O 34a_100000210259_200009817547 [1,0,1,0,0,0|1,0,0]=3 1772 B9R0.45 CCCCCCOCC=O 7a_100000210259_200015260668 [1,0,1,0,0,0|1,0,0]=3 1773 B9R0.45 CCCCCCOCCC 34a_100000210258_100000210314 [1,0,1,0,0,0|2,0,0]=4 1774 B9R0.45 CCCCCCOCCC 34a_100000210259_100000210303 [1,0,1,0,0,0|2,0,0]=4 1775 B9R0.45 CCCCCCOCCC 7a_100000210259_100000210303 [1,0,1,0,0,0|2,0,0]=4 1776 B9R0.45 CCCCCCOCCO 34a_100000210259_100000211926 [1,0,1,0,0,0|1,0,1]=4 1777 B9R0.45 CCCCCCOCCO 7a_100000210259_100000211926 [1,0,1,0,0,0|1,0,1]=4 1778 B9R0.45 CCCCCCSCC=O 62a_100000210314_200015260668 [1,0,1,0,0,0|1,0,0]=3 1779 B9R0.45 CCCCCCSCC=O 62a_200015260668_100000210757 [1,0,1,0,0,0|1,0,0]=3 1780 B9R0.45 CCCCCCSCCC 62a_100000210303_100000210757 [1,0,1,0,0,0|2,0,0]=4 1781 B9R0.45 CCCCCCSCCC 62a_100000210314_100000210303 [1,0,1,0,0,0|2,0,0]=4 1782 B9R0.45 CCCCCCSCCO 62a_100000210314_100000211926 [1,0,1,0,0,0|1,0,1]=4 1783 B9R0.45 CCCCCCSCCO 62a_100000211926_100000210757 [1,0,1,0,0,0|1,0,1]=4 1784 B9R0.45 CCCCCNCCCC 2230a_100000102301_100000210326 [1,0,1,0,0,0|1,0,1]=4 1785 B9R0.45 CCCCCNCCCC 2230a_100000209983_100000210211 [1,0,1,0,0,0|1,0,1]=4 1786 B9R0.45 CCCCCNCCCC 7a_106832991798_100000210326 [1,0,1,0,0,0|1,0,1]=4 1787 B9R0.45 CCCCCNCCCO 2230a_100000209983_100000230001 [1,0,1,0,0,0|1,0,1]=4 1788 B9R0.45 CCCCCOCCCBr 34a_100011217188_100000718602 [1,0,1,0,0,0|1,0,1]=4 1789 B9R0.45 CCCCCOCCCC 34a_100000210227_100000718602 [1,0,1,0,0,0|0,0,1]=3 1790 B9R0.45 CCCCCOCCCC 34a_100000210253_100000210210 [1,0,1,0,0,0|0,0,1]=3 1791 B9R0.45 CCCCCOCCCC 7a_100000210227_100000210326 [1,0,1,0,0,0|0,0,1]=3 1792 B9R0.45 CCCCCOCCCC 7a_100000210253_100000210211 [1,0,1,0,0,0|0,0,1]=3 1793 B9R0.45 CCCCCOCCCCl 34a_100000230001_100000718602 [1,0,1,0,0,0|1,0,1]=4 1794 B9R0.45 CCCCCOCCCF 34a_100000210253_100011934791 [1,0,1,0,0,0|1,0,1]=4 1795 B9R0.45 CCCCCOCCCF 34a_100000759539_100000718602 [1,0,1,0,0,0|1,0,1]=4 1796 B9R0.45 CCCCCOCCCF 7a_100000210253_100011934791 [1,0,1,0,0,0|1,0,1]=4 1797 B9R0.45 CCCCCOCCCN 34a_100000182051_100000718602 [1,0,1,0,0,0|1,0,1]=4 1798 B9R0.45 CCCCCOCCCO 34a_100000210253_100000230001 [1,0,1,0,0,0|1,0,1]=4 1799 B9R0.45 CCCCCOCCCO 7a_100000210253_100011215043 [1,0,1,0,0,0|1,0,1]=4 1800 B9R0.45 CCCCCOCCOC 34a_100000210237_100000718602 [1,0,1,0,0,0|1,0,1]=4 1801 B9R0.45 CCCCCOCCOC 34a_100000210253_100011201679 [1,0,1,0,0,0|1,0,1]=4 1802 B9R0.45 CCCCCOCCOC 34a_100011215259_200000210301 [1,0,1,0,0,0|1,0,1]=4 1803 B9R0.45 CCCCCOCCOC 7a_100000210253_100000233755 [1,0,1,0,0,0|1,0,1]=4 1804 B9R0.45 CCCCCOCCOC 7a_100011215259_200000210301 [1,0,1,0,0,0|1,0,1]=4 1805 B9R0.45 CCCCCOCCO[13CH3] 34a_100011215259_200025704644 [1,0,1,0,0,0|1,0,1]=4 1806 B9R0.45 CCCCCOCCO[13CH3] 7a_100011215259_200025704644 [1,0,1,0,0,0|1,0,1]=4 1807 B9R0.45 CCCCCOCCSC 34a_100000210253_100000212216 [1,0,1,0,0,0|1,0,1]=4 1808 B9R0.45 CCCCCOCCSC 34a_100000230434_100000718602 [1,0,1,0,0,0|1,0,1]=4 1809 B9R0.45 CCCCCOCCSC 7a_100000210253_100000212216 [1,0,1,0,0,0|1,0,1]=4 1810 B9R0.45 CCCCCOCCSC 7a_100000230434_100000210326 [1,0,1,0,0,0|1,0,1]=4 1811 B9R0.45 CCCCCSCCCC 62a_100000210211_100000210326 [1,0,1,0,0,0|0,1,1]=4 1812 B9R0.45 CCCCCSCCCC 62a_100000210326_100000210210 [1,0,1,0,0,0|0,1,1]=4 1813 B9R0.45 CCCCCSCCCO 62a_100000210326_100011215043 [1,0,1,0,0,0|1,0,1]=4 1814 B9R0.45 CCCCCSCCCO 62a_100011215043_100000210326 [1,0,1,0,0,0|1,0,1]=4 1815 B9R0.45 CCCCNCCCC=O 2230a_100000102301_200011292268 [1,0,1,0,0,0|1,0,0]=3 1816 B9R0.45 CCCCNCCCC=O 7a_106832991798_200011292268 [1,0,1,0,0,0|1,0,0]=3 1817 B9R0.45 CCCCNCCCCO 2230a_100000102301_100000210776 [1,0,1,0,0,0|1,0,1]=4 1818 B9R0.45 CCCCNCCCCO 2230a_100000750430_100000210211 [1,0,1,0,0,0|1,0,1]=4 1819 B9R0.45 CCCCNCCCCO 34a_100000750430_100000210210 [1,0,1,0,0,0|1,0,1]=4 1820 B9R0.45 CCCCNCCCCO 7a_106832991798_100000210776 [1,0,1,0,0,0|1,0,1]=4 1821 B9R0.45 CCCCOCCCC=O 7a_100000210227_200011292268 [1,0,1,0,0,0|1,0,0]=3 1822 B9R0.45 CCCCOCCCCBr 34a_100011216708_100000210210 [1,0,1,0,0,0|1,0,1]=4 1823 B9R0.45 CCCCOCCCCCl 34a_100000210776_100000210210 [1,0,1,0,0,0|1,0,1]=4 1824 B9R0.45 CCCCOCCCCCl 7a_100000210776_100000210211 [1,0,1,0,0,0|1,0,1]=4 1825 B9R0.45 CCCCOCCCCF 34a_100000210227_100000729493 [1,0,1,0,0,0|1,0,1]=4 1826 B9R0.45 CCCCOCCCCF 34a_100011995726_100000210210 [1,0,1,0,0,0|1,0,1]=4 1827 B9R0.45 CCCCOCCCCF 7a_100000210227_100000729493 [1,0,1,0,0,0|1,0,1]=4 1828 B9R0.45 CCCCOCCCCF 7a_100011995726_100000210211 [1,0,1,0,0,0|1,0,1]=4 1829 B9R0.45 CCCCOCCCCI 34a_200012148704_100000210210 [1,0,1,0,0,0|1,0,1]=4 1830 B9R0.45 CCCCOCCCCN 34a_100000750430_100000210210 [1,0,1,0,0,0|1,0,1]=4 1831 B9R0.45 CCCCOCCCCO 34a_100000210227_100011216708 [1,0,1,0,0,0|1,0,1]=4 1832 B9R0.45 CCCCOCCCCO 7a_100000210227_100000210776 [1,0,1,0,0,0|1,0,1]=4 1833 B9R0.45 CCCCOCCCNC 2230a_200000211371_200000210301 [1,0,1,0,0,0|1,0,1]=4 1834 B9R0.45 CCCCOCCCNC 34a_100000213112_100000210210 [1,0,1,0,0,0|1,0,1]=4 1835 B9R0.45 CCCCOCCCNC 34a_200000211371_200000210301 [1,0,1,0,0,0|1,0,1]=4 1836 B9R0.45 CCCCOCCCN[13CH3] 2230a_200000211371_200025704644 [1,0,1,0,0,0|1,0,1]=4 1837 B9R0.45 CCCCOCCCN[13CH3] 34a_200000211371_200025704644 [1,0,1,0,0,0|1,0,1]=4 1838 B9R0.45 CCCCOCCCOC 34a_100000210227_100000740836 [1,0,1,0,0,0|1,0,1]=4 1839 B9R0.45 CCCCOCCCOC 34a_100000740835_100000210210 [1,0,1,0,0,0|1,0,1]=4 1840 B9R0.45 CCCCOCCCOC 34a_200011215613_200000210301 [1,0,1,0,0,0|1,0,1]=4 1841 B9R0.45 CCCCOCCCOC 7a_100000210227_100000740836 [1,0,1,0,0,0|1,0,1]=4 1842 B9R0.45 CCCCOCCCOC 7a_200011215613_200000210301 [1,0,1,0,0,0|1,0,1]=4 1843 B9R0.45 CCCCOCCCO[13CH3] 34a_200011215613_200025704644 [1,0,1,0,0,0|1,0,1]=4 1844 B9R0.45 CCCCOCCCO[13CH3] 7a_200011215613_200025704644 [1,0,1,0,0,0|1,0,1]=4 1845 B9R0.45 CCCCOCCCSC 34a_100000690336_100000210210 [1,0,1,0,0,0|1,0,1]=4 1846 B9R0.45 CCCCOCCCSC 7a_100000690336_100000210211 [1,0,1,0,0,0|1,0,1]=4 1847 B9R0.45 CCCCOCCNCC 2230a_100015525214_100000743108 [1,0,1,0,0,0|1,0,1]=4 1848 B9R0.45 CCCCOCCOCC 34a_100000210136_100000210210 [1,0,1,0,0,0|1,0,1]=4 1849 B9R0.45 CCCCOCCOCC 34a_100000210227_100000210147 [1,0,1,0,0,0|1,0,1]=4 1850 B9R0.45 CCCCOCCOCC 34a_100000210238_100000210202 [1,0,1,0,0,0|1,0,1]=4 1851 B9R0.45 CCCCOCCOCC 34a_100121572206_100000743108 [1,0,1,0,0,0|1,0,1]=4 1852 B9R0.45 CCCCOCCOCC 7a_100000210136_100000210211 [1,0,1,0,0,0|1,0,1]=4 1853 B9R0.45 CCCCOCCOCC 7a_100000210227_100011215890 [1,0,1,0,0,0|1,0,1]=4 1854 B9R0.45 CCCCOCCOCC 7a_100000210238_100000210202 [1,0,1,0,0,0|1,0,1]=4 1855 B9R0.45 CCCCOCCSCC 34a_100000210227_100000757381 [1,0,1,0,0,0|1,0,1]=4 1856 B9R0.45 CCCCOCCSCC 34a_100000212035_100000210210 [1,0,1,0,0,0|1,0,1]=4 1857 B9R0.45 CCCCOCCSCC 62a_100000210202_100000743108 [1,0,1,0,0,0|1,0,1]=4 1858 B9R0.45 CCCCOCCSCC 62a_100000743108_100000210202 [1,0,1,0,0,0|1,0,1]=4 1859 B9R0.45 CCCCOCCSCC 7a_100000210227_100000757381 [1,0,1,0,0,0|1,0,1]=4 1860 B9R0.45 CCCCOCCSCC 7a_100000212035_100000210211 [1,0,1,0,0,0|1,0,1]=4 1861 B9R0.45 CCCCOCOCCC 34a_100000210258_100011995733 [1,0,1,0,0,0|1,0,1]=4 1862 B9R0.45 CCCCOCSCC=O 62a_100011995733_200015260668 [1,0,1,0,0,0|2,0,0]=4 1863 B9R0.45 CCCCOCSCC=O 62a_200015260668_100011995733 [1,0,1,0,0,0|2,0,0]=4 1864 B9R0.45 CCCCOCSCCC 62a_100000210303_100011995733 [1,0,1,0,0,0|1,0,1]=4 1865 B9R0.45 CCCCOCSCCC 62a_100011995733_100000210303 [1,0,1,0,0,0|1,0,1]=4 1866 B9R0.45 CCCCSCCCC=O 62a_100000210211_200011292268 [1,0,1,0,0,0|1,0,0]=3 1867 B9R0.45 CCCCSCCCC=O 62a_200011292268_100000210210 [1,0,1,0,0,0|1,0,0]=3 1868 B9R0.45 CCCCSCCCCO 62a_100000210211_100000210776 [1,0,1,0,0,0|1,0,1]=4 1869 B9R0.45 CCCCSCCCCO 62a_100000210776_100000210210 [1,0,1,0,0,0|1,0,1]=4 1870 B9R0.45 CCCNCCCCCO 2230a_100000762737_100000210303 [1,0,1,0,0,0|1,0,1]=4 1871 B9R0.45 CCCNCCCCCO 34a_100000762737_100000210303 [1,0,1,0,0,0|1,0,1]=4 1872 B9R0.45 CCCOCCCCCO 34a_100000210258_100000746330 [1,0,1,0,0,0|1,0,1]=4 1873 B9R0.45 CCCOCCNCC=O 2230a_100161115042_200015260668 [1,0,1,0,0,0|2,0,0]=4 1874 B9R0.45 CCCOCCNCC=O 34a_100161115042_200009817547 [1,0,1,0,0,0|2,0,0]=4 1875 B9R0.45 CCCOCCOCC=O 34a_100000752267_200009817547 [1,0,1,0,0,0|2,0,0]=4 1876 B9R0.45 CCCOCCOCC=O 7a_100000752267_200015260668 [1,0,1,0,0,0|2,0,0]=4 1877 B9R0.45 CCCOCCSCC=O 62a_100011215938_200015260668 [1,0,1,0,0,0|2,0,0]=4 1878 B9R0.45 CCCOCCSCC=O 62a_200015260668_100011215938 [1,0,1,0,0,0|2,0,0]=4 1879 B9R0.45 CCCSCCCCC=O 62a_100000139335_100000210303 [1,0,1,0,0,0|1,0,0]=3 1880 B9R0.45 CCCSCCCCC=O 62a_100000210303_100000139335 [1,0,1,0,0,0|1,0,0]=3 1881 B9R0.45 CCCSCCCCCO 62a_100000210303_100000746330 [1,0,1,0,0,0|1,0,1]=4 1882 B9R0.45 CCCSCCCCCO 62a_100000746330_100000210303 [1,0,1,0,0,0|1,0,1]=4 1883 B9R0.45 CCCSCCNCC=O 2230a_100020603323_200015260668 [1,0,1,0,0,0|2,0,0]=4 1884 B9R0.45 CCCSCCOCC=O 34a_200000230433_200009817547 [1,0,1,0,0,0|2,0,0]=4 1885 B9R0.45 CCCSCCOCC=O 7a_200000230433_200015260668 [1,0,1,0,0,0|2,0,0]=4 1886 B9R0.45 CCNCCCCCC=O 2230a_100015525214_100000139337 [1,0,1,0,0,0|1,0,0]=3 1887 B9R0.45 CCNCCCCCCO 2230a_100000686447_100000210202 [1,0,1,0,0,0|1,0,1]=4 1888 B9R0.45 CCNCCCCCCO 2230a_100015525214_100000766143 [1,0,1,0,0,0|1,0,1]=4 1889 B9R0.45 CCNCCCCCCO 34a_100000686447_100000210202 [1,0,1,0,0,0|1,0,1]=4 1890 B9R0.45 CCOCCCCCCO 34a_100121572206_100000766143 [1,0,1,0,0,0|1,0,1]=4 1891 B9R0.45 CCOCCCNCC=O 2230a_100000210961_200015260668 [1,0,1,0,0,0|2,0,0]=4 1892 B9R0.45 CCOCCCNCC=O 34a_100000210961_200009817547 [1,0,1,0,0,0|2,0,0]=4 1893 B9R0.45 CCOCCCOCC=O 34a_100000757476_200009817547 [1,0,1,0,0,0|2,0,0]=4 1894 B9R0.45 CCOCCCOCC=O 7a_100000757476_200015260668 [1,0,1,0,0,0|2,0,0]=4 1895 B9R0.45 CCOCCCSCC=O 62a_100012232248_200015260668 [1,0,1,0,0,0|2,0,0]=4 1896 B9R0.45 CCOCCCSCC=O 62a_200015260668_100012232248 [1,0,1,0,0,0|2,0,0]=4 1897 B9R0.45 CCOCSCCCC=O 62a_100000739092_200011292268 [1,0,1,0,0,0|2,0,0]=4 1898 B9R0.45 CCOCSCCCC=O 62a_200011292268_100000739092 [1,0,1,0,0,0|2,0,0]=4 1899 B9R0.45 CCSCCCCCC=O 62a_100000139337_100000210202 [1,0,1,0,0,0|1,0,0]=3 1900 B9R0.45 CCSCCCCCC=O 62a_100000210202_100000139337 [1,0,1,0,0,0|1,0,0]=3 1901 B9R0.45 CCSCCCCCCO 62a_100000210202_100000766143 [1,0,1,0,0,0|1,0,1]=4 1902 B9R0.45 CCSCCCCCCO 62a_100000766143_100000210202 [1,0,1,0,0,0|1,0,1]=4 1903 B9R0.45 CCSCCCOCC=O 34a_100011216438_200009817547 [1,0,1,0,0,0|2,0,0]=4 1904 B9R0.45 CCSCCCOCC=O 7a_100011216438_200015260668 [1,0,1,0,0,0|2,0,0]=4 1905 B9R0.45 CNCCCCCCCO 2230a_100011996573_200000210301 [1,0,1,0,0,0|1,0,1]=4 1906 B9R0.45 CNCCCCCCCO 2230a_106832991635_100000760002 [1,0,1,0,0,0|1,0,1]=4 1907 B9R0.45 CNCCCCCCCO 34a_100011996573_200000210301 [1,0,1,0,0,0|1,0,1]=4 1908 B9R0.45 CNCCCCCCCO 34a_100102657272_100000760002 [1,0,1,0,0,0|1,0,1]=4 1909 B9R0.45 CNCCCCCCCO 7a_106832991635_100000760002 [1,0,1,0,0,0|1,0,1]=4 1910 B9R0.45 COCCCCCCCO 34a_100138415774_100000760002 [1,0,1,0,0,0|1,0,1]=4 1911 B9R0.45 COCCCCOCC=O 34a_100000740925_200009817547 [1,0,1,0,0,0|2,0,0]=4 1912 B9R0.45 COCCCCSCC=O 62a_100000730899_200015260668 [1,0,1,0,0,0|2,0,0]=4 1913 B9R0.45 COCCCCSCC=O 62a_200015260668_100000730899 [1,0,1,0,0,0|2,0,0]=4 1914 B9R0.45 COCCNCCCC=O 2230a_100000209980_200011292268 [1,0,1,0,0,0|2,0,0]=4 1915 B9R0.45 COCCSCCCC=O 62a_100000233755_200011292268 [1,0,1,0,0,0|2,0,0]=4 1916 B9R0.45 COCCSCCCC=O 62a_200011292268_100000233755 [1,0,1,0,0,0|2,0,0]=4 1917 B9R0.45 COCSCCCCC=O 62a_100000139335_100000766300 [1,0,1,0,0,0|2,0,0]=4 1918 B9R0.45 COCSCCCCC=O 62a_100000766300_100000139335 [1,0,1,0,0,0|2,0,0]=4 1919 B9R0.45 CSCCCCCCCO 62a_100000760002_200000210301 [1,0,1,0,0,0|1,0,1]=4 1920 B9R0.45 CSCCCCCCCO 62a_200000210301_100000760002 [1,0,1,0,0,0|1,0,1]=4 1921 B9R0.45 CSCCCCOCC=O 34a_100011217163_200009817547 [1,0,1,0,0,0|2,0,0]=4 1922 B9R0.45 CSCCCCOCC=O 7a_100011217163_200015260668 [1,0,1,0,0,0|2,0,0]=4 1923 B9R0.45 CSCCNCCCC=O 2230a_100020590264_200011292268 [1,0,1,0,0,0|2,0,0]=4 1924 B9R0.45 CSCCOCCCC=O 7a_100000230434_200011292268 [1,0,1,0,0,0|2,0,0]=4 1925 B9R0.45 CSCCSCCCC=O 62a_100000212216_200011292268 [1,0,1,0,0,0|2,0,0]=4 1926 B9R0.45 CSCCSCCCC=O 62a_200011292268_100000751147 [1,0,1,0,0,0|2,0,0]=4 1927 B9R0.45 CSCSCCCCC=O 62a_100000139335_100011218213 [1,0,1,0,0,0|2,0,0]=4 1928 B9R0.45 CSCSCCCCC=O 62a_100011218213_100000139335 [1,0,1,0,0,0|2,0,0]=4 1929 B9R0.45 NCCCCCOCC=O 34a_100000762737_200009817547 [1,0,1,0,0,0|2,0,0]=4 1930 B9R0.45 O=CCCCCCSCF 62a_100000139337_100015361967 [1,0,1,0,0,0|2,0,0]=4 1931 B9R0.45 O=CCCCCCSCF 62a_100015361967_100000139337 [1,0,1,0,0,0|2,0,0]=4 1932 B9R0.45 O=CCCCCNCCO 2230a_100016997473_100000139335 [1,0,1,0,0,0|2,0,0]=4 1933 B9R0.45 O=CCCCCSCCF 62a_100000139335_100011217306 [1,0,1,0,0,0|2,0,0]=4 1934 B9R0.45 O=CCCCCSCCF 62a_100011217306_100000139335 [1,0,1,0,0,0|2,0,0]=4 1935 B9R0.45 O=CCCCCSCCO 62a_100000139335_100000211926 [1,0,1,0,0,0|2,0,0]=4 1936 B9R0.45 O=CCCCCSCCO 62a_100000211926_100000139335 [1,0,1,0,0,0|2,0,0]=4 1937 B9R0.45 O=CCCCNCCCF 2230a_100015189416_200011292268 [1,0,1,0,0,0|2,0,0]=4 1938 B9R0.45 O=CCCCSCCCF 62a_100011934791_200011292268 [1,0,1,0,0,0|2,0,0]=4 1939 B9R0.45 O=CCCCSCCCF 62a_200011292268_100011934791 [1,0,1,0,0,0|2,0,0]=4 1940 B9R0.45 O=CCCCSCCCO 62a_100011215043_200011292268 [1,0,1,0,0,0|2,0,0]=4 1941 B9R0.45 O=CCCCSCCCO 62a_200011292268_100011215043 [1,0,1,0,0,0|2,0,0]=4 1942 B9R0.45 O=CCNCCCCCO 2230a_100000762737_200015260668 [1,0,1,0,0,0|2,0,0]=4 1943 B9R0.45 O=CCNCCCCCO 34a_100000762737_200009817547 [1,0,1,0,0,0|2,0,0]=4 1944 B9R0.45 O=CCOCCCCCBr 34a_100000746331_200009817547 [1,0,1,0,0,0|2,0,0]=4 1945 B9R0.45 O=CCOCCCCCBr 7a_100000746331_200015260668 [1,0,1,0,0,0|2,0,0]=4 1946 B9R0.45 O=CCOCCCCCCl 34a_100000746330_200009817547 [1,0,1,0,0,0|2,0,0]=4 1947 B9R0.45 O=CCOCCCCCCl 7a_100000746330_200015260668 [1,0,1,0,0,0|2,0,0]=4 1948 B9R0.45 O=CCOCCCCCI 34a_200012148887_200009817547 [1,0,1,0,0,0|2,0,0]=4 1949 B9R0.45 O=CCOCCCCCI 7a_200012148887_200015260668 [1,0,1,0,0,0|2,0,0]=4 1950 B9R0.45 O=CCSCCCCCF 62a_100000729378_200015260668 [1,0,1,0,0,0|2,0,0]=4 1951 B9R0.45 O=CCSCCCCCF 62a_200015260668_100000729378 [1,0,1,0,0,0|2,0,0]=4 1952 B9R0.45 O=CCSCCCCCO 62a_100000746330_200015260668 [1,0,1,0,0,0|2,0,0]=4 1953 B9R0.45 O=CCSCCCCCO 62a_200015260668_100000746330 [1,0,1,0,0,0|2,0,0]=4 1954 B9R0.45 [13CH3]NCCCCCCCO 2230a_100011996573_200025704644 [1,0,1,0,0,0|1,0,1]=4 1955 B9R0.45 [13CH3]NCCCCCCCO 34a_100011996573_200025704644 [1,0,1,0,0,0|1,0,1]=4 1956 B9R0.45 [13CH3]SCCCCCCCO 62a_100000760002_200025704644 [1,0,1,0,0,0|1,0,1]=4 1957 B9R0.45 [13CH3]SCCCCCCCO 62a_200025704644_100000760002 [1,0,1,0,0,0|1,0,1]=4 1958 B9R0.46 CCC(=O)CCCCCF 1458a_100000210414_100000729378 [1,0,1,0,0,0|2,0,0]=4 1959 B9R0.46 CCC(=O)CCCCCO 1458a_100000210414_100000746330 [1,0,1,0,0,0|2,0,0]=4 1960 B9R0.46 CCC(=O)CCCCCO 1458a_100102619762_100000210202 [1,0,1,0,0,0|2,0,0]=4 1961 B9R0.46 CCC(=O)CCCCOC 1458a_100000210414_100000755781 [1,0,1,0,0,0|2,0,0]=4 1962 B9R0.46 CCC(=O)NCCCCO 240690a_100000750430_100000210414 [1,0,1,0,0,0|2,0,0]=4 1963 B9R0.46 CCC(=O)NCCCCO 527a_100000750430_100000210414 [1,0,1,0,0,0|2,0,0]=4 1964 B9R0.46 CCC(=O)NCCCOC 1626a_100150723488_100000210414 [1,0,1,0,0,0|2,0,0]=4 1965 B9R0.46 CCC(=O)NCCCOC 240690a_100150723488_100000210414 [1,0,1,0,0,0|2,0,0]=4 1966 B9R0.46 CCC(=O)NCCCOC 527a_100150723488_100000210414 [1,0,1,0,0,0|2,0,0]=4 1967 B9R0.46 CCC(=O)NCCCSC 11a_100000749238_100000210414 [1,0,1,0,0,0|2,0,0]=4 1968 B9R0.46 CCC(=O)NCCCSC 1626a_100000749238_100000210414 [1,0,1,0,0,0|2,0,0]=4 1969 B9R0.46 CCC(=O)NCCCSC 240690a_100000749238_100000210414 [1,0,1,0,0,0|2,0,0]=4 1970 B9R0.46 CCC(=O)NCCCSC 527a_100000749238_100000210414 [1,0,1,0,0,0|2,0,0]=4 1971 B9R0.46 CCC(=O)OCCOCF 7a_200000031056_100015361967 [1,0,1,0,0,0|2,0,0]=4 1972 B9R0.46 CCCCC=CC(=O)CC 1458a_100016266645_100000210202 [1,0,1,0,0,0|1,0,1]=4 1973 B9R0.46 CCCCCCC(=O)CC 1458a_100000210414_100000210757 [1,0,1,0,0,0|1,0,0]=3 1974 B9R0.46 CCCCCCC(=O)CC 1458a_100102632555_100000210202 [1,0,1,0,0,0|1,0,0]=3 1975 B9R0.46 CCCCCCC(=O)CF 1458a_100102632555_100015361967 [1,0,1,0,0,0|2,0,0]=4 1976 B9R0.46 CCCCCCC(=O)CO 1458a_100000210174_100000210757 [1,0,1,0,0,0|2,0,0]=4 1977 B9R0.46 CCCCCCC(=O)NC 11a_106832991635_100102632555 [1,0,1,0,0,0|2,0,0]=4 1978 B9R0.46 CCCCCCC(=O)NC 1626a_100102657272_100102632555 [1,0,1,0,0,0|2,0,0]=4 1979 B9R0.46 CCCCCCC(=O)NC 240690a_100102657272_100102632555 [1,0,1,0,0,0|2,0,0]=4 1980 B9R0.46 CCCCCCC(=O)NC 527a_100102657272_100102632555 [1,0,1,0,0,0|2,0,0]=4 1981 B9R0.46 CCCCCNC(=O)CC 11a_100000209983_100000210414 [1,0,1,0,0,0|1,0,0]=3 1982 B9R0.46 CCCCCNC(=O)CC 1626a_100000209983_100000210414 [1,0,1,0,0,0|1,0,0]=3 1983 B9R0.46 CCCCCNC(=O)CC 240690a_100000209983_100000210414 [1,0,1,0,0,0|1,0,0]=3 1984 B9R0.46 CCCCCNC(=O)CC 527a_100000209983_100000210414 [1,0,1,0,0,0|1,0,0]=3 1985 B9R0.46 CCCCCNC(=O)CO 240690a_100000209983_100000210174 [1,0,1,0,0,0|2,0,0]=4 1986 B9R0.46 CCCCCNC(=O)CO 527a_100000209983_100000210174 [1,0,1,0,0,0|2,0,0]=4 1987 B9R0.46 CCCCCNC(=O)NC 2708a_100000209983_106832991635 [1,0,1,0,0,0|2,0,0]=4 1988 B9R0.46 CCCCCNC(=O)NC 2708a_100102657272_100000209983 [1,0,1,0,0,0|2,0,0]=4 1989 B9R0.46 CCCCCNC(=O)NC 273464a_100000209983_100102657272 [1,0,1,0,0,0|2,0,0]=4 1990 B9R0.46 CCCCCNC(=O)NC 273464a_100102657272_100000209983 [1,0,1,0,0,0|2,0,0]=4 1991 B9R0.46 CCCCCNC(=O)NC 512a_100000209983_100102657272 [1,0,1,0,0,0|2,0,0]=4 1992 B9R0.46 CCCCCNC(=O)NC 512a_106832991638_100000209983 [1,0,1,0,0,0|2,0,0]=4 1993 B9R0.46 CCCCCOC(C)CC 34a_100000210253_100011215416 [1,0,1,0,0,0|1,0,1]=4 1994 B9R0.46 CCCCCOC(C)CC 7a_100000210228_100000210326 [1,0,1,0,0,0|1,0,1]=4 1995 B9R0.46 CCCCCOC(C)CC 7a_100000210253_100000758301 [1,0,1,0,0,0|1,0,1]=4 1996 B9R0.46 CCCCNCC(=O)CC 7a_106832991798_100000747405 [1,0,1,0,0,0|2,0,0]=4 1997 B9R0.46 CCCCNNC(=O)CC 22a_100025702795_100000210414 [1,0,1,0,0,0|2,0,0]=4 1998 B9R0.46 CCCCOCC(=O)CC 1458a_100000210414_100011995733 [1,0,1,0,0,0|2,0,0]=4 1999 B9R0.46 CCCCOCC(=O)CC 1458a_100000757543_100000210202 [1,0,1,0,0,0|2,0,0]=4 2000 B9R0.46 CCCCOCC(=O)CC 34a_100000725409_100000210210 [1,0,1,0,0,0|2,0,0]=4 2001 B9R0.46 CCCCOCC(=O)CC 7a_100000210227_100000747405 [1,0,1,0,0,0|2,0,0]=4 2002 B9R0.46 CCCCSCC(=O)CC 1458a_100000191162_100000210202 [1,0,1,0,0,0|2,0,0]=4 2003 B9R0.46 CCCCSCC(=O)CC 62a_100000210211_100000747405 [1,0,1,0,0,0|2,0,0]=4 2004 B9R0.46 CCCCSCC(=O)CC 62a_100000747405_100000210210 [1,0,1,0,0,0|2,0,0]=4 2005 B9R0.46 CCCOCCC(=O)CC 1458a_100000210414_100011215938 [1,0,1,0,0,0|2,0,0]=4 2006 B9R0.46 CCCSCOC(=O)OC 62a_100000210303_100000139417 [1,0,1,0,0,0|2,0,0]=4 2007 B9R0.46 CCNCCNC(=O)CC 34a_100132302217_100000210202 [1,0,1,0,0,0|2,0,0]=4 2008 B9R0.46 CCOCCCC(=O)CC 1458a_100000210414_100012232248 [1,0,1,0,0,0|2,0,0]=4 2009 B9R0.46 CCOCCNC(=O)CC 11a_100011200944_100000210414 [1,0,1,0,0,0|2,0,0]=4 2010 B9R0.46 CCOCCNC(=O)CC 1626a_102516460346_100000210414 [1,0,1,0,0,0|2,0,0]=4 2011 B9R0.46 CCOCCNC(=O)CC 240690a_100011200944_100000210414 [1,0,1,0,0,0|2,0,0]=4 2012 B9R0.46 CCOCCNC(=O)CC 34a_200000158885_100000210202 [1,0,1,0,0,0|2,0,0]=4 2013 B9R0.46 CCOCCNC(=O)CC 527a_100011200944_100000210414 [1,0,1,0,0,0|2,0,0]=4 2014 B9R0.46 CCOCCNC(=O)CC 7a_200000158885_100000210202 [1,0,1,0,0,0|2,0,0]=4 2015 B9R0.46 CCOCCOC(=O)CC 7a_200000031056_100000210202 [1,0,1,0,0,0|1,0,0]=3 2016 B9R0.46 CCOCCOC(=O)NC 34a_100121572206_200011997002 [1,0,1,0,0,0|2,0,0]=4 2017 B9R0.46 CCOCCOC(=O)OC 34a_100010262106_100000210202 [1,0,1,0,0,0|2,0,0]=4 2018 B9R0.46 CCSCCNC(=O)CC 11a_100000106463_100000210414 [1,0,1,0,0,0|2,0,0]=4 2019 B9R0.46 CCSCCNC(=O)CC 1626a_100000106463_100000210414 [1,0,1,0,0,0|2,0,0]=4 2020 B9R0.46 CCSCCNC(=O)CC 240690a_100000106463_100000210414 [1,0,1,0,0,0|2,0,0]=4 2021 B9R0.46 CCSCCNC(=O)CC 527a_100000106463_100000210414 [1,0,1,0,0,0|2,0,0]=4 2022 B9R0.46 CCSCCOC(=O)NC 62a_100000210202_200011997002 [1,0,1,0,0,0|2,0,0]=4 2023 B9R0.46 CCSCCOC(=O)NC 62a_200011997002_100000210202 [1,0,1,0,0,0|2,0,0]=4 2024 B9R0.2 CC(=O)CCCCCCF 1458a_100000070787_100015922095 [1,0,1,0,0,0|2,0,0]=4 2025 B9R0.2 CC(=O)CCCCCCO 1458a_100000070787_100000766143 [1,0,1,0,0,0|2,0,0]=4 2026 B9R0.2 CC(=O)CCCCCCO 1458a_100011996774_200000210301 [1,0,1,0,0,0|2,0,0]=4 2027 B9R0.2 CCCCCCCC(=O)C 1458a_100000070787_100000210614 [1,0,1,0,0,0|1,0,0]=3 2028 B9R0.2 CCCCCCCC(=O)C 1458a_100000211969_200000210301 [1,0,1,0,0,0|1,0,0]=3 2029 B9R0.2 CCCCCCCC(=O)[13CH3] 1458a_100000211969_200025704644 [1,0,1,0,0,0|1,0,0]=3 2030 B9R0.2 CCCCCCNC(=O)C 11a_100000210581_100015343762 [1,0,1,0,0,0|2,0,0]=4 2031 B9R0.2 CCCCCCNC(=O)C 1626a_100000210581_100015343762 [1,0,1,0,0,0|2,0,0]=4 2032 B9R0.2 CCCCCCNC(=O)C 240690a_100000210581_100015343762 [1,0,1,0,0,0|2,0,0]=4 2033 B9R0.2 CCCCCCNC(=O)C 527a_100000210581_100103153847 [1,0,1,0,0,0|2,0,0]=4 2034 B9R0.2 CCCCCNCC(=O)N 2230a_100000209983_100000747473 [1,0,1,0,0,0|2,0,0]=4 2035 B9R0.2 CCCCCNCC(=O)N 2230a_100000711301_100000210326 [1,0,1,0,0,0|2,0,0]=4 2036 B9R0.2 CCCCCNCC(=O)O 269956a_100016091260_100000210326 [1,0,1,0,0,0|1,0,0]=3 2037 B9R0.2 CCCCCOCC(=O)C 34a_100000211253_100000718602 [1,0,1,0,0,0|2,0,0]=4 2038 B9R0.2 CCCCCOCC(=O)N 34a_100000210253_100000187820 [1,0,1,0,0,0|2,0,0]=4 2039 B9R0.2 CCCCCOCC(=O)N 7a_100000210253_100000187820 [1,0,1,0,0,0|2,0,0]=4 2040 B9R0.2 CCCCCOCC(=O)[O-] 34a_100000210253_100020667443 [1,0,1,0,0,0|1,0,1]=4 2041 B9R0.2 CCCCCSCC(=O)N 62a_100000210326_100000747473 [1,0,1,0,0,0|2,0,0]=4 2042 B9R0.2 CCCCCSCC(=O)N 62a_100000747473_100000210326 [1,0,1,0,0,0|2,0,0]=4 2043 B9R0.2 CCCCCSCC(=O)[O-] 62a_100000210326_100020667443 [1,0,1,0,0,0|1,0,1]=4 2044 B9R0.2 CCCCCSCC(=O)[O-] 62a_100020667443_100000210326 [1,0,1,0,0,0|1,0,1]=4 2045 B9R0.2 CCCCNCCC(=O)C 7a_106832991798_100000053229 [1,0,1,0,0,0|2,0,0]=4 2046 B9R0.2 CCCCNCCC(=O)N 2230a_100000102301_100000744528 [1,0,1,0,0,0|2,0,0]=4 2047 B9R0.2 CCCCNCCC(=O)N 7a_106832991798_100000744528 [1,0,1,0,0,0|2,0,0]=4 2048 B9R0.2 CCCCNOCC(=O)O 269956a_100000106656_100000210211 [1,0,1,0,0,0|2,0,0]=4 2049 B9R0.2 CCCCOCCC(=O)C 1458a_100000070787_100000743108 [1,0,1,0,0,0|2,0,0]=4 2050 B9R0.2 CCCCOCCC(=O)C 34a_100000759926_100000210210 [1,0,1,0,0,0|2,0,0]=4 2051 B9R0.2 CCCCOCCC(=O)C 7a_100000210227_100000053229 [1,0,1,0,0,0|2,0,0]=4 2052 B9R0.2 CCCCOCCC(=O)C 7a_100000759926_100000210211 [1,0,1,0,0,0|2,0,0]=4 2053 B9R0.2 CCCCOCCC(=O)N 34a_100000210227_100000731001 [1,0,1,0,0,0|2,0,0]=4 2054 B9R0.2 CCCCOCCC(=O)N 34a_100000757172_100000210210 [1,0,1,0,0,0|2,0,0]=4 2055 B9R0.2 CCCCOCCC(=O)N 7a_100000210227_100000744528 [1,0,1,0,0,0|2,0,0]=4 2056 B9R0.2 CCCCOCCC(=O)N 7a_100000757172_100000210211 [1,0,1,0,0,0|2,0,0]=4 2057 B9R0.2 CCCCSCCC(=O)C 62a_100000053229_100000210210 [1,0,1,0,0,0|2,0,0]=4 2058 B9R0.2 CCCCSCCC(=O)C 62a_100000210211_100000053229 [1,0,1,0,0,0|2,0,0]=4 2059 B9R0.2 CCCCSCCC(=O)N 62a_100000210211_100000744528 [1,0,1,0,0,0|2,0,0]=4 2060 B9R0.2 CCCCSCCC(=O)N 62a_100000744528_100000210210 [1,0,1,0,0,0|2,0,0]=4 2061 B9R0.2 CCCNCCCC(=O)N 34a_100000739312_100000210303 [1,0,1,0,0,0|2,0,0]=4 2062 B9R0.2 CCCOCCCC(=O)C 34a_100000210258_100000685027 [1,0,1,0,0,0|2,0,0]=4 2063 B9R0.2 CCCOCCCC(=O)C 34a_100000759063_100000210303 [1,0,1,0,0,0|2,0,0]=4 2064 B9R0.2 CCCOCCCC(=O)C 7a_100000759063_100000210303 [1,0,1,0,0,0|2,0,0]=4 2065 B9R0.2 CCCOCCCC(=O)N 34a_100000210258_100102525003 [1,0,1,0,0,0|2,0,0]=4 2066 B9R0.2 CCCSCCCC(=O)C 62a_100000210303_100011215641 [1,0,1,0,0,0|2,0,0]=4 2067 B9R0.2 CCCSCCCC(=O)C 62a_100011215641_100000210303 [1,0,1,0,0,0|2,0,0]=4 2068 B9R0.2 CCCSCCCC(=O)N 62a_100000210303_100102525003 [1,0,1,0,0,0|2,0,0]=4 2069 B9R0.2 CCCSCCCC(=O)N 62a_100102525003_100000210303 [1,0,1,0,0,0|2,0,0]=4 2070 B9R0.2 CCNCCCCC(=O)N 34a_100000696515_100000210202 [1,0,1,0,0,0|2,0,0]=4 2071 B9R0.2 CCNCCOCC(=O)O 269956a_100000700818_100000210202 [1,0,1,0,0,0|2,0,0]=4 2072 B9R0.2 CCOCCCCC(=O)C 34a_100121572206_100009817362 [1,0,1,0,0,0|2,0,0]=4 2073 B9R0.2 CCOCCCCC(=O)N 34a_100012022536_100000210202 [1,0,1,0,0,0|2,0,0]=4 2074 B9R0.2 CCOCCCCC(=O)N 7a_100012022536_100000210202 [1,0,1,0,0,0|2,0,0]=4 2075 B9R0.2 CCOCCNCC(=O)O 269956a_100016091260_100000210147 [1,0,1,0,0,0|2,0,0]=4 2076 B9R0.2 CCSCCCCC(=O)C 62a_100000210202_100000735457 [1,0,1,0,0,0|2,0,0]=4 2077 B9R0.2 CCSCCCCC(=O)C 62a_100000735457_100000210202 [1,0,1,0,0,0|2,0,0]=4 2078 B9R0.2 CCSCCNCC(=O)O 269956a_100016091260_100000757381 [1,0,1,0,0,0|2,0,0]=4 2079 B9R0.2 CNCCCCCC(=O)N 2230a_106832991635_100009817443 [1,0,1,0,0,0|2,0,0]=4 2080 B9R0.2 CNCCCCCC(=O)N 34a_100102657272_100009817443 [1,0,1,0,0,0|2,0,0]=4 2081 B9R0.2 CNCCCCCC(=O)N 7a_106832991635_100009817443 [1,0,1,0,0,0|2,0,0]=4 2082 B9R0.2 COCCCCCC(=O)C 1458a_100011935119_200000210301 [1,0,1,0,0,0|2,0,0]=4 2083 B9R0.2 COCCCCCC(=O)N 34a_100000123541_200000210301 [1,0,1,0,0,0|2,0,0]=4 2084 B9R0.2 COCCCCCC(=O)N 34a_100138415774_100009817443 [1,0,1,0,0,0|2,0,0]=4 2085 B9R0.2 COCCCCCC(=O)N 7a_100000123541_200000210301 [1,0,1,0,0,0|2,0,0]=4 2086 B9R0.2 COCCCCCC(=O)[13CH3] 1458a_100011935119_200025704644 [1,0,1,0,0,0|2,0,0]=4 2087 B9R0.2 COCCCCCC(=O)[O-] 7a_100102619762_200000210301 [1,0,1,0,0,0|1,0,1]=4 2088 B9R0.2 COCCCNCC(=O)O 269956a_100016091260_100000740836 [1,0,1,0,0,0|2,0,0]=4 2089 B9R0.2 CSCCCCCC(=O)N 62a_100009817443_200000210301 [1,0,1,0,0,0|2,0,0]=4 2090 B9R0.2 CSCCCCCC(=O)N 62a_200000210301_100009817443 [1,0,1,0,0,0|2,0,0]=4 2091 B9R0.2 O=C(O)CNCCCCF 269956a_100016091260_100000729493 [1,0,1,0,0,0|2,0,0]=4 2092 B9R0.2 O=C(O)CNCCCCO 269956a_100016091260_100000210776 [1,0,1,0,0,0|2,0,0]=4 2093 B9R0.2 [13CH3]C(=O)CCCCCCO 1458a_100011996774_200025704644 [1,0,1,0,0,0|2,0,0]=4 2094 B9R0.2 [13CH3]OCCCCCC(=O)N 34a_100000123541_200025704644 [1,0,1,0,0,0|2,0,0]=4 2095 B9R0.2 [13CH3]OCCCCCC(=O)N 7a_100000123541_200025704644 [1,0,1,0,0,0|2,0,0]=4 2096 B9R0.2 [13CH3]OCCCCCC(=O)[O-] 7a_100102619762_200025704644 [1,0,1,0,0,0|1,0,1]=4 2097 B9R0.2 [13CH3]SCCCCCC(=O)N 62a_100009817443_200025704644 [1,0,1,0,0,0|2,0,0]=4 2098 B9R0.2 [13CH3]SCCCCCC(=O)N 62a_200025704644_100009817443 [1,0,1,0,0,0|2,0,0]=4 2099 B9R0.4 CC(=O)OC(C)SCCF 62a_100009818208_100011217306 [1,0,1,0,0,0|2,0,0]=4 2100 B9R0.4 CC(=O)OC(C)SCCF 62a_100011217306_100009818208 [1,0,1,0,0,0|2,0,0]=4 2101 B9R0.4 CC(=O)OC(C)SCCO 62a_100000211926_100009818208 [1,0,1,0,0,0|2,0,0]=4 2102 B9R0.4 CC(=O)OC(C)SCCO 62a_100009818208_100000211926 [1,0,1,0,0,0|2,0,0]=4 2103 B9R0.4 CCCCC(C)NC(=O)C 11a_100000126638_100015343762 [1,0,1,0,0,0|1,0,0]=3 2104 B9R0.4 CCCCC(C)NC(=O)C 1626a_100000126638_100015343762 [1,0,1,0,0,0|1,0,0]=3 2105 B9R0.4 CCCCC(C)NC(=O)C 240690a_100000126638_100015343762 [1,0,1,0,0,0|1,0,0]=3 2106 B9R0.4 CCCCC(C)NC(=O)C 527a_100000126638_100103153847 [1,0,1,0,0,0|1,0,0]=3 2107 B9R0.4 CCCCC(C)OC(C)C 34a_100000212225_200011215066 [1,0,1,0,0,0|1,0,1]=4 2108 B9R0.4 CCCCC(C)OC(C)C 34a_100000687866_100000210206 [1,0,1,0,0,0|1,0,1]=4 2109 B9R0.4 CCCCC(C)OC(C)C 7a_100000687866_100000210206 [1,0,1,0,0,0|1,0,1]=4 2110 B9R0.4 CCCSC(C)OC(=O)C 62a_100000210303_100009818208 [1,0,1,0,0,0|1,0,0]=3 2111 B9R0.4 CCCSC(C)OC(=O)C 62a_100009818208_100000210303 [1,0,1,0,0,0|1,0,0]=3 2112 B9R0.4 COCSC(C)OC(=O)C 62a_100000766300_100009818208 [1,0,1,0,0,0|2,0,0]=4 2113 B9R0.4 COCSC(C)OC(=O)C 62a_100009818208_100000766300 [1,0,1,0,0,0|2,0,0]=4 2114 B9R0.4 CSCSC(C)OC(=O)C 62a_100009818208_100011218213 [1,0,1,0,0,0|2,0,0]=4 2115 B9R0.4 CSCSC(C)OC(=O)C 62a_100011218213_100009818208 [1,0,1,0,0,0|2,0,0]=4 2116 B9R0.18 CCCCC(C)COCC 34a_100011995851_100000210202 [1,0,1,0,0,0|2,0,0]=4 2117 B9R0.18 CCCCC(C)COCC 7a_100011995851_100000210202 [1,0,1,0,0,0|2,0,0]=4 2118 B9R0.18 CCCCC(C)NCC=O 2230a_100000126638_200015260668 [1,0,1,0,0,0|2,0,0]=4 2119 B9R0.18 CCCCC(C)NCCC 2230a_100000126638_100000210303 [1,0,1,0,0,0|1,0,1]=4 2120 B9R0.18 CCCCC(C)NCCC 270004a_100020643023_100000210087 [1,0,1,0,0,0|1,0,1]=4 2121 B9R0.18 CCCCC(C)OCC=O 34a_100000687866_200009817547 [1,0,1,0,0,0|2,0,0]=4 2122 B9R0.18 CCCCC(C)OCC=O 7a_100000687866_200015260668 [1,0,1,0,0,0|2,0,0]=4 2123 B9R0.18 CCCCC(C)OCCBr 34a_100000211926_200011215066 [1,0,1,0,0,0|1,0,1]=4 2124 B9R0.18 CCCCC(C)OCCC 34a_100000210258_200011215066 [1,0,1,0,0,0|0,0,1]=3 2125 B9R0.18 CCCCC(C)OCCC 34a_100000687866_100000210303 [1,0,1,0,0,0|0,0,1]=3 2126 B9R0.18 CCCCC(C)OCCC 7a_100000687866_100000210303 [1,0,1,0,0,0|0,0,1]=3 2127 B9R0.18 CCCCC(C)OCCF 34a_100000687866_100011217306 [1,0,1,0,0,0|1,0,1]=4 2128 B9R0.18 CCCCC(C)OCCF 7a_100000687866_100011217306 [1,0,1,0,0,0|1,0,1]=4 2129 B9R0.18 CCCCC(C)OCCN 34a_100000210304_200011215066 [1,0,1,0,0,0|1,0,1]=4 2130 B9R0.18 CCCCC(C)OCCO 34a_100000687866_100000211926 [1,0,1,0,0,0|1,0,1]=4 2131 B9R0.18 CCCCC(C)OCCO 7a_100000687866_100000211926 [1,0,1,0,0,0|1,0,1]=4 2132 B9R0.18 CCCCC(C)OCSC 34a_100000687866_100011218213 [1,0,1,0,0,0|1,0,1]=4 2133 B9R0.18 CCCCC(C)SCC=O 62a_200011215066_200015260668 [1,0,1,0,0,0|2,0,0]=4 2134 B9R0.18 CCCCC(C)SCC=O 62a_200015260668_200011215066 [1,0,1,0,0,0|2,0,0]=4 2135 B9R0.18 CCCCC(C)SCCC 62a_100000210303_200011215066 [1,0,1,0,0,0|0,1,1]=4 2136 B9R0.18 CCCCC(C)SCCC 62a_200011215066_100000210303 [1,0,1,0,0,0|0,1,1]=4 2137 B9R0.18 CCCOC(C)CCCCl 34a_200000718107_100000210303 [1,0,1,0,0,0|1,0,1]=4 2138 B9R0.18 CCCOC(C)CCCCl 7a_200000718107_100000210303 [1,0,1,0,0,0|1,0,1]=4 2139 B9R0.18 CCCOC(C)CNCC 2230a_100015185124_100000210202 [1,0,1,0,0,0|1,0,1]=4 2140 B9R0.18 CCCOC(C)CNCC 34a_100015185124_100000210202 [1,0,1,0,0,0|1,0,1]=4 2141 B9R0.18 CCCOC(C)COCC 34a_100000718985_100000210303 [1,0,1,0,0,0|1,0,1]=4 2142 B9R0.18 CCCOC(C)COCC 7a_100000718985_100000210303 [1,0,1,0,0,0|1,0,1]=4 2143 B9R0.34 CCC(=O)N[C@H](C)CCO 240690a_100000706166_100000210414 [1,0,1,0,0,0|2,0,0]=4 2144 B9R0.34 CCC(=O)N[C@H](C)CCO 527a_100000706166_100000210414 [1,0,1,0,0,0|2,0,0]=4 2145 B9R0.34 CCC(=O)N[C@H](C)COC 11a_100000764878_100000210414 [1,0,1,0,0,0|2,0,0]=4 2146 B9R0.34 CCC(=O)N[C@H](C)COC 1626a_100000764878_100000210414 [1,0,1,0,0,0|2,0,0]=4 2147 B9R0.34 CCC(=O)N[C@H](C)COC 240690a_100000764878_100000210414 [1,0,1,0,0,0|2,0,0]=4 2148 B9R0.34 CCC(=O)N[C@H](C)COC 527a_100000764878_100000210414 [1,0,1,0,0,0|2,0,0]=4 2149 B9R0.34 CCCC(=CC(=O)CC)C 1458a_100020676950_100000210202 [1,0,1,0,0,0|1,0,1]=4 2150 B9R0.34 CCCC(C)CC(=O)CC 1458a_100000210414_100011216630 [1,0,1,0,0,0|1,0,0]=3 2151 B9R0.34 CCCC(C)CC(=O)CC 1458a_100000748435_100000210202 [1,0,1,0,0,0|1,0,0]=3 2152 B9R0.34 CCCC(C)CC(=O)CF 1458a_100000748435_100015361967 [1,0,1,0,0,0|2,0,0]=4 2153 B9R0.34 CCCC(C)CC(=O)CO 1458a_100000210174_100011216630 [1,0,1,0,0,0|2,0,0]=4 2154 B9R0.34 CCCC(C)CC(=O)NC 11a_106832991635_100000748435 [1,0,1,0,0,0|2,0,0]=4 2155 B9R0.34 CCCC(C)CC(=O)NC 1626a_100102657272_100000748435 [1,0,1,0,0,0|2,0,0]=4 2156 B9R0.34 CCCC(C)CC(=O)NC 240690a_100102657272_100000748435 [1,0,1,0,0,0|2,0,0]=4 2157 B9R0.34 CCCC(C)CC(=O)NC 527a_100102657272_100000748435 [1,0,1,0,0,0|2,0,0]=4 2158 B9R0.34 CCCC(C)NC(=O)CC 11a_100000741246_100000210414 [1,0,1,0,0,0|1,0,0]=3 2159 B9R0.34 CCCC(C)NC(=O)CC 1626a_100000741246_100000210414 [1,0,1,0,0,0|1,0,0]=3 2160 B9R0.34 CCCC(C)NC(=O)CC 240690a_100000741246_100000210414 [1,0,1,0,0,0|1,0,0]=3 2161 B9R0.34 CCCC(C)NC(=O)CC 527a_100000741246_100000210414 [1,0,1,0,0,0|1,0,0]=3 2162 B9R0.34 CCCC(C)NC(=O)CO 240690a_100000741246_100000210174 [1,0,1,0,0,0|2,0,0]=4 2163 B9R0.34 CCCC(C)NC(=O)CO 527a_100000741246_100000210174 [1,0,1,0,0,0|2,0,0]=4 2164 B9R0.34 CCCC(C)NC(=O)NC 2708a_100000741246_106832991635 [1,0,1,0,0,0|2,0,0]=4 2165 B9R0.34 CCCC(C)NC(=O)NC 2708a_100102657272_100000741246 [1,0,1,0,0,0|2,0,0]=4 2166 B9R0.34 CCCC(C)NC(=O)NC 273464a_100000741246_100102657272 [1,0,1,0,0,0|2,0,0]=4 2167 B9R0.34 CCCC(C)NC(=O)NC 512a_100000741246_100102657272 [1,0,1,0,0,0|2,0,0]=4 2168 B9R0.34 CCCC(C)NC(=O)NC 512a_106832991638_100000741246 [1,0,1,0,0,0|2,0,0]=4 2169 B9R0.34 CCCC(C)OC(C)CC 34a_100000764384_100011215416 [1,0,1,0,0,0|1,0,1]=4 2170 B9R0.34 CCCC(C)OC(C)CC 7a_100000210228_100000766640 [1,0,1,0,0,0|1,0,1]=4 2171 B9R0.34 CCCC(C)OC(C)CC 7a_100000764384_100000758301 [1,0,1,0,0,0|1,0,1]=4 2172 B9R0.34 CCCN(C)CC(=O)CC 269982a_100000747261_100000747405 [1,0,1,0,0,0|2,0,0]=4 2173 B9R0.34 CCSC(C)CC(=O)CC 1458a_200011311441_100000210202 [1,0,1,0,0,0|2,0,0]=4 2174 B9R0.14 CCC(COC)NC(=O)C 11a_100000757820_100015343762 [1,0,1,0,0,0|2,0,0]=4 2175 B9R0.14 CCC(COC)NC(=O)C 1626a_100000757820_100015343762 [1,0,1,0,0,0|2,0,0]=4 2176 B9R0.14 CCC(COC)NC(=O)C 240690a_100000757820_100015343762 [1,0,1,0,0,0|2,0,0]=4 2177 B9R0.14 CCC(COC)NC(=O)C 527a_100000757820_100103153847 [1,0,1,0,0,0|2,0,0]=4 2178 B9R0.14 CCCC(CC)NC(=O)C 11a_100000747048_100015343762 [1,0,1,0,0,0|1,0,0]=3 2179 B9R0.14 CCCC(CC)NC(=O)C 1626a_100000747048_100015343762 [1,0,1,0,0,0|1,0,0]=3 2180 B9R0.14 CCCC(CC)NC(=O)C 240690a_100000747048_100015343762 [1,0,1,0,0,0|1,0,0]=3 2181 B9R0.14 CCCC(CC)NC(=O)C 527a_100000747048_100103153847 [1,0,1,0,0,0|1,0,0]=3 2182 B9R0.14 CCCC(CC)OC(C)C 34a_100000687864_100000210206 [1,0,1,0,0,0|1,0,1]=4 2183 B9R0.14 CCCC(CC)OC(C)C 7a_100000687864_100000210206 [1,0,1,0,0,0|1,0,1]=4 2184 B9R0.14 CCC[C@@H](CO)NC(=O)C 240690a_100000732646_100015343762 [1,0,1,0,0,0|2,0,0]=4 2185 B9R0.14 CCC[C@@H](CO)NC(=O)C 527a_100000732646_100103153847 [1,0,1,0,0,0|2,0,0]=4 2186 B9R0.40 C=CC(CCC)OCCC 34a_100011216692_100000210303 [1,0,1,0,0,0|2,0,0]=4 2187 B9R0.40 C=CC(CCC)OCCC 7a_100011216692_100000210303 [1,0,1,0,0,0|2,0,0]=4 2188 B9R0.40 C=CC(CCCC)OCC 34a_200011215037_100000210202 [1,0,1,0,0,0|2,0,0]=4 2189 B9R0.40 C=CC(CCCC)OCC 7a_200011215037_100000210202 [1,0,1,0,0,0|2,0,0]=4 2190 B9R0.40 CCCCC(CC)CNC 2230a_100000209976_200000210301 [1,0,1,0,0,0|2,0,0]=4 2191 B9R0.40 CCCCC(CC)CNC 2230a_106832991635_100000211942 [1,0,1,0,0,0|2,0,0]=4 2192 B9R0.40 CCCCC(CC)CNC 269862a_106832991636_100011219736 [1,0,1,0,0,0|2,0,0]=4 2193 B9R0.40 CCCCC(CC)CNC 270004a_106832991635_100011219736 [1,0,1,0,0,0|2,0,0]=4 2194 B9R0.40 CCCCC(CC)CNC 34a_100102657272_100000211942 [1,0,1,0,0,0|2,0,0]=4 2195 B9R0.40 CCCCC(CC)CNC 7a_106832991635_100000211942 [1,0,1,0,0,0|2,0,0]=4 2196 B9R0.40 CCCCC(CC)CN[13CH3] 2230a_100000209976_200025704644 [1,0,1,0,0,0|2,0,0]=4 2197 B9R0.40 CCCCC(CC)COC 34a_100000210273_200000210301 [1,0,1,0,0,0|2,0,0]=4 2198 B9R0.40 CCCCC(CC)COC 34a_100138415774_100000211942 [1,0,1,0,0,0|2,0,0]=4 2199 B9R0.40 CCCCC(CC)COC 7a_100000210273_200000210301 [1,0,1,0,0,0|2,0,0]=4 2200 B9R0.40 CCCCC(CC)CO[13CH3] 34a_100000210273_200025704644 [1,0,1,0,0,0|2,0,0]=4 2201 B9R0.40 CCCCC(CC)CO[13CH3] 7a_100000210273_200025704644 [1,0,1,0,0,0|2,0,0]=4 2202 B9R0.40 CCCCC(CC)CSC 62a_100000211942_200000210301 [1,0,1,0,0,0|2,0,0]=4 2203 B9R0.40 CCCCC(CC)CSC 62a_200000210301_100000211942 [1,0,1,0,0,0|2,0,0]=4 2204 B9R0.40 CCCCC(CC)CS[13CH3] 62a_100000211942_200025704644 [1,0,1,0,0,0|2,0,0]=4 2205 B9R0.40 CCCCC(CC)CS[13CH3] 62a_200025704644_100000211942 [1,0,1,0,0,0|2,0,0]=4 2206 B9R0.40 CCCCC(CC)NCC 270004a_100015525214_100000753412 [1,0,1,0,0,0|1,0,1]=4 2207 B9R0.40 CCCCC(CC)OCC 34a_100011215227_100000210202 [1,0,1,0,0,0|0,0,1]=3 2208 B9R0.40 CCCCC(CC)OCC 34a_100121572206_200011216223 [1,0,1,0,0,0|0,0,1]=3 2209 B9R0.40 CCCCC(CC)OCC 7a_100011215227_100000210202 [1,0,1,0,0,0|0,0,1]=3 2210 B9R0.40 CCCCC(CC)OCF 34a_100011215227_100015361967 [1,0,1,0,0,0|1,0,1]=4 2211 B9R0.40 CCCCC(CC)OCF 7a_100011215227_100015361967 [1,0,1,0,0,0|1,0,1]=4 2212 B9R0.40 CCCCC(CC)SCC 62a_100000210202_200011216223 [1,0,1,0,0,0|0,1,1]=4 2213 B9R0.40 CCCCC(CC)SCC 62a_200011216223_100000210202 [1,0,1,0,0,0|0,1,1]=4 2214 B9R0.40 CCCCC(CCC)NC 34a_100102657272_100000211913 [1,0,1,0,0,0|1,0,1]=4 2215 B9R0.40 CCCCC(CCC)NC 7a_106832991635_100000211913 [1,0,1,0,0,0|1,0,1]=4 2216 B9R0.40 CCCCC(CCC)OC 34a_100011215800_200000210301 [1,0,1,0,0,0|0,0,1]=3 2217 B9R0.40 CCCCC(CCC)OC 34a_100138415774_100000211913 [1,0,1,0,0,0|0,0,1]=3 2218 B9R0.40 CCCCC(CCC)OC 7a_100011215800_200000210301 [1,0,1,0,0,0|0,0,1]=3 2219 B9R0.40 CCCCC(CCC)O[13CH3] 34a_100011215800_200025704644 [1,0,1,0,0,0|0,0,1]=3 2220 B9R0.40 CCCCC(CCC)O[13CH3] 7a_100011215800_200025704644 [1,0,1,0,0,0|0,0,1]=3 2221 B9R0.40 CCCCC(CCC)SC 62a_100000211913_200000210301 [1,0,1,0,0,0|0,1,1]=4 2222 B9R0.40 CCCCC(CCC)SC 62a_200000210301_100000211913 [1,0,1,0,0,0|0,1,1]=4 2223 B9R0.40 CCCCC(CCC)S[13CH3] 62a_100000211913_200025704644 [1,0,1,0,0,0|0,1,1]=4 2224 B9R0.40 CCCCC(CCC)S[13CH3] 62a_200025704644_100000211913 [1,0,1,0,0,0|0,1,1]=4 2225 B9R0.40 CCCCN(CC)CC=O 2230a_100000207695_200015260668 [1,0,1,0,0,0|2,0,0]=4 2226 B9R0.40 CCCCN(CC)CC=O 269982a_100000207695_200015260668 [1,0,1,0,0,0|2,0,0]=4 2227 B9R0.40 CCNCC(CC)OCC 2230a_100015183923_100000210202 [1,0,1,0,0,0|1,0,1]=4 2228 B9R0.40 CCNCC(CC)OCC 34a_100015183923_100000210202 [1,0,1,0,0,0|1,0,1]=4 2229 B9R0.17 CCCC(CCC)OCC 34a_100121572206_200011218217 [1,0,1,0,0,0|1,0,1]=4 2230 B9R0.17 CCCC(CCC)OCC 34a_200011218534_100000210202 [1,0,1,0,0,0|1,0,1]=4 2231 B9R0.17 CCCC(CCC)OCC 7a_200011218534_100000210202 [1,0,1,0,0,0|1,0,1]=4 2232 B9R0.17 CCCC(CCC)OCF 34a_200011218534_100015361967 [1,0,1,0,0,0|1,0,1]=4 2233 B9R0.17 CCCC(CCC)OCF 7a_200011218534_100015361967 [1,0,1,0,0,0|1,0,1]=4 2234 B9R0.17 CCCN(CC=O)CCC 2230a_100000210455_200015260668 [1,0,1,0,0,0|2,0,0]=4 2235 B9R0.17 CCCN(CC=O)CCC 269982a_100000210455_200015260668 [1,0,1,0,0,0|2,0,0]=4 2236 B9R1.2 COC1CCCC(=O)C1 34a_100012613340_200000210301 [2,0,0,0,0,0|2,0,0]=4 2237 B9R1.2 [13CH3]OC1CCCC(=O)C1 34a_100012613340_200025704644 [2,0,0,0,0,0|2,0,0]=4 2238 B9R1.8 CCNC1C=CCCC1 2230a_100015525214_100000751183 [2,0,0,0,0,0|2,0,0]=4 2239 B9R1.8 CCOC1C=CCCC1 34a_100011215024_100000210202 [2,0,0,0,0,0|2,0,0]=4 2240 B9R1.8 CCOC1CCCCO1 34a_100000033831_100000210202 [2,0,0,0,0,0|1,0,1]=4 2241 B9R1.8 CCSC1C=CCCC1 62a_100000210202_100000751183 [2,0,0,0,0,0|2,0,0]=4 2242 B9R1.8 CCSC1C=CCCC1 62a_100000751183_100000210202 [2,0,0,0,0,0|2,0,0]=4 2243 B9R1.8 CNCC1CCCCO1 2230a_100000174945_200000210301 [2,0,0,0,0,0|1,0,1]=4 2244 B9R1.8 CNCC1CCCCO1 2230a_106832991635_100000211543 [2,0,0,0,0,0|1,0,1]=4 2245 B9R1.8 CNCC1CCCCO1 34a_100000174945_200000210301 [2,0,0,0,0,0|1,0,1]=4 2246 B9R1.8 CNCC1CCCCO1 34a_100102657272_100000211543 [2,0,0,0,0,0|1,0,1]=4 2247 B9R1.8 CNCC1CCCCO1 7a_106832991635_100000211543 [2,0,0,0,0,0|1,0,1]=4 2248 B9R1.8 COCC1CCC=CO1 34a_100011217868_200000210301 [2,0,0,0,0,0|1,0,1]=4 2249 B9R1.8 COCC1CCCCO1 34a_100000211370_200000210301 [2,0,0,0,0,0|1,0,1]=4 2250 B9R1.8 COCC1CCCCO1 34a_100138415774_100000211543 [2,0,0,0,0,0|1,0,1]=4 2251 B9R1.8 COCC1CCCCO1 7a_100000211370_200000210301 [2,0,0,0,0,0|1,0,1]=4 2252 B9R1.8 CSCC1CCCCO1 62a_100000211543_200000210301 [2,0,0,0,0,0|1,0,1]=4 2253 B9R1.8 CSCC1CCCCO1 62a_200000210301_100000211543 [2,0,0,0,0,0|1,0,1]=4 2254 B9R1.8 [13CH3]NCC1CCCCO1 2230a_100000174945_200025704644 [2,0,0,0,0,0|1,0,1]=4 2255 B9R1.8 [13CH3]NCC1CCCCO1 34a_100000174945_200025704644 [2,0,0,0,0,0|1,0,1]=4 2256 B9R1.8 [13CH3]OCC1CCC=CO1 34a_100011217868_200025704644 [2,0,0,0,0,0|1,0,1]=4 2257 B9R1.8 [13CH3]OCC1CCCCO1 34a_100000211370_200025704644 [2,0,0,0,0,0|1,0,1]=4 2258 B9R1.8 [13CH3]OCC1CCCCO1 7a_100000211370_200025704644 [2,0,0,0,0,0|1,0,1]=4 2259 B9R1.8 [13CH3]SCC1CCCCO1 62a_100000211543_200025704644 [2,0,0,0,0,0|1,0,1]=4 2260 B9R1.8 [13CH3]SCC1CCCCO1 62a_200025704644_100000211543 [2,0,0,0,0,0|1,0,1]=4 2261 B11R0.2 C=C(C)CC(=O)CCCCCC 1458a_100102632555_100000748629 [0,1,1,0,0,0|1,0,1]=4 2262 B11R0.2 CC(C)CC(=O)CCCCCF 1458a_100000210554_100000729378 [0,1,1,0,0,0|2,0,0]=4 2263 B11R0.2 CC(C)CC(=O)CCCCCO 1458a_100000210554_100000746330 [0,1,1,0,0,0|2,0,0]=4 2264 B11R0.2 CC(C)CC(=O)CCCCCO 1458a_100102619762_100000210624 [0,1,1,0,0,0|2,0,0]=4 2265 B11R0.2 CC(C)CC(=O)NCCCCO 240690a_100000750430_100000210554 [0,1,1,0,0,0|2,0,0]=4 2266 B11R0.2 CC(C)CC(=O)NCCCCO 527a_100000750430_100000210554 [0,1,1,0,0,0|2,0,0]=4 2267 B11R0.2 CC(O)CC(=O)CCCCCO 1458a_100102619762_100011218427 [0,1,1,0,0,0|2,0,0]=4 2268 B11R0.2 CCCCC=CC(=O)CC(C)C 1458a_100016266645_100000210624 [0,1,1,0,0,0|1,0,1]=4 2269 B11R0.2 CCCCC=CC(=O)CC(C)O 1458a_100016266645_100011218427 [0,1,1,0,0,0|1,0,1]=4 2270 B11R0.2 CCCCCCC(=O)CC(C)C 1458a_100000210554_100000210757 [0,1,1,0,0,0|1,0,0]=3 2271 B11R0.2 CCCCCCC(=O)CC(C)C 1458a_100102632555_100000210624 [0,1,1,0,0,0|1,0,0]=3 2272 B11R0.2 CCCCCCC(=O)CC(C)O 1458a_100102632555_100011218427 [0,1,1,0,0,0|1,0,0]=3 2273 B11R0.2 CCCCCCC(=O)CC(F)F 1458a_100102632555_100011934356 [0,1,1,0,0,0|2,0,0]=4 2274 B11R0.2 CCCCCCC(=O)CN(C)C 1458a_100000750896_100000210757 [0,1,1,0,0,0|2,0,0]=4 2275 B11R0.2 CCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210757 [0,1,1,0,0,0|1,0,0]=3 2276 B11R0.2 CCCCCCC(=O)C[S+](C)C 1458a_200159257847_100000210757 [0,1,1,0,0,0|2,0,0]=4 2277 B11R0.2 CCCCCCC(=O)NC(C)C 11a_100138425928_100102632555 [0,1,1,0,0,0|2,0,0]=4 2278 B11R0.2 CCCCCCC(=O)NC(C)C 1626a_100138425928_100102632555 [0,1,1,0,0,0|2,0,0]=4 2279 B11R0.2 CCCCCCC(=O)NC(C)C 240690a_100138425928_100102632555 [0,1,1,0,0,0|2,0,0]=4 2280 B11R0.2 CCCCCCC(=O)NC(C)C 527a_100138425928_100102632555 [0,1,1,0,0,0|2,0,0]=4 2281 B11R0.2 CCCCCNC(=O)CC(=O)C 1458a_100000070787_100000230301 [0,1,1,0,0,0|1,0,1]=4 2282 B11R0.2 CCCCCNC(=O)CC(C)C 11a_100000209983_100000210554 [0,1,1,0,0,0|1,0,0]=3 2283 B11R0.2 CCCCCNC(=O)CC(C)C 1626a_100000209983_100000210554 [0,1,1,0,0,0|1,0,0]=3 2284 B11R0.2 CCCCCNC(=O)CC(C)C 240690a_100000209983_100000210554 [0,1,1,0,0,0|1,0,0]=3 2285 B11R0.2 CCCCCNC(=O)CC(C)C 527a_100000209983_100000210554 [0,1,1,0,0,0|1,0,0]=3 2286 B11R0.2 CCCCCNC(=O)CN(C)C 11a_100000209983_100000750896 [0,1,1,0,0,0|2,0,0]=4 2287 B11R0.2 CCCCCNC(=O)CN(C)C 2230a_100102631434_100000230301 [0,1,1,0,0,0|2,0,0]=4 2288 B11R0.2 CCCCCNC(=O)CN(C)C 240690a_100000209983_100000750896 [0,1,1,0,0,0|2,0,0]=4 2289 B11R0.2 CCCCCNC(=O)CN(C)C 269982a_100102631434_100000230301 [0,1,1,0,0,0|2,0,0]=4 2290 B11R0.2 CCCCCNC(=O)CN(C)C 527a_100000209983_100000750896 [0,1,1,0,0,0|2,0,0]=4 2291 B11R0.2 CCCCCNC(=O)C[C@@H](C)O 240690a_100000209983_100011933948 [0,1,1,0,0,0|1,0,0]=3 2292 B11R0.2 CCCCCNC(=O)C[S+](C)C 11a_100000209983_200159257847 [0,1,1,0,0,0|2,0,0]=4 2293 B11R0.2 CCCCCNC(=O)C[S+](C)C 1626a_100000209983_200159257847 [0,1,1,0,0,0|2,0,0]=4 2294 B11R0.2 CCCCCNC(=O)C[S+](C)C 240690a_100000209983_200159257847 [0,1,1,0,0,0|2,0,0]=4 2295 B11R0.2 CCCCCNC(=O)C[S+](C)C 527a_100000209983_200159257847 [0,1,1,0,0,0|2,0,0]=4 2296 B11R0.2 CCCCCNC(=O)NC(C)C 2708a_100000209983_100138425928 [0,1,1,0,0,0|2,0,0]=4 2297 B11R0.2 CCCCCNC(=O)NC(C)C 2708a_100138425928_100000209983 [0,1,1,0,0,0|2,0,0]=4 2298 B11R0.2 CCCCCNC(=O)NC(C)C 273464a_100138425928_100000209983 [0,1,1,0,0,0|2,0,0]=4 2299 B11R0.2 CCCCCNC(=O)NC(C)C 512a_100000209983_100138425928 [0,1,1,0,0,0|2,0,0]=4 2300 B11R0.2 CCCCCNC(=O)NC(C)C 512a_100138425928_100000209983 [0,1,1,0,0,0|2,0,0]=4 2301 B11R0.2 CCCCCOC(C)CC(C)C 34a_100000210253_100000731052 [0,1,1,0,0,0|1,0,1]=4 2302 B11R0.2 CCCCCOC(C)CC(C)C 34a_100000211805_100000718602 [0,1,1,0,0,0|1,0,1]=4 2303 B11R0.2 CCCCCOC(C)CC(C)C 7a_100000210253_100000731052 [0,1,1,0,0,0|1,0,1]=4 2304 B11R0.2 CCCCCOC(C)CC(C)C 7a_100000211805_100000210326 [0,1,1,0,0,0|1,0,1]=4 2305 B11R0.2 CCCCNNC(=O)CC(C)C 22a_100025702795_100000210554 [0,1,1,0,0,0|2,0,0]=4 2306 B11R0.2 CCCCNNC(=O)C[C@@H](C)O 22a_100025702795_100011933948 [0,1,1,0,0,0|2,0,0]=4 2307 B11R0.2 CCCCOCC(=O)CC(C)C 1458a_100000210554_100011995733 [0,1,1,0,0,0|2,0,0]=4 2308 B11R0.2 CCCCOCC(=O)CC(C)C 1458a_100000757543_100000210624 [0,1,1,0,0,0|2,0,0]=4 2309 B11R0.2 CCCCOCC(=O)CC(C)O 1458a_100000757543_100011218427 [0,1,1,0,0,0|2,0,0]=4 2310 B11R0.2 CCCCOCC(=O)C[C@@H](C)O 1458a_100011933948_100011995733 [0,1,1,0,0,0|2,0,0]=4 2311 B11R0.2 CCCCSCC(=O)CC(C)C 1458a_100000191162_100000210624 [0,1,1,0,0,0|2,0,0]=4 2312 B11R0.2 CCCCSCC(=O)CC(C)O 1458a_100000191162_100011218427 [0,1,1,0,0,0|2,0,0]=4 2313 B11R0.2 CCCOCCC(=O)CC(C)C 1458a_100000210554_100011215938 [0,1,1,0,0,0|2,0,0]=4 2314 B11R0.2 CCCOCCC(=O)C[C@@H](C)O 1458a_100011933948_100011215938 [0,1,1,0,0,0|2,0,0]=4 2315 B11R0.2 CCCSCOC(=O)OC(C)C 62a_100000003507_100000210303 [0,1,1,0,0,0|2,0,0]=4 2316 B11R0.2 CCCSCOC(=O)OC(C)C 62a_100000210303_100000003507 [0,1,1,0,0,0|2,0,0]=4 2317 B11R0.2 CCOCCCC(=O)CC(C)C 1458a_100000210554_100012232248 [0,1,1,0,0,0|2,0,0]=4 2318 B11R0.2 CCOCCCC(=O)C[C@@H](C)O 1458a_100011933948_100012232248 [0,1,1,0,0,0|2,0,0]=4 2319 B11R0.2 CCOCCNC(=O)CC(C)C 11a_100011200944_100000210554 [0,1,1,0,0,0|2,0,0]=4 2320 B11R0.2 CCOCCNC(=O)CC(C)C 1626a_102516460346_100000210554 [0,1,1,0,0,0|2,0,0]=4 2321 B11R0.2 CCOCCNC(=O)CC(C)C 240690a_100011200944_100000210554 [0,1,1,0,0,0|2,0,0]=4 2322 B11R0.2 CCOCCNC(=O)CC(C)C 527a_100011200944_100000210554 [0,1,1,0,0,0|2,0,0]=4 2323 B11R0.2 CCOCCNC(=O)C[C@@H](C)O 240690a_100011200944_100011933948 [0,1,1,0,0,0|2,0,0]=4 2324 B11R0.2 CCOCCOC(=O)CC(=O)C 1458a_100000070787_200000101388 [0,1,1,0,0,0|1,0,1]=4 2325 B11R0.2 CCOCCOC(=O)CC(=O)C 34a_100121572206_100000102702 [0,1,1,0,0,0|1,0,1]=4 2326 B11R0.2 CCOCCOC(=O)CN(C)C 2230a_100102631434_200000101388 [0,1,1,0,0,0|2,0,0]=4 2327 B11R0.2 CCOCCOC(=O)CN(C)C 269982a_100102631434_200000101388 [0,1,1,0,0,0|2,0,0]=4 2328 B11R0.2 CCSCCNC(=O)CC(C)C 11a_100000106463_100000210554 [0,1,1,0,0,0|2,0,0]=4 2329 B11R0.2 CCSCCNC(=O)CC(C)C 1626a_100000106463_100000210554 [0,1,1,0,0,0|2,0,0]=4 2330 B11R0.2 CCSCCNC(=O)CC(C)C 240690a_100000106463_100000210554 [0,1,1,0,0,0|2,0,0]=4 2331 B11R0.2 CCSCCNC(=O)CC(C)C 527a_100000106463_100000210554 [0,1,1,0,0,0|2,0,0]=4 2332 B11R0.2 CCSCCNC(=O)C[C@@H](C)O 240690a_100000106463_100011933948 [0,1,1,0,0,0|2,0,0]=4 2333 B11R0.2 CCSCCOC(=O)CC(=O)C 62a_100000102702_100000210202 [0,1,1,0,0,0|1,0,1]=4 2334 B11R0.2 CCSCCOC(=O)CC(=O)C 62a_100000210202_100000102702 [0,1,1,0,0,0|1,0,1]=4 2335 B11R0.2 COCCCCC(=O)CC(C)C 1458a_100000210554_100000755781 [0,1,1,0,0,0|2,0,0]=4 2336 B11R0.2 COCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000755781 [0,1,1,0,0,0|2,0,0]=4 2337 B11R0.2 COCCCNC(=O)CC(C)C 1626a_100150723488_100000210554 [0,1,1,0,0,0|2,0,0]=4 2338 B11R0.2 COCCCNC(=O)CC(C)C 240690a_100150723488_100000210554 [0,1,1,0,0,0|2,0,0]=4 2339 B11R0.2 COCCCNC(=O)CC(C)C 527a_100150723488_100000210554 [0,1,1,0,0,0|2,0,0]=4 2340 B11R0.2 COCCCNC(=O)C[C@@H](C)O 240690a_100150723488_100011933948 [0,1,1,0,0,0|2,0,0]=4 2341 B11R0.2 CSCCCNC(=O)CC(C)C 11a_100000749238_100000210554 [0,1,1,0,0,0|2,0,0]=4 2342 B11R0.2 CSCCCNC(=O)CC(C)C 1626a_100000749238_100000210554 [0,1,1,0,0,0|2,0,0]=4 2343 B11R0.2 CSCCCNC(=O)CC(C)C 240690a_100000749238_100000210554 [0,1,1,0,0,0|2,0,0]=4 2344 B11R0.2 CSCCCNC(=O)CC(C)C 527a_100000749238_100000210554 [0,1,1,0,0,0|2,0,0]=4 2345 B11R0.2 CSCCCNC(=O)C[C@@H](C)O 240690a_100000749238_100011933948 [0,1,1,0,0,0|2,0,0]=4 2346 B11R0.2 C[C@@H](O)CC(=O)CCCCCF 1458a_100011933948_100000729378 [0,1,1,0,0,0|2,0,0]=4 2347 B11R0.2 C[C@@H](O)CC(=O)CCCCCO 1458a_100011933948_100000746330 [0,1,1,0,0,0|2,0,0]=4 2348 B11R0.2 C[C@@H](O)CC(=O)NCCCCO 240690a_100000750430_100011933948 [0,1,1,0,0,0|2,0,0]=4 2349 B11R0.4 C#CCCCCCC(=O)CCC 1458a_100000211992_100012094781 [0,1,1,0,0,0|1,0,1]=4 2350 B11R0.4 C#CCCCCCC(=O)CCC 1458a_100000694772_100000210303 [0,1,1,0,0,0|1,0,1]=4 2351 B11R0.4 C#CCCCCNC(=O)CCC 11a_100000706060_100000211992 [0,1,1,0,0,0|1,0,1]=4 2352 B11R0.4 C#CCCCCNC(=O)CCC 1626a_100000706060_100000211992 [0,1,1,0,0,0|1,0,1]=4 2353 B11R0.4 C#CCCCCNC(=O)CCC 240690a_100000706060_100000211992 [0,1,1,0,0,0|1,0,1]=4 2354 B11R0.4 C#CCCCCNC(=O)CCC 527a_100000706060_100000211992 [0,1,1,0,0,0|1,0,1]=4 2355 B11R0.4 C#CCCCOCC(=O)CCC 7a_100000215630_100000747444 [0,1,1,0,0,0|0,0,2]=4 2356 B11R0.4 C#CCCNCOC(=O)CCC 34a_100000755551_100000034017 [0,1,1,0,0,0|0,0,2]=4 2357 B11R0.4 C#CCCOCOC(=O)CCC 34a_100011215631_100000034017 [0,1,1,0,0,0|0,0,2]=4 2358 B11R0.4 C#CCCSCOC(=O)CCC 62a_100000688953_100000034017 [0,1,1,0,0,0|0,0,2]=4 2359 B11R0.4 C/C=C/COCOC(=O)CCC 34a_100016270725_100000034017 [0,1,1,0,0,0|0,0,2]=4 2360 B11R0.4 C/C=C/CSCOC(=O)CCC 62a_100102629194_100000034017 [0,1,1,0,0,0|0,0,2]=4 2361 B11R0.4 C=CCCCCCC(=O)CCC 1458a_100000211992_100000700193 [0,1,1,0,0,0|1,0,1]=4 2362 B11R0.4 C=CCCCCCC(=O)CCC 1458a_100011934241_100000210303 [0,1,1,0,0,0|1,0,1]=4 2363 B11R0.4 C=CCCCCNC(=O)CCC 11a_100000703577_100000211992 [0,1,1,0,0,0|1,0,1]=4 2364 B11R0.4 C=CCCCCNC(=O)CCC 1626a_100000703577_100000211992 [0,1,1,0,0,0|1,0,1]=4 2365 B11R0.4 C=CCCCCNC(=O)CCC 240690a_100000703577_100000211992 [0,1,1,0,0,0|1,0,1]=4 2366 B11R0.4 C=CCCCCNC(=O)CCC 527a_100000703577_100000211992 [0,1,1,0,0,0|1,0,1]=4 2367 B11R0.4 C=CCCCOCC(=O)CCC 7a_100000758997_100000747444 [0,1,1,0,0,0|0,0,2]=4 2368 B11R0.4 C=CCCNCOC(=O)CCC 2230a_100015191253_100000034017 [0,1,1,0,0,0|0,0,2]=4 2369 B11R0.4 C=CCCOCOC(=O)CCC 34a_100011205117_100000034017 [0,1,1,0,0,0|0,0,2]=4 2370 B11R0.4 C=CCCSCOC(=O)CCC 62a_100000754431_100000034017 [0,1,1,0,0,0|0,0,2]=4 2371 B11R0.4 CC#CCNCOC(=O)CCC 2230a_100000685387_100000034017 [0,1,1,0,0,0|0,0,2]=4 2372 B11R0.4 CC#CCNCOC(=O)CCC 34a_100000685387_100000034017 [0,1,1,0,0,0|0,0,2]=4 2373 B11R0.4 CC#CCOCOC(=O)CCC 34a_100000761923_100000034017 [0,1,1,0,0,0|0,0,2]=4 2374 B11R0.4 CC#CCSCOC(=O)CCC 62a_100000748600_100000034017 [0,1,1,0,0,0|0,0,2]=4 2375 B11R0.4 CC=CCSCOC(=O)CCC 62a_100000070051_100000034017 [0,1,1,0,0,0|0,0,2]=4 2376 B11R0.4 CCCC(=O)CCCCCC#N 1458a_100000211992_100009813376 [0,1,1,0,0,0|1,0,1]=4 2377 B11R0.4 CCCC(=O)CCCCCCF 1458a_100000211992_100015922095 [0,1,1,0,0,0|1,0,0]=3 2378 B11R0.4 CCCC(=O)CCCCCCO 1458a_100000211992_100000766143 [0,1,1,0,0,0|1,0,0]=3 2379 B11R0.4 CCCC(=O)CCCCCCO 1458a_100011996774_100000210303 [0,1,1,0,0,0|1,0,0]=3 2380 B11R0.4 CCCC(=O)CCCCCOC 1458a_100011935119_100000210303 [0,1,1,0,0,0|1,0,0]=3 2381 B11R0.4 CCCC(=O)CCOCCOC 1458a_100000211992_100000695917 [0,1,1,0,0,0|2,0,0]=4 2382 B11R0.4 CCCC(=O)CCOCCOC 1458a_100000745395_100000210303 [0,1,1,0,0,0|2,0,0]=4 2383 B11R0.4 CCCC(=O)CNCCCCO 2230a_100000750430_100000747444 [0,1,1,0,0,0|2,0,0]=4 2384 B11R0.4 CCCC(=O)CNCCCSC 2230a_100000749238_100000747444 [0,1,1,0,0,0|2,0,0]=4 2385 B11R0.4 CCCC(=O)CNCCOCC 2230a_102516460346_100000747444 [0,1,1,0,0,0|2,0,0]=4 2386 B11R0.4 CCCC(=O)CNCCSCC 2230a_100000106463_100000747444 [0,1,1,0,0,0|2,0,0]=4 2387 B11R0.4 CCCC(=O)COCCCCCl 7a_100000210776_100000747444 [0,1,1,0,0,0|1,0,0]=3 2388 B11R0.4 CCCC(=O)COCCCCF 7a_100011995726_100000747444 [0,1,1,0,0,0|1,0,0]=3 2389 B11R0.4 CCCC(=O)COCCCSC 7a_100000690336_100000747444 [0,1,1,0,0,0|1,0,0]=3 2390 B11R0.4 CCCC(=O)COCCOCC 7a_100000210136_100000747444 [0,1,1,0,0,0|1,0,0]=3 2391 B11R0.4 CCCC(=O)COCCSCC 7a_100000212035_100000747444 [0,1,1,0,0,0|1,0,0]=3 2392 B11R0.4 CCCC(=O)CSCCCCF 62a_100000729493_100000747444 [0,1,1,0,0,0|1,1,0]=4 2393 B11R0.4 CCCC(=O)CSCCCCF 62a_100000747444_100000729493 [0,1,1,0,0,0|1,1,0]=4 2394 B11R0.4 CCCC(=O)CSCCCCO 62a_100000210776_100000747444 [0,1,1,0,0,0|1,1,0]=4 2395 B11R0.4 CCCC(=O)CSCCCCO 62a_100000747444_100000210776 [0,1,1,0,0,0|1,1,0]=4 2396 B11R0.4 CCCC(=O)CSCCCOC 62a_100000709357_100000747444 [0,1,1,0,0,0|1,1,0]=4 2397 B11R0.4 CCCC(=O)CSCCCOC 62a_100000747444_100000709357 [0,1,1,0,0,0|1,1,0]=4 2398 B11R0.4 CCCC(=O)CSCCOCC 62a_100000210147_100000747444 [0,1,1,0,0,0|1,1,0]=4 2399 B11R0.4 CCCC(=O)CSCCOCC 62a_100000747444_100011215890 [0,1,1,0,0,0|1,1,0]=4 2400 B11R0.4 CCCC(=O)CSCCSCC 62a_100000747444_100000757381 [0,1,1,0,0,0|1,1,0]=4 2401 B11R0.4 CCCC(=O)CSCCSCC 62a_100000757381_100000747444 [0,1,1,0,0,0|1,1,0]=4 2402 B11R0.4 CCCC(=O)NCCCCC#N 11a_100000751965_100000211992 [0,1,1,0,0,0|1,0,1]=4 2403 B11R0.4 CCCC(=O)NCCCCC#N 1626a_100000751965_100000211992 [0,1,1,0,0,0|1,0,1]=4 2404 B11R0.4 CCCC(=O)NCCCCC#N 240690a_100000751965_100000211992 [0,1,1,0,0,0|1,0,1]=4 2405 B11R0.4 CCCC(=O)NCCCCC#N 527a_100000751965_100000211992 [0,1,1,0,0,0|1,0,1]=4 2406 B11R0.4 CCCC(=O)NCCCCCO 240690a_100000762737_100000211992 [0,1,1,0,0,0|1,0,0]=3 2407 B11R0.4 CCCC(=O)NCCCOCC 11a_100000210961_100000211992 [0,1,1,0,0,0|1,0,0]=3 2408 B11R0.4 CCCC(=O)NCCCOCC 1626a_100000210961_100000211992 [0,1,1,0,0,0|1,0,0]=3 2409 B11R0.4 CCCC(=O)NCCCOCC 240690a_100000210961_100000211992 [0,1,1,0,0,0|1,0,0]=3 2410 B11R0.4 CCCC(=O)NCCCOCC 527a_100000210961_100000211992 [0,1,1,0,0,0|1,0,0]=3 2411 B11R0.4 CCCC(=O)NCCOCCO 240690a_100000211614_100000211992 [0,1,1,0,0,0|2,0,0]=4 2412 B11R0.4 CCCC(=O)NCCSCCO 240690a_100011219999_100000211992 [0,1,1,0,0,0|2,0,0]=4 2413 B11R0.4 CCCC(=O)NCCSCCO 527a_100011219999_100000211992 [0,1,1,0,0,0|2,0,0]=4 2414 B11R0.4 CCCC(=O)NNCCCOC 22a_100025702787_100000211992 [0,1,1,0,0,0|2,0,0]=4 2415 B11R0.4 CCCC(=O)NNCCOCC 22a_100000732670_100000211992 [0,1,1,0,0,0|2,0,0]=4 2416 B11R0.4 CCCC(=O)OCNCCCF 2230a_100015189416_100000034017 [0,1,1,0,0,0|1,0,0]=3 2417 B11R0.4 CCCC(=O)OCNCCCF 34a_100015189416_100000034017 [0,1,1,0,0,0|1,0,0]=3 2418 B11R0.4 CCCC(=O)OCNCCOC 2230a_100000209980_100000034017 [0,1,1,0,0,0|1,0,0]=3 2419 B11R0.4 CCCC(=O)OCNCCSC 2230a_100020590264_100000034017 [0,1,1,0,0,0|1,0,0]=3 2420 B11R0.4 CCCC(=O)OCOCCCBr 34a_100011217188_100000034017 [0,1,1,0,0,0|1,0,0]=3 2421 B11R0.4 CCCC(=O)OCOCCCCl 34a_100000230001_100000034017 [0,1,1,0,0,0|1,0,0]=3 2422 B11R0.4 CCCC(=O)OCOCCCF 34a_100000759539_100000034017 [0,1,1,0,0,0|1,0,0]=3 2423 B11R0.4 CCCC(=O)OCOCCCN 34a_100000182051_100000034017 [0,1,1,0,0,0|1,0,0]=3 2424 B11R0.4 CCCC(=O)OCOCCOC 34a_100000210237_100000034017 [0,1,1,0,0,0|1,0,0]=3 2425 B11R0.4 CCCC(=O)OCOCCON 34a_100000700252_100000034017 [0,1,1,0,0,0|2,0,0]=4 2426 B11R0.4 CCCC(=O)OCOCCSC 34a_100000230434_100000034017 [0,1,1,0,0,0|1,0,0]=3 2427 B11R0.4 CCCC(=O)OCSCCC#N 62a_100011215226_100000034017 [0,1,1,0,0,0|1,0,1]=4 2428 B11R0.4 CCCC(=O)OCSCCCF 62a_100011934791_100000034017 [0,1,1,0,0,0|1,0,0]=3 2429 B11R0.4 CCCC(=O)OCSCCCO 62a_100011215043_100000034017 [0,1,1,0,0,0|1,0,0]=3 2430 B11R0.4 CCCC(=O)OCSCCOC 62a_100000233755_100000034017 [0,1,1,0,0,0|1,0,0]=3 2431 B11R0.4 CCCC(=O)OCSCCSC 62a_100000212216_100000034017 [0,1,1,0,0,0|1,0,0]=3 2432 B11R0.4 CCCC(=O)OCSCOCC 62a_100000739092_100000034017 [0,1,1,0,0,0|1,0,0]=3 2433 B11R0.4 CCCC(C)OCCCCCBr 34a_100000746331_100000766640 [0,1,1,0,0,0|1,0,1]=4 2434 B11R0.4 CCCC(C)OCCCCCBr 7a_100000746331_100000766640 [0,1,1,0,0,0|1,0,1]=4 2435 B11R0.4 CCCC(C)OCCCCCCl 34a_100000746330_100000766640 [0,1,1,0,0,0|1,0,1]=4 2436 B11R0.4 CCCC(C)OCCCCCCl 7a_100000746330_100000766640 [0,1,1,0,0,0|1,0,1]=4 2437 B11R0.4 CCCC(C)OCCCCCF 34a_100000764384_100000729378 [0,1,1,0,0,0|1,0,1]=4 2438 B11R0.4 CCCC(C)OCCCCCF 7a_100000764384_100000729378 [0,1,1,0,0,0|1,0,1]=4 2439 B11R0.4 CCCC(C)OCCCCCI 34a_200012148887_100000766640 [0,1,1,0,0,0|1,0,1]=4 2440 B11R0.4 CCCC(C)OCCCCCI 7a_200012148887_100000766640 [0,1,1,0,0,0|1,0,1]=4 2441 B11R0.4 CCCC(C)OCCCCCN 34a_100000762737_100000766640 [0,1,1,0,0,0|1,0,1]=4 2442 B11R0.4 CCCC(C)OCCCCCO 34a_100000764384_100000746330 [0,1,1,0,0,0|1,0,1]=4 2443 B11R0.4 CCCC(C)OCCCCCO 7a_100000764384_100000746330 [0,1,1,0,0,0|1,0,1]=4 2444 B11R0.4 CCCC(C)OCCCCOC 34a_100000740925_100000766640 [0,1,1,0,0,0|1,0,1]=4 2445 B11R0.4 CCCC(C)OCCCCOC 34a_100000764384_100000755781 [0,1,1,0,0,0|1,0,1]=4 2446 B11R0.4 CCCC(C)OCCCCOC 7a_100000764384_100000730899 [0,1,1,0,0,0|1,0,1]=4 2447 B11R0.4 CCCC(C)OCCCCSC 34a_100011217163_100000766640 [0,1,1,0,0,0|1,0,1]=4 2448 B11R0.4 CCCC(C)OCCCCSC 7a_100011217163_100000766640 [0,1,1,0,0,0|1,0,1]=4 2449 B11R0.4 CCCC(C)OCCCOCC 34a_100000757476_100000766640 [0,1,1,0,0,0|1,0,1]=4 2450 B11R0.4 CCCC(C)OCCCOCC 34a_100000764384_100012232248 [0,1,1,0,0,0|1,0,1]=4 2451 B11R0.4 CCCC(C)OCCCOCC 7a_100000757476_100000766640 [0,1,1,0,0,0|1,0,1]=4 2452 B11R0.4 CCCC(C)OCCCOCC 7a_100000764384_100012232248 [0,1,1,0,0,0|1,0,1]=4 2453 B11R0.4 CCCC(C)OCCCSCC 34a_100011216438_100000766640 [0,1,1,0,0,0|1,0,1]=4 2454 B11R0.4 CCCC(C)OCCCSCC 7a_100011216438_100000766640 [0,1,1,0,0,0|1,0,1]=4 2455 B11R0.4 CCCC/C=C/CC(=O)CCC 1458a_200016282684_100000210303 [0,1,1,0,0,0|1,0,1]=4 2456 B11R0.4 CCCCC=NNC(=O)CCC 4a_100000189770_100000210104 [0,1,1,0,0,0|1,0,1]=4 2457 B11R0.4 CCCCCC#CC(=O)CCC 1458a_100011215388_100000210303 [0,1,1,0,0,0|1,0,0]=3 2458 B11R0.4 CCCCCC#CC(=O)CCF 1458a_100011215388_100011217306 [0,1,1,0,0,0|2,0,0]=4 2459 B11R0.4 CCCCCC#CC(=O)CCO 1458a_100011215388_100000211926 [0,1,1,0,0,0|2,0,0]=4 2460 B11R0.4 CCCCCC#CC(=O)NCC 240690a_100015525214_100011215388 [0,1,1,0,0,0|2,0,0]=4 2461 B11R0.4 CCCCCC=CC(=O)CCC 1458a_100016263427_100000210303 [0,1,1,0,0,0|1,0,0]=3 2462 B11R0.4 CCCCCC=CC(=O)CCF 1458a_100016263427_100011217306 [0,1,1,0,0,0|2,0,0]=4 2463 B11R0.4 CCCCCC=CC(=O)CCO 1458a_100016263427_100000211926 [0,1,1,0,0,0|2,0,0]=4 2464 B11R0.4 CCCCCC=CC(=O)NCC 11a_100015525214_100016263427 [0,1,1,0,0,0|2,0,0]=4 2465 B11R0.4 CCCCCC=CC(=O)NCC 240690a_100015525214_100016263427 [0,1,1,0,0,0|2,0,0]=4 2466 B11R0.4 CCCCCCCC(=O)CCC 1458a_100000211969_100000210303 [0,1,1,0,0,0|1,0,0]=3 2467 B11R0.4 CCCCCCCC(=O)CCC 1458a_100000211992_100000210614 [0,1,1,0,0,0|1,0,0]=3 2468 B11R0.4 CCCCCCCC(=O)CCF 1458a_100000211969_100011217306 [0,1,1,0,0,0|2,0,0]=4 2469 B11R0.4 CCCCCCCC(=O)CCO 1458a_100000211969_100000211926 [0,1,1,0,0,0|2,0,0]=4 2470 B11R0.4 CCCCCCCC(=O)CCO 1458a_100011216618_100000210614 [0,1,1,0,0,0|2,0,0]=4 2471 B11R0.4 CCCCCCCC(=O)COC 1458a_100000210968_100000210614 [0,1,1,0,0,0|2,0,0]=4 2472 B11R0.4 CCCCCCCC(=O)CSC 1458a_100000184570_100000210614 [0,1,1,0,0,0|2,0,0]=4 2473 B11R0.4 CCCCCCCC(=O)NCC 11a_100015525214_100000211969 [0,1,1,0,0,0|2,0,0]=4 2474 B11R0.4 CCCCCCCC(=O)NCC 240690a_100015525214_100000211969 [0,1,1,0,0,0|2,0,0]=4 2475 B11R0.4 CCCCCCCC(=O)NCC 527a_100015525214_100000211969 [0,1,1,0,0,0|2,0,0]=4 2476 B11R0.4 CCCCCCNC(=O)CCC 11a_100000210581_100000211992 [0,1,1,0,0,0|1,0,0]=3 2477 B11R0.4 CCCCCCNC(=O)CCC 1626a_100000210581_100000211992 [0,1,1,0,0,0|1,0,0]=3 2478 B11R0.4 CCCCCCNC(=O)CCC 240690a_100000210581_100000211992 [0,1,1,0,0,0|1,0,0]=3 2479 B11R0.4 CCCCCCNC(=O)CCC 527a_100000210581_100000211992 [0,1,1,0,0,0|1,0,0]=3 2480 B11R0.4 CCCCCCNC(=O)CCO 240690a_100000210581_100011216618 [0,1,1,0,0,0|2,0,0]=4 2481 B11R0.4 CCCCCCNC(=O)CNC 2230a_106832991635_100000230325 [0,1,1,0,0,0|2,0,0]=4 2482 B11R0.4 CCCCCCNC(=O)CNC 34a_100102657272_100000230325 [0,1,1,0,0,0|2,0,0]=4 2483 B11R0.4 CCCCCCNC(=O)CNC 7a_106832991635_100000230325 [0,1,1,0,0,0|2,0,0]=4 2484 B11R0.4 CCCCCCNC(=O)COC 11a_100000210581_100000210968 [0,1,1,0,0,0|2,0,0]=4 2485 B11R0.4 CCCCCCNC(=O)COC 1626a_100000210581_100000210968 [0,1,1,0,0,0|2,0,0]=4 2486 B11R0.4 CCCCCCNC(=O)COC 240690a_100000210581_100000210968 [0,1,1,0,0,0|2,0,0]=4 2487 B11R0.4 CCCCCCNC(=O)COC 34a_100138415774_100000230325 [0,1,1,0,0,0|2,0,0]=4 2488 B11R0.4 CCCCCCNC(=O)COC 527a_100000210581_100000210968 [0,1,1,0,0,0|2,0,0]=4 2489 B11R0.4 CCCCCCNC(=O)CSC 11a_100000210581_100000184570 [0,1,1,0,0,0|2,0,0]=4 2490 B11R0.4 CCCCCCNC(=O)CSC 1626a_100000210581_100000184570 [0,1,1,0,0,0|2,0,0]=4 2491 B11R0.4 CCCCCCNC(=O)CSC 240690a_100000210581_100000184570 [0,1,1,0,0,0|2,0,0]=4 2492 B11R0.4 CCCCCCNC(=O)CSC 527a_100000210581_100000184570 [0,1,1,0,0,0|2,0,0]=4 2493 B11R0.4 CCCCCCNC(=O)CSC 62a_100000230325_200000210301 [0,1,1,0,0,0|2,0,0]=4 2494 B11R0.4 CCCCCCNC(=O)CS[13CH3] 62a_100000230325_200025704644 [0,1,1,0,0,0|2,0,0]=4 2495 B11R0.4 CCCCCCNC(=O)NCC 2708a_100000210581_100015525214 [0,1,1,0,0,0|2,0,0]=4 2496 B11R0.4 CCCCCCNC(=O)NCC 2708a_100015525214_100000210581 [0,1,1,0,0,0|2,0,0]=4 2497 B11R0.4 CCCCCCNC(=O)NCC 273464a_100000210581_100015525214 [0,1,1,0,0,0|2,0,0]=4 2498 B11R0.4 CCCCCCNC(=O)NCC 273464a_100015525214_100000210581 [0,1,1,0,0,0|2,0,0]=4 2499 B11R0.4 CCCCCCNC(=O)NCC 512a_100000210581_100015525214 [0,1,1,0,0,0|2,0,0]=4 2500 B11R0.4 CCCCCCNC(=O)NCC 512a_100015525214_100000210581 [0,1,1,0,0,0|2,0,0]=4 2501 B11R0.4 CCCCCCOC(C)CCC 34a_100000210259_100000766640 [0,1,1,0,0,0|1,0,1]=4 2502 B11R0.4 CCCCCCOC(C)CCC 34a_100000764384_100000210314 [0,1,1,0,0,0|1,0,1]=4 2503 B11R0.4 CCCCCCOC(C)CCC 7a_100000210259_100000766640 [0,1,1,0,0,0|1,0,1]=4 2504 B11R0.4 CCCCCCOC(C)CCC 7a_100000764384_100000210314 [0,1,1,0,0,0|1,0,1]=4 2505 B11R0.4 CCCCCNCC(=O)CCC 2230a_100000209983_100000747444 [0,1,1,0,0,0|1,0,0]=3 2506 B11R0.4 CCCCCNCC(=O)NCC 2230a_100000209983_100000183381 [0,1,1,0,0,0|2,0,0]=4 2507 B11R0.4 CCCCCNCC(=O)NCC 2230a_100016988866_100000210326 [0,1,1,0,0,0|2,0,0]=4 2508 B11R0.4 CCCCCNCC(=O)OCC 2230a_100000209983_100000188475 [0,1,1,0,0,0|2,0,0]=4 2509 B11R0.4 CCCCCNN=C(C)CCC 4a_100000694160_100000211909 [0,1,1,0,0,0|2,0,0]=4 2510 B11R0.4 CCCCCNNC(=O)CCC 22a_100000694160_100000211992 [0,1,1,0,0,0|1,0,0]=3 2511 B11R0.4 CCCCCNNC(=O)CCO 22a_100000694160_100011216618 [0,1,1,0,0,0|2,0,0]=4 2512 B11R0.4 CCCCCNNC(=O)COC 22a_100000694160_100000210968 [0,1,1,0,0,0|2,0,0]=4 2513 B11R0.4 CCCCCNNC(=O)CSC 22a_100000694160_100000184570 [0,1,1,0,0,0|2,0,0]=4 2514 B11R0.4 CCCCCNNC(=O)NCC 273464a_100015525214_100000694160 [0,1,1,0,0,0|2,0,0]=4 2515 B11R0.4 CCCCCNNC(=O)NCC 512a_100000694160_100015525214 [0,1,1,0,0,0|2,0,0]=4 2516 B11R0.4 CCCCCNNC(=O)NCC 512a_100015525214_100000694160 [0,1,1,0,0,0|2,0,0]=4 2517 B11R0.4 CCCCCOCC(=O)CCC 7a_100000210253_100000747444 [0,1,1,0,0,0|0,0,0]=2 2518 B11R0.4 CCCCCOCC(=O)NCC 34a_100000210253_100000183381 [0,1,1,0,0,0|1,0,0]=3 2519 B11R0.4 CCCCCOCC(=O)NCC 7a_100000210253_100000183381 [0,1,1,0,0,0|1,0,0]=3 2520 B11R0.4 CCCCCOCC(=O)NCO 34a_100000210253_100000185155 [0,1,1,0,0,0|2,0,0]=4 2521 B11R0.4 CCCCCOCC(=O)NCO 7a_100000210253_100000185155 [0,1,1,0,0,0|2,0,0]=4 2522 B11R0.4 CCCCCOCC(=O)OCC 34a_100000210253_100000188475 [0,1,1,0,0,0|1,0,0]=3 2523 B11R0.4 CCCCCOCC(=O)OCC 7a_100000210253_100000188475 [0,1,1,0,0,0|1,0,0]=3 2524 B11R0.4 CCCCCOCC(C)CCC 34a_100000210253_100011216630 [0,1,1,0,0,0|1,0,1]=4 2525 B11R0.4 CCCCCOCC(C)CCC 34a_100000688023_100000718602 [0,1,1,0,0,0|1,0,1]=4 2526 B11R0.4 CCCCCOCC(C)CCC 7a_100000210253_100011216630 [0,1,1,0,0,0|1,0,1]=4 2527 B11R0.4 CCCCCOCC(C)CCC 7a_100000688023_100000210326 [0,1,1,0,0,0|1,0,1]=4 2528 B11R0.4 CCCCCOC[C@@H](N)CCC 34a_100000732646_100000718602 [0,1,1,0,0,0|1,0,1]=4 2529 B11R0.4 CCCCCSCC(=O)CCC 62a_100000210326_100000747444 [0,1,1,0,0,0|0,1,0]=3 2530 B11R0.4 CCCCCSCC(=O)CCC 62a_100000747444_100000210326 [0,1,1,0,0,0|0,1,0]=3 2531 B11R0.4 CCCCCSCC(=O)NCC 62a_100000183381_100000210326 [0,1,1,0,0,0|1,1,0]=4 2532 B11R0.4 CCCCCSCC(=O)NCC 62a_100000210326_100000183381 [0,1,1,0,0,0|1,1,0]=4 2533 B11R0.4 CCCCCSCC(=O)OCC 62a_100000188475_100000210326 [0,1,1,0,0,0|1,1,0]=4 2534 B11R0.4 CCCCCSCC(=O)OCC 62a_100000210326_100000188475 [0,1,1,0,0,0|1,1,0]=4 2535 B11R0.4 CCCCNCCC(=O)NCC 2230a_100000102301_100000737597 [0,1,1,0,0,0|2,0,0]=4 2536 B11R0.4 CCCCNCCC(=O)NCC 34a_100025743525_100000210210 [0,1,1,0,0,0|2,0,0]=4 2537 B11R0.4 CCCCNCCC(=O)NCC 7a_106832991798_100000737597 [0,1,1,0,0,0|2,0,0]=4 2538 B11R0.4 CCCCNCCC(=O)OCC 2230a_100000102301_100011206558 [0,1,1,0,0,0|2,0,0]=4 2539 B11R0.4 CCCCNCCC(=O)OCC 7a_106832991798_100011206558 [0,1,1,0,0,0|2,0,0]=4 2540 B11R0.4 CCCCNCOC(=O)CCC 2230a_100000102301_100000034017 [0,1,1,0,0,0|0,0,0]=2 2541 B11R0.4 CCCCOCCC(=O)CCC 1458a_100000211992_100000743108 [0,1,1,0,0,0|1,0,0]=3 2542 B11R0.4 CCCCOCCC(=O)CCO 1458a_100011216618_100000743108 [0,1,1,0,0,0|2,0,0]=4 2543 B11R0.4 CCCCOCCC(=O)COC 1458a_100000210968_100000743108 [0,1,1,0,0,0|2,0,0]=4 2544 B11R0.4 CCCCOCCC(=O)CSC 1458a_100000184570_100000743108 [0,1,1,0,0,0|2,0,0]=4 2545 B11R0.4 CCCCOCCC(=O)NCC 7a_100000210227_100000737597 [0,1,1,0,0,0|2,0,0]=4 2546 B11R0.4 CCCCOCCC(=O)OCC 34a_100000210227_100000765890 [0,1,1,0,0,0|2,0,0]=4 2547 B11R0.4 CCCCOCCC(=O)OCC 7a_100000210227_100011206558 [0,1,1,0,0,0|2,0,0]=4 2548 B11R0.4 CCCCOCOC(=O)CCC 34a_100000210227_100000034017 [0,1,1,0,0,0|0,0,0]=2 2549 B11R0.4 CCCCOCOC(C)CCC 34a_100000764384_100011995733 [0,1,1,0,0,0|1,0,1]=4 2550 B11R0.4 CCCCSCCC(=O)NCC 62a_100000210211_100000737597 [0,1,1,0,0,0|2,0,0]=4 2551 B11R0.4 CCCCSCCC(=O)NCC 62a_100000737597_100000210210 [0,1,1,0,0,0|2,0,0]=4 2552 B11R0.4 CCCCSCCC(=O)OCC 62a_100000210211_100000765890 [0,1,1,0,0,0|2,0,0]=4 2553 B11R0.4 CCCCSCCC(=O)OCC 62a_100000765890_100000210210 [0,1,1,0,0,0|2,0,0]=4 2554 B11R0.4 CCCCSCOC(=O)CCC 62a_100000210211_100000034017 [0,1,1,0,0,0|0,0,0]=2 2555 B11R0.4 CCCCSCOC(=O)OCC 62a_100000210211_100000075025 [0,1,1,0,0,0|1,0,0]=3 2556 B11R0.4 CCCOCCCC(=O)OCC 34a_100000210258_100009991533 [0,1,1,0,0,0|2,0,0]=4 2557 B11R0.4 CCCOCCCC(=O)OCC 7a_100012001163_100000210303 [0,1,1,0,0,0|2,0,0]=4 2558 B11R0.4 CCCOCCNC(=O)CCC 1626a_100161115042_100000211992 [0,1,1,0,0,0|1,0,0]=3 2559 B11R0.4 CCCOCCNC(=O)CCC 240690a_100161115042_100000211992 [0,1,1,0,0,0|1,0,0]=3 2560 B11R0.4 CCCOCCNC(=O)CCC 527a_100161115042_100000211992 [0,1,1,0,0,0|1,0,0]=3 2561 B11R0.4 CCCOCCNC(=O)CCO 240690a_100161115042_100011216618 [0,1,1,0,0,0|2,0,0]=4 2562 B11R0.4 CCCOCCNC(=O)COC 1626a_100161115042_100000210968 [0,1,1,0,0,0|2,0,0]=4 2563 B11R0.4 CCCOCCNC(=O)COC 240690a_100161115042_100000210968 [0,1,1,0,0,0|2,0,0]=4 2564 B11R0.4 CCCOCCNC(=O)COC 527a_100161115042_100000210968 [0,1,1,0,0,0|2,0,0]=4 2565 B11R0.4 CCCOCCNC(=O)CSC 1626a_100161115042_100000184570 [0,1,1,0,0,0|2,0,0]=4 2566 B11R0.4 CCCOCCNC(=O)CSC 240690a_100161115042_100000184570 [0,1,1,0,0,0|2,0,0]=4 2567 B11R0.4 CCCOCCNC(=O)CSC 527a_100161115042_100000184570 [0,1,1,0,0,0|2,0,0]=4 2568 B11R0.4 CCCOCCNC(=O)NCC 2708a_100015525214_100161115042 [0,1,1,0,0,0|2,0,0]=4 2569 B11R0.4 CCCOCCNC(=O)NCC 2708a_100161115042_100015525214 [0,1,1,0,0,0|2,0,0]=4 2570 B11R0.4 CCCOCCNC(=O)NCC 273464a_100015525214_100161115042 [0,1,1,0,0,0|2,0,0]=4 2571 B11R0.4 CCCOCCNC(=O)NCC 273464a_100161115042_100015525214 [0,1,1,0,0,0|2,0,0]=4 2572 B11R0.4 CCCOCCNC(=O)NCC 512a_100015525214_100161115042 [0,1,1,0,0,0|2,0,0]=4 2573 B11R0.4 CCCOCCNC(=O)NCC 512a_100161115042_100015525214 [0,1,1,0,0,0|2,0,0]=4 2574 B11R0.4 CCCOCCNC(=O)OCC 34a_100000158857_100000210303 [0,1,1,0,0,0|2,0,0]=4 2575 B11R0.4 CCCOCCOC(C)CCC 34a_100000752267_100000766640 [0,1,1,0,0,0|1,0,1]=4 2576 B11R0.4 CCCOCCOC(C)CCC 34a_100000764384_100011215938 [0,1,1,0,0,0|1,0,1]=4 2577 B11R0.4 CCCOCCOC(C)CCC 7a_100000752267_100000766640 [0,1,1,0,0,0|1,0,1]=4 2578 B11R0.4 CCCOCCOC(C)CCC 7a_100000764384_100011215938 [0,1,1,0,0,0|1,0,1]=4 2579 B11R0.4 CCCSCCCC(=O)OCC 62a_100000210303_100009991533 [0,1,1,0,0,0|2,0,0]=4 2580 B11R0.4 CCCSCCCC(=O)OCC 62a_100009991533_100000210303 [0,1,1,0,0,0|2,0,0]=4 2581 B11R0.4 CCCSCCNC(=O)CCC 11a_100020603323_100000211992 [0,1,1,0,0,0|1,0,0]=3 2582 B11R0.4 CCCSCCNC(=O)CCC 240690a_100020603323_100000211992 [0,1,1,0,0,0|1,0,0]=3 2583 B11R0.4 CCCSCCNC(=O)CCC 527a_100020603323_100000211992 [0,1,1,0,0,0|1,0,0]=3 2584 B11R0.4 CCCSCCNC(=O)CCO 240690a_100020603323_100011216618 [0,1,1,0,0,0|2,0,0]=4 2585 B11R0.4 CCCSCCNC(=O)COC 11a_100020603323_100000210968 [0,1,1,0,0,0|2,0,0]=4 2586 B11R0.4 CCCSCCNC(=O)COC 240690a_100020603323_100000210968 [0,1,1,0,0,0|2,0,0]=4 2587 B11R0.4 CCCSCCNC(=O)COC 527a_100020603323_100000210968 [0,1,1,0,0,0|2,0,0]=4 2588 B11R0.4 CCCSCCNC(=O)CSC 11a_100020603323_100000184570 [0,1,1,0,0,0|2,0,0]=4 2589 B11R0.4 CCCSCCNC(=O)CSC 240690a_100020603323_100000184570 [0,1,1,0,0,0|2,0,0]=4 2590 B11R0.4 CCCSCCNC(=O)CSC 527a_100020603323_100000184570 [0,1,1,0,0,0|2,0,0]=4 2591 B11R0.4 CCCSCCNC(=O)NCC 2708a_100015525214_100020603323 [0,1,1,0,0,0|2,0,0]=4 2592 B11R0.4 CCCSCCNC(=O)NCC 2708a_100020603323_100015525214 [0,1,1,0,0,0|2,0,0]=4 2593 B11R0.4 CCCSCCNC(=O)NCC 273464a_100015525214_100020603323 [0,1,1,0,0,0|2,0,0]=4 2594 B11R0.4 CCCSCCNC(=O)NCC 273464a_100020603323_100015525214 [0,1,1,0,0,0|2,0,0]=4 2595 B11R0.4 CCCSCCNC(=O)NCC 512a_100015525214_100020603323 [0,1,1,0,0,0|2,0,0]=4 2596 B11R0.4 CCCSCCNC(=O)NCC 512a_100020603323_100015525214 [0,1,1,0,0,0|2,0,0]=4 2597 B11R0.4 CCCSCCNC(=O)OCC 62a_100000210303_200011445536 [0,1,1,0,0,0|2,0,0]=4 2598 B11R0.4 CCCSCCOC(C)CCC 34a_200000230433_100000766640 [0,1,1,0,0,0|1,0,1]=4 2599 B11R0.4 CCCSCCOC(C)CCC 7a_200000230433_100000766640 [0,1,1,0,0,0|1,0,1]=4 2600 B11R0.4 CCNC(=O)CCCCCCO 240690a_100015525214_100011996774 [0,1,1,0,0,0|2,0,0]=4 2601 B11R0.4 CCNC(=O)CCCCCOC 11a_100015525214_100011935119 [0,1,1,0,0,0|2,0,0]=4 2602 B11R0.4 CCNC(=O)CCCCCOC 240690a_100015525214_100011935119 [0,1,1,0,0,0|2,0,0]=4 2603 B11R0.4 CCNC(=O)CCCCCOC 527a_100015525214_100011935119 [0,1,1,0,0,0|2,0,0]=4 2604 B11R0.4 CCNC(=O)COCCCCBr 34a_100011216708_100000183381 [0,1,1,0,0,0|2,0,0]=4 2605 B11R0.4 CCNC(=O)COCCCCCl 34a_100000210776_100000183381 [0,1,1,0,0,0|2,0,0]=4 2606 B11R0.4 CCNC(=O)COCCCCCl 7a_100000210776_100000183381 [0,1,1,0,0,0|2,0,0]=4 2607 B11R0.4 CCNC(=O)COCCCCF 34a_100011995726_100000183381 [0,1,1,0,0,0|2,0,0]=4 2608 B11R0.4 CCNC(=O)COCCCCF 7a_100011995726_100000183381 [0,1,1,0,0,0|2,0,0]=4 2609 B11R0.4 CCNC(=O)COCCCCI 34a_200012148704_100000183381 [0,1,1,0,0,0|2,0,0]=4 2610 B11R0.4 CCNC(=O)COCCCCN 34a_100000750430_100000183381 [0,1,1,0,0,0|2,0,0]=4 2611 B11R0.4 CCNC(=O)COCCCNC 34a_100000213112_100000183381 [0,1,1,0,0,0|2,0,0]=4 2612 B11R0.4 CCNC(=O)COCCCOC 34a_100000740835_100000183381 [0,1,1,0,0,0|2,0,0]=4 2613 B11R0.4 CCNC(=O)COCCCSC 34a_100000690336_100000183381 [0,1,1,0,0,0|2,0,0]=4 2614 B11R0.4 CCNC(=O)COCCCSC 7a_100000690336_100000183381 [0,1,1,0,0,0|2,0,0]=4 2615 B11R0.4 CCNC(=O)COCCOCC 34a_100000210136_100000183381 [0,1,1,0,0,0|2,0,0]=4 2616 B11R0.4 CCNC(=O)COCCOCC 7a_100000210136_100000183381 [0,1,1,0,0,0|2,0,0]=4 2617 B11R0.4 CCNC(=O)COCCSCC 34a_100000212035_100000183381 [0,1,1,0,0,0|2,0,0]=4 2618 B11R0.4 CCNC(=O)COCCSCC 7a_100000212035_100000183381 [0,1,1,0,0,0|2,0,0]=4 2619 B11R0.4 CCNC(=O)NCCCCCO 2708a_100015525214_100000762737 [0,1,1,0,0,0|2,0,0]=4 2620 B11R0.4 CCNC(=O)NCCCCCO 273464a_100000762737_100015525214 [0,1,1,0,0,0|2,0,0]=4 2621 B11R0.4 CCNC(=O)NCCCCCO 273464a_100015525214_100000762737 [0,1,1,0,0,0|2,0,0]=4 2622 B11R0.4 CCNC(=O)NCCCCCO 512a_100000762737_100015525214 [0,1,1,0,0,0|2,0,0]=4 2623 B11R0.4 CCNC(=O)NCCCCCO 512a_100015525214_100000762737 [0,1,1,0,0,0|2,0,0]=4 2624 B11R0.4 CCNC(=O)NCCCOCC 2708a_100000210961_100015525214 [0,1,1,0,0,0|2,0,0]=4 2625 B11R0.4 CCNC(=O)NCCCOCC 2708a_100015525214_100000210961 [0,1,1,0,0,0|2,0,0]=4 2626 B11R0.4 CCNC(=O)NCCCOCC 273464a_100000210961_100015525214 [0,1,1,0,0,0|2,0,0]=4 2627 B11R0.4 CCNC(=O)NCCCOCC 273464a_100015525214_100000210961 [0,1,1,0,0,0|2,0,0]=4 2628 B11R0.4 CCNC(=O)NCCCOCC 512a_100000210961_100015525214 [0,1,1,0,0,0|2,0,0]=4 2629 B11R0.4 CCNC(=O)NCCCOCC 512a_100015525214_100000210961 [0,1,1,0,0,0|2,0,0]=4 2630 B11R0.4 CCNCCCCC(=O)OCC 2230a_100015525214_100000750268 [0,1,1,0,0,0|2,0,0]=4 2631 B11R0.4 CCNCCOCC(=O)OCC 2230a_100015525214_100000088970 [0,1,1,0,0,0|2,0,0]=4 2632 B11R0.4 CCOC(=O)CCCCCNC 2230a_106832991635_100000755133 [0,1,1,0,0,0|2,0,0]=4 2633 B11R0.4 CCOC(=O)CCCCCNC 34a_100102657272_100000755133 [0,1,1,0,0,0|2,0,0]=4 2634 B11R0.4 CCOC(=O)CCCCCNC 7a_106832991635_100000755133 [0,1,1,0,0,0|2,0,0]=4 2635 B11R0.4 CCOC(=O)CCCCCOC 34a_100138415774_100000755133 [0,1,1,0,0,0|2,0,0]=4 2636 B11R0.4 CCOC(=O)CCCCCOC 7a_100011214988_200000210301 [0,1,1,0,0,0|2,0,0]=4 2637 B11R0.4 CCOC(=O)CCCCCO[13CH3] 7a_100011214988_200025704644 [0,1,1,0,0,0|2,0,0]=4 2638 B11R0.4 CCOC(=O)CCCCCSC 62a_100000755133_200000210301 [0,1,1,0,0,0|2,0,0]=4 2639 B11R0.4 CCOC(=O)CCCCCSC 62a_200000210301_100000755133 [0,1,1,0,0,0|2,0,0]=4 2640 B11R0.4 CCOC(=O)CCCCCS[13CH3] 62a_100000755133_200025704644 [0,1,1,0,0,0|2,0,0]=4 2641 B11R0.4 CCOC(=O)CCCCCS[13CH3] 62a_200025704644_100000755133 [0,1,1,0,0,0|2,0,0]=4 2642 B11R0.4 CCOC(=O)CCCCSCC 62a_100000210202_100000750268 [0,1,1,0,0,0|2,0,0]=4 2643 B11R0.4 CCOC(=O)CCCCSCC 62a_100000750268_100000210202 [0,1,1,0,0,0|2,0,0]=4 2644 B11R0.4 CCOC(=O)COCCCCBr 34a_100011216708_100000188475 [0,1,1,0,0,0|2,0,0]=4 2645 B11R0.4 CCOC(=O)COCCCCCl 34a_100000210776_100000188475 [0,1,1,0,0,0|2,0,0]=4 2646 B11R0.4 CCOC(=O)COCCCCCl 7a_100000210776_100000188475 [0,1,1,0,0,0|2,0,0]=4 2647 B11R0.4 CCOC(=O)COCCCCF 34a_100011995726_100000188475 [0,1,1,0,0,0|2,0,0]=4 2648 B11R0.4 CCOC(=O)COCCCCF 7a_100011995726_100000188475 [0,1,1,0,0,0|2,0,0]=4 2649 B11R0.4 CCOC(=O)COCCCCI 34a_200012148704_100000188475 [0,1,1,0,0,0|2,0,0]=4 2650 B11R0.4 CCOC(=O)COCCCCN 34a_100000750430_100000188475 [0,1,1,0,0,0|2,0,0]=4 2651 B11R0.4 CCOC(=O)COCCCNC 2230a_106832991635_100009893628 [0,1,1,0,0,0|2,0,0]=4 2652 B11R0.4 CCOC(=O)COCCCNC 34a_100000213112_100000188475 [0,1,1,0,0,0|2,0,0]=4 2653 B11R0.4 CCOC(=O)COCCCNC 34a_100102657272_100009893628 [0,1,1,0,0,0|2,0,0]=4 2654 B11R0.4 CCOC(=O)COCCCNC 7a_106832991635_100009893628 [0,1,1,0,0,0|2,0,0]=4 2655 B11R0.4 CCOC(=O)COCCCOC 34a_100000740835_100000188475 [0,1,1,0,0,0|2,0,0]=4 2656 B11R0.4 CCOC(=O)COCCCOC 34a_100138415774_100009893628 [0,1,1,0,0,0|2,0,0]=4 2657 B11R0.4 CCOC(=O)COCCCSC 34a_100000690336_100000188475 [0,1,1,0,0,0|2,0,0]=4 2658 B11R0.4 CCOC(=O)COCCCSC 62a_100009893628_200000210301 [0,1,1,0,0,0|2,0,0]=4 2659 B11R0.4 CCOC(=O)COCCCSC 62a_200000210301_100009893628 [0,1,1,0,0,0|2,0,0]=4 2660 B11R0.4 CCOC(=O)COCCCSC 7a_100000690336_100000188475 [0,1,1,0,0,0|2,0,0]=4 2661 B11R0.4 CCOC(=O)COCCCS[13CH3] 62a_100009893628_200025704644 [0,1,1,0,0,0|2,0,0]=4 2662 B11R0.4 CCOC(=O)COCCCS[13CH3] 62a_200025704644_100009893628 [0,1,1,0,0,0|2,0,0]=4 2663 B11R0.4 CCOC(=O)COCCSCC 34a_100000212035_100000188475 [0,1,1,0,0,0|2,0,0]=4 2664 B11R0.4 CCOC(=O)COCCSCC 62a_100000088970_100000210202 [0,1,1,0,0,0|2,0,0]=4 2665 B11R0.4 CCOC(=O)COCCSCC 62a_100000210202_100000088970 [0,1,1,0,0,0|2,0,0]=4 2666 B11R0.4 CCOC(=O)COCCSCC 7a_100000212035_100000188475 [0,1,1,0,0,0|2,0,0]=4 2667 B11R0.4 CCOC(=O)OCSCCCF 62a_100011934791_100000075025 [0,1,1,0,0,0|2,0,0]=4 2668 B11R0.4 CCOC(=O)OCSCCCO 62a_100011215043_100000075025 [0,1,1,0,0,0|2,0,0]=4 2669 B11R0.4 CCOC(=O)OCSCCOC 62a_100000233755_100000075025 [0,1,1,0,0,0|2,0,0]=4 2670 B11R0.4 CCOC(=O)OCSCCSC 62a_100000212216_100000075025 [0,1,1,0,0,0|2,0,0]=4 2671 B11R0.4 CCOCCCCC(=O)OCC 34a_100121572206_100000750268 [0,1,1,0,0,0|2,0,0]=4 2672 B11R0.4 CCOCCCNC(=O)CCO 240690a_100000210961_100011216618 [0,1,1,0,0,0|2,0,0]=4 2673 B11R0.4 CCOCCCNC(=O)COC 11a_100000210961_100000210968 [0,1,1,0,0,0|2,0,0]=4 2674 B11R0.4 CCOCCCNC(=O)COC 1626a_100000210961_100000210968 [0,1,1,0,0,0|2,0,0]=4 2675 B11R0.4 CCOCCCNC(=O)COC 240690a_100000210961_100000210968 [0,1,1,0,0,0|2,0,0]=4 2676 B11R0.4 CCOCCCNC(=O)COC 527a_100000210961_100000210968 [0,1,1,0,0,0|2,0,0]=4 2677 B11R0.4 CCOCCCNC(=O)CSC 11a_100000210961_100000184570 [0,1,1,0,0,0|2,0,0]=4 2678 B11R0.4 CCOCCCNC(=O)CSC 1626a_100000210961_100000184570 [0,1,1,0,0,0|2,0,0]=4 2679 B11R0.4 CCOCCCNC(=O)CSC 240690a_100000210961_100000184570 [0,1,1,0,0,0|2,0,0]=4 2680 B11R0.4 CCOCCCNC(=O)CSC 527a_100000210961_100000184570 [0,1,1,0,0,0|2,0,0]=4 2681 B11R0.4 CCOCCOCC(=O)OCC 34a_100000210136_100000188475 [0,1,1,0,0,0|2,0,0]=4 2682 B11R0.4 CCOCCOCC(=O)OCC 34a_100121572206_100000088970 [0,1,1,0,0,0|2,0,0]=4 2683 B11R0.4 CCOCCOCC(=O)OCC 7a_100000210136_100000188475 [0,1,1,0,0,0|2,0,0]=4 2684 B11R0.4 CCOCSCOC(=O)OCC 62a_100000739092_100000075025 [0,1,1,0,0,0|2,0,0]=4 2685 B11R0.4 COCC(=O)CCCCCCF 1458a_100000210968_100015922095 [0,1,1,0,0,0|2,0,0]=4 2686 B11R0.4 COCC(=O)CCCCCCO 1458a_100000210968_100000766143 [0,1,1,0,0,0|2,0,0]=4 2687 B11R0.4 COCC(=O)NCCCCCO 240690a_100000762737_100000210968 [0,1,1,0,0,0|2,0,0]=4 2688 B11R0.4 COCCCCCC(=O)CCF 1458a_100011935119_100011217306 [0,1,1,0,0,0|2,0,0]=4 2689 B11R0.4 COCCCCCC(=O)CCO 1458a_100011935119_100000211926 [0,1,1,0,0,0|2,0,0]=4 2690 B11R0.4 CSCC(=O)CCCCCCF 1458a_100000184570_100015922095 [0,1,1,0,0,0|2,0,0]=4 2691 B11R0.4 CSCC(=O)CCCCCCO 1458a_100000184570_100000766143 [0,1,1,0,0,0|2,0,0]=4 2692 B11R0.4 CSCC(=O)NCCCCCO 240690a_100000762737_100000184570 [0,1,1,0,0,0|2,0,0]=4 2693 B11R0.4 O=C(CCF)CCCCCCO 1458a_100011996774_100011217306 [0,1,1,0,0,0|2,0,0]=4 2694 B11R0.4 O=C(CCO)CCCCCCF 1458a_100011216618_100015922095 [0,1,1,0,0,0|2,0,0]=4 2695 B11R0.4 O=C(CCO)CCCCCCO 1458a_100011216618_100000766143 [0,1,1,0,0,0|2,0,0]=4 2696 B11R0.4 O=C(CCO)CCCCCCO 1458a_100011996774_100000211926 [0,1,1,0,0,0|2,0,0]=4 2697 B11R0.4 O=C(CCO)NCCCCCO 240690a_100000762737_100011216618 [0,1,1,0,0,0|2,0,0]=4 2698 B11R0.5 CCCCC(=O)CC(=O)CCC 1458a_100000210183_100000747444 [0,1,1,0,0,0|1,0,1]=4 2699 B11R0.5 CCCCC(C)NC(=O)CCC 11a_100000126638_100000211992 [0,1,1,0,0,0|1,0,0]=3 2700 B11R0.5 CCCCC(C)NC(=O)CCC 1626a_100000126638_100000211992 [0,1,1,0,0,0|1,0,0]=3 2701 B11R0.5 CCCCC(C)NC(=O)CCC 240690a_100000126638_100000211992 [0,1,1,0,0,0|1,0,0]=3 2702 B11R0.5 CCCCC(C)NC(=O)CCC 527a_100000126638_100000211992 [0,1,1,0,0,0|1,0,0]=3 2703 B11R0.5 CCCCC(C)NC(=O)CCO 240690a_100000126638_100011216618 [0,1,1,0,0,0|2,0,0]=4 2704 B11R0.5 CCCCC(C)NC(=O)COC 11a_100000126638_100000210968 [0,1,1,0,0,0|2,0,0]=4 2705 B11R0.5 CCCCC(C)NC(=O)COC 1626a_100000126638_100000210968 [0,1,1,0,0,0|2,0,0]=4 2706 B11R0.5 CCCCC(C)NC(=O)COC 240690a_100000126638_100000210968 [0,1,1,0,0,0|2,0,0]=4 2707 B11R0.5 CCCCC(C)NC(=O)COC 527a_100000126638_100000210968 [0,1,1,0,0,0|2,0,0]=4 2708 B11R0.5 CCCCC(C)NC(=O)CSC 11a_100000126638_100000184570 [0,1,1,0,0,0|2,0,0]=4 2709 B11R0.5 CCCCC(C)NC(=O)CSC 1626a_100000126638_100000184570 [0,1,1,0,0,0|2,0,0]=4 2710 B11R0.5 CCCCC(C)NC(=O)CSC 240690a_100000126638_100000184570 [0,1,1,0,0,0|2,0,0]=4 2711 B11R0.5 CCCCC(C)NC(=O)CSC 527a_100000126638_100000184570 [0,1,1,0,0,0|2,0,0]=4 2712 B11R0.5 CCCCC(C)NC(=O)NCC 2708a_100000126638_100015525214 [0,1,1,0,0,0|2,0,0]=4 2713 B11R0.5 CCCCC(C)NC(=O)NCC 2708a_100015525214_100000126638 [0,1,1,0,0,0|2,0,0]=4 2714 B11R0.5 CCCCC(C)NC(=O)NCC 273464a_100000126638_100015525214 [0,1,1,0,0,0|2,0,0]=4 2715 B11R0.5 CCCCC(C)NC(=O)NCC 273464a_100015525214_100000126638 [0,1,1,0,0,0|2,0,0]=4 2716 B11R0.5 CCCCC(C)NC(=O)NCC 512a_100000126638_100015525214 [0,1,1,0,0,0|2,0,0]=4 2717 B11R0.5 CCCCC(C)NC(=O)NCC 512a_100015525214_100000126638 [0,1,1,0,0,0|2,0,0]=4 2718 B11R0.5 CCCCC(C)OC(C)CCC 34a_100000687866_100000766640 [0,1,1,0,0,0|1,0,1]=4 2719 B11R0.5 CCCCC(C)OC(C)CCC 34a_100000764384_200011215066 [0,1,1,0,0,0|1,0,1]=4 2720 B11R0.5 CCCCC(C)OC(C)CCC 7a_100000687866_100000766640 [0,1,1,0,0,0|1,0,1]=4 2721 B11R0.5 CCCCC(C)OC(C)CCC 7a_100000764384_200011215066 [0,1,1,0,0,0|1,0,1]=4 2722 B11R0.5 CCCCN(C)CC(=O)CCC 2230a_100000207549_100000747444 [0,1,1,0,0,0|2,0,0]=4 2723 B11R0.5 CCCCN(C)CC(=O)CCC 269982a_100000207549_100000747444 [0,1,1,0,0,0|2,0,0]=4 2724 B11R0.5 CCCSC(C)OC(=O)OCC 62a_100000036008_100000210303 [0,1,1,0,0,0|2,0,0]=4 2725 B11R0.5 CCCSC(C)OC(=O)OCC 62a_100000210303_100000036008 [0,1,1,0,0,0|2,0,0]=4 2726 B11R0.62 CCCC(=O)CNC(C)CCC 2230a_100000741246_100000747444 [0,1,1,0,0,0|2,0,0]=4 2727 B11R0.62 CCCC(=O)COC(=O)CCC 1458a_100000211992_100000034017 [0,1,1,0,0,0|0,0,1]=3 2728 B11R0.62 CCCC(=O)COC(C)CCC 7a_100000764384_100000747444 [0,1,1,0,0,0|2,0,0]=4 2729 B11R0.62 CCCC(=O)CSC(C)CCC 62a_100000747444_100000766640 [0,1,1,0,0,0|2,0,0]=4 2730 B11R0.62 CCCC(=O)CSC(C)CCC 62a_100000766640_100000747444 [0,1,1,0,0,0|2,0,0]=4 2731 B11R0.62 CCCC(=O)NCC(O)COC 240690a_100000756049_100000211992 [0,1,1,0,0,0|2,0,0]=4 2732 B11R0.62 CCCC(=O)NCC(O)COC 527a_100000756049_100000211992 [0,1,1,0,0,0|2,0,0]=4 2733 B11R0.62 CCCC(=O)OCC(=O)CCO 1458a_100011216618_100000034017 [0,1,1,0,0,0|1,0,1]=4 2734 B11R0.62 CCCC(=O)OCC(=O)COC 1458a_100000210968_100000034017 [0,1,1,0,0,0|1,0,1]=4 2735 B11R0.62 CCCC(=O)OCC(=O)CSC 1458a_100000184570_100000034017 [0,1,1,0,0,0|1,0,1]=4 2736 B11R0.62 CCCC(=O)OCN(C)CCC 2230a_100000747261_100000034017 [0,1,1,0,0,0|1,0,0]=3 2737 B11R0.62 CCCC(=O)OCN(C)CCC 269982a_100000747261_100000034017 [0,1,1,0,0,0|1,0,0]=3 2738 B11R0.62 CCCC(=O)OCN(C)CCO 2230a_100000210263_100000034017 [0,1,1,0,0,0|2,0,0]=4 2739 B11R0.62 CCCC(=O)OCN(C)CCO 269982a_100000210263_100000034017 [0,1,1,0,0,0|2,0,0]=4 2740 B11R0.62 CCCC(C)COC(C)CCC 34a_100000688023_100000766640 [0,1,1,0,0,0|1,0,1]=4 2741 B11R0.62 CCCC(C)COC(C)CCC 34a_100000764384_100011216630 [0,1,1,0,0,0|1,0,1]=4 2742 B11R0.62 CCCC(C)COC(C)CCC 7a_100000688023_100000766640 [0,1,1,0,0,0|1,0,1]=4 2743 B11R0.62 CCCC(C)COC(C)CCC 7a_100000764384_100011216630 [0,1,1,0,0,0|1,0,1]=4 2744 B11R0.62 CCCC(C)OC[C@@H](N)CCC 34a_100000732646_100000766640 [0,1,1,0,0,0|1,0,1]=4 2745 B11R0.81 C#CCCC(=O)CCCCCC 1458a_100000692101_100000210757 [0,1,1,0,0,0|1,0,1]=4 2746 B11R0.81 C#CCCC(=O)CCCCCC 1458a_100102632555_100000753159 [0,1,1,0,0,0|1,0,1]=4 2747 B11R0.81 C#CCCC(=O)NCCCCC 11a_100000209983_100000692101 [0,1,1,0,0,0|1,0,1]=4 2748 B11R0.81 C#CCCC(=O)NCCCCC 1626a_100000209983_100000692101 [0,1,1,0,0,0|1,0,1]=4 2749 B11R0.81 C#CCCC(=O)NCCCCC 240690a_100000209983_100000692101 [0,1,1,0,0,0|1,0,1]=4 2750 B11R0.81 C#CCCC(=O)NCCCCC 527a_100000209983_100000692101 [0,1,1,0,0,0|1,0,1]=4 2751 B11R0.81 C/C=C/CC(=O)CCCCCC 1458a_100102632555_100102629194 [0,1,1,0,0,0|1,0,1]=4 2752 B11R0.81 C=CCCC(=O)CCCCCC 1458a_100000749702_100000210757 [0,1,1,0,0,0|1,0,1]=4 2753 B11R0.81 C=CCCC(=O)CCCCCC 1458a_100102632555_100000754431 [0,1,1,0,0,0|1,0,1]=4 2754 B11R0.81 C=CCCC(=O)NCCCCC 11a_100000209983_100000749702 [0,1,1,0,0,0|1,0,1]=4 2755 B11R0.81 C=CCCC(=O)NCCCCC 1626a_100000209983_100000749702 [0,1,1,0,0,0|1,0,1]=4 2756 B11R0.81 C=CCCC(=O)NCCCCC 240690a_100000209983_100000749702 [0,1,1,0,0,0|1,0,1]=4 2757 B11R0.81 C=CCCC(=O)NCCCCC 527a_100000209983_100000749702 [0,1,1,0,0,0|1,0,1]=4 2758 B11R0.81 CC#CCC(=O)CCCCCC 1458a_100102632555_100000748600 [0,1,1,0,0,0|1,0,1]=4 2759 B11R0.81 CC=CCC(=O)CCCCCC 1458a_100102632555_100000070051 [0,1,1,0,0,0|1,0,1]=4 2760 B11R0.81 CC=CCC(=O)CCCCCC 1458a_100121576822_100000210757 [0,1,1,0,0,0|1,0,1]=4 2761 B11R0.81 CC=CCC(=O)NCCCCC 11a_100000209983_100121576822 [0,1,1,0,0,0|1,0,1]=4 2762 B11R0.81 CC=CCC(=O)NCCCCC 1626a_100000209983_100121576822 [0,1,1,0,0,0|1,0,1]=4 2763 B11R0.81 CC=CCC(=O)NCCCCC 240690a_100000209983_100121576822 [0,1,1,0,0,0|1,0,1]=4 2764 B11R0.81 CC=CCC(=O)NCCCCC 527a_100000209983_100121576822 [0,1,1,0,0,0|1,0,1]=4 2765 B11R0.81 CCC#CC(=O)CCCCCC 1458a_100011827653_100000210757 [0,1,1,0,0,0|1,0,1]=4 2766 B11R0.81 CCC=CC(=O)CCCCCC 1458a_100000212282_100000210757 [0,1,1,0,0,0|1,0,1]=4 2767 B11R0.81 CCC=CC(=O)NCCCCC 11a_100000209983_100000212282 [0,1,1,0,0,0|1,0,1]=4 2768 B11R0.81 CCC=CC(=O)NCCCCC 1626a_100000209983_100000212282 [0,1,1,0,0,0|1,0,1]=4 2769 B11R0.81 CCC=CC(=O)NCCCCC 240690a_100000209983_100000212282 [0,1,1,0,0,0|1,0,1]=4 2770 B11R0.81 CCCCC(=O)CCCCCF 1458a_100000210183_100000729378 [0,1,1,0,0,0|2,0,0]=4 2771 B11R0.81 CCCCC(=O)CCCCCO 1458a_100000210183_100000746330 [0,1,1,0,0,0|2,0,0]=4 2772 B11R0.81 CCCCC(=O)CCCCCO 1458a_100102619762_100000210211 [0,1,1,0,0,0|2,0,0]=4 2773 B11R0.81 CCCCC(=O)CCCCOC 1458a_100000210183_100000755781 [0,1,1,0,0,0|2,0,0]=4 2774 B11R0.81 CCCCC(=O)CCCOCC 1458a_100000210183_100012232248 [0,1,1,0,0,0|2,0,0]=4 2775 B11R0.81 CCCCC(=O)CCOCCC 1458a_100000210183_100011215938 [0,1,1,0,0,0|2,0,0]=4 2776 B11R0.81 CCCCC(=O)NCCCCO 240690a_100000750430_100000210183 [0,1,1,0,0,0|2,0,0]=4 2777 B11R0.81 CCCCC(=O)NCCCCO 527a_100000750430_100000210183 [0,1,1,0,0,0|2,0,0]=4 2778 B11R0.81 CCCCC(=O)NCCCOC 1626a_100150723488_100000210183 [0,1,1,0,0,0|2,0,0]=4 2779 B11R0.81 CCCCC(=O)NCCCOC 240690a_100150723488_100000210183 [0,1,1,0,0,0|2,0,0]=4 2780 B11R0.81 CCCCC(=O)NCCCOC 527a_100150723488_100000210183 [0,1,1,0,0,0|2,0,0]=4 2781 B11R0.81 CCCCC(=O)NCCCSC 11a_100000749238_100000210183 [0,1,1,0,0,0|2,0,0]=4 2782 B11R0.81 CCCCC(=O)NCCCSC 1626a_100000749238_100000210183 [0,1,1,0,0,0|2,0,0]=4 2783 B11R0.81 CCCCC(=O)NCCCSC 240690a_100000749238_100000210183 [0,1,1,0,0,0|2,0,0]=4 2784 B11R0.81 CCCCC(=O)NCCCSC 527a_100000749238_100000210183 [0,1,1,0,0,0|2,0,0]=4 2785 B11R0.81 CCCCC(=O)NCCOCC 11a_100011200944_100000210183 [0,1,1,0,0,0|2,0,0]=4 2786 B11R0.81 CCCCC(=O)NCCOCC 1626a_102516460346_100000210183 [0,1,1,0,0,0|2,0,0]=4 2787 B11R0.81 CCCCC(=O)NCCOCC 240690a_100011200944_100000210183 [0,1,1,0,0,0|2,0,0]=4 2788 B11R0.81 CCCCC(=O)NCCOCC 527a_100011200944_100000210183 [0,1,1,0,0,0|2,0,0]=4 2789 B11R0.81 CCCCC(=O)NCCSCC 11a_100000106463_100000210183 [0,1,1,0,0,0|2,0,0]=4 2790 B11R0.81 CCCCC(=O)NCCSCC 1626a_100000106463_100000210183 [0,1,1,0,0,0|2,0,0]=4 2791 B11R0.81 CCCCC(=O)NCCSCC 240690a_100000106463_100000210183 [0,1,1,0,0,0|2,0,0]=4 2792 B11R0.81 CCCCC(=O)NCCSCC 527a_100000106463_100000210183 [0,1,1,0,0,0|2,0,0]=4 2793 B11R0.81 CCCCC=CC(=O)CCCC 1458a_100016266645_100000210211 [0,1,1,0,0,0|1,0,1]=4 2794 B11R0.81 CCCCC=CC(=O)CCCF 1458a_100016266645_100011934791 [0,1,1,0,0,0|1,0,1]=4 2795 B11R0.81 CCCCC=CC(=O)CCCO 1458a_100016266645_100011215043 [0,1,1,0,0,0|1,0,1]=4 2796 B11R0.81 CCCCC=CC(=O)CCOC 1458a_100016266645_100000233755 [0,1,1,0,0,0|1,0,1]=4 2797 B11R0.81 CCCCC=CC(=O)CCSC 1458a_100016266645_100000751147 [0,1,1,0,0,0|1,0,1]=4 2798 B11R0.81 CCCCC=CC(=O)NCCC 11a_100020643023_100016266645 [0,1,1,0,0,0|1,0,1]=4 2799 B11R0.81 CCCCC=CC(=O)NCCC 1626a_100020643023_100016266645 [0,1,1,0,0,0|1,0,1]=4 2800 B11R0.81 CCCCC=CC(=O)NCCC 240690a_100020643023_100016266645 [0,1,1,0,0,0|1,0,1]=4 2801 B11R0.81 CCCCCCC(=O)CCC#N 1458a_100011934036_100000210757 [0,1,1,0,0,0|1,0,1]=4 2802 B11R0.81 CCCCCCC(=O)CCC#N 1458a_100102632555_100011215226 [0,1,1,0,0,0|1,0,1]=4 2803 B11R0.81 CCCCCCC(=O)CCCC 1458a_100000210183_100000210757 [0,1,1,0,0,0|1,0,0]=3 2804 B11R0.81 CCCCCCC(=O)CCCC 1458a_100102632555_100000210211 [0,1,1,0,0,0|1,0,0]=3 2805 B11R0.81 CCCCCCC(=O)CCCF 1458a_100102632555_100011934791 [0,1,1,0,0,0|1,0,0]=3 2806 B11R0.81 CCCCCCC(=O)CCCO 1458a_100102632555_100011215043 [0,1,1,0,0,0|1,0,0]=3 2807 B11R0.81 CCCCCCC(=O)CCOC 1458a_100000749529_100000210757 [0,1,1,0,0,0|1,0,0]=3 2808 B11R0.81 CCCCCCC(=O)CCOC 1458a_100102632555_100000233755 [0,1,1,0,0,0|1,0,0]=3 2809 B11R0.81 CCCCCCC(=O)CCSC 1458a_100000174002_100000210757 [0,1,1,0,0,0|1,0,0]=3 2810 B11R0.81 CCCCCCC(=O)CCSC 1458a_100102632555_100000751147 [0,1,1,0,0,0|1,0,0]=3 2811 B11R0.81 CCCCCCC(=O)COCC 1458a_100000211967_100000210757 [0,1,1,0,0,0|1,0,0]=3 2812 B11R0.81 CCCCCCC(=O)CSCC 1458a_100000230394_100000210757 [0,1,1,0,0,0|1,0,0]=3 2813 B11R0.81 CCCCCCC(=O)NCCC 11a_100020643023_100102632555 [0,1,1,0,0,0|1,0,0]=3 2814 B11R0.81 CCCCCCC(=O)NCCC 1626a_100020643023_100102632555 [0,1,1,0,0,0|1,0,0]=3 2815 B11R0.81 CCCCCCC(=O)NCCC 240690a_100020643023_100102632555 [0,1,1,0,0,0|1,0,0]=3 2816 B11R0.81 CCCCCCC(=O)NCCC 527a_100020643023_100102632555 [0,1,1,0,0,0|1,0,0]=3 2817 B11R0.81 CCCCCCC(=O)NCCF 11a_100000724931_100102632555 [0,1,1,0,0,0|2,0,0]=4 2818 B11R0.81 CCCCCCC(=O)NCCF 1626a_100000724931_100102632555 [0,1,1,0,0,0|2,0,0]=4 2819 B11R0.81 CCCCCCC(=O)NCCF 240690a_100000724931_100102632555 [0,1,1,0,0,0|2,0,0]=4 2820 B11R0.81 CCCCCCC(=O)NCCF 527a_100000724931_100102632555 [0,1,1,0,0,0|2,0,0]=4 2821 B11R0.81 CCCCCCC(=O)NCCO 240690a_100000210304_100102632555 [0,1,1,0,0,0|2,0,0]=4 2822 B11R0.81 CCCCCCC(=O)NCCO 527a_100000210304_100102632555 [0,1,1,0,0,0|2,0,0]=4 2823 B11R0.81 CCCCCCC(=O)NNCC 22a_100000756455_100102632555 [0,1,1,0,0,0|2,0,0]=4 2824 B11R0.81 CCCCCNC(=O)CCC#N 11a_100000209983_100011934036 [0,1,1,0,0,0|1,0,1]=4 2825 B11R0.81 CCCCCNC(=O)CCC#N 1626a_100000209983_100011934036 [0,1,1,0,0,0|1,0,1]=4 2826 B11R0.81 CCCCCNC(=O)CCC#N 240690a_100000209983_100011934036 [0,1,1,0,0,0|1,0,1]=4 2827 B11R0.81 CCCCCNC(=O)CCC#N 527a_100000209983_100011934036 [0,1,1,0,0,0|1,0,1]=4 2828 B11R0.81 CCCCCNC(=O)CCCC 11a_100000209983_100000210183 [0,1,1,0,0,0|1,0,0]=3 2829 B11R0.81 CCCCCNC(=O)CCCC 1626a_100000209983_100000210183 [0,1,1,0,0,0|1,0,0]=3 2830 B11R0.81 CCCCCNC(=O)CCCC 240690a_100000209983_100000210183 [0,1,1,0,0,0|1,0,0]=3 2831 B11R0.81 CCCCCNC(=O)CCCC 527a_100000209983_100000210183 [0,1,1,0,0,0|1,0,0]=3 2832 B11R0.81 CCCCCNC(=O)CCOC 11a_100000209983_100000749529 [0,1,1,0,0,0|1,0,0]=3 2833 B11R0.81 CCCCCNC(=O)CCOC 1626a_100000209983_100000749529 [0,1,1,0,0,0|1,0,0]=3 2834 B11R0.81 CCCCCNC(=O)CCOC 240690a_100000209983_100000749529 [0,1,1,0,0,0|1,0,0]=3 2835 B11R0.81 CCCCCNC(=O)CCOC 527a_100000209983_100000749529 [0,1,1,0,0,0|1,0,0]=3 2836 B11R0.81 CCCCCNC(=O)CCSC 11a_100000209983_100000174002 [0,1,1,0,0,0|1,0,0]=3 2837 B11R0.81 CCCCCNC(=O)CCSC 1626a_100000209983_100000174002 [0,1,1,0,0,0|1,0,0]=3 2838 B11R0.81 CCCCCNC(=O)CCSC 240690a_100000209983_100000174002 [0,1,1,0,0,0|1,0,0]=3 2839 B11R0.81 CCCCCNC(=O)CCSC 527a_100000209983_100000174002 [0,1,1,0,0,0|1,0,0]=3 2840 B11R0.81 CCCCCNC(=O)CNCC 2230a_100015525214_100000230301 [0,1,1,0,0,0|1,0,0]=3 2841 B11R0.81 CCCCCNC(=O)COCC 11a_100000209983_100000211967 [0,1,1,0,0,0|1,0,0]=3 2842 B11R0.81 CCCCCNC(=O)COCC 1626a_100000209983_100000211967 [0,1,1,0,0,0|1,0,0]=3 2843 B11R0.81 CCCCCNC(=O)COCC 240690a_100000209983_100000211967 [0,1,1,0,0,0|1,0,0]=3 2844 B11R0.81 CCCCCNC(=O)COCC 34a_100121572206_100000230301 [0,1,1,0,0,0|1,0,0]=3 2845 B11R0.81 CCCCCNC(=O)COCC 527a_100000209983_100000211967 [0,1,1,0,0,0|1,0,0]=3 2846 B11R0.81 CCCCCNC(=O)CSCC 11a_100000209983_100000230394 [0,1,1,0,0,0|1,0,0]=3 2847 B11R0.81 CCCCCNC(=O)CSCC 1626a_100000209983_100000230394 [0,1,1,0,0,0|1,0,0]=3 2848 B11R0.81 CCCCCNC(=O)CSCC 240690a_100000209983_100000230394 [0,1,1,0,0,0|1,0,0]=3 2849 B11R0.81 CCCCCNC(=O)CSCC 527a_100000209983_100000230394 [0,1,1,0,0,0|1,0,0]=3 2850 B11R0.81 CCCCCNC(=O)CSCC 62a_100000210202_100000230301 [0,1,1,0,0,0|1,0,0]=3 2851 B11R0.81 CCCCCNC(=O)CSCC 62a_100000230301_100000210202 [0,1,1,0,0,0|1,0,0]=3 2852 B11R0.81 CCCCCNC(=O)CSCF 62a_100000230301_100015361967 [0,1,1,0,0,0|2,0,0]=4 2853 B11R0.81 CCCCCNC(=O)CSCF 62a_100015361967_100000230301 [0,1,1,0,0,0|2,0,0]=4 2854 B11R0.81 CCCCCNC(=O)NCCC 2708a_100000209983_100020643023 [0,1,1,0,0,0|1,0,0]=3 2855 B11R0.81 CCCCCNC(=O)NCCC 2708a_100020643023_100000209983 [0,1,1,0,0,0|1,0,0]=3 2856 B11R0.81 CCCCCNC(=O)NCCC 273464a_100000209983_100020643023 [0,1,1,0,0,0|1,0,0]=3 2857 B11R0.81 CCCCCNC(=O)NCCC 273464a_100020643023_100000209983 [0,1,1,0,0,0|1,0,0]=3 2858 B11R0.81 CCCCCNC(=O)NCCC 512a_100000209983_100020643023 [0,1,1,0,0,0|1,0,0]=3 2859 B11R0.81 CCCCCNC(=O)NCCC 512a_100020643023_100000209983 [0,1,1,0,0,0|1,0,0]=3 2860 B11R0.81 CCCCCNC(=O)NCCF 2708a_100000209983_100000724931 [0,1,1,0,0,0|2,0,0]=4 2861 B11R0.81 CCCCCNC(=O)NCCF 273464a_100000209983_100000724931 [0,1,1,0,0,0|2,0,0]=4 2862 B11R0.81 CCCCCNC(=O)NCCF 273464a_100000724931_100000209983 [0,1,1,0,0,0|2,0,0]=4 2863 B11R0.81 CCCCCNC(=O)NCCF 512a_100000209983_100000724931 [0,1,1,0,0,0|2,0,0]=4 2864 B11R0.81 CCCCCNC(=O)NCCO 2708a_100000209983_100000210304 [0,1,1,0,0,0|2,0,0]=4 2865 B11R0.81 CCCCCNC(=O)NCCO 273464a_100000209983_100000210304 [0,1,1,0,0,0|2,0,0]=4 2866 B11R0.81 CCCCCNC(=O)NCCO 273464a_100000210304_100000209983 [0,1,1,0,0,0|2,0,0]=4 2867 B11R0.81 CCCCCNC(=O)NCCO 512a_100000209983_100000210304 [0,1,1,0,0,0|2,0,0]=4 2868 B11R0.81 CCCCCNC(=O)NNCC 273464a_100000209983_100000756455 [0,1,1,0,0,0|2,0,0]=4 2869 B11R0.81 CCCCCNC(=O)NNCC 512a_100000209983_100000756455 [0,1,1,0,0,0|2,0,0]=4 2870 B11R0.81 CCCCCNC(=O)NNCC 512a_100000756455_100000209983 [0,1,1,0,0,0|2,0,0]=4 2871 B11R0.81 CCCCCOC(C)CCCC 34a_100000210253_200011215066 [0,1,1,0,0,0|1,0,1]=4 2872 B11R0.81 CCCCCOC(C)CCCC 34a_100000687866_100000718602 [0,1,1,0,0,0|1,0,1]=4 2873 B11R0.81 CCCCCOC(C)CCCC 7a_100000210253_200011215066 [0,1,1,0,0,0|1,0,1]=4 2874 B11R0.81 CCCCCOC(C)CCCC 7a_100000687866_100000210326 [0,1,1,0,0,0|1,0,1]=4 2875 B11R0.81 CCCCCOC(C)CCCCl 34a_200000718107_100000718602 [0,1,1,0,0,0|1,0,1]=4 2876 B11R0.81 CCCCCOC(C)CCCCl 7a_200000718107_100000210326 [0,1,1,0,0,0|1,0,1]=4 2877 B11R0.81 CCCCCOC(C)COCC 34a_100000718985_100000718602 [0,1,1,0,0,0|1,0,1]=4 2878 B11R0.81 CCCCCOC(C)COCC 7a_100000718985_100000210326 [0,1,1,0,0,0|1,0,1]=4 2879 B11R0.81 CCCCNCC(=O)NCCC 2230a_100000102301_100000183358 [0,1,1,0,0,0|2,0,0]=4 2880 B11R0.81 CCCCNCC(=O)NCCC 2230a_100000174927_100000210211 [0,1,1,0,0,0|2,0,0]=4 2881 B11R0.81 CCCCNCC(=O)NCCC 7a_106832991798_100000183358 [0,1,1,0,0,0|2,0,0]=4 2882 B11R0.81 CCCCNCC(=O)OCCC 2230a_100000102301_200011215008 [0,1,1,0,0,0|2,0,0]=4 2883 B11R0.81 CCCCNCC(=O)OCCC 7a_106832991798_200011215008 [0,1,1,0,0,0|2,0,0]=4 2884 B11R0.81 CCCCNNC(=O)CCCC 22a_100025702795_100000210183 [0,1,1,0,0,0|2,0,0]=4 2885 B11R0.81 CCCCNNC(=O)CCOC 22a_100025702795_100000749529 [0,1,1,0,0,0|2,0,0]=4 2886 B11R0.81 CCCCNNC(=O)CCSC 22a_100025702795_100000174002 [0,1,1,0,0,0|2,0,0]=4 2887 B11R0.81 CCCCNNC(=O)COCC 22a_100025702795_100000211967 [0,1,1,0,0,0|2,0,0]=4 2888 B11R0.81 CCCCNNC(=O)CSCC 22a_100025702795_100000230394 [0,1,1,0,0,0|2,0,0]=4 2889 B11R0.81 CCCCNNC(=O)NCCC 273464a_100020643023_100025702795 [0,1,1,0,0,0|2,0,0]=4 2890 B11R0.81 CCCCNNC(=O)NCCC 512a_100020643023_100025702795 [0,1,1,0,0,0|2,0,0]=4 2891 B11R0.81 CCCCNNC(=O)NCCC 512a_100025702795_100020643023 [0,1,1,0,0,0|2,0,0]=4 2892 B11R0.81 CCCCOCC(=O)CCCC 1458a_100000210183_100011995733 [0,1,1,0,0,0|2,0,0]=4 2893 B11R0.81 CCCCOCC(=O)CCCC 1458a_100000757543_100000210211 [0,1,1,0,0,0|2,0,0]=4 2894 B11R0.81 CCCCOCC(=O)CCCF 1458a_100000757543_100011934791 [0,1,1,0,0,0|2,0,0]=4 2895 B11R0.81 CCCCOCC(=O)CCCO 1458a_100000757543_100011215043 [0,1,1,0,0,0|2,0,0]=4 2896 B11R0.81 CCCCOCC(=O)CCOC 1458a_100000749529_100011995733 [0,1,1,0,0,0|2,0,0]=4 2897 B11R0.81 CCCCOCC(=O)CCOC 1458a_100000757543_100000233755 [0,1,1,0,0,0|2,0,0]=4 2898 B11R0.81 CCCCOCC(=O)CCSC 1458a_100000174002_100011995733 [0,1,1,0,0,0|2,0,0]=4 2899 B11R0.81 CCCCOCC(=O)CCSC 1458a_100000757543_100000751147 [0,1,1,0,0,0|2,0,0]=4 2900 B11R0.81 CCCCOCC(=O)COCC 1458a_100000211967_100011995733 [0,1,1,0,0,0|2,0,0]=4 2901 B11R0.81 CCCCOCC(=O)CSCC 1458a_100000230394_100011995733 [0,1,1,0,0,0|2,0,0]=4 2902 B11R0.81 CCCCOCC(=O)NCCC 11a_100020643023_100000757543 [0,1,1,0,0,0|2,0,0]=4 2903 B11R0.81 CCCCOCC(=O)NCCC 1626a_100020643023_100000757543 [0,1,1,0,0,0|2,0,0]=4 2904 B11R0.81 CCCCOCC(=O)NCCC 240690a_100020643023_100000757543 [0,1,1,0,0,0|2,0,0]=4 2905 B11R0.81 CCCCOCC(=O)NCCC 34a_100000210227_100000183358 [0,1,1,0,0,0|2,0,0]=4 2906 B11R0.81 CCCCOCC(=O)NCCC 527a_100020643023_100000757543 [0,1,1,0,0,0|2,0,0]=4 2907 B11R0.81 CCCCOCC(=O)NCCC 7a_100000210227_100000183358 [0,1,1,0,0,0|2,0,0]=4 2908 B11R0.81 CCCCOCC(=O)OCCC 34a_100000210227_200011215008 [0,1,1,0,0,0|2,0,0]=4 2909 B11R0.81 CCCCOCC(=O)OCCC 7a_100000210227_200011215008 [0,1,1,0,0,0|2,0,0]=4 2910 B11R0.81 CCCCSCC(=O)CCCC 1458a_100000191162_100000210211 [0,1,1,0,0,0|2,0,0]=4 2911 B11R0.81 CCCCSCC(=O)CCCF 1458a_100000191162_100011934791 [0,1,1,0,0,0|2,0,0]=4 2912 B11R0.81 CCCCSCC(=O)CCCO 1458a_100000191162_100011215043 [0,1,1,0,0,0|2,0,0]=4 2913 B11R0.81 CCCCSCC(=O)CCOC 1458a_100000191162_100000233755 [0,1,1,0,0,0|2,0,0]=4 2914 B11R0.81 CCCCSCC(=O)CCSC 1458a_100000191162_100000751147 [0,1,1,0,0,0|2,0,0]=4 2915 B11R0.81 CCCCSCC(=O)NCCC 11a_100020643023_100000191162 [0,1,1,0,0,0|2,0,0]=4 2916 B11R0.81 CCCCSCC(=O)NCCC 1626a_100020643023_100000191162 [0,1,1,0,0,0|2,0,0]=4 2917 B11R0.81 CCCCSCC(=O)NCCC 240690a_100020643023_100000191162 [0,1,1,0,0,0|2,0,0]=4 2918 B11R0.81 CCCCSCC(=O)NCCC 527a_100020643023_100000191162 [0,1,1,0,0,0|2,0,0]=4 2919 B11R0.81 CCCCSCC(=O)NCCC 62a_100000183358_100000210210 [0,1,1,0,0,0|2,0,0]=4 2920 B11R0.81 CCCCSCC(=O)NCCC 62a_100000210211_100000183358 [0,1,1,0,0,0|2,0,0]=4 2921 B11R0.81 CCCCSCC(=O)OCCC 62a_100000210211_200011215008 [0,1,1,0,0,0|2,0,0]=4 2922 B11R0.81 CCCCSCC(=O)OCCC 62a_200011215008_100000210210 [0,1,1,0,0,0|2,0,0]=4 2923 B11R0.81 CCCNC(=O)CCCCCO 240690a_100020643023_100102619762 [0,1,1,0,0,0|2,0,0]=4 2924 B11R0.81 CCCNC(=O)CCCNCC 2230a_100015525214_100011194427 [0,1,1,0,0,0|2,0,0]=4 2925 B11R0.81 CCCNC(=O)CCCSCC 62a_100000210202_100011194427 [0,1,1,0,0,0|2,0,0]=4 2926 B11R0.81 CCCNC(=O)CCCSCC 62a_100011194427_100000210202 [0,1,1,0,0,0|2,0,0]=4 2927 B11R0.81 CCCNC(=O)NCCCCO 2708a_100000750430_100020643023 [0,1,1,0,0,0|2,0,0]=4 2928 B11R0.81 CCCNC(=O)NCCCCO 2708a_100020643023_100000750430 [0,1,1,0,0,0|2,0,0]=4 2929 B11R0.81 CCCNC(=O)NCCCCO 273464a_100000750430_100020643023 [0,1,1,0,0,0|2,0,0]=4 2930 B11R0.81 CCCNC(=O)NCCCCO 273464a_100020643023_100000750430 [0,1,1,0,0,0|2,0,0]=4 2931 B11R0.81 CCCNC(=O)NCCCCO 512a_100000750430_100020643023 [0,1,1,0,0,0|2,0,0]=4 2932 B11R0.81 CCCNC(=O)NCCCCO 512a_100020643023_100000750430 [0,1,1,0,0,0|2,0,0]=4 2933 B11R0.81 CCCNC(=O)NCCCOC 2708a_100020643023_100150723488 [0,1,1,0,0,0|2,0,0]=4 2934 B11R0.81 CCCNC(=O)NCCCOC 2708a_100150723488_100020643023 [0,1,1,0,0,0|2,0,0]=4 2935 B11R0.81 CCCNC(=O)NCCCOC 273464a_100020643023_100150723488 [0,1,1,0,0,0|2,0,0]=4 2936 B11R0.81 CCCNC(=O)NCCCOC 273464a_100150723488_100020643023 [0,1,1,0,0,0|2,0,0]=4 2937 B11R0.81 CCCNC(=O)NCCCOC 512a_100020643023_100150723488 [0,1,1,0,0,0|2,0,0]=4 2938 B11R0.81 CCCNC(=O)NCCCSC 2708a_100000749238_100020643023 [0,1,1,0,0,0|2,0,0]=4 2939 B11R0.81 CCCNC(=O)NCCCSC 2708a_100020643023_100000749238 [0,1,1,0,0,0|2,0,0]=4 2940 B11R0.81 CCCNC(=O)NCCCSC 273464a_100000749238_100020643023 [0,1,1,0,0,0|2,0,0]=4 2941 B11R0.81 CCCNC(=O)NCCCSC 273464a_100020643023_100000749238 [0,1,1,0,0,0|2,0,0]=4 2942 B11R0.81 CCCNC(=O)NCCCSC 512a_100000749238_100020643023 [0,1,1,0,0,0|2,0,0]=4 2943 B11R0.81 CCCNC(=O)NCCCSC 512a_100020643023_100000749238 [0,1,1,0,0,0|2,0,0]=4 2944 B11R0.81 CCCNC(=O)NCCOCC 2708a_100011200944_100020643023 [0,1,1,0,0,0|2,0,0]=4 2945 B11R0.81 CCCNC(=O)NCCOCC 2708a_100020643023_100011200944 [0,1,1,0,0,0|2,0,0]=4 2946 B11R0.81 CCCNC(=O)NCCOCC 273464a_100020643023_102516460346 [0,1,1,0,0,0|2,0,0]=4 2947 B11R0.81 CCCNC(=O)NCCOCC 273464a_102516460346_100020643023 [0,1,1,0,0,0|2,0,0]=4 2948 B11R0.81 CCCNC(=O)NCCOCC 512a_100011200944_100020643023 [0,1,1,0,0,0|2,0,0]=4 2949 B11R0.81 CCCNC(=O)NCCOCC 512a_100020643023_100011200944 [0,1,1,0,0,0|2,0,0]=4 2950 B11R0.81 CCCNC(=O)NCCSCC 2708a_100000106463_100020643023 [0,1,1,0,0,0|2,0,0]=4 2951 B11R0.81 CCCNC(=O)NCCSCC 2708a_100020643023_100000106463 [0,1,1,0,0,0|2,0,0]=4 2952 B11R0.81 CCCNC(=O)NCCSCC 273464a_100000106463_100020643023 [0,1,1,0,0,0|2,0,0]=4 2953 B11R0.81 CCCNC(=O)NCCSCC 273464a_100020643023_100000106463 [0,1,1,0,0,0|2,0,0]=4 2954 B11R0.81 CCCNC(=O)NCCSCC 512a_100000106463_100020643023 [0,1,1,0,0,0|2,0,0]=4 2955 B11R0.81 CCCNC(=O)NCCSCC 512a_100020643023_100000106463 [0,1,1,0,0,0|2,0,0]=4 2956 B11R0.81 CCCOC(=O)OCNCCF 34a_100000724931_200000139673 [0,1,1,0,0,0|2,0,0]=4 2957 B11R0.81 CCCOC(=O)OCNCCO 34a_100016990907_200000139673 [0,1,1,0,0,0|2,0,0]=4 2958 B11R0.81 CCCOC(=O)OCOCCBr 34a_100000211926_200000139673 [0,1,1,0,0,0|2,0,0]=4 2959 B11R0.81 CCCOC(=O)OCOCCN 34a_100000210304_200000139673 [0,1,1,0,0,0|2,0,0]=4 2960 B11R0.81 CCCOC(=O)OCSCCC 62a_100000210303_200000139673 [0,1,1,0,0,0|1,0,0]=3 2961 B11R0.81 CCCOC(=O)OCSCCF 62a_100011217306_200000139673 [0,1,1,0,0,0|2,0,0]=4 2962 B11R0.81 CCCOC(=O)OCSCCO 62a_100000211926_200000139673 [0,1,1,0,0,0|2,0,0]=4 2963 B11R0.81 CCCOC(=O)OCSCOC 62a_100000766300_200000139673 [0,1,1,0,0,0|2,0,0]=4 2964 B11R0.81 CCCOC(=O)OCSCSC 62a_100011218213_200000139673 [0,1,1,0,0,0|2,0,0]=4 2965 B11R0.81 CCCOCCC(=O)CCOC 1458a_100000749529_100011215938 [0,1,1,0,0,0|2,0,0]=4 2966 B11R0.81 CCCOCCC(=O)CCSC 1458a_100000174002_100011215938 [0,1,1,0,0,0|2,0,0]=4 2967 B11R0.81 CCCOCCC(=O)COCC 1458a_100000211967_100011215938 [0,1,1,0,0,0|2,0,0]=4 2968 B11R0.81 CCCOCCC(=O)CSCC 1458a_100000230394_100011215938 [0,1,1,0,0,0|2,0,0]=4 2969 B11R0.81 CCCOCOC(=O)OCCC 34a_100000210258_200000139673 [0,1,1,0,0,0|1,0,0]=3 2970 B11R0.81 CCNCC(=O)NCCCOC 2230a_100015525214_100000183178 [0,1,1,0,0,0|2,0,0]=4 2971 B11R0.81 CCNCC(=O)OCCOCC 2230a_100015525214_200000101388 [0,1,1,0,0,0|1,0,0]=3 2972 B11R0.81 CCOCC(=O)CCCCCF 1458a_100000211967_100000729378 [0,1,1,0,0,0|2,0,0]=4 2973 B11R0.81 CCOCC(=O)CCCCCO 1458a_100000211967_100000746330 [0,1,1,0,0,0|2,0,0]=4 2974 B11R0.81 CCOCC(=O)CCCCOC 1458a_100000211967_100000755781 [0,1,1,0,0,0|2,0,0]=4 2975 B11R0.81 CCOCC(=O)NCCCCO 240690a_100000750430_100000211967 [0,1,1,0,0,0|2,0,0]=4 2976 B11R0.81 CCOCC(=O)NCCCCO 527a_100000750430_100000211967 [0,1,1,0,0,0|2,0,0]=4 2977 B11R0.81 CCOCC(=O)NCCCOC 1626a_100150723488_100000211967 [0,1,1,0,0,0|2,0,0]=4 2978 B11R0.81 CCOCC(=O)NCCCOC 240690a_100150723488_100000211967 [0,1,1,0,0,0|2,0,0]=4 2979 B11R0.81 CCOCC(=O)NCCCOC 34a_100121572206_100000183178 [0,1,1,0,0,0|2,0,0]=4 2980 B11R0.81 CCOCC(=O)NCCCOC 527a_100150723488_100000211967 [0,1,1,0,0,0|2,0,0]=4 2981 B11R0.81 CCOCC(=O)NCCCSC 11a_100000749238_100000211967 [0,1,1,0,0,0|2,0,0]=4 2982 B11R0.81 CCOCC(=O)NCCCSC 1626a_100000749238_100000211967 [0,1,1,0,0,0|2,0,0]=4 2983 B11R0.81 CCOCC(=O)NCCCSC 240690a_100000749238_100000211967 [0,1,1,0,0,0|2,0,0]=4 2984 B11R0.81 CCOCC(=O)NCCCSC 527a_100000749238_100000211967 [0,1,1,0,0,0|2,0,0]=4 2985 B11R0.81 CCOCC(=O)NCCSCC 11a_100000106463_100000211967 [0,1,1,0,0,0|2,0,0]=4 2986 B11R0.81 CCOCC(=O)NCCSCC 1626a_100000106463_100000211967 [0,1,1,0,0,0|2,0,0]=4 2987 B11R0.81 CCOCC(=O)NCCSCC 240690a_100000106463_100000211967 [0,1,1,0,0,0|2,0,0]=4 2988 B11R0.81 CCOCC(=O)NCCSCC 527a_100000106463_100000211967 [0,1,1,0,0,0|2,0,0]=4 2989 B11R0.81 CCOCCCC(=O)CCOC 1458a_100000749529_100012232248 [0,1,1,0,0,0|2,0,0]=4 2990 B11R0.81 CCOCCCC(=O)CCSC 1458a_100000174002_100012232248 [0,1,1,0,0,0|2,0,0]=4 2991 B11R0.81 CCOCCCC(=O)COCC 1458a_100000211967_100012232248 [0,1,1,0,0,0|2,0,0]=4 2992 B11R0.81 CCOCCCC(=O)CSCC 1458a_100000230394_100012232248 [0,1,1,0,0,0|2,0,0]=4 2993 B11R0.81 CCOCCNC(=O)CCOC 11a_100011200944_100000749529 [0,1,1,0,0,0|2,0,0]=4 2994 B11R0.81 CCOCCNC(=O)CCOC 1626a_102516460346_100000749529 [0,1,1,0,0,0|2,0,0]=4 2995 B11R0.81 CCOCCNC(=O)CCOC 240690a_100011200944_100000749529 [0,1,1,0,0,0|2,0,0]=4 2996 B11R0.81 CCOCCNC(=O)CCOC 527a_100011200944_100000749529 [0,1,1,0,0,0|2,0,0]=4 2997 B11R0.81 CCOCCNC(=O)CCSC 11a_100011200944_100000174002 [0,1,1,0,0,0|2,0,0]=4 2998 B11R0.81 CCOCCNC(=O)CCSC 1626a_102516460346_100000174002 [0,1,1,0,0,0|2,0,0]=4 2999 B11R0.81 CCOCCNC(=O)CCSC 240690a_100011200944_100000174002 [0,1,1,0,0,0|2,0,0]=4 3000 B11R0.81 CCOCCNC(=O)CCSC 527a_100011200944_100000174002 [0,1,1,0,0,0|2,0,0]=4 3001 B11R0.81 CCOCCNC(=O)COCC 11a_100011200944_100000211967 [0,1,1,0,0,0|2,0,0]=4 3002 B11R0.81 CCOCCNC(=O)COCC 1626a_102516460346_100000211967 [0,1,1,0,0,0|2,0,0]=4 3003 B11R0.81 CCOCCNC(=O)COCC 240690a_100011200944_100000211967 [0,1,1,0,0,0|2,0,0]=4 3004 B11R0.81 CCOCCNC(=O)COCC 527a_100011200944_100000211967 [0,1,1,0,0,0|2,0,0]=4 3005 B11R0.81 CCOCCNC(=O)CSCC 11a_100011200944_100000230394 [0,1,1,0,0,0|2,0,0]=4 3006 B11R0.81 CCOCCNC(=O)CSCC 1626a_102516460346_100000230394 [0,1,1,0,0,0|2,0,0]=4 3007 B11R0.81 CCOCCNC(=O)CSCC 240690a_100011200944_100000230394 [0,1,1,0,0,0|2,0,0]=4 3008 B11R0.81 CCOCCNC(=O)CSCC 527a_100011200944_100000230394 [0,1,1,0,0,0|2,0,0]=4 3009 B11R0.81 CCOCCOC(=O)COCC 34a_100121572206_200000101388 [0,1,1,0,0,0|1,0,0]=3 3010 B11R0.81 CCOCCOC(=O)CSCC 62a_100000210202_200000101388 [0,1,1,0,0,0|1,0,0]=3 3011 B11R0.81 CCOCCOC(=O)CSCC 62a_200000101388_100000210202 [0,1,1,0,0,0|1,0,0]=3 3012 B11R0.81 CCOCCOC(=O)CSCF 62a_100015361967_200000101388 [0,1,1,0,0,0|2,0,0]=4 3013 B11R0.81 CCOCCOC(=O)CSCF 62a_200000101388_100015361967 [0,1,1,0,0,0|2,0,0]=4 3014 B11R0.81 CCSCC(=O)CCCCCF 1458a_100000230394_100000729378 [0,1,1,0,0,0|2,0,0]=4 3015 B11R0.81 CCSCC(=O)CCCCCO 1458a_100000230394_100000746330 [0,1,1,0,0,0|2,0,0]=4 3016 B11R0.81 CCSCC(=O)CCCCOC 1458a_100000230394_100000755781 [0,1,1,0,0,0|2,0,0]=4 3017 B11R0.81 CCSCC(=O)NCCCCO 240690a_100000750430_100000230394 [0,1,1,0,0,0|2,0,0]=4 3018 B11R0.81 CCSCC(=O)NCCCCO 527a_100000750430_100000230394 [0,1,1,0,0,0|2,0,0]=4 3019 B11R0.81 CCSCC(=O)NCCCOC 1626a_100150723488_100000230394 [0,1,1,0,0,0|2,0,0]=4 3020 B11R0.81 CCSCC(=O)NCCCOC 240690a_100150723488_100000230394 [0,1,1,0,0,0|2,0,0]=4 3021 B11R0.81 CCSCC(=O)NCCCOC 527a_100150723488_100000230394 [0,1,1,0,0,0|2,0,0]=4 3022 B11R0.81 CCSCC(=O)NCCCOC 62a_100000183178_100000210202 [0,1,1,0,0,0|2,0,0]=4 3023 B11R0.81 CCSCC(=O)NCCCSC 11a_100000749238_100000230394 [0,1,1,0,0,0|2,0,0]=4 3024 B11R0.81 CCSCC(=O)NCCCSC 1626a_100000749238_100000230394 [0,1,1,0,0,0|2,0,0]=4 3025 B11R0.81 CCSCC(=O)NCCCSC 240690a_100000749238_100000230394 [0,1,1,0,0,0|2,0,0]=4 3026 B11R0.81 CCSCC(=O)NCCCSC 527a_100000749238_100000230394 [0,1,1,0,0,0|2,0,0]=4 3027 B11R0.81 CCSCCNC(=O)CCOC 11a_100000106463_100000749529 [0,1,1,0,0,0|2,0,0]=4 3028 B11R0.81 CCSCCNC(=O)CCOC 1626a_100000106463_100000749529 [0,1,1,0,0,0|2,0,0]=4 3029 B11R0.81 CCSCCNC(=O)CCOC 240690a_100000106463_100000749529 [0,1,1,0,0,0|2,0,0]=4 3030 B11R0.81 CCSCCNC(=O)CCOC 527a_100000106463_100000749529 [0,1,1,0,0,0|2,0,0]=4 3031 B11R0.81 CCSCCNC(=O)CCSC 11a_100000106463_100000174002 [0,1,1,0,0,0|2,0,0]=4 3032 B11R0.81 CCSCCNC(=O)CCSC 1626a_100000106463_100000174002 [0,1,1,0,0,0|2,0,0]=4 3033 B11R0.81 CCSCCNC(=O)CCSC 240690a_100000106463_100000174002 [0,1,1,0,0,0|2,0,0]=4 3034 B11R0.81 CCSCCNC(=O)CCSC 527a_100000106463_100000174002 [0,1,1,0,0,0|2,0,0]=4 3035 B11R0.81 CCSCCNC(=O)CSCC 11a_100000106463_100000230394 [0,1,1,0,0,0|2,0,0]=4 3036 B11R0.81 CCSCCNC(=O)CSCC 1626a_100000106463_100000230394 [0,1,1,0,0,0|2,0,0]=4 3037 B11R0.81 CCSCCNC(=O)CSCC 240690a_100000106463_100000230394 [0,1,1,0,0,0|2,0,0]=4 3038 B11R0.81 CCSCCNC(=O)CSCC 527a_100000106463_100000230394 [0,1,1,0,0,0|2,0,0]=4 3039 B11R0.81 COCCC(=O)CCCCCF 1458a_100000749529_100000729378 [0,1,1,0,0,0|2,0,0]=4 3040 B11R0.81 COCCC(=O)CCCCCO 1458a_100000749529_100000746330 [0,1,1,0,0,0|2,0,0]=4 3041 B11R0.81 COCCC(=O)CCCCCO 1458a_100102619762_100000233755 [0,1,1,0,0,0|2,0,0]=4 3042 B11R0.81 COCCC(=O)NCCCCO 240690a_100000750430_100000749529 [0,1,1,0,0,0|2,0,0]=4 3043 B11R0.81 COCCC(=O)NCCCCO 527a_100000750430_100000749529 [0,1,1,0,0,0|2,0,0]=4 3044 B11R0.81 COCCC(=O)NCCCSC 11a_100000749238_100000749529 [0,1,1,0,0,0|2,0,0]=4 3045 B11R0.81 COCCC(=O)NCCCSC 1626a_100000749238_100000749529 [0,1,1,0,0,0|2,0,0]=4 3046 B11R0.81 COCCC(=O)NCCCSC 240690a_100000749238_100000749529 [0,1,1,0,0,0|2,0,0]=4 3047 B11R0.81 COCCC(=O)NCCCSC 527a_100000749238_100000749529 [0,1,1,0,0,0|2,0,0]=4 3048 B11R0.81 COCCCCC(=O)CCOC 1458a_100000749529_100000755781 [0,1,1,0,0,0|2,0,0]=4 3049 B11R0.81 COCCCCC(=O)CCSC 1458a_100000174002_100000755781 [0,1,1,0,0,0|2,0,0]=4 3050 B11R0.81 COCCCNC(=O)CCOC 1626a_100150723488_100000749529 [0,1,1,0,0,0|2,0,0]=4 3051 B11R0.81 COCCCNC(=O)CCOC 240690a_100150723488_100000749529 [0,1,1,0,0,0|2,0,0]=4 3052 B11R0.81 COCCCNC(=O)CCOC 527a_100150723488_100000749529 [0,1,1,0,0,0|2,0,0]=4 3053 B11R0.81 COCCCNC(=O)CCSC 1626a_100150723488_100000174002 [0,1,1,0,0,0|2,0,0]=4 3054 B11R0.81 COCCCNC(=O)CCSC 240690a_100150723488_100000174002 [0,1,1,0,0,0|2,0,0]=4 3055 B11R0.81 COCCCNC(=O)CCSC 527a_100150723488_100000174002 [0,1,1,0,0,0|2,0,0]=4 3056 B11R0.81 CSCCC(=O)CCCCCF 1458a_100000174002_100000729378 [0,1,1,0,0,0|2,0,0]=4 3057 B11R0.81 CSCCC(=O)CCCCCO 1458a_100000174002_100000746330 [0,1,1,0,0,0|2,0,0]=4 3058 B11R0.81 CSCCC(=O)CCCCCO 1458a_100102619762_100000751147 [0,1,1,0,0,0|2,0,0]=4 3059 B11R0.81 CSCCC(=O)NCCCCO 240690a_100000750430_100000174002 [0,1,1,0,0,0|2,0,0]=4 3060 B11R0.81 CSCCC(=O)NCCCCO 527a_100000750430_100000174002 [0,1,1,0,0,0|2,0,0]=4 3061 B11R0.81 CSCCCNC(=O)CCSC 11a_100000749238_100000174002 [0,1,1,0,0,0|2,0,0]=4 3062 B11R0.81 CSCCCNC(=O)CCSC 1626a_100000749238_100000174002 [0,1,1,0,0,0|2,0,0]=4 3063 B11R0.81 CSCCCNC(=O)CCSC 240690a_100000749238_100000174002 [0,1,1,0,0,0|2,0,0]=4 3064 B11R0.81 CSCCCNC(=O)CCSC 527a_100000749238_100000174002 [0,1,1,0,0,0|2,0,0]=4 3065 B11R0.81 O=C(CCCF)CCCCCO 1458a_100102619762_100011934791 [0,1,1,0,0,0|2,0,0]=4 3066 B11R0.81 O=C(CCCO)CCCCCO 1458a_100102619762_100011215043 [0,1,1,0,0,0|2,0,0]=4 3067 B11R0.142 CCC(C)C(=O)CCCCCF 1458a_100011192722_100000729378 [0,1,1,0,0,0|2,0,0]=4 3068 B11R0.142 CCC(C)C(=O)CCCCCO 1458a_100011192722_100000746330 [0,1,1,0,0,0|2,0,0]=4 3069 B11R0.142 CCC(C)C(=O)CCCCCO 1458a_100102619762_100000758301 [0,1,1,0,0,0|2,0,0]=4 3070 B11R0.142 CCC(C)C(=O)CCCCOC 1458a_100011192722_100000755781 [0,1,1,0,0,0|2,0,0]=4 3071 B11R0.142 CCC(C)C(=O)NCCCCO 240690a_100000750430_100011192722 [0,1,1,0,0,0|2,0,0]=4 3072 B11R0.142 CCC(C)C(=O)NCCCCO 527a_100000750430_100011192722 [0,1,1,0,0,0|2,0,0]=4 3073 B11R0.142 CCC(C)C(=O)NCCCOC 1626a_100150723488_100011192722 [0,1,1,0,0,0|2,0,0]=4 3074 B11R0.142 CCC(C)C(=O)NCCCOC 240690a_100150723488_100011192722 [0,1,1,0,0,0|2,0,0]=4 3075 B11R0.142 CCC(C)C(=O)NCCCOC 527a_100150723488_100011192722 [0,1,1,0,0,0|2,0,0]=4 3076 B11R0.142 CCC(C)C(=O)NCCCSC 11a_100000749238_100011192722 [0,1,1,0,0,0|2,0,0]=4 3077 B11R0.142 CCC(C)C(=O)NCCCSC 1626a_100000749238_100011192722 [0,1,1,0,0,0|2,0,0]=4 3078 B11R0.142 CCC(C)C(=O)NCCCSC 240690a_100000749238_100011192722 [0,1,1,0,0,0|2,0,0]=4 3079 B11R0.142 CCC(C)C(=O)NCCCSC 527a_100000749238_100011192722 [0,1,1,0,0,0|2,0,0]=4 3080 B11R0.142 CCC(O)C(=O)CCCCCF 1458a_100011196387_100000729378 [0,1,1,0,0,0|2,0,0]=4 3081 B11R0.142 CCC(O)C(=O)CCCCCO 1458a_100011196387_100000746330 [0,1,1,0,0,0|2,0,0]=4 3082 B11R0.142 CCC(O)C(=O)CCCCOC 1458a_100011196387_100000755781 [0,1,1,0,0,0|2,0,0]=4 3083 B11R0.142 CCC(O)C(=O)NCCCCO 240690a_100000750430_100011196387 [0,1,1,0,0,0|2,0,0]=4 3084 B11R0.142 CCC(O)C(=O)NCCCOC 240690a_100150723488_100011196387 [0,1,1,0,0,0|2,0,0]=4 3085 B11R0.142 CCC(O)C(=O)NCCCSC 240690a_100000749238_100011196387 [0,1,1,0,0,0|2,0,0]=4 3086 B11R0.142 CCCCC=CC(=O)C(C)CC 1458a_100016266645_100000758301 [0,1,1,0,0,0|1,0,1]=4 3087 B11R0.142 CCCCCCC(=O)C(C)CC 1458a_100011192722_100000210757 [0,1,1,0,0,0|1,0,0]=3 3088 B11R0.142 CCCCCCC(=O)C(C)CC 1458a_100102632555_100000758301 [0,1,1,0,0,0|1,0,0]=3 3089 B11R0.142 CCCCCCC(=O)C(C)OC 1458a_100000743197_100000210757 [0,1,1,0,0,0|2,0,0]=4 3090 B11R0.142 CCCCCCC(=O)C(C)SC 1458a_100000149566_100000210757 [0,1,1,0,0,0|2,0,0]=4 3091 B11R0.142 CCCCCCC(=O)C(O)CC 1458a_100011196387_100000210757 [0,1,1,0,0,0|1,0,0]=3 3092 B11R0.142 CCCCCCC(=O)C(O)CO 1458a_100011215603_100000210757 [0,1,1,0,0,0|2,0,0]=4 3093 B11R0.142 CCCCCCC(=O)N(C)CC 11a_100000225621_100102632555 [0,1,1,0,0,0|2,0,0]=4 3094 B11R0.142 CCCCCCC(=O)N(C)CC 1626a_100000225621_100102632555 [0,1,1,0,0,0|2,0,0]=4 3095 B11R0.142 CCCCCCC(=O)N(C)CC 240690a_100000225621_100102632555 [0,1,1,0,0,0|2,0,0]=4 3096 B11R0.142 CCCCCCC(=O)N(C)CC 527a_100000225621_100102632555 [0,1,1,0,0,0|2,0,0]=4 3097 B11R0.142 CCCCCNC(=O)C(C)CC 11a_100000209983_100011192722 [0,1,1,0,0,0|1,0,0]=3 3098 B11R0.142 CCCCCNC(=O)C(C)CC 1626a_100000209983_100011192722 [0,1,1,0,0,0|1,0,0]=3 3099 B11R0.142 CCCCCNC(=O)C(C)CC 240690a_100000209983_100011192722 [0,1,1,0,0,0|1,0,0]=3 3100 B11R0.142 CCCCCNC(=O)C(C)CC 527a_100000209983_100011192722 [0,1,1,0,0,0|1,0,0]=3 3101 B11R0.142 CCCCCNC(=O)C(C)NC 2230a_106832991635_100000735910 [0,1,1,0,0,0|2,0,0]=4 3102 B11R0.142 CCCCCNC(=O)C(C)NC 7a_106832991635_100000735910 [0,1,1,0,0,0|2,0,0]=4 3103 B11R0.142 CCCCCNC(=O)C(C)OC 11a_100000209983_100000743197 [0,1,1,0,0,0|2,0,0]=4 3104 B11R0.142 CCCCCNC(=O)C(C)OC 1626a_100000209983_100000743197 [0,1,1,0,0,0|2,0,0]=4 3105 B11R0.142 CCCCCNC(=O)C(C)OC 240690a_100000209983_100000743197 [0,1,1,0,0,0|2,0,0]=4 3106 B11R0.142 CCCCCNC(=O)C(C)OC 527a_100000209983_100000743197 [0,1,1,0,0,0|2,0,0]=4 3107 B11R0.142 CCCCCNC(=O)C(C)SC 11a_100000209983_100000149566 [0,1,1,0,0,0|2,0,0]=4 3108 B11R0.142 CCCCCNC(=O)C(C)SC 1626a_100000209983_100000149566 [0,1,1,0,0,0|2,0,0]=4 3109 B11R0.142 CCCCCNC(=O)C(C)SC 240690a_100000209983_100000149566 [0,1,1,0,0,0|2,0,0]=4 3110 B11R0.142 CCCCCNC(=O)C(C)SC 527a_100000209983_100000149566 [0,1,1,0,0,0|2,0,0]=4 3111 B11R0.142 CCCCCNC(=O)C(C)SC 62a_100000735910_200000210301 [0,1,1,0,0,0|2,0,0]=4 3112 B11R0.142 CCCCCNC(=O)C(C)SC 62a_200000210301_100000735910 [0,1,1,0,0,0|2,0,0]=4 3113 B11R0.142 CCCCCNC(=O)C(C)S[13CH3] 62a_100000735910_200025704644 [0,1,1,0,0,0|2,0,0]=4 3114 B11R0.142 CCCCCNC(=O)C(C)S[13CH3] 62a_200025704644_100000735910 [0,1,1,0,0,0|2,0,0]=4 3115 B11R0.142 CCCCCNC(=O)C(O)CC 240690a_100000209983_100011196387 [0,1,1,0,0,0|1,0,0]=3 3116 B11R0.142 CCCCCNC(=O)C(O)CO 240690a_100000209983_100011215603 [0,1,1,0,0,0|2,0,0]=4 3117 B11R0.142 CCCCCNC(=O)N(C)CC 2708a_100000209983_100000225621 [0,1,1,0,0,0|2,0,0]=4 3118 B11R0.142 CCCCCNC(=O)N(C)CC 273464a_100000209983_100000225621 [0,1,1,0,0,0|2,0,0]=4 3119 B11R0.142 CCCCCOC(C)C(C)CC 7a_100011215189_100000210326 [0,1,1,0,0,0|1,0,1]=4 3120 B11R0.142 CCCCNNC(=O)C(C)CC 22a_100025702795_100011192722 [0,1,1,0,0,0|2,0,0]=4 3121 B11R0.142 CCCCNNC(=O)C(O)CC 22a_100025702795_100011196387 [0,1,1,0,0,0|2,0,0]=4 3122 B11R0.142 CCCCOCC(=O)C(C)CC 1458a_100000757543_100000758301 [0,1,1,0,0,0|2,0,0]=4 3123 B11R0.142 CCCCOCC(=O)C(C)CC 1458a_100011192722_100011995733 [0,1,1,0,0,0|2,0,0]=4 3124 B11R0.142 CCCCOCC(=O)C(O)CC 1458a_100011196387_100011995733 [0,1,1,0,0,0|2,0,0]=4 3125 B11R0.142 CCCCSCC(=O)C(C)CC 1458a_100000191162_100000758301 [0,1,1,0,0,0|2,0,0]=4 3126 B11R0.142 CCCOCCC(=O)C(C)CC 1458a_100011192722_100011215938 [0,1,1,0,0,0|2,0,0]=4 3127 B11R0.142 CCCOCCC(=O)C(O)CC 1458a_100011196387_100011215938 [0,1,1,0,0,0|2,0,0]=4 3128 B11R0.142 CCOCCCC(=O)C(C)CC 1458a_100011192722_100012232248 [0,1,1,0,0,0|2,0,0]=4 3129 B11R0.142 CCOCCCC(=O)C(O)CC 1458a_100011196387_100012232248 [0,1,1,0,0,0|2,0,0]=4 3130 B11R0.142 CCOCCNC(=O)C(C)CC 11a_100011200944_100011192722 [0,1,1,0,0,0|2,0,0]=4 3131 B11R0.142 CCOCCNC(=O)C(C)CC 1626a_102516460346_100011192722 [0,1,1,0,0,0|2,0,0]=4 3132 B11R0.142 CCOCCNC(=O)C(C)CC 240690a_100011200944_100011192722 [0,1,1,0,0,0|2,0,0]=4 3133 B11R0.142 CCOCCNC(=O)C(C)CC 527a_100011200944_100011192722 [0,1,1,0,0,0|2,0,0]=4 3134 B11R0.142 CCOCCNC(=O)C(O)CC 240690a_100011200944_100011196387 [0,1,1,0,0,0|2,0,0]=4 3135 B11R0.142 CCSCCNC(=O)C(C)CC 11a_100000106463_100011192722 [0,1,1,0,0,0|2,0,0]=4 3136 B11R0.142 CCSCCNC(=O)C(C)CC 1626a_100000106463_100011192722 [0,1,1,0,0,0|2,0,0]=4 3137 B11R0.142 CCSCCNC(=O)C(C)CC 240690a_100000106463_100011192722 [0,1,1,0,0,0|2,0,0]=4 3138 B11R0.142 CCSCCNC(=O)C(C)CC 527a_100000106463_100011192722 [0,1,1,0,0,0|2,0,0]=4 3139 B11R0.142 CCSCCNC(=O)C(O)CC 240690a_100000106463_100011196387 [0,1,1,0,0,0|2,0,0]=4 3140 B11R0.155 CCCC(=O)N(C)CCCCO 240690a_100000717598_100000211992 [0,1,1,0,0,0|2,0,0]=4 3141 B11R0.155 CCCC(=O)N(C)CCCOC 11a_100000224831_100000211992 [0,1,1,0,0,0|2,0,0]=4 3142 B11R0.155 CCCC(=O)N(C)CCCOC 1626a_100000224831_100000211992 [0,1,1,0,0,0|2,0,0]=4 3143 B11R0.155 CCCC(=O)N(C)CCCOC 240690a_100000224831_100000211992 [0,1,1,0,0,0|2,0,0]=4 3144 B11R0.155 CCCC(=O)N(C)CCCOC 527a_100000224831_100000211992 [0,1,1,0,0,0|2,0,0]=4 3145 B11R0.155 CCCCCC(=O)C(=O)NCC 1458a_200011297158_100000210326 [0,1,1,0,0,0|2,0,0]=4 3146 B11R0.155 CCCCCC(C)C(=O)CCC 1458a_100000211992_200011218191 [0,1,1,0,0,0|1,0,0]=3 3147 B11R0.155 CCCCCC(C)C(=O)CCC 1458a_100011215998_100000210303 [0,1,1,0,0,0|1,0,0]=3 3148 B11R0.155 CCCCCC(C)C(=O)CCF 1458a_100011215998_100011217306 [0,1,1,0,0,0|2,0,0]=4 3149 B11R0.155 CCCCCC(C)C(=O)CCO 1458a_100011215998_100000211926 [0,1,1,0,0,0|2,0,0]=4 3150 B11R0.155 CCCCCC(C)C(=O)CCO 1458a_100011216618_200011218191 [0,1,1,0,0,0|2,0,0]=4 3151 B11R0.155 CCCCCC(C)C(=O)COC 1458a_100000210968_200011218191 [0,1,1,0,0,0|2,0,0]=4 3152 B11R0.155 CCCCCC(C)C(=O)CSC 1458a_100000184570_200011218191 [0,1,1,0,0,0|2,0,0]=4 3153 B11R0.155 CCCCCC(C)C(=O)NCC 11a_100015525214_100011215998 [0,1,1,0,0,0|2,0,0]=4 3154 B11R0.155 CCCCCC(C)C(=O)NCC 240690a_100015525214_100011215998 [0,1,1,0,0,0|2,0,0]=4 3155 B11R0.155 CCCCCC(C)C(=O)NCC 527a_100015525214_100011215998 [0,1,1,0,0,0|2,0,0]=4 3156 B11R0.155 CCCCCN(C)C(=O)CCC 11a_100000223495_100000211992 [0,1,1,0,0,0|1,0,0]=3 3157 B11R0.155 CCCCCN(C)C(=O)CCC 1626a_100000223495_100000211992 [0,1,1,0,0,0|1,0,0]=3 3158 B11R0.155 CCCCCN(C)C(=O)CCC 240690a_100000223495_100000211992 [0,1,1,0,0,0|1,0,0]=3 3159 B11R0.155 CCCCCN(C)C(=O)CCC 527a_100000223495_100000211992 [0,1,1,0,0,0|1,0,0]=3 3160 B11R0.155 CCCCCN(C)C(=O)CCO 240690a_100000223495_100011216618 [0,1,1,0,0,0|2,0,0]=4 3161 B11R0.155 CCCCCN(C)C(=O)COC 11a_100000223495_100000210968 [0,1,1,0,0,0|2,0,0]=4 3162 B11R0.155 CCCCCN(C)C(=O)COC 1626a_100000223495_100000210968 [0,1,1,0,0,0|2,0,0]=4 3163 B11R0.155 CCCCCN(C)C(=O)COC 240690a_100000223495_100000210968 [0,1,1,0,0,0|2,0,0]=4 3164 B11R0.155 CCCCCN(C)C(=O)COC 527a_100000223495_100000210968 [0,1,1,0,0,0|2,0,0]=4 3165 B11R0.155 CCCCCN(C)C(=O)CSC 11a_100000223495_100000184570 [0,1,1,0,0,0|2,0,0]=4 3166 B11R0.155 CCCCCN(C)C(=O)CSC 1626a_100000223495_100000184570 [0,1,1,0,0,0|2,0,0]=4 3167 B11R0.155 CCCCCN(C)C(=O)CSC 240690a_100000223495_100000184570 [0,1,1,0,0,0|2,0,0]=4 3168 B11R0.155 CCCCCN(C)C(=O)CSC 527a_100000223495_100000184570 [0,1,1,0,0,0|2,0,0]=4 3169 B11R0.155 CCCCCN(C)C(=O)NCC 2708a_100015525214_100000223495 [0,1,1,0,0,0|2,0,0]=4 3170 B11R0.155 CCCCCN(C)C(=O)NCC 273464a_100015525214_100000223495 [0,1,1,0,0,0|2,0,0]=4 3171 B11R0.155 CCCCSC(C)C(=O)CCC 1458a_100000191163_100000210303 [0,1,1,0,0,0|2,0,0]=4 3172 B11R0.161 C#CC(CCC)OCCCCC 34a_200011217317_100000718602 [0,1,1,0,0,0|1,0,1]=4 3173 B11R0.161 C#CC(CCC)OCCCCC 7a_200011217317_100000210326 [0,1,1,0,0,0|1,0,1]=4 3174 B11R0.161 C=CC(CCC)OCCCCC 34a_100011216692_100000718602 [0,1,1,0,0,0|1,0,1]=4 3175 B11R0.161 C=CC(CCC)OCCCCC 7a_100011216692_100000210326 [0,1,1,0,0,0|1,0,1]=4 3176 B11R0.161 CCCCCOC(C#N)CCC 34a_100000686963_100000718602 [0,1,1,0,0,0|1,0,1]=4 3177 B11R0.161 CCCCCOC(C#N)CCC 7a_100000686963_100000210326 [0,1,1,0,0,0|1,0,1]=4 3178 B11R0.161 CCCCCOC(CC)CCC 34a_100000687864_100000718602 [0,1,1,0,0,0|1,0,1]=4 3179 B11R0.161 CCCCCOC(CC)CCC 7a_100000210253_100011219200 [0,1,1,0,0,0|1,0,1]=4 3180 B11R0.161 CCCCCOC(CC)CCC 7a_100000687864_100000210326 [0,1,1,0,0,0|1,0,1]=4 3181 B11R0.174 CCC(C)CCNC(=O)CCO 240690a_100020591266_100011216618 [0,1,1,0,0,0|2,0,0]=4 3182 B11R0.174 CCC(C)CCNC(=O)COC 11a_100020591266_100000210968 [0,1,1,0,0,0|2,0,0]=4 3183 B11R0.174 CCC(C)CCNC(=O)COC 1626a_100020591266_100000210968 [0,1,1,0,0,0|2,0,0]=4 3184 B11R0.174 CCC(C)CCNC(=O)COC 240690a_100020591266_100000210968 [0,1,1,0,0,0|2,0,0]=4 3185 B11R0.174 CCC(C)CCNC(=O)COC 527a_100020591266_100000210968 [0,1,1,0,0,0|2,0,0]=4 3186 B11R0.174 CCC(C)CCNC(=O)CSC 11a_100020591266_100000184570 [0,1,1,0,0,0|2,0,0]=4 3187 B11R0.174 CCC(C)CCNC(=O)CSC 1626a_100020591266_100000184570 [0,1,1,0,0,0|2,0,0]=4 3188 B11R0.174 CCC(C)CCNC(=O)CSC 240690a_100020591266_100000184570 [0,1,1,0,0,0|2,0,0]=4 3189 B11R0.174 CCC(C)CCNC(=O)CSC 527a_100020591266_100000184570 [0,1,1,0,0,0|2,0,0]=4 3190 B11R0.174 CCCC(=O)CCCN(C)CC 1458a_100000211992_100015186262 [0,1,1,0,0,0|2,0,0]=4 3191 B11R0.174 CCCC(=O)CNCC(C)CC 2230a_100020588543_100000747444 [0,1,1,0,0,0|2,0,0]=4 3192 B11R0.174 CCCC(=O)CNCC(O)CC 2230a_100011218483_100000747444 [0,1,1,0,0,0|2,0,0]=4 3193 B11R0.174 CCCC(=O)COC[C@@H](C)CC 7a_100009816381_100000747444 [0,1,1,0,0,0|2,0,0]=4 3194 B11R0.174 CCCC(=O)CSCC(C)CC 62a_100000747444_100000748023 [0,1,1,0,0,0|2,0,0]=4 3195 B11R0.174 CCCC(=O)CSCC(C)CC 62a_100000748023_100000747444 [0,1,1,0,0,0|2,0,0]=4 3196 B11R0.174 CCCC(=O)CSCC(O)CC 62a_100000747444_100011218378 [0,1,1,0,0,0|2,0,0]=4 3197 B11R0.174 CCCC(=O)CSCC(O)CC 62a_100011218378_100000747444 [0,1,1,0,0,0|2,0,0]=4 3198 B11R0.174 CCCC(=O)CSC[C@@H](C)CC 62a_100000747444_100009816398 [0,1,1,0,0,0|2,0,0]=4 3199 B11R0.174 CCCC(=O)CSC[C@@H](C)CC 62a_100009816398_100000747444 [0,1,1,0,0,0|2,0,0]=4 3200 B11R0.174 CCCC(=O)NCCC(C)CC 11a_100020591266_100000211992 [0,1,1,0,0,0|1,0,0]=3 3201 B11R0.174 CCCC(=O)NCCC(C)CC 1626a_100020591266_100000211992 [0,1,1,0,0,0|1,0,0]=3 3202 B11R0.174 CCCC(=O)NCCC(C)CC 240690a_100020591266_100000211992 [0,1,1,0,0,0|1,0,0]=3 3203 B11R0.174 CCCC(=O)NCCC(C)CC 527a_100020591266_100000211992 [0,1,1,0,0,0|1,0,0]=3 3204 B11R0.174 CCCC(=O)NCCC(C)CO 240690a_106354213184_100000211992 [0,1,1,0,0,0|2,0,0]=4 3205 B11R0.174 CCCC(=O)NCCC(C)CO 527a_106354213184_100000211992 [0,1,1,0,0,0|2,0,0]=4 3206 B11R0.174 CCCC(=O)NNCC(O)CC 22a_100015206393_100000211992 [0,1,1,0,0,0|2,0,0]=4 3207 B11R0.174 CCCC(=O)OCNC(C)CC 2230a_100000209981_100000034017 [0,1,1,0,0,0|1,0,0]=3 3208 B11R0.174 CCCC(=O)OCN[C@H](C)CO 2230a_100000737577_100000034017 [0,1,1,0,0,0|2,0,0]=4 3209 B11R0.174 CCCC(=O)OCOC(C)CF 34a_100016041109_100000034017 [0,1,1,0,0,0|2,0,0]=4 3210 B11R0.174 CCCC(=O)OCOC(C)CN 34a_100000210904_100000034017 [0,1,1,0,0,0|2,0,0]=4 3211 B11R0.174 CCCC(=O)OCSC(C)CC 62a_100000758301_100000034017 [0,1,1,0,0,0|1,0,0]=3 3212 B11R0.174 CCCC(=O)OCSC(C)CO 62a_100012180447_100000034017 [0,1,1,0,0,0|2,0,0]=4 3213 B11R0.174 CCCC(=O)OCSC(C)OC 62a_100009879195_100000034017 [0,1,1,0,0,0|2,0,0]=4 3214 B11R0.174 CCCC(=O)OCS[C@H](C)CO 62a_100016084084_100000034017 [0,1,1,0,0,0|2,0,0]=4 3215 B11R0.174 CCCC(C)OCCC(C)CC 7a_100011215188_100000766640 [0,1,1,0,0,0|1,0,1]=4 3216 B11R0.174 CCNC(=O)NCCC(C)CC 2708a_100015525214_100020591266 [0,1,1,0,0,0|2,0,0]=4 3217 B11R0.174 CCNC(=O)NCCC(C)CC 2708a_100020591266_100015525214 [0,1,1,0,0,0|2,0,0]=4 3218 B11R0.174 CCNC(=O)NCCC(C)CC 273464a_100015525214_100020591266 [0,1,1,0,0,0|2,0,0]=4 3219 B11R0.174 CCNC(=O)NCCC(C)CC 273464a_100020591266_100015525214 [0,1,1,0,0,0|2,0,0]=4 3220 B11R0.174 CCNC(=O)NCCC(C)CC 512a_100015525214_100020591266 [0,1,1,0,0,0|2,0,0]=4 3221 B11R0.174 CCNC(=O)NCCC(C)CC 512a_100020591266_100015525214 [0,1,1,0,0,0|2,0,0]=4 3222 B11R0.174 CCOC(=O)OCSC(C)CC 62a_100000758301_100000075025 [0,1,1,0,0,0|2,0,0]=4 3223 B11R0.176 C=C(C)COCOC(=O)CCC 34a_100000210245_100000034017 [0,1,1,0,0,0|1,0,1]=4 3224 B11R0.176 C=C(C)CSCOC(=O)CCC 62a_100000748629_100000034017 [0,1,1,0,0,0|1,0,1]=4 3225 B11R0.176 CC(C)CCCCC(=O)CCF 1458a_100011933920_100011217306 [0,1,1,0,0,0|2,0,0]=4 3226 B11R0.176 CC(C)CCCCC(=O)CCO 1458a_100011216618_100011216152 [0,1,1,0,0,0|2,0,0]=4 3227 B11R0.176 CC(C)CCCCC(=O)CCO 1458a_100011933920_100000211926 [0,1,1,0,0,0|2,0,0]=4 3228 B11R0.176 CC(C)CCCNC(=O)CCO 240690a_200000737386_100011216618 [0,1,1,0,0,0|2,0,0]=4 3229 B11R0.176 CCCC(=O)CCCCC(=O)C 1458a_100000211992_100000735457 [0,1,1,0,0,0|1,0,1]=4 3230 B11R0.176 CCCC(=O)CCCCC(C)C 1458a_100000211992_100011216152 [0,1,1,0,0,0|1,0,0]=3 3231 B11R0.176 CCCC(=O)CCCCC(C)C 1458a_100011933920_100000210303 [0,1,1,0,0,0|1,0,0]=3 3232 B11R0.176 CCCC(=O)CNCCC(C)O 2230a_200000755665_100000747444 [0,1,1,0,0,0|2,0,0]=4 3233 B11R0.176 CCCC(=O)COCCC(C)C 7a_100000210254_100000747444 [0,1,1,0,0,0|2,0,0]=4 3234 B11R0.176 CCCC(=O)CSCCC(C)C 62a_100000210312_100000747444 [0,1,1,0,0,0|2,0,0]=4 3235 B11R0.176 CCCC(=O)CSCCC(C)C 62a_100000747444_100000210312 [0,1,1,0,0,0|2,0,0]=4 3236 B11R0.176 CCCC(=O)CSCCC(C)O 62a_100000747444_100012276601 [0,1,1,0,0,0|2,0,0]=4 3237 B11R0.176 CCCC(=O)CSCCC(C)O 62a_100012276601_100000747444 [0,1,1,0,0,0|2,0,0]=4 3238 B11R0.176 CCCC(=O)NCCCC(C)C 11a_200000737386_100000211992 [0,1,1,0,0,0|1,0,0]=3 3239 B11R0.176 CCCC(=O)NCCCC(C)C 1626a_200000737386_100000211992 [0,1,1,0,0,0|1,0,0]=3 3240 B11R0.176 CCCC(=O)NCCCC(C)C 240690a_200000737386_100000211992 [0,1,1,0,0,0|1,0,0]=3 3241 B11R0.176 CCCC(=O)NCCCC(C)C 527a_200000737386_100000211992 [0,1,1,0,0,0|1,0,0]=3 3242 B11R0.176 CCCC(=O)NCCCN(C)C 240690a_102531767803_100000211992 [0,1,1,0,0,0|2,0,0]=4 3243 B11R0.176 CCCC(=O)NCCCN(C)C 527a_102531767803_100000211992 [0,1,1,0,0,0|2,0,0]=4 3244 B11R0.176 CCCC(=O)NCCCS(=O)C 11a_200000753449_100000211992 [0,1,1,0,0,0|2,0,0]=4 3245 B11R0.176 CCCC(=O)NCCCS(=O)C 240690a_200000753449_100000211992 [0,1,1,0,0,0|2,0,0]=4 3246 B11R0.176 CCCC(=O)NCCCS(=O)C 527a_200000753449_100000211992 [0,1,1,0,0,0|2,0,0]=4 3247 B11R0.176 CCCC(=O)NCCOC(C)C 11a_100000701111_100000211992 [0,1,1,0,0,0|2,0,0]=4 3248 B11R0.176 CCCC(=O)NCCOC(C)C 1626a_100000701111_100000211992 [0,1,1,0,0,0|2,0,0]=4 3249 B11R0.176 CCCC(=O)NCCOC(C)C 240690a_100000701111_100000211992 [0,1,1,0,0,0|2,0,0]=4 3250 B11R0.176 CCCC(=O)NCCOC(C)C 527a_100000701111_100000211992 [0,1,1,0,0,0|2,0,0]=4 3251 B11R0.176 CCCC(=O)NCCSC(C)C 11a_100000731138_100000211992 [0,1,1,0,0,0|2,0,0]=4 3252 B11R0.176 CCCC(=O)NCCSC(C)C 1626a_100000731138_100000211992 [0,1,1,0,0,0|2,0,0]=4 3253 B11R0.176 CCCC(=O)NCCSC(C)C 240690a_100000731138_100000211992 [0,1,1,0,0,0|2,0,0]=4 3254 B11R0.176 CCCC(=O)NCCSC(C)C 527a_100000731138_100000211992 [0,1,1,0,0,0|2,0,0]=4 3255 B11R0.176 CCCC(=O)OCNCC(C)C 2230a_100000210953_100000034017 [0,1,1,0,0,0|1,0,0]=3 3256 B11R0.176 CCCC(=O)OCNCC(C)C 34a_100000210953_100000034017 [0,1,1,0,0,0|1,0,0]=3 3257 B11R0.176 CCCC(=O)OCNCC(C)O 2230a_100000210904_100000034017 [0,1,1,0,0,0|1,0,0]=3 3258 B11R0.176 CCCC(=O)OCNCC(C)O 34a_100000210904_100000034017 [0,1,1,0,0,0|1,0,0]=3 3259 B11R0.176 CCCC(=O)OCNCC(F)F 34a_100000765723_100000034017 [0,1,1,0,0,0|2,0,0]=4 3260 B11R0.176 CCCC(=O)OCOCC(=O)C 34a_100000211253_100000034017 [0,1,1,0,0,0|1,0,1]=4 3261 B11R0.176 CCCC(=O)OCOCC(C)Br 34a_100012180447_100000034017 [0,1,1,0,0,0|1,0,0]=3 3262 B11R0.176 CCCC(=O)OCOCC(C)C 34a_100000210257_100000034017 [0,1,1,0,0,0|1,0,0]=3 3263 B11R0.176 CCCC(=O)OCOCC(C)F 34a_100015925927_100000034017 [0,1,1,0,0,0|1,0,0]=3 3264 B11R0.176 CCCC(=O)OCOCC(F)F 34a_100000743014_100000034017 [0,1,1,0,0,0|2,0,0]=4 3265 B11R0.176 CCCC(=O)OCOC[C@@H](C)Cl 34a_100016084084_100000034017 [0,1,1,0,0,0|1,0,0]=3 3266 B11R0.176 CCCC(=O)OCOC[C@@H](C)N 34a_100000737577_100000034017 [0,1,1,0,0,0|1,0,0]=3 3267 B11R0.176 CCCC(=O)OCSCC(C)C 62a_100000210624_100000034017 [0,1,1,0,0,0|1,0,0]=3 3268 B11R0.176 CCCC(=O)OCSCC(C)O 62a_100011218427_100000034017 [0,1,1,0,0,0|1,0,0]=3 3269 B11R0.176 CCCC(=O)OCSCC(F)F 62a_100011934356_100000034017 [0,1,1,0,0,0|2,0,0]=4 3270 B11R0.176 CCCC(=O)OCSC[C@@H](C)O 62a_100009817552_100000034017 [0,1,1,0,0,0|1,0,0]=3 3271 B11R0.176 CCCC(C)OCCCC(C)C 34a_100000210774_100000766640 [0,1,1,0,0,0|1,0,1]=4 3272 B11R0.176 CCCC(C)OCCCC(C)C 34a_100000764384_100011214892 [0,1,1,0,0,0|1,0,1]=4 3273 B11R0.176 CCCC(C)OCCCC(C)C 7a_100000210774_100000766640 [0,1,1,0,0,0|1,0,1]=4 3274 B11R0.176 CCCC(C)OCCCC(C)C 7a_100000764384_100011214892 [0,1,1,0,0,0|1,0,1]=4 3275 B11R0.176 CCCC(C)OCCCC(C)O 34a_100000764384_200000718107 [0,1,1,0,0,0|1,0,1]=4 3276 B11R0.176 CCCC(C)OCCCC(C)O 7a_100000764384_200000718107 [0,1,1,0,0,0|1,0,1]=4 3277 B11R0.176 CCNC(=O)CCCCC(C)C 11a_100015525214_100011933920 [0,1,1,0,0,0|2,0,0]=4 3278 B11R0.176 CCNC(=O)CCCCC(C)C 240690a_100015525214_100011933920 [0,1,1,0,0,0|2,0,0]=4 3279 B11R0.176 CCNC(=O)CCCCC(C)C 527a_100015525214_100011933920 [0,1,1,0,0,0|2,0,0]=4 3280 B11R0.176 CCNC(=O)NCCCC(C)C 2708a_100015525214_200000737386 [0,1,1,0,0,0|2,0,0]=4 3281 B11R0.176 CCNC(=O)NCCCC(C)C 2708a_200000737386_100015525214 [0,1,1,0,0,0|2,0,0]=4 3282 B11R0.176 CCNC(=O)NCCCC(C)C 273464a_100015525214_200000737386 [0,1,1,0,0,0|2,0,0]=4 3283 B11R0.176 CCNC(=O)NCCCC(C)C 273464a_200000737386_100015525214 [0,1,1,0,0,0|2,0,0]=4 3284 B11R0.176 CCNC(=O)NCCCC(C)C 512a_100015525214_200000737386 [0,1,1,0,0,0|2,0,0]=4 3285 B11R0.176 CCNC(=O)NCCCC(C)C 512a_200000737386_100015525214 [0,1,1,0,0,0|2,0,0]=4 3286 B11R0.176 CCOC(=O)OCSCC(C)C 62a_100000210624_100000075025 [0,1,1,0,0,0|2,0,0]=4 3287 B11R0.176 CCOC(=O)OCSCC(C)O 62a_100011218427_100000075025 [0,1,1,0,0,0|2,0,0]=4 3288 B11R0.176 CCOC(=O)OCSC[C@@H](C)O 62a_100009817552_100000075025 [0,1,1,0,0,0|2,0,0]=4 3289 B11R0.176 COCC(=O)CCCCC(C)C 1458a_100000210968_100011216152 [0,1,1,0,0,0|2,0,0]=4 3290 B11R0.176 COCC(=O)NCCCC(C)C 11a_200000737386_100000210968 [0,1,1,0,0,0|2,0,0]=4 3291 B11R0.176 COCC(=O)NCCCC(C)C 1626a_200000737386_100000210968 [0,1,1,0,0,0|2,0,0]=4 3292 B11R0.176 COCC(=O)NCCCC(C)C 240690a_200000737386_100000210968 [0,1,1,0,0,0|2,0,0]=4 3293 B11R0.176 COCC(=O)NCCCC(C)C 527a_200000737386_100000210968 [0,1,1,0,0,0|2,0,0]=4 3294 B11R0.176 CSCC(=O)CCCCC(C)C 1458a_100000184570_100011216152 [0,1,1,0,0,0|2,0,0]=4 3295 B11R0.176 CSCC(=O)NCCCC(C)C 11a_200000737386_100000184570 [0,1,1,0,0,0|2,0,0]=4 3296 B11R0.176 CSCC(=O)NCCCC(C)C 1626a_200000737386_100000184570 [0,1,1,0,0,0|2,0,0]=4 3297 B11R0.176 CSCC(=O)NCCCC(C)C 240690a_200000737386_100000184570 [0,1,1,0,0,0|2,0,0]=4 3298 B11R0.176 CSCC(=O)NCCCC(C)C 527a_200000737386_100000184570 [0,1,1,0,0,0|2,0,0]=4 3299 B11R0.304 CCCCCNS(=O)(=O)CCC 270084a_100000209983_100000211391 [0,1,1,0,0,0|2,0,0]=4 3300 B11R0.304 CCCCCNS(=O)(=O)CCC 274078a_100000209983_100000211391 [0,1,1,0,0,0|2,0,0]=4 3301 B11R0.304 CCCCCNS(=O)(=O)CCC 40a_100000209983_100000054278 [0,1,1,0,0,0|2,0,0]=4 3302 B11R0.304 CCCCCOC(C)(C)CCC 7a_100000748436_100000210326 [0,1,1,0,0,0|1,0,1]=4 3303 B11R0.30 CC(=O)CCCCCCC(C)C 1458a_100000040743_200000210301 [0,1,1,0,0,0|1,0,0]=3 3304 B11R0.30 CC(=O)CCCCNCC(=O)O 269956a_100016091260_100000735457 [0,1,1,0,0,0|1,0,1]=4 3305 B11R0.30 CC(=O)CCCCNCC(C)C 34a_100000210953_100009817362 [0,1,1,0,0,0|2,0,0]=4 3306 B11R0.30 CC(=O)CCCCNCC(C)O 34a_100000210904_100009817362 [0,1,1,0,0,0|2,0,0]=4 3307 B11R0.30 CC(=O)CCCCOCC(C)Br 34a_100012180447_100009817362 [0,1,1,0,0,0|2,0,0]=4 3308 B11R0.30 CC(=O)CCCCOCC(C)C 34a_100000210257_100009817362 [0,1,1,0,0,0|2,0,0]=4 3309 B11R0.30 CC(=O)CCCCOCC(C)F 34a_100015925927_100009817362 [0,1,1,0,0,0|2,0,0]=4 3310 B11R0.30 CC(=O)CCCCOC[C@@H](C)Cl 34a_100016084084_100009817362 [0,1,1,0,0,0|2,0,0]=4 3311 B11R0.30 CC(=O)CCCCOC[C@@H](C)N 34a_100000737577_100009817362 [0,1,1,0,0,0|2,0,0]=4 3312 B11R0.30 CC(=O)CCCCSCC(C)C 62a_100000210624_100000735457 [0,1,1,0,0,0|2,0,0]=4 3313 B11R0.30 CC(=O)CCCCSCC(C)C 62a_100000735457_100000210760 [0,1,1,0,0,0|2,0,0]=4 3314 B11R0.30 CC(=O)CCCCSCC(C)O 62a_100000735457_100011218427 [0,1,1,0,0,0|2,0,0]=4 3315 B11R0.30 CC(=O)CCCCSCC(C)O 62a_100011218427_100000735457 [0,1,1,0,0,0|2,0,0]=4 3316 B11R0.30 CC(=O)CCCCSC[C@@H](C)O 62a_100000735457_100009817552 [0,1,1,0,0,0|2,0,0]=4 3317 B11R0.30 CC(=O)CCCCSC[C@@H](C)O 62a_100009817552_100000735457 [0,1,1,0,0,0|2,0,0]=4 3318 B11R0.30 CC(=O)CCCOCCC(C)Br 34a_100009893172_100000685027 [0,1,1,0,0,0|2,0,0]=4 3319 B11R0.30 CC(=O)CCCOCCC(C)C 34a_100000210254_100000685027 [0,1,1,0,0,0|2,0,0]=4 3320 B11R0.30 CC(=O)CCCOCCC(C)C 34a_100000759063_100000210312 [0,1,1,0,0,0|2,0,0]=4 3321 B11R0.30 CC(=O)CCCOCCC(C)C 7a_100000210254_100011215641 [0,1,1,0,0,0|2,0,0]=4 3322 B11R0.30 CC(=O)CCCOCCC(C)C 7a_100000759063_100000210626 [0,1,1,0,0,0|2,0,0]=4 3323 B11R0.30 CC(=O)CCCOCCC(C)O 34a_100000759063_100012276601 [0,1,1,0,0,0|2,0,0]=4 3324 B11R0.30 CC(=O)CCCOCCC(C)O 7a_100000759063_100012276601 [0,1,1,0,0,0|2,0,0]=4 3325 B11R0.30 CC(=O)CCCOCC[C@@H](C)N 34a_100000706166_100000685027 [0,1,1,0,0,0|2,0,0]=4 3326 B11R0.30 CC(=O)CCCSCCC(C)C 62a_100000210312_100011215641 [0,1,1,0,0,0|2,0,0]=4 3327 B11R0.30 CC(=O)CCCSCCC(C)C 62a_100011215641_100000210312 [0,1,1,0,0,0|2,0,0]=4 3328 B11R0.30 CC(=O)CCCSCCC(C)O 62a_100011215641_100012276601 [0,1,1,0,0,0|2,0,0]=4 3329 B11R0.30 CC(=O)CCCSCCC(C)O 62a_100012276601_100011215641 [0,1,1,0,0,0|2,0,0]=4 3330 B11R0.30 CC(=O)CCOCCCC(C)C 34a_100000759926_100011214892 [0,1,1,0,0,0|2,0,0]=4 3331 B11R0.30 CC(=O)CCOCCCC(C)C 7a_100000210774_100000053229 [0,1,1,0,0,0|2,0,0]=4 3332 B11R0.30 CC(=O)CCOCCCC(C)C 7a_100000759926_100011214892 [0,1,1,0,0,0|2,0,0]=4 3333 B11R0.30 CC(=O)CCOCCCC(C)O 34a_100000759926_200000718107 [0,1,1,0,0,0|2,0,0]=4 3334 B11R0.30 CC(=O)CCOCCCC(C)O 7a_100000759926_200000718107 [0,1,1,0,0,0|2,0,0]=4 3335 B11R0.30 CC(=O)CCSCCCC(C)C 62a_100000053229_100011214892 [0,1,1,0,0,0|2,0,0]=4 3336 B11R0.30 CC(=O)CCSCCCC(C)C 62a_100011214892_100000053229 [0,1,1,0,0,0|2,0,0]=4 3337 B11R0.30 CC(=O)CCSCCCC(C)O 62a_100000053229_200000718107 [0,1,1,0,0,0|2,0,0]=4 3338 B11R0.30 CC(=O)CCSCCCC(C)O 62a_200000718107_100000053229 [0,1,1,0,0,0|2,0,0]=4 3339 B11R0.30 CC(=O)COCCCCC(C)C 34a_100000211253_100011216152 [0,1,1,0,0,0|2,0,0]=4 3340 B11R0.30 CC(=O)NCCCCCC(C)C 1626a_100011290863_100015343762 [0,1,1,0,0,0|2,0,0]=4 3341 B11R0.30 CC(=O)NCCCCCC(C)C 240690a_100011290863_100015343762 [0,1,1,0,0,0|2,0,0]=4 3342 B11R0.30 CC(=O)NCCCCCC(C)C 527a_100011290863_100103153847 [0,1,1,0,0,0|2,0,0]=4 3343 B11R0.30 CC(Br)CCOCCCC(=O)N 34a_100009893172_100102525003 [0,1,1,0,0,0|2,0,0]=4 3344 B11R0.30 CC(C)CCCCCCC(=O)[13CH3] 1458a_100000040743_200025704644 [0,1,1,0,0,0|1,0,0]=3 3345 B11R0.30 CC(C)CCCCNCC(=O)N 2230a_100000711301_100011216152 [0,1,1,0,0,0|2,0,0]=4 3346 B11R0.30 CC(C)CCCCNCC(=O)O 269956a_100016091260_100011216152 [0,1,1,0,0,0|1,0,0]=3 3347 B11R0.30 CC(C)CCCCOCC(=O)N 34a_100011214890_100000187820 [0,1,1,0,0,0|2,0,0]=4 3348 B11R0.30 CC(C)CCCCOCC(=O)N 7a_100011214890_100000187820 [0,1,1,0,0,0|2,0,0]=4 3349 B11R0.30 CC(C)CCCCOCC(=O)[O-] 34a_100011214890_100020667443 [0,1,1,0,0,0|1,0,1]=4 3350 B11R0.30 CC(C)CCCCSCC(=O)N 62a_100000747473_100011216152 [0,1,1,0,0,0|2,0,0]=4 3351 B11R0.30 CC(C)CCCCSCC(=O)N 62a_100011216152_100000747473 [0,1,1,0,0,0|2,0,0]=4 3352 B11R0.30 CC(C)CCCCSCC(=O)[O-] 62a_100011216152_100020667443 [0,1,1,0,0,0|1,0,1]=4 3353 B11R0.30 CC(C)CCCCSCC(=O)[O-] 62a_100020667443_100011216152 [0,1,1,0,0,0|1,0,1]=4 3354 B11R0.30 CC(C)CCCNCCC(=O)N 2230a_200000737386_100000744528 [0,1,1,0,0,0|2,0,0]=4 3355 B11R0.30 CC(C)CCCNCCC(=O)N 34a_200000737386_100000731001 [0,1,1,0,0,0|2,0,0]=4 3356 B11R0.30 CC(C)CCCNOCC(=O)O 269956a_100000106656_100011214892 [0,1,1,0,0,0|2,0,0]=4 3357 B11R0.30 CC(C)CCCOCCC(=O)N 34a_100000210774_100000731001 [0,1,1,0,0,0|2,0,0]=4 3358 B11R0.30 CC(C)CCCOCCC(=O)N 34a_100000757172_100011214892 [0,1,1,0,0,0|2,0,0]=4 3359 B11R0.30 CC(C)CCCOCCC(=O)N 7a_100000210774_100000744528 [0,1,1,0,0,0|2,0,0]=4 3360 B11R0.30 CC(C)CCCOCCC(=O)N 7a_100000757172_100011214892 [0,1,1,0,0,0|2,0,0]=4 3361 B11R0.30 CC(C)CCCSCCC(=O)N 62a_100000744528_100011214892 [0,1,1,0,0,0|2,0,0]=4 3362 B11R0.30 CC(C)CCCSCCC(=O)N 62a_100011214892_100000744528 [0,1,1,0,0,0|2,0,0]=4 3363 B11R0.30 CC(C)CCNCCCC(=O)N 269862a_100000739312_100000185833 [0,1,1,0,0,0|2,0,0]=4 3364 B11R0.30 CC(C)CCNCCCC(=O)N 34a_100000739312_100000210312 [0,1,1,0,0,0|2,0,0]=4 3365 B11R0.30 CC(C)CCOCCCC(=O)N 34a_100000210254_100102525003 [0,1,1,0,0,0|2,0,0]=4 3366 B11R0.30 CC(C)CCOCCCC(=O)N 7a_100000210254_100102525003 [0,1,1,0,0,0|2,0,0]=4 3367 B11R0.30 CC(C)CCSCCCC(=O)N 62a_100000210312_100102525003 [0,1,1,0,0,0|2,0,0]=4 3368 B11R0.30 CC(C)CCSCCCC(=O)N 62a_100102525003_100000210312 [0,1,1,0,0,0|2,0,0]=4 3369 B11R0.30 CC(C)CNCCCCC(=O)N 270004a_100000696515_100000210432 [0,1,1,0,0,0|2,0,0]=4 3370 B11R0.30 CC(C)CNCCCCC(=O)N 34a_100000696515_100000210624 [0,1,1,0,0,0|2,0,0]=4 3371 B11R0.30 CC(C)CNCCOCC(=O)O 269956a_100000700818_100000210760 [0,1,1,0,0,0|2,0,0]=4 3372 B11R0.30 CC(C)COCCCCC(=O)N 34a_100012022536_100000210624 [0,1,1,0,0,0|2,0,0]=4 3373 B11R0.30 CC(C)COCCCCC(=O)N 7a_100012022536_100000210760 [0,1,1,0,0,0|2,0,0]=4 3374 B11R0.30 CC(C)NCCCCCC(=O)N 2230a_100138425928_100009817443 [0,1,1,0,0,0|2,0,0]=4 3375 B11R0.30 CC(C)NCCCCCC(=O)N 34a_100138425928_100009817443 [0,1,1,0,0,0|2,0,0]=4 3376 B11R0.30 CC(C)OCCCCCC(=O)N 34a_100000123541_100000210206 [0,1,1,0,0,0|2,0,0]=4 3377 B11R0.30 CC(C)OCCCCCC(=O)N 34a_100000212225_100009817443 [0,1,1,0,0,0|2,0,0]=4 3378 B11R0.30 CC(C)OCCCCCC(=O)N 7a_100000123541_100000210206 [0,1,1,0,0,0|2,0,0]=4 3379 B11R0.30 CC(C)OCCCCCC(=O)[O-] 7a_100102619762_100000210206 [0,1,1,0,0,0|1,0,1]=4 3380 B11R0.30 CC(C)SCCCCCC(=O)N 62a_100000210206_100009817443 [0,1,1,0,0,0|2,0,0]=4 3381 B11R0.30 CC(C)SCCCCCC(=O)N 62a_100009817443_100000210206 [0,1,1,0,0,0|2,0,0]=4 3382 B11R0.30 CC(O)CCCNOCC(=O)O 269956a_100000106656_200000718107 [0,1,1,0,0,0|2,0,0]=4 3383 B11R0.30 CC(O)CCCOCCC(=O)N 34a_100000757172_200000718107 [0,1,1,0,0,0|2,0,0]=4 3384 B11R0.30 CC(O)CCCOCCC(=O)N 7a_100000757172_200000718107 [0,1,1,0,0,0|2,0,0]=4 3385 B11R0.30 CC(O)CCCSCCC(=O)N 62a_100000744528_200000718107 [0,1,1,0,0,0|2,0,0]=4 3386 B11R0.30 CC(O)CCCSCCC(=O)N 62a_200000718107_100000744528 [0,1,1,0,0,0|2,0,0]=4 3387 B11R0.30 CC(O)CCNCCCC(=O)N 34a_100000739312_100012276601 [0,1,1,0,0,0|2,0,0]=4 3388 B11R0.30 CC(O)CCSCCCC(=O)N 62a_100012276601_100102525003 [0,1,1,0,0,0|2,0,0]=4 3389 B11R0.30 CC(O)CCSCCCC(=O)N 62a_100102525003_100012276601 [0,1,1,0,0,0|2,0,0]=4 3390 B11R0.30 CC(O)CNCCCCC(=O)N 34a_100000696515_100011218427 [0,1,1,0,0,0|2,0,0]=4 3391 B11R0.30 CC(O)CNCCOCC(=O)O 269956a_100000700818_100011218427 [0,1,1,0,0,0|2,0,0]=4 3392 B11R0.30 CC(O)COCCCCC(=O)N 34a_100012022536_100011218427 [0,1,1,0,0,0|2,0,0]=4 3393 B11R0.30 CC(O)COCCCCC(=O)N 7a_100012022536_100011218427 [0,1,1,0,0,0|2,0,0]=4 3394 B11R0.30 CN(C)CCCCNCC(=O)O 269956a_100016091260_100000690147 [0,1,1,0,0,0|2,0,0]=4 3395 B11R0.30 C[C@@H](N)CCOCCCC(=O)N 34a_100000706166_100102525003 [0,1,1,0,0,0|2,0,0]=4 3396 B11R0.30 C[C@@H](O)CNCCCCC(=O)N 34a_100000696515_100009817552 [0,1,1,0,0,0|2,0,0]=4 3397 B11R0.30 C[C@@H](O)CNCCOCC(=O)O 269956a_100000700818_100009817552 [0,1,1,0,0,0|2,0,0]=4 3398 B11R0.30 C[C@@H](O)COCCCCC(=O)N 34a_100012022536_100009817552 [0,1,1,0,0,0|2,0,0]=4 3399 B11R0.30 C[C@@H](O)COCCCCC(=O)N 7a_100012022536_100009817552 [0,1,1,0,0,0|2,0,0]=4 3400 B11R0.40 C#CC(=O)CCCCCCCC 1458a_100000211873_100000210759 [0,1,1,0,0,0|1,0,0]=3 3401 B11R0.40 C#CC(=O)CCCCCCCO 1458a_100000211873_100000760002 [0,1,1,0,0,0|2,0,0]=4 3402 B11R0.40 C#CC(=O)CCCCCCOC 1458a_100000211873_100011998445 [0,1,1,0,0,0|2,0,0]=4 3403 B11R0.40 C#CCCCCCCC(=O)CO 1458a_100000210174_100012276617 [0,1,1,0,0,0|0,0,2]=4 3404 B11R0.40 C=CC(=O)CCCCCCCC 1458a_100000185746_100000210759 [0,1,1,0,0,0|1,0,0]=3 3405 B11R0.40 C=CC(=O)CCCCCCCO 1458a_100000185746_100000760002 [0,1,1,0,0,0|2,0,0]=4 3406 B11R0.40 C=CC(=O)CCCCCCOC 1458a_100000185746_100011998445 [0,1,1,0,0,0|2,0,0]=4 3407 B11R0.40 C=CC(=O)NCCCCCCC 1626a_100000229938_100000185746 [0,1,1,0,0,0|2,0,0]=4 3408 B11R0.40 C=CC(=O)NCCCCCCC 240690a_100000229938_200121576911 [0,1,1,0,0,0|2,0,0]=4 3409 B11R0.40 C=CCCCCCCC(=O)CO 1458a_100000210174_100011215473 [0,1,1,0,0,0|0,0,2]=4 3410 B11R0.40 CCC(=O)CCCCCCCO 1458a_100000210414_100000760002 [0,1,1,0,0,0|2,0,0]=4 3411 B11R0.40 CCC(=O)CCCCCCCO 1458a_100011219782_100000210202 [0,1,1,0,0,0|2,0,0]=4 3412 B11R0.40 CCC(=O)CCCCCCOC 1458a_100000210414_100011998445 [0,1,1,0,0,0|2,0,0]=4 3413 B11R0.40 CCCCCC#CCC(=O)CO 1458a_100000210174_100009816472 [0,1,1,0,0,0|0,0,2]=4 3414 B11R0.40 CCCCCCCCC(=O)CC 1458a_100000210188_100000210202 [0,1,1,0,0,0|1,0,0]=3 3415 B11R0.40 CCCCCCCCC(=O)CC 1458a_100000210414_100000210759 [0,1,1,0,0,0|1,0,0]=3 3416 B11R0.40 CCCCCCCCC(=O)CF 1458a_100000210188_100015361967 [0,1,1,0,0,0|1,0,0]=3 3417 B11R0.40 CCCCCCCCC(=O)CO 1458a_100000210174_100000210759 [0,1,1,0,0,0|0,0,0]=2 3418 B11R0.40 CCCCCCCCC(=O)NC 11a_106832991635_100000210188 [0,1,1,0,0,0|1,0,0]=3 3419 B11R0.40 CCCCCCCCC(=O)NC 1626a_100102657272_100000210188 [0,1,1,0,0,0|1,0,0]=3 3420 B11R0.40 CCCCCCCCC(=O)NC 240690a_100102657272_100000210188 [0,1,1,0,0,0|1,0,0]=3 3421 B11R0.40 CCCCCCCCC(=O)NC 527a_100102657272_100000210188 [0,1,1,0,0,0|1,0,0]=3 3422 B11R0.40 CCCCCCCCC(C)OC 34a_100000210740_200000210301 [0,1,1,0,0,0|1,0,1]=4 3423 B11R0.40 CCCCCCCCC(C)OC 7a_100000210740_200000210301 [0,1,1,0,0,0|1,0,1]=4 3424 B11R0.40 CCCCCCCCC(C)O[13CH3] 34a_100000210740_200025704644 [0,1,1,0,0,0|1,0,1]=4 3425 B11R0.40 CCCCCCCCC(C)O[13CH3] 7a_100000210740_200025704644 [0,1,1,0,0,0|1,0,1]=4 3426 B11R0.40 CCCCCCCNC(=O)CC 11a_100000229938_100000210414 [0,1,1,0,0,0|2,0,0]=4 3427 B11R0.40 CCCCCCCNC(=O)CC 1626a_100000229938_100000210414 [0,1,1,0,0,0|2,0,0]=4 3428 B11R0.40 CCCCCCCNC(=O)CC 240690a_100000229938_100000210414 [0,1,1,0,0,0|2,0,0]=4 3429 B11R0.40 CCCCCCCNC(=O)CC 527a_100000229938_100000210414 [0,1,1,0,0,0|2,0,0]=4 3430 B11R0.40 CCCCCCCNC(=O)CO 240690a_100000229938_100000210174 [0,1,1,0,0,0|1,0,0]=3 3431 B11R0.40 CCCCCCCNC(=O)CO 527a_100000229938_100000210174 [0,1,1,0,0,0|1,0,0]=3 3432 B11R0.40 CCCCCCCNC(=O)NC 2708a_100000229938_106832991635 [0,1,1,0,0,0|2,0,0]=4 3433 B11R0.40 CCCCCCCNC(=O)NC 2708a_100102657272_100000229938 [0,1,1,0,0,0|2,0,0]=4 3434 B11R0.40 CCCCCCCNC(=O)NC 273464a_100000229938_100102657272 [0,1,1,0,0,0|2,0,0]=4 3435 B11R0.40 CCCCCCCNC(=O)NC 273464a_100102657272_100000229938 [0,1,1,0,0,0|2,0,0]=4 3436 B11R0.40 CCCCCCCNC(=O)NC 512a_100000229938_100102657272 [0,1,1,0,0,0|2,0,0]=4 3437 B11R0.40 CCCCCCCNC(=O)NC 512a_106832991638_100000229938 [0,1,1,0,0,0|2,0,0]=4 3438 B11R0.40 CCCCCCNCC(=O)NC 2230a_100000210581_100000183359 [0,1,1,0,0,0|2,0,0]=4 3439 B11R0.40 CCCCCCNCC(=O)NC 2230a_100000693194_100000210314 [0,1,1,0,0,0|2,0,0]=4 3440 B11R0.40 CCCCCCNCC(=O)OC 2230a_100000210581_100000747449 [0,1,1,0,0,0|1,0,0]=3 3441 B11R0.40 CCCCCCOCC(=O)CC 34a_100000725409_100000210314 [0,1,1,0,0,0|2,0,0]=4 3442 B11R0.40 CCCCCCOCC(=O)CC 7a_100000210259_100000747405 [0,1,1,0,0,0|2,0,0]=4 3443 B11R0.40 CCCCCCOCC(=O)NC 34a_100000210259_100000183359 [0,1,1,0,0,0|2,0,0]=4 3444 B11R0.40 CCCCCCOCC(=O)NC 34a_100000750040_100000210314 [0,1,1,0,0,0|2,0,0]=4 3445 B11R0.40 CCCCCCOCC(=O)NC 7a_100000210259_100000183359 [0,1,1,0,0,0|2,0,0]=4 3446 B11R0.40 CCCCCCOCC(=O)OC 34a_100000210259_100000747449 [0,1,1,0,0,0|1,0,0]=3 3447 B11R0.40 CCCCCCOCC(=O)OC 7a_100000210259_100000747449 [0,1,1,0,0,0|1,0,0]=3 3448 B11R0.40 CCCCCCSCC(=O)CC 62a_100000210314_100000747405 [0,1,1,0,0,0|2,0,0]=4 3449 B11R0.40 CCCCCCSCC(=O)CC 62a_100000747405_100000210757 [0,1,1,0,0,0|2,0,0]=4 3450 B11R0.40 CCCCCCSCC(=O)NC 62a_100000183359_100000210757 [0,1,1,0,0,0|2,0,0]=4 3451 B11R0.40 CCCCCCSCC(=O)NC 62a_100000210314_100000183359 [0,1,1,0,0,0|2,0,0]=4 3452 B11R0.40 CCCCCCSCC(=O)OC 62a_100000210314_100000747449 [0,1,1,0,0,0|1,0,0]=3 3453 B11R0.40 CCCCCCSCC(=O)OC 62a_100000747449_100000210757 [0,1,1,0,0,0|1,0,0]=3 3454 B11R0.40 CCCCCNCCC(=O)NC 2230a_100000209983_100000737683 [0,1,1,0,0,0|2,0,0]=4 3455 B11R0.40 CCCCCNCCC(=O)NC 2230a_100000738227_100000210326 [0,1,1,0,0,0|2,0,0]=4 3456 B11R0.40 CCCCCNCCC(=O)NC 34a_100000738227_100000718602 [0,1,1,0,0,0|2,0,0]=4 3457 B11R0.40 CCCCCNCCC(=O)OC 2230a_100000209983_100000204255 [0,1,1,0,0,0|1,0,0]=3 3458 B11R0.40 CCCCCOCCC(=NO)N 34a_100000749954_100000718602 [0,1,1,0,0,0|2,0,0]=4 3459 B11R0.40 CCCCCOCCC(=O)NC 34a_100000210253_100012179268 [0,1,1,0,0,0|2,0,0]=4 3460 B11R0.40 CCCCCOCCC(=O)NC 34a_100000754576_100000718602 [0,1,1,0,0,0|2,0,0]=4 3461 B11R0.40 CCCCCOCCC(=O)NC 7a_100000210253_100000737683 [0,1,1,0,0,0|2,0,0]=4 3462 B11R0.40 CCCCCOCCC(=O)OC 34a_100000210253_100000742370 [0,1,1,0,0,0|1,0,0]=3 3463 B11R0.40 CCCCCOCCC(=O)OC 7a_100000210253_100000204255 [0,1,1,0,0,0|1,0,0]=3 3464 B11R0.40 CCCCCSCCC(=O)NC 62a_100000210326_100000737683 [0,1,1,0,0,0|2,0,0]=4 3465 B11R0.40 CCCCCSCCC(=O)NC 62a_100000737683_100000210326 [0,1,1,0,0,0|2,0,0]=4 3466 B11R0.40 CCCCCSCCC(=O)OC 62a_100000204255_100000210326 [0,1,1,0,0,0|1,0,0]=3 3467 B11R0.40 CCCCCSCCC(=O)OC 62a_100000210326_100000204255 [0,1,1,0,0,0|1,0,0]=3 3468 B11R0.40 CCCCCSCOC(=O)OC 62a_100000210326_100000139417 [0,1,1,0,0,0|2,0,0]=4 3469 B11R0.40 CCCCNCCCC(=O)NC 2230a_100000102301_100000741757 [0,1,1,0,0,0|2,0,0]=4 3470 B11R0.40 CCCCNCCCC(=O)NC 2230a_100000740002_100000210211 [0,1,1,0,0,0|2,0,0]=4 3471 B11R0.40 CCCCNCCCC(=O)NC 34a_100000740002_100000210210 [0,1,1,0,0,0|2,0,0]=4 3472 B11R0.40 CCCCNCCCC(=O)NC 7a_106832991798_100000741757 [0,1,1,0,0,0|2,0,0]=4 3473 B11R0.40 CCCCNCCCC(=O)OC 2230a_100000102301_100011218270 [0,1,1,0,0,0|1,0,0]=3 3474 B11R0.40 CCCCNCCCC(=O)OC 7a_106832991798_100011218270 [0,1,1,0,0,0|1,0,0]=3 3475 B11R0.40 CCCCOCCCC(=O)NC 34a_100000210227_100000741757 [0,1,1,0,0,0|2,0,0]=4 3476 B11R0.40 CCCCOCCCC(=O)NC 7a_100000210227_100000741757 [0,1,1,0,0,0|2,0,0]=4 3477 B11R0.40 CCCCOCCCC(=O)NN 34a_100000211488_100000210210 [0,1,1,0,0,0|2,0,0]=4 3478 B11R0.40 CCCCOCCCC(=O)OC 34a_100000210227_100000742333 [0,1,1,0,0,0|1,0,0]=3 3479 B11R0.40 CCCCOCCCC(=O)OC 7a_100000210227_100011218270 [0,1,1,0,0,0|1,0,0]=3 3480 B11R0.40 CCCCOCCNC(=O)OC 34a_100000757965_100000210210 [0,1,1,0,0,0|2,0,0]=4 3481 B11R0.40 CCCCOCCOC(=O)OC 34a_100010262106_100000210210 [0,1,1,0,0,0|2,0,0]=4 3482 B11R0.40 CCCCOCSCC(=O)OC 62a_100000747449_100011995733 [0,1,1,0,0,0|2,0,0]=4 3483 B11R0.40 CCCCOCSCC(=O)OC 62a_100011995733_100000747449 [0,1,1,0,0,0|2,0,0]=4 3484 B11R0.40 CCCCSCCCC(=O)NC 62a_100000210211_100000741757 [0,1,1,0,0,0|2,0,0]=4 3485 B11R0.40 CCCCSCCCC(=O)NC 62a_100000741757_100000210210 [0,1,1,0,0,0|2,0,0]=4 3486 B11R0.40 CCCCSCCCC(=O)OC 62a_100000210211_100011218270 [0,1,1,0,0,0|1,0,0]=3 3487 B11R0.40 CCCCSCCCC(=O)OC 62a_100011218270_100000210210 [0,1,1,0,0,0|1,0,0]=3 3488 B11R0.40 CCCCSCCNC(=O)CO 240690a_100025743550_100000210174 [0,1,1,0,0,0|2,0,0]=4 3489 B11R0.40 CCCCSCCNC(=O)CO 527a_100025743550_100000210174 [0,1,1,0,0,0|2,0,0]=4 3490 B11R0.40 CCCOCCCCC(=O)OC 34a_100000059025_100000210303 [0,1,1,0,0,0|1,0,0]=3 3491 B11R0.40 CCCOCCCCC(=O)OC 34a_100000210258_100000204269 [0,1,1,0,0,0|1,0,0]=3 3492 B11R0.40 CCCOCCCCC(=O)OC 7a_100000059025_100000210303 [0,1,1,0,0,0|1,0,0]=3 3493 B11R0.40 CCCOCCCNC(=O)CO 240690a_100011217757_100000210174 [0,1,1,0,0,0|2,0,0]=4 3494 B11R0.40 CCCOCCCNC(=O)CO 527a_100011217757_100000210174 [0,1,1,0,0,0|2,0,0]=4 3495 B11R0.40 CCCOCCNCC(=O)OC 2230a_100161115042_100000747449 [0,1,1,0,0,0|2,0,0]=4 3496 B11R0.40 CCCOCCNCC(=O)OC 34a_100161115042_100000747449 [0,1,1,0,0,0|2,0,0]=4 3497 B11R0.40 CCCOCCOCC(=O)OC 34a_100000210258_100000090808 [0,1,1,0,0,0|2,0,0]=4 3498 B11R0.40 CCCOCCOCC(=O)OC 34a_100000752267_100000747449 [0,1,1,0,0,0|2,0,0]=4 3499 B11R0.40 CCCOCCOCC(=O)OC 7a_100000752267_100000747449 [0,1,1,0,0,0|2,0,0]=4 3500 B11R0.40 CCCOCCSCC(=O)OC 62a_100000747449_100011215938 [0,1,1,0,0,0|2,0,0]=4 3501 B11R0.40 CCCOCCSCC(=O)OC 62a_100011215938_100000747449 [0,1,1,0,0,0|2,0,0]=4 3502 B11R0.40 CCCSCCCCC(=O)OC 62a_100000204269_100000210303 [0,1,1,0,0,0|1,0,0]=3 3503 B11R0.40 CCCSCCCCC(=O)OC 62a_100000210303_100000204269 [0,1,1,0,0,0|1,0,0]=3 3504 B11R0.40 CCCSCCNCC(=O)OC 2230a_100020603323_100000747449 [0,1,1,0,0,0|2,0,0]=4 3505 B11R0.40 CCCSCCOCC(=O)OC 34a_200000230433_100000747449 [0,1,1,0,0,0|2,0,0]=4 3506 B11R0.40 CCCSCCOCC(=O)OC 62a_100000090808_100000210303 [0,1,1,0,0,0|2,0,0]=4 3507 B11R0.40 CCCSCCOCC(=O)OC 62a_100000210303_100000090808 [0,1,1,0,0,0|2,0,0]=4 3508 B11R0.40 CCCSCCOCC(=O)OC 7a_200000230433_100000747449 [0,1,1,0,0,0|2,0,0]=4 3509 B11R0.40 CCNCCCCCC(=O)OC 2230a_100015525214_100009816466 [0,1,1,0,0,0|1,0,0]=3 3510 B11R0.40 CCOCCCCCC(=O)OC 34a_100000074720_100000210202 [0,1,1,0,0,0|1,0,0]=3 3511 B11R0.40 CCOCCCCCC(=O)OC 34a_100121572206_100009816466 [0,1,1,0,0,0|1,0,0]=3 3512 B11R0.40 CCOCCCCCC(=O)OC 7a_100000074720_100000210202 [0,1,1,0,0,0|1,0,0]=3 3513 B11R0.40 CCOCCCNCC(=O)OC 2230a_100000210961_100000747449 [0,1,1,0,0,0|2,0,0]=4 3514 B11R0.40 CCOCCCNCC(=O)OC 34a_100000210961_100000747449 [0,1,1,0,0,0|2,0,0]=4 3515 B11R0.40 CCOCCCOCC(=O)OC 34a_100000757476_100000747449 [0,1,1,0,0,0|2,0,0]=4 3516 B11R0.40 CCOCCCOCC(=O)OC 7a_100000757476_100000747449 [0,1,1,0,0,0|2,0,0]=4 3517 B11R0.40 CCOCCCSCC(=O)OC 62a_100000747449_100012232248 [0,1,1,0,0,0|2,0,0]=4 3518 B11R0.40 CCOCCCSCC(=O)OC 62a_100012232248_100000747449 [0,1,1,0,0,0|2,0,0]=4 3519 B11R0.40 CCOCCNCCC(=O)OC 2230a_102516460346_100000204255 [0,1,1,0,0,0|2,0,0]=4 3520 B11R0.40 CCOCCNCCC(=O)OC 34a_102516460346_100000742370 [0,1,1,0,0,0|2,0,0]=4 3521 B11R0.40 CCOCCOCCC(=O)CO 1458a_100000210174_100011211534 [0,1,1,0,0,0|2,0,0]=4 3522 B11R0.40 CCOCCOCCC(=O)OC 34a_100000210136_100000742370 [0,1,1,0,0,0|2,0,0]=4 3523 B11R0.40 CCOCCOCCC(=O)OC 7a_100000210136_100000204255 [0,1,1,0,0,0|2,0,0]=4 3524 B11R0.40 CCOCCSCCC(=O)OC 62a_100000204255_100011215890 [0,1,1,0,0,0|2,0,0]=4 3525 B11R0.40 CCOCCSCCC(=O)OC 62a_100000210147_100000204255 [0,1,1,0,0,0|2,0,0]=4 3526 B11R0.40 CCOCSCCCC(=O)OC 62a_100000739092_100011218270 [0,1,1,0,0,0|2,0,0]=4 3527 B11R0.40 CCOCSCCCC(=O)OC 62a_100011218270_100000739092 [0,1,1,0,0,0|2,0,0]=4 3528 B11R0.40 CCSCCCCCC(=O)OC 62a_100000210202_100009816466 [0,1,1,0,0,0|1,0,0]=3 3529 B11R0.40 CCSCCCCCC(=O)OC 62a_100009816466_100000210202 [0,1,1,0,0,0|1,0,0]=3 3530 B11R0.40 CCSCCCOCC(=O)OC 34a_100011216438_100000747449 [0,1,1,0,0,0|2,0,0]=4 3531 B11R0.40 CCSCCCOCC(=O)OC 7a_100011216438_100000747449 [0,1,1,0,0,0|2,0,0]=4 3532 B11R0.40 CCSCCNCCC(=O)OC 2230a_100000106463_100000204255 [0,1,1,0,0,0|2,0,0]=4 3533 B11R0.40 CCSCCOCCC(=O)OC 34a_100000212035_100000742370 [0,1,1,0,0,0|2,0,0]=4 3534 B11R0.40 CCSCCOCCC(=O)OC 7a_100000212035_100000204255 [0,1,1,0,0,0|2,0,0]=4 3535 B11R0.40 CCSCCSCCC(=O)OC 62a_100000204255_100000757381 [0,1,1,0,0,0|2,0,0]=4 3536 B11R0.40 CCSCCSCCC(=O)OC 62a_100000757381_100000204255 [0,1,1,0,0,0|2,0,0]=4 3537 B11R0.40 CNC(=O)CCCCCCCO 240690a_100102657272_100011219782 [0,1,1,0,0,0|2,0,0]=4 3538 B11R0.40 CNCCCCCCC(=O)OC 2230a_106832991635_100009815986 [0,1,1,0,0,0|1,0,0]=3 3539 B11R0.40 CNCCCCCCC(=O)OC 34a_100102657272_100009815986 [0,1,1,0,0,0|1,0,0]=3 3540 B11R0.40 CNCCCCCCC(=O)OC 7a_106832991635_100009815986 [0,1,1,0,0,0|1,0,0]=3 3541 B11R0.40 CNCCCOCCC(=O)OC 34a_100000213112_100000742370 [0,1,1,0,0,0|2,0,0]=4 3542 B11R0.40 COC(=O)CCCCCCO[13CH3] 34a_100009863599_200025704644 [0,1,1,0,0,0|1,0,0]=3 3543 B11R0.40 COC(=O)CCCCCCO[13CH3] 7a_100009863599_200025704644 [0,1,1,0,0,0|1,0,0]=3 3544 B11R0.40 COC(=O)CCCCCCSC 62a_100009815986_200000210301 [0,1,1,0,0,0|1,0,0]=3 3545 B11R0.40 COC(=O)CCCCCCSC 62a_200000210301_100009815986 [0,1,1,0,0,0|1,0,0]=3 3546 B11R0.40 COC(=O)CCCCCCS[13CH3] 62a_100009815986_200025704644 [0,1,1,0,0,0|1,0,0]=3 3547 B11R0.40 COC(=O)CCCCCCS[13CH3] 62a_200025704644_100009815986 [0,1,1,0,0,0|1,0,0]=3 3548 B11R0.40 COC(=O)CCCCCOCF 34a_100000074720_100015361967 [0,1,1,0,0,0|2,0,0]=4 3549 B11R0.40 COC(=O)CCCCCOCF 7a_100000074720_100015361967 [0,1,1,0,0,0|2,0,0]=4 3550 B11R0.40 COC(=O)CCCCCSCF 62a_100009816466_100015361967 [0,1,1,0,0,0|2,0,0]=4 3551 B11R0.40 COC(=O)CCCCCSCF 62a_100015361967_100009816466 [0,1,1,0,0,0|2,0,0]=4 3552 B11R0.40 COC(=O)CCCCNCCF 34a_100000724931_100000204269 [0,1,1,0,0,0|2,0,0]=4 3553 B11R0.40 COC(=O)CCCCNCCO 2230a_100016997473_100000204269 [0,1,1,0,0,0|2,0,0]=4 3554 B11R0.40 COC(=O)CCCCNCCO 34a_100016990907_100000204269 [0,1,1,0,0,0|2,0,0]=4 3555 B11R0.40 COC(=O)CCCCOCCBr 34a_100000211926_100000204269 [0,1,1,0,0,0|2,0,0]=4 3556 B11R0.40 COC(=O)CCCCOCCF 34a_100000059025_100011217306 [0,1,1,0,0,0|2,0,0]=4 3557 B11R0.40 COC(=O)CCCCOCCF 7a_100000059025_100011217306 [0,1,1,0,0,0|2,0,0]=4 3558 B11R0.40 COC(=O)CCCCOCCN 34a_100000210304_100000204269 [0,1,1,0,0,0|2,0,0]=4 3559 B11R0.40 COC(=O)CCCCOCCO 34a_100000059025_100000211926 [0,1,1,0,0,0|2,0,0]=4 3560 B11R0.40 COC(=O)CCCCOCCO 7a_100000059025_100000211926 [0,1,1,0,0,0|2,0,0]=4 3561 B11R0.40 COC(=O)CCCCOCSC 34a_100000059025_100011218213 [0,1,1,0,0,0|2,0,0]=4 3562 B11R0.40 COC(=O)CCCCSCCF 62a_100000204269_100011217306 [0,1,1,0,0,0|2,0,0]=4 3563 B11R0.40 COC(=O)CCCCSCCF 62a_100011217306_100000204269 [0,1,1,0,0,0|2,0,0]=4 3564 B11R0.40 COC(=O)CCCCSCCO 62a_100000204269_100000211926 [0,1,1,0,0,0|2,0,0]=4 3565 B11R0.40 COC(=O)CCCCSCCO 62a_100000211926_100000204269 [0,1,1,0,0,0|2,0,0]=4 3566 B11R0.40 COC(=O)CCCCSCSC 62a_100000204269_100011218213 [0,1,1,0,0,0|2,0,0]=4 3567 B11R0.40 COC(=O)CCCCSCSC 62a_100011218213_100000204269 [0,1,1,0,0,0|2,0,0]=4 3568 B11R0.40 COC(=O)CCCNCCCF 2230a_100015189416_100011218270 [0,1,1,0,0,0|2,0,0]=4 3569 B11R0.40 COC(=O)CCCNCCCF 34a_100015189416_100000742333 [0,1,1,0,0,0|2,0,0]=4 3570 B11R0.40 COC(=O)CCCNCCSC 2230a_100020590264_100011218270 [0,1,1,0,0,0|2,0,0]=4 3571 B11R0.40 COC(=O)CCCOCCCBr 34a_100011217188_100000742333 [0,1,1,0,0,0|2,0,0]=4 3572 B11R0.40 COC(=O)CCCOCCCCl 34a_100000230001_100000742333 [0,1,1,0,0,0|2,0,0]=4 3573 B11R0.40 COC(=O)CCCOCCCF 34a_100000759539_100000742333 [0,1,1,0,0,0|2,0,0]=4 3574 B11R0.40 COC(=O)CCCOCCCN 34a_100000182051_100000742333 [0,1,1,0,0,0|2,0,0]=4 3575 B11R0.40 COC(=O)CCCOCCSC 34a_100000230434_100000742333 [0,1,1,0,0,0|2,0,0]=4 3576 B11R0.40 COC(=O)CCCOCCSC 7a_100000230434_100011218270 [0,1,1,0,0,0|2,0,0]=4 3577 B11R0.40 COC(=O)CCCSCCCF 62a_100011218270_100011934791 [0,1,1,0,0,0|2,0,0]=4 3578 B11R0.40 COC(=O)CCCSCCCF 62a_100011934791_100011218270 [0,1,1,0,0,0|2,0,0]=4 3579 B11R0.40 COC(=O)CCCSCCCO 62a_100011215043_100011218270 [0,1,1,0,0,0|2,0,0]=4 3580 B11R0.40 COC(=O)CCCSCCCO 62a_100011218270_100011215043 [0,1,1,0,0,0|2,0,0]=4 3581 B11R0.40 COC(=O)CCCSCCSC 62a_100000212216_100011218270 [0,1,1,0,0,0|2,0,0]=4 3582 B11R0.40 COC(=O)CCCSCCSC 62a_100011218270_100000751147 [0,1,1,0,0,0|2,0,0]=4 3583 B11R0.40 COC(=O)CCNCCCCO 2230a_100000750430_100000204255 [0,1,1,0,0,0|2,0,0]=4 3584 B11R0.40 COC(=O)CCNCCCCO 34a_100000750430_100000742370 [0,1,1,0,0,0|2,0,0]=4 3585 B11R0.40 COC(=O)CCNCCCSC 2230a_100000749238_100000204255 [0,1,1,0,0,0|2,0,0]=4 3586 B11R0.40 COC(=O)CCOCCCCBr 34a_100011216708_100000742370 [0,1,1,0,0,0|2,0,0]=4 3587 B11R0.40 COC(=O)CCOCCCCCl 34a_100000210776_100000742370 [0,1,1,0,0,0|2,0,0]=4 3588 B11R0.40 COC(=O)CCOCCCCCl 7a_100000210776_100000204255 [0,1,1,0,0,0|2,0,0]=4 3589 B11R0.40 COC(=O)CCOCCCCF 34a_100011995726_100000742370 [0,1,1,0,0,0|2,0,0]=4 3590 B11R0.40 COC(=O)CCOCCCCF 7a_100011995726_100000204255 [0,1,1,0,0,0|2,0,0]=4 3591 B11R0.40 COC(=O)CCOCCCCI 34a_200012148704_100000742370 [0,1,1,0,0,0|2,0,0]=4 3592 B11R0.40 COC(=O)CCOCCCCN 34a_100000750430_100000742370 [0,1,1,0,0,0|2,0,0]=4 3593 B11R0.40 COC(=O)CCOCCCSC 34a_100000690336_100000742370 [0,1,1,0,0,0|2,0,0]=4 3594 B11R0.40 COC(=O)CCOCCCSC 7a_100000690336_100000204255 [0,1,1,0,0,0|2,0,0]=4 3595 B11R0.40 COC(=O)CCSCCCCF 62a_100000204255_100000729493 [0,1,1,0,0,0|2,0,0]=4 3596 B11R0.40 COC(=O)CCSCCCCF 62a_100000729493_100000204255 [0,1,1,0,0,0|2,0,0]=4 3597 B11R0.40 COC(=O)CCSCCCCO 62a_100000204255_100000210776 [0,1,1,0,0,0|2,0,0]=4 3598 B11R0.40 COC(=O)CCSCCCCO 62a_100000210776_100000204255 [0,1,1,0,0,0|2,0,0]=4 3599 B11R0.40 COC(=O)CNCCCCCO 2230a_100000762737_100000747449 [0,1,1,0,0,0|2,0,0]=4 3600 B11R0.40 COC(=O)CNCCCCCO 34a_100000762737_100000747449 [0,1,1,0,0,0|2,0,0]=4 3601 B11R0.40 COC(=O)COCCCCCBr 34a_100000746331_100000747449 [0,1,1,0,0,0|2,0,0]=4 3602 B11R0.40 COC(=O)COCCCCCBr 7a_100000746331_100000747449 [0,1,1,0,0,0|2,0,0]=4 3603 B11R0.40 COC(=O)COCCCCCCl 34a_100000746330_100000747449 [0,1,1,0,0,0|2,0,0]=4 3604 B11R0.40 COC(=O)COCCCCCCl 7a_100000746330_100000747449 [0,1,1,0,0,0|2,0,0]=4 3605 B11R0.40 COC(=O)COCCCCCI 34a_200012148887_100000747449 [0,1,1,0,0,0|2,0,0]=4 3606 B11R0.40 COC(=O)COCCCCCI 7a_200012148887_100000747449 [0,1,1,0,0,0|2,0,0]=4 3607 B11R0.40 COC(=O)COCCCCCN 34a_100000762737_100000747449 [0,1,1,0,0,0|2,0,0]=4 3608 B11R0.40 COC(=O)COCCCCSC 34a_100011217163_100000747449 [0,1,1,0,0,0|2,0,0]=4 3609 B11R0.40 COC(=O)COCCCCSC 7a_100011217163_100000747449 [0,1,1,0,0,0|2,0,0]=4 3610 B11R0.40 COC(=O)CSCCCCCF 62a_100000729378_100000747449 [0,1,1,0,0,0|2,0,0]=4 3611 B11R0.40 COC(=O)CSCCCCCF 62a_100000747449_100000729378 [0,1,1,0,0,0|2,0,0]=4 3612 B11R0.40 COC(=O)CSCCCCCO 62a_100000746330_100000747449 [0,1,1,0,0,0|2,0,0]=4 3613 B11R0.40 COC(=O)CSCCCCCO 62a_100000747449_100000746330 [0,1,1,0,0,0|2,0,0]=4 3614 B11R0.40 COCCCCCCC(=O)CO 1458a_100000210174_100011998445 [0,1,1,0,0,0|1,0,0]=3 3615 B11R0.40 COCCCCCCC(=O)OC 34a_100009863599_200000210301 [0,1,1,0,0,0|1,0,0]=3 3616 B11R0.40 COCCCCCCC(=O)OC 34a_100138415774_100009815986 [0,1,1,0,0,0|1,0,0]=3 3617 B11R0.40 COCCCCCCC(=O)OC 7a_100009863599_200000210301 [0,1,1,0,0,0|1,0,0]=3 3618 B11R0.40 COCCCCCNC(=O)CO 240690a_100000747528_100000210174 [0,1,1,0,0,0|2,0,0]=4 3619 B11R0.40 COCCCCCNC(=O)CO 527a_100000747528_100000210174 [0,1,1,0,0,0|2,0,0]=4 3620 B11R0.40 COCCCCOCC(=O)OC 34a_100000740925_100000747449 [0,1,1,0,0,0|2,0,0]=4 3621 B11R0.40 COCCCCSCC(=O)OC 62a_100000730899_100000747449 [0,1,1,0,0,0|2,0,0]=4 3622 B11R0.40 COCCCCSCC(=O)OC 62a_100000747449_100000730899 [0,1,1,0,0,0|2,0,0]=4 3623 B11R0.40 COCCCNCCC(=O)OC 34a_100150723488_100000742370 [0,1,1,0,0,0|2,0,0]=4 3624 B11R0.40 COCCCOCCC(=O)OC 34a_100000740835_100000742370 [0,1,1,0,0,0|2,0,0]=4 3625 B11R0.40 COCCCSCCC(=O)OC 62a_100000204255_100000709357 [0,1,1,0,0,0|2,0,0]=4 3626 B11R0.40 COCCCSCCC(=O)OC 62a_100000709357_100000204255 [0,1,1,0,0,0|2,0,0]=4 3627 B11R0.40 COCCNCCCC(=O)OC 2230a_100000209980_100011218270 [0,1,1,0,0,0|2,0,0]=4 3628 B11R0.40 COCCOCCCC(=O)CO 1458a_100000210174_100011216529 [0,1,1,0,0,0|2,0,0]=4 3629 B11R0.40 COCCOCCCC(=O)OC 34a_100000210237_100000742333 [0,1,1,0,0,0|2,0,0]=4 3630 B11R0.40 COCCSCCCC(=O)OC 62a_100000233755_100011218270 [0,1,1,0,0,0|2,0,0]=4 3631 B11R0.40 COCCSCCCC(=O)OC 62a_100011218270_100000233755 [0,1,1,0,0,0|2,0,0]=4 3632 B11R0.40 COCSCCCCC(=O)OC 62a_100000204269_100000766300 [0,1,1,0,0,0|2,0,0]=4 3633 B11R0.40 COCSCCCCC(=O)OC 62a_100000766300_100000204269 [0,1,1,0,0,0|2,0,0]=4 3634 B11R0.40 N#CCCCCCCC(=O)CO 1458a_100000210174_100009813337 [0,1,1,0,0,0|1,0,1]=4 3635 B11R0.40 O=C(CF)CCCCCCCO 1458a_100011219782_100015361967 [0,1,1,0,0,0|2,0,0]=4 3636 B11R0.40 O=C(CO)CCCCCCCO 1458a_100000210174_100000760002 [0,1,1,0,0,0|1,0,0]=3 3637 B11R0.40 O=C(CO)NCCCCCCO 240690a_100000686447_100000210174 [0,1,1,0,0,0|2,0,0]=4 3638 B11R0.40 O=C(CO)NCCCCCCO 527a_100000686447_100000210174 [0,1,1,0,0,0|2,0,0]=4 3639 B11R0.42 CC(CNCCCCF)C(=O)O 269956a_100000749485_100000729493 [0,1,1,0,0,0|2,0,0]=4 3640 B11R0.42 CC(CNCCCCO)C(=O)O 269956a_100000749485_100000210776 [0,1,1,0,0,0|2,0,0]=4 3641 B11R0.42 CCCCCCCC(C)C(=O)C 1458a_100000070787_200011218727 [0,1,1,0,0,0|1,0,0]=3 3642 B11R0.42 CCCCCCCN(C)C(=O)C 11a_100000228206_100015343762 [0,1,1,0,0,0|2,0,0]=4 3643 B11R0.42 CCCCCCCN(C)C(=O)C 1626a_100000228206_100015343762 [0,1,1,0,0,0|2,0,0]=4 3644 B11R0.42 CCCCCCCN(C)C(=O)C 240690a_100000228206_100015343762 [0,1,1,0,0,0|2,0,0]=4 3645 B11R0.42 CCCCCCCN(C)C(=O)C 527a_100000228206_100103153847 [0,1,1,0,0,0|2,0,0]=4 3646 B11R0.42 CCCCCCNC(C)C(=O)C 2230a_100000210581_100009814033 [0,1,1,0,0,0|2,0,0]=4 3647 B11R0.42 CCCCCCNC(C)C(=O)N 2230a_100000210581_100000702099 [0,1,1,0,0,0|2,0,0]=4 3648 B11R0.42 CCCCCCNC(F)C(=O)N 2230a_100000210581_100009813875 [0,1,1,0,0,0|2,0,0]=4 3649 B11R0.42 CCCCCCN[C@@H](C)C(=O)O 269956a_100000743915_100000210757 [0,1,1,0,0,0|1,0,0]=3 3650 B11R0.42 CCCCCCN[C@H](C)C(=O)N 2230a_100000119354_100000210314 [0,1,1,0,0,0|2,0,0]=4 3651 B11R0.42 CCCCCCN[C@H](C)C(=O)N 34a_100000119354_100000210314 [0,1,1,0,0,0|2,0,0]=4 3652 B11R0.42 CCCCCCOC(C)C(=O)C 34a_100000212229_100000210314 [0,1,1,0,0,0|2,0,0]=4 3653 B11R0.42 CCCCCCOC(C)C(=O)C 7a_100000210259_100000179758 [0,1,1,0,0,0|2,0,0]=4 3654 B11R0.42 CCCCCCOC(C)C(=O)N 34a_100000210259_100000702099 [0,1,1,0,0,0|2,0,0]=4 3655 B11R0.42 CCCCCCOC(C)C(=O)N 7a_100000210259_100000702099 [0,1,1,0,0,0|2,0,0]=4 3656 B11R0.42 CCCCCCOC(F)C(=O)N 34a_100000210259_100009813875 [0,1,1,0,0,0|2,0,0]=4 3657 B11R0.42 CCCCCCOC(F)C(=O)N 7a_100000210259_100009813875 [0,1,1,0,0,0|2,0,0]=4 3658 B11R0.42 CCCCCCOC(F)C(=O)[O-] 34a_100000210259_100020610796 [0,1,1,0,0,0|1,0,1]=4 3659 B11R0.42 CCCCCCO[C@@H](C)C(=O)[O-] 7a_217856618621_100000210314 [0,1,1,0,0,0|1,0,1]=4 3660 B11R0.42 CCCCCCO[C@H](C)C(=O)N 34a_100000731257_100000210314 [0,1,1,0,0,0|2,0,0]=4 3661 B11R0.42 CCCCCCO[C@H](C)C(=O)N 7a_100000731257_100000210314 [0,1,1,0,0,0|2,0,0]=4 3662 B11R0.42 CCCCCCSC(C)C(=O)C 62a_100000210314_100009814033 [0,1,1,0,0,0|2,0,0]=4 3663 B11R0.42 CCCCCCSC(C)C(=O)C 62a_100009814033_100000210757 [0,1,1,0,0,0|2,0,0]=4 3664 B11R0.42 CCCCCCSC(C)C(=O)N 62a_100000210314_100000702099 [0,1,1,0,0,0|2,0,0]=4 3665 B11R0.42 CCCCCCSC(C)C(=O)N 62a_100000702099_100000210757 [0,1,1,0,0,0|2,0,0]=4 3666 B11R0.42 CCCCCCSC(F)C(=O)N 62a_100000210314_100009813875 [0,1,1,0,0,0|2,0,0]=4 3667 B11R0.42 CCCCCCSC(F)C(=O)N 62a_100009813875_100000210757 [0,1,1,0,0,0|2,0,0]=4 3668 B11R0.42 CCCCCCSC(F)C(=O)[O-] 62a_100000210314_100020610796 [0,1,1,0,0,0|1,0,1]=4 3669 B11R0.42 CCCCCCSC(F)C(=O)[O-] 62a_100020610796_100000210757 [0,1,1,0,0,0|1,0,1]=4 3670 B11R0.42 CCCCCNCC(C)C(=O)O 269956a_100000749485_100000210326 [0,1,1,0,0,0|1,0,0]=3 3671 B11R0.42 CCCCCNCC(F)C(=O)O 269956a_100000084737_100000210326 [0,1,1,0,0,0|1,0,0]=3 3672 B11R0.42 CCCCCOCC(C)C(=O)C 34a_100000032740_100000718602 [0,1,1,0,0,0|2,0,0]=4 3673 B11R0.42 CCCCCOCC(C)C(=O)C 7a_100000032740_100000210326 [0,1,1,0,0,0|2,0,0]=4 3674 B11R0.42 CCCCCOC[C@H](N)C(=O)N 34a_100000729942_100000718602 [0,1,1,0,0,0|2,0,0]=4 3675 B11R0.42 CCCCOCN[C@@H](C)C(=O)O 269956a_100000743915_100011995733 [0,1,1,0,0,0|2,0,0]=4 3676 B11R0.42 CCCOCCN[C@@H](C)C(=O)O 269956a_100000743915_100011215938 [0,1,1,0,0,0|2,0,0]=4 3677 B11R0.42 CCOCCCN[C@@H](C)C(=O)O 269956a_100000743915_100012232248 [0,1,1,0,0,0|2,0,0]=4 3678 B11R0.42 CCOCCNCC(C)C(=O)O 269956a_100000749485_100000210147 [0,1,1,0,0,0|2,0,0]=4 3679 B11R0.42 CCOCCNCC(F)C(=O)O 269956a_100000084737_100000210147 [0,1,1,0,0,0|2,0,0]=4 3680 B11R0.42 CCSCCNCC(C)C(=O)O 269956a_100000749485_100000757381 [0,1,1,0,0,0|2,0,0]=4 3681 B11R0.42 CCSCCNCC(F)C(=O)O 269956a_100000084737_100000757381 [0,1,1,0,0,0|2,0,0]=4 3682 B11R0.42 COCCCCN[C@@H](C)C(=O)O 269956a_100000743915_100000730899 [0,1,1,0,0,0|2,0,0]=4 3683 B11R0.42 COCCCNCC(C)C(=O)O 269956a_100000749485_100000740836 [0,1,1,0,0,0|2,0,0]=4 3684 B11R0.42 COCCCNCC(F)C(=O)O 269956a_100000084737_100000740836 [0,1,1,0,0,0|2,0,0]=4 3685 B11R0.42 C[C@H](NCCCCCF)C(=O)O 269956a_100000743915_100000729378 [0,1,1,0,0,0|2,0,0]=4 3686 B11R0.42 C[C@H](NCCCCCO)C(=O)O 269956a_100000743915_100000746330 [0,1,1,0,0,0|2,0,0]=4 3687 B11R0.42 O=C(O)C(F)CNCCCCF 269956a_100000084737_100000729493 [0,1,1,0,0,0|2,0,0]=4 3688 B11R0.42 O=C(O)C(F)CNCCCCO 269956a_100000084737_100000210776 [0,1,1,0,0,0|2,0,0]=4 3689 B11R0.46 CCCCCC(=O)CCC(=O)N 1458a_100011215257_100000210326 [0,1,1,0,0,0|1,0,1]=4 3690 B11R0.46 CCCCCC(C)CCC(=O)C 1458a_100000034243_200000210301 [0,1,1,0,0,0|1,0,0]=3 3691 B11R0.46 CCCCCC(C)CCC(=O)[13CH3] 1458a_100000034243_200025704644 [0,1,1,0,0,0|1,0,0]=3 3692 B11R0.46 CCCCCC(C)NCC(=O)N 2230a_100000211957_100000747473 [0,1,1,0,0,0|2,0,0]=4 3693 B11R0.46 CCCCCC(C)NCC(=O)N 2230a_100000711301_200011218191 [0,1,1,0,0,0|2,0,0]=4 3694 B11R0.46 CCCCCC(C)NCC(=O)O 269956a_100016091260_200011218191 [0,1,1,0,0,0|1,0,0]=3 3695 B11R0.46 CCCCCC(C)OCC(=O)C 34a_100000211253_200011218191 [0,1,1,0,0,0|2,0,0]=4 3696 B11R0.46 CCCCCC(C)OCC(=O)N 34a_100011215632_100000187820 [0,1,1,0,0,0|2,0,0]=4 3697 B11R0.46 CCCCCC(C)OCC(=O)N 7a_100011215632_100000187820 [0,1,1,0,0,0|2,0,0]=4 3698 B11R0.46 CCCCCC(C)OCC(=O)[O-] 34a_100011215632_100020667443 [0,1,1,0,0,0|1,0,1]=4 3699 B11R0.46 CCCCCC(C)SCC(=O)N 62a_100000747473_200011218191 [0,1,1,0,0,0|2,0,0]=4 3700 B11R0.46 CCCCCC(C)SCC(=O)N 62a_200011218191_100000747473 [0,1,1,0,0,0|2,0,0]=4 3701 B11R0.46 CCCCCC(C)SCC(=O)[O-] 62a_100020667443_200011218191 [0,1,1,0,0,0|1,0,1]=4 3702 B11R0.46 CCCCCC(C)SCC(=O)[O-] 62a_200011218191_100020667443 [0,1,1,0,0,0|1,0,1]=4 3703 B11R0.46 CCCCCN(C)CCC(=O)C 1458a_100016987678_200000210301 [0,1,1,0,0,0|2,0,0]=4 3704 B11R0.46 CCCCCN(C)CCC(=O)C 269982a_100000223495_100000053229 [0,1,1,0,0,0|2,0,0]=4 3705 B11R0.46 CCCCCN(C)CCC(=O)N 2230a_100000223495_100000744528 [0,1,1,0,0,0|2,0,0]=4 3706 B11R0.46 CCCCCN(C)CCC(=O)N 2230a_100000730477_100000210326 [0,1,1,0,0,0|2,0,0]=4 3707 B11R0.46 CCCCCN(C)CCC(=O)N 269982a_100000223495_100000744528 [0,1,1,0,0,0|2,0,0]=4 3708 B11R0.46 CCCCCN(C)CCC(=O)[13CH3] 1458a_100016987678_200025704644 [0,1,1,0,0,0|2,0,0]=4 3709 B11R0.111 CCC(=O)CCCCCC(=O)N 1458a_100000210414_100009817443 [0,1,1,0,0,0|1,0,1]=4 3710 B11R0.111 CCC(C)CCCOCC(=O)N 7a_100011216074_100000187820 [0,1,1,0,0,0|2,0,0]=4 3711 B11R0.111 CCC(C)CCNCCC(=O)N 2230a_100020591266_100000744528 [0,1,1,0,0,0|2,0,0]=4 3712 B11R0.111 CCC(C)CCOCCC(=O)C 7a_100011215188_100000053229 [0,1,1,0,0,0|2,0,0]=4 3713 B11R0.111 CCC(C)CCOCCC(=O)N 7a_100011215188_100000744528 [0,1,1,0,0,0|2,0,0]=4 3714 B11R0.111 CCC(C)CNCCCC(=O)N 34a_100000739312_100000748023 [0,1,1,0,0,0|2,0,0]=4 3715 B11R0.111 CCC(C)COCCCC(=O)C 34a_100000759063_100000748023 [0,1,1,0,0,0|2,0,0]=4 3716 B11R0.111 CCC(C)COCCCC(=O)C 7a_100000759063_100000748023 [0,1,1,0,0,0|2,0,0]=4 3717 B11R0.111 CCC(C)CSCCCC(=O)C 62a_100000748023_100011215641 [0,1,1,0,0,0|2,0,0]=4 3718 B11R0.111 CCC(C)CSCCCC(=O)C 62a_100011215641_100000748023 [0,1,1,0,0,0|2,0,0]=4 3719 B11R0.111 CCC(C)CSCCCC(=O)N 62a_100000748023_100102525003 [0,1,1,0,0,0|2,0,0]=4 3720 B11R0.111 CCC(C)CSCCCC(=O)N 62a_100102525003_100000748023 [0,1,1,0,0,0|2,0,0]=4 3721 B11R0.111 CCC(C)NCCCCC(=O)N 34a_100000696515_100011215416 [0,1,1,0,0,0|2,0,0]=4 3722 B11R0.111 CCC(C)NCCOCC(=O)O 269956a_100000700818_100000758301 [0,1,1,0,0,0|2,0,0]=4 3723 B11R0.111 CCC(C)OCCCCC(=O)C 7a_100000210228_100000735457 [0,1,1,0,0,0|2,0,0]=4 3724 B11R0.111 CCC(C)OCCCCC(=O)N 34a_100012022536_100011215416 [0,1,1,0,0,0|2,0,0]=4 3725 B11R0.111 CCC(C)OCCCCC(=O)N 7a_100012022536_100000758301 [0,1,1,0,0,0|2,0,0]=4 3726 B11R0.111 CCC(C)SCCCCC(=O)C 62a_100000735457_100000758301 [0,1,1,0,0,0|2,0,0]=4 3727 B11R0.111 CCC(C)SCCCCC(=O)C 62a_100000758301_100000735457 [0,1,1,0,0,0|2,0,0]=4 3728 B11R0.111 CCC(O)CNCCCC(=O)N 34a_100000739312_100011218378 [0,1,1,0,0,0|2,0,0]=4 3729 B11R0.111 CCC(O)COCCCC(=O)C 34a_100000759063_100011218378 [0,1,1,0,0,0|2,0,0]=4 3730 B11R0.111 CCC(O)COCCCC(=O)C 7a_100000759063_100011218378 [0,1,1,0,0,0|2,0,0]=4 3731 B11R0.111 CCC(O)CSCCCC(=O)C 62a_100011215641_100011218378 [0,1,1,0,0,0|2,0,0]=4 3732 B11R0.111 CCC(O)CSCCCC(=O)C 62a_100011218378_100011215641 [0,1,1,0,0,0|2,0,0]=4 3733 B11R0.111 CCC(O)CSCCCC(=O)N 62a_100011218378_100102525003 [0,1,1,0,0,0|2,0,0]=4 3734 B11R0.111 CCC(O)CSCCCC(=O)N 62a_100102525003_100011218378 [0,1,1,0,0,0|2,0,0]=4 3735 B11R0.111 CCN(C)CCCCCC(=O)N 2230a_100000225621_100009817443 [0,1,1,0,0,0|2,0,0]=4 3736 B11R0.111 CCN(C)CCCCCC(=O)N 269982a_100000225621_100009817443 [0,1,1,0,0,0|2,0,0]=4 3737 B11R0.111 CCN(C)CCCNCC(=O)O 269956a_100016091260_100015186262 [0,1,1,0,0,0|2,0,0]=4 3738 B11R0.111 CC[C@H](C)CNCCCC(=O)N 34a_100000739312_100009816398 [0,1,1,0,0,0|2,0,0]=4 3739 B11R0.111 CC[C@H](C)COCCCC(=O)C 34a_100000759063_100009816398 [0,1,1,0,0,0|2,0,0]=4 3740 B11R0.111 CC[C@H](C)COCCCC(=O)C 7a_100000759063_100009816398 [0,1,1,0,0,0|2,0,0]=4 3741 B11R0.111 CC[C@H](C)COCCCC(=O)C 7a_100009816381_100011215641 [0,1,1,0,0,0|2,0,0]=4 3742 B11R0.111 CC[C@H](C)COCCCC(=O)N 7a_100009816381_100102525003 [0,1,1,0,0,0|2,0,0]=4 3743 B11R0.111 CC[C@H](C)CSCCCC(=O)C 62a_100009816398_100011215641 [0,1,1,0,0,0|2,0,0]=4 3744 B11R0.111 CC[C@H](C)CSCCCC(=O)C 62a_100011215641_100009816398 [0,1,1,0,0,0|2,0,0]=4 3745 B11R0.111 CC[C@H](C)CSCCCC(=O)N 62a_100009816398_100102525003 [0,1,1,0,0,0|2,0,0]=4 3746 B11R0.111 CC[C@H](C)CSCCCC(=O)N 62a_100102525003_100009816398 [0,1,1,0,0,0|2,0,0]=4 3747 B11R0.147 CCCCC(=O)CCCC(=O)C 1458a_100000210183_100011215641 [0,1,1,0,0,0|1,0,1]=4 3748 B11R0.147 CCCCC(=O)CCCC(=O)N 1458a_100000210183_100102525003 [0,1,1,0,0,0|1,0,1]=4 3749 B11R0.147 CCCCC(C)COCC(=O)N 34a_100011995851_100000187820 [0,1,1,0,0,0|2,0,0]=4 3750 B11R0.147 CCCCC(C)COCC(=O)N 7a_100011995851_100000187820 [0,1,1,0,0,0|2,0,0]=4 3751 B11R0.147 CCCCC(C)COCC(=O)[O-] 34a_100011995851_100020667443 [0,1,1,0,0,0|1,0,1]=4 3752 B11R0.147 CCCCC(C)NCCC(=O)N 2230a_100000126638_100000744528 [0,1,1,0,0,0|2,0,0]=4 3753 B11R0.147 CCCCC(C)NOCC(=O)O 269956a_100000106656_200011215066 [0,1,1,0,0,0|2,0,0]=4 3754 B11R0.147 CCCCC(C)OCCC(=O)C 34a_100000759926_200011215066 [0,1,1,0,0,0|2,0,0]=4 3755 B11R0.147 CCCCC(C)OCCC(=O)C 7a_100000687866_100000053229 [0,1,1,0,0,0|2,0,0]=4 3756 B11R0.147 CCCCC(C)OCCC(=O)C 7a_100000759926_200011215066 [0,1,1,0,0,0|2,0,0]=4 3757 B11R0.147 CCCCC(C)OCCC(=O)N 34a_100000687866_100000731001 [0,1,1,0,0,0|2,0,0]=4 3758 B11R0.147 CCCCC(C)OCCC(=O)N 34a_100000757172_200011215066 [0,1,1,0,0,0|2,0,0]=4 3759 B11R0.147 CCCCC(C)OCCC(=O)N 7a_100000687866_100000744528 [0,1,1,0,0,0|2,0,0]=4 3760 B11R0.147 CCCCC(C)OCCC(=O)N 7a_100000757172_200011215066 [0,1,1,0,0,0|2,0,0]=4 3761 B11R0.147 CCCCC(C)SCCC(=O)C 62a_100000053229_200011215066 [0,1,1,0,0,0|2,0,0]=4 3762 B11R0.147 CCCCC(C)SCCC(=O)C 62a_200011215066_100000053229 [0,1,1,0,0,0|2,0,0]=4 3763 B11R0.147 CCCCC(C)SCCC(=O)N 62a_100000744528_200011215066 [0,1,1,0,0,0|2,0,0]=4 3764 B11R0.147 CCCCC(C)SCCC(=O)N 62a_200011215066_100000744528 [0,1,1,0,0,0|2,0,0]=4 3765 B11R0.147 CCCCN(C)CCCC(=O)C 269982a_100000207549_100011215641 [0,1,1,0,0,0|2,0,0]=4 3766 B11R0.147 CCCCN(C)CCCC(=O)N 269982a_100000207549_100102525003 [0,1,1,0,0,0|2,0,0]=4 3767 B11R0.147 CCCCN(C)CCCC(=O)O 269956a_100000719178_100000210211 [0,1,1,0,0,0|1,0,0]=3 3768 B11R0.147 CCCC[C@H](N)COCC(=O)N 34a_100011934283_100000187820 [0,1,1,0,0,0|2,0,0]=4 3769 B11R0.147 CCCC[C@H](N)COCC(=O)[O-] 34a_100011934283_100020667443 [0,1,1,0,0,0|1,0,1]=4 3770 B11R0.147 CCCOC(C)CCCC(=O)[O-] 7a_100000761597_100000210303 [0,1,1,0,0,0|1,0,1]=4 3771 B11R0.147 CCOCN(C)CCCC(=O)O 269956a_100000719178_100000739092 [0,1,1,0,0,0|2,0,0]=4 3772 B11R0.147 CN(CCCF)CCCC(=O)O 269956a_100000719178_100011934791 [0,1,1,0,0,0|2,0,0]=4 3773 B11R0.147 CN(CCCO)CCCC(=O)O 269956a_100000719178_100011215043 [0,1,1,0,0,0|2,0,0]=4 3774 B11R0.147 COCCN(C)CCCC(=O)O 269956a_100000719178_100000233755 [0,1,1,0,0,0|2,0,0]=4 3775 B11R0.147 CSCCN(C)CCCC(=O)O 269956a_100000719178_100000212216 [0,1,1,0,0,0|2,0,0]=4 3776 B11R0.148 C#CCCCCCCCC(=O)C 1458a_100000070787_100153394163 [0,1,1,0,0,0|1,0,1]=4 3777 B11R0.148 C#CCCCCCCCC(=O)C 1458a_100000087357_200000210301 [0,1,1,0,0,0|1,0,1]=4 3778 B11R0.148 C#CCCCCCCCC(=O)[13CH3] 1458a_100000087357_200025704644 [0,1,1,0,0,0|1,0,1]=4 3779 B11R0.148 C#CCCCCCNCC(=O)O 269956a_100016091260_100012094781 [0,1,1,0,0,0|0,0,2]=4 3780 B11R0.148 C=C(Br)CCOCCCCCC 34a_100009813270_100000210314 [0,1,1,0,0,0|2,0,0]=4 3781 B11R0.148 C=C(C)CCNCCCCCC 2230a_100000210581_100000730704 [0,1,1,0,0,0|2,0,0]=4 3782 B11R0.148 C=C(C)CCOCCCCCC 34a_100000210259_100000730704 [0,1,1,0,0,0|2,0,0]=4 3783 B11R0.148 C=C(C)CCOCCCCCC 34a_100000764851_100000210314 [0,1,1,0,0,0|2,0,0]=4 3784 B11R0.148 C=C(C)CCOCCCCCC 7a_100000210259_100000730704 [0,1,1,0,0,0|2,0,0]=4 3785 B11R0.148 C=C(C)CCSCCCCCC 62a_100000210314_100000730704 [0,1,1,0,0,0|2,0,0]=4 3786 B11R0.148 C=C(C)CCSCCCCCC 62a_100000730704_100000210757 [0,1,1,0,0,0|2,0,0]=4 3787 B11R0.148 C=C(C)CNCCCCCCC 2230a_100000229938_100000748629 [0,1,1,0,0,0|2,0,0]=4 3788 B11R0.148 C=C(C)COCCCCCCC 34a_100000210245_100000210614 [0,1,1,0,0,0|2,0,0]=4 3789 B11R0.148 C=C(C)COCCCCCCC 34a_100000210272_100000748629 [0,1,1,0,0,0|2,0,0]=4 3790 B11R0.148 C=C(C)COCCCCCCC 7a_100000210272_100000748629 [0,1,1,0,0,0|2,0,0]=4 3791 B11R0.148 C=C(C)CSCCCCCCC 62a_100000210614_100000211660 [0,1,1,0,0,0|2,0,0]=4 3792 B11R0.148 C=C(C)CSCCCCCCC 62a_100000748629_100000210316 [0,1,1,0,0,0|2,0,0]=4 3793 B11R0.148 C=C(F)CNCCCCCCC 2230a_100000229938_100009893438 [0,1,1,0,0,0|2,0,0]=4 3794 B11R0.148 C=C(F)COCCCCCCC 34a_100000210272_100009893438 [0,1,1,0,0,0|2,0,0]=4 3795 B11R0.148 C=C(F)COCCCCCCC 34a_200010262243_100000210614 [0,1,1,0,0,0|2,0,0]=4 3796 B11R0.148 C=C(F)COCCCCCCC 7a_100000210272_100000042424 [0,1,1,0,0,0|2,0,0]=4 3797 B11R0.148 C=C(F)CSCCCCCCC 62a_100000042424_100000210316 [0,1,1,0,0,0|2,0,0]=4 3798 B11R0.148 C=C(F)CSCCCCCCC 62a_100000210614_100000042424 [0,1,1,0,0,0|2,0,0]=4 3799 B11R0.148 C=CCCCCCCCC(=O)C 1458a_100000070787_100012355270 [0,1,1,0,0,0|1,0,1]=4 3800 B11R0.148 C=CCCCCCCCC(=O)C 1458a_100011216160_200000210301 [0,1,1,0,0,0|1,0,1]=4 3801 B11R0.148 C=CCCCCCCCC(=O)[13CH3] 1458a_100011216160_200025704644 [0,1,1,0,0,0|1,0,1]=4 3802 B11R0.148 C=CCCCCCNCC(=O)O 269956a_100016091260_100000700193 [0,1,1,0,0,0|0,0,2]=4 3803 B11R0.148 CC(=O)CCCCCCCCO 1458a_100000070787_100000033203 [0,1,1,0,0,0|1,0,0]=3 3804 B11R0.148 CC(=O)CCCCNCCCF 34a_100015189416_100009817362 [0,1,1,0,0,0|2,0,0]=4 3805 B11R0.148 CC(=O)CCCCOCCCBr 34a_100011217188_100009817362 [0,1,1,0,0,0|2,0,0]=4 3806 B11R0.148 CC(=O)CCCCOCCCCl 34a_100000230001_100009817362 [0,1,1,0,0,0|2,0,0]=4 3807 B11R0.148 CC(=O)CCCCOCCCF 34a_100000759539_100009817362 [0,1,1,0,0,0|2,0,0]=4 3808 B11R0.148 CC(=O)CCCCOCCCN 34a_100000182051_100009817362 [0,1,1,0,0,0|2,0,0]=4 3809 B11R0.148 CC(=O)CCCCSCCCF 62a_100000735457_100011934791 [0,1,1,0,0,0|2,0,0]=4 3810 B11R0.148 CC(=O)CCCCSCCCF 62a_100011934791_100000735457 [0,1,1,0,0,0|2,0,0]=4 3811 B11R0.148 CC(=O)CCCCSCCCO 62a_100000735457_100011215043 [0,1,1,0,0,0|2,0,0]=4 3812 B11R0.148 CC(=O)CCCCSCCCO 62a_100011215043_100000735457 [0,1,1,0,0,0|2,0,0]=4 3813 B11R0.148 CC(=O)CCCNCCCCO 34a_100000750430_100000685027 [0,1,1,0,0,0|2,0,0]=4 3814 B11R0.148 CC(=O)CCCOCCCCBr 34a_100011216708_100000685027 [0,1,1,0,0,0|2,0,0]=4 3815 B11R0.148 CC(=O)CCCOCCCCCl 34a_100000210776_100000685027 [0,1,1,0,0,0|2,0,0]=4 3816 B11R0.148 CC(=O)CCCOCCCCCl 7a_100000210776_100011215641 [0,1,1,0,0,0|2,0,0]=4 3817 B11R0.148 CC(=O)CCCOCCCCF 34a_100000759063_100000729493 [0,1,1,0,0,0|2,0,0]=4 3818 B11R0.148 CC(=O)CCCOCCCCF 34a_100011995726_100000685027 [0,1,1,0,0,0|2,0,0]=4 3819 B11R0.148 CC(=O)CCCOCCCCF 7a_100000759063_100000729493 [0,1,1,0,0,0|2,0,0]=4 3820 B11R0.148 CC(=O)CCCOCCCCF 7a_100011995726_100011215641 [0,1,1,0,0,0|2,0,0]=4 3821 B11R0.148 CC(=O)CCCOCCCCI 34a_200012148704_100000685027 [0,1,1,0,0,0|2,0,0]=4 3822 B11R0.148 CC(=O)CCCOCCCCN 34a_100000750430_100000685027 [0,1,1,0,0,0|2,0,0]=4 3823 B11R0.148 CC(=O)CCCOCCCCO 34a_100000759063_100011216708 [0,1,1,0,0,0|2,0,0]=4 3824 B11R0.148 CC(=O)CCCOCCCCO 7a_100000759063_100000210776 [0,1,1,0,0,0|2,0,0]=4 3825 B11R0.148 CC(=O)CCCSCCCCF 62a_100000729493_100011215641 [0,1,1,0,0,0|2,0,0]=4 3826 B11R0.148 CC(=O)CCCSCCCCF 62a_100011215641_100000729493 [0,1,1,0,0,0|2,0,0]=4 3827 B11R0.148 CC(=O)CCCSCCCCO 62a_100000210776_100011215641 [0,1,1,0,0,0|2,0,0]=4 3828 B11R0.148 CC(=O)CCCSCCCCO 62a_100011215641_100000210776 [0,1,1,0,0,0|2,0,0]=4 3829 B11R0.148 CC(=O)CCOCCCCCBr 7a_100000746331_100000053229 [0,1,1,0,0,0|2,0,0]=4 3830 B11R0.148 CC(=O)CCOCCCCCCl 7a_100000746330_100000053229 [0,1,1,0,0,0|2,0,0]=4 3831 B11R0.148 CC(=O)CCOCCCCCF 34a_100000759926_100000729378 [0,1,1,0,0,0|2,0,0]=4 3832 B11R0.148 CC(=O)CCOCCCCCF 7a_100000759926_100000729378 [0,1,1,0,0,0|2,0,0]=4 3833 B11R0.148 CC(=O)CCOCCCCCI 7a_200012148887_100000053229 [0,1,1,0,0,0|2,0,0]=4 3834 B11R0.148 CC(=O)CCOCCCCCO 34a_100000759926_100000746330 [0,1,1,0,0,0|2,0,0]=4 3835 B11R0.148 CC(=O)CCOCCCCCO 7a_100000759926_100000746330 [0,1,1,0,0,0|2,0,0]=4 3836 B11R0.148 CC(=O)CCSCCCCCF 62a_100000053229_100000729378 [0,1,1,0,0,0|2,0,0]=4 3837 B11R0.148 CC(=O)CCSCCCCCF 62a_100000729378_100000053229 [0,1,1,0,0,0|2,0,0]=4 3838 B11R0.148 CC(=O)CCSCCCCCO 62a_100000053229_100000746330 [0,1,1,0,0,0|2,0,0]=4 3839 B11R0.148 CC(=O)CCSCCCCCO 62a_100000746330_100000053229 [0,1,1,0,0,0|2,0,0]=4 3840 B11R0.148 CC(=O)COCCCCCCF 34a_100000211253_100015922095 [0,1,1,0,0,0|2,0,0]=4 3841 B11R0.148 CC(=O)COCCCCCCO 34a_100000211253_100000766143 [0,1,1,0,0,0|2,0,0]=4 3842 B11R0.148 CC(=O)NCCCCCCCO 240690a_100011996573_100015343762 [0,1,1,0,0,0|2,0,0]=4 3843 B11R0.148 CC(=O)NCCCCCCN[13CH3] 2230a_200011996284_200025704644 [0,1,1,0,0,0|2,0,0]=4 3844 B11R0.148 CC(=O)NCCCCCCN[13CH3] 34a_200011996284_200025704644 [0,1,1,0,0,0|2,0,0]=4 3845 B11R0.148 CCCCC#CCCCC(=O)C 1458a_100000070787_200000047210 [0,1,1,0,0,0|1,0,1]=4 3846 B11R0.148 CCCCC/C=C/CCC(=O)C 1458a_200015255902_200000210301 [0,1,1,0,0,0|1,0,1]=4 3847 B11R0.148 CCCCC/C=C/CCC(=O)[13CH3] 1458a_200015255902_200025704644 [0,1,1,0,0,0|1,0,1]=4 3848 B11R0.148 CCCCCC/C=C/CC(=O)C 1458a_100020681715_200000210301 [0,1,1,0,0,0|1,0,1]=4 3849 B11R0.148 CCCCCC/C=C/CC(=O)[13CH3] 1458a_100020681715_200025704644 [0,1,1,0,0,0|1,0,1]=4 3850 B11R0.148 CCCCCCCC=CC(=O)C 1458a_200015332781_200000210301 [0,1,1,0,0,0|1,0,1]=4 3851 B11R0.148 CCCCCCCC=CC(=O)[13CH3] 1458a_200015332781_200025704644 [0,1,1,0,0,0|1,0,1]=4 3852 B11R0.148 CCCCCCCCCC(=O)C 1458a_100000070787_100000210670 [0,1,1,0,0,0|1,0,0]=3 3853 B11R0.148 CCCCCCCCCC(=O)C 1458a_100000210558_200000210301 [0,1,1,0,0,0|1,0,0]=3 3854 B11R0.148 CCCCCCCCCC(=O)[13CH3] 1458a_100000210558_200025704644 [0,1,1,0,0,0|1,0,0]=3 3855 B11R0.148 CCCCCCCCNC(=O)C 11a_100000229939_100015343762 [0,1,1,0,0,0|1,0,0]=3 3856 B11R0.148 CCCCCCCCNC(=O)C 1626a_100000229939_100015343762 [0,1,1,0,0,0|1,0,0]=3 3857 B11R0.148 CCCCCCCCNC(=O)C 240690a_100000229939_100015343762 [0,1,1,0,0,0|1,0,0]=3 3858 B11R0.148 CCCCCCCCNC(=O)C 527a_100000229939_100103153847 [0,1,1,0,0,0|1,0,0]=3 3859 B11R0.148 CCCCCCCNCC(=O)N 2230a_100000229938_100000747473 [0,1,1,0,0,0|1,0,0]=3 3860 B11R0.148 CCCCCCCNCC(=O)N 2230a_100000711301_100000210681 [0,1,1,0,0,0|1,0,0]=3 3861 B11R0.148 CCCCCCCNCC(=O)O 269956a_100016091260_100000210614 [0,1,1,0,0,0|0,0,0]=2 3862 B11R0.148 CCCCCCCNCC(C)O 2230a_100000210904_100000210681 [0,1,1,0,0,0|1,0,1]=4 3863 B11R0.148 CCCCCCCNCC(C)O 2230a_100000229938_100011218427 [0,1,1,0,0,0|1,0,1]=4 3864 B11R0.148 CCCCCCCNCC(C)O 34a_100000210904_100000210614 [0,1,1,0,0,0|1,0,1]=4 3865 B11R0.148 CCCCCCCNC[C@@H](C)O 2230a_100000229938_100009817552 [0,1,1,0,0,0|1,0,1]=4 3866 B11R0.148 CCCCCCCOCC(=O)C 34a_100000211253_100000210614 [0,1,1,0,0,0|1,0,0]=3 3867 B11R0.148 CCCCCCCOCC(=O)N 34a_100000210272_100000187820 [0,1,1,0,0,0|1,0,0]=3 3868 B11R0.148 CCCCCCCOCC(=O)N 7a_100000210272_100000187820 [0,1,1,0,0,0|1,0,0]=3 3869 B11R0.148 CCCCCCCOCC(=O)[O-] 34a_100000210272_100020667443 [0,1,1,0,0,0|0,0,1]=3 3870 B11R0.148 CCCCCCCOCC(C)O 34a_100000210272_100011218427 [0,1,1,0,0,0|1,0,1]=4 3871 B11R0.148 CCCCCCCOCC(C)O 7a_100000210272_100011218427 [0,1,1,0,0,0|1,0,1]=4 3872 B11R0.148 CCCCCCCOC[C@@H](C)O 34a_100000210272_100009817552 [0,1,1,0,0,0|1,0,1]=4 3873 B11R0.148 CCCCCCCOC[C@@H](C)O 7a_100000210272_100009817552 [0,1,1,0,0,0|1,0,1]=4 3874 B11R0.148 CCCCCCCOC[N+](=O)[O-] 34a_100000210272_100000761209 [0,1,1,0,0,0|1,0,1]=4 3875 B11R0.148 CCCCCCCSCC(=O)N 62a_100000210614_100000747473 [0,1,1,0,0,0|1,0,0]=3 3876 B11R0.148 CCCCCCCSCC(=O)N 62a_100000747473_100000210316 [0,1,1,0,0,0|1,0,0]=3 3877 B11R0.148 CCCCCCCSCC(=O)[O-] 62a_100000210614_100020667443 [0,1,1,0,0,0|0,0,1]=3 3878 B11R0.148 CCCCCCCSCC(=O)[O-] 62a_100020667443_100000210316 [0,1,1,0,0,0|0,0,1]=3 3879 B11R0.148 CCCCCCCSCC(C)O 62a_100000210614_100011218427 [0,1,1,0,0,0|1,0,1]=4 3880 B11R0.148 CCCCCCCSCC(C)O 62a_100011218427_100000210316 [0,1,1,0,0,0|1,0,1]=4 3881 B11R0.148 CCCCCCCSC[C@@H](C)O 62a_100000210614_100009817552 [0,1,1,0,0,0|1,0,1]=4 3882 B11R0.148 CCCCCCCSC[C@@H](C)O 62a_100009817552_100000210316 [0,1,1,0,0,0|1,0,1]=4 3883 B11R0.148 CCCCCCCSC[N+](=O)[O-] 62a_100000210614_100000761209 [0,1,1,0,0,0|1,0,1]=4 3884 B11R0.148 CCCCCCNCCC(=O)N 2230a_100000210581_100000744528 [0,1,1,0,0,0|1,0,0]=3 3885 B11R0.148 CCCCCCNCCC(C)O 2230a_100000210581_100012276601 [0,1,1,0,0,0|1,0,1]=4 3886 B11R0.148 CCCCCCNCCC(C)O 2230a_200000755665_100000210314 [0,1,1,0,0,0|1,0,1]=4 3887 B11R0.148 CCCCCCNOCC(=O)O 269956a_100000106656_100000210757 [0,1,1,0,0,0|1,0,0]=3 3888 B11R0.148 CCCCCCOCCC(=O)C 34a_100000759926_100000210314 [0,1,1,0,0,0|1,0,0]=3 3889 B11R0.148 CCCCCCOCCC(=O)C 7a_100000210259_100000053229 [0,1,1,0,0,0|1,0,0]=3 3890 B11R0.148 CCCCCCOCCC(=O)C 7a_100000759926_100000210314 [0,1,1,0,0,0|1,0,0]=3 3891 B11R0.148 CCCCCCOCCC(=O)N 34a_100000210259_100000731001 [0,1,1,0,0,0|1,0,0]=3 3892 B11R0.148 CCCCCCOCCC(=O)N 34a_100000757172_100000210314 [0,1,1,0,0,0|1,0,0]=3 3893 B11R0.148 CCCCCCOCCC(=O)N 7a_100000210259_100000744528 [0,1,1,0,0,0|1,0,0]=3 3894 B11R0.148 CCCCCCOCCC(=O)N 7a_100000757172_100000210314 [0,1,1,0,0,0|1,0,0]=3 3895 B11R0.148 CCCCCCOCCC(C)O 34a_100000210259_100012276601 [0,1,1,0,0,0|1,0,1]=4 3896 B11R0.148 CCCCCCOCCC(C)O 7a_100000210259_100012276601 [0,1,1,0,0,0|1,0,1]=4 3897 B11R0.148 CCCCCCOCOC(=O)C 34a_100000210259_100009813279 [0,1,1,0,0,0|2,0,0]=4 3898 B11R0.148 CCCCCCSCCC(=O)C 62a_100000053229_100000210757 [0,1,1,0,0,0|1,0,0]=3 3899 B11R0.148 CCCCCCSCCC(=O)C 62a_100000210314_100000053229 [0,1,1,0,0,0|1,0,0]=3 3900 B11R0.148 CCCCCCSCCC(=O)N 62a_100000210314_100000744528 [0,1,1,0,0,0|1,0,0]=3 3901 B11R0.148 CCCCCCSCCC(=O)N 62a_100000744528_100000210757 [0,1,1,0,0,0|1,0,0]=3 3902 B11R0.148 CCCCCCSCCC(C)O 62a_100000210314_100012276601 [0,1,1,0,0,0|1,0,1]=4 3903 B11R0.148 CCCCCCSCCC(C)O 62a_100012276601_100000210757 [0,1,1,0,0,0|1,0,1]=4 3904 B11R0.148 CCCCCCSCOC(=O)C 62a_100000076356_100000210757 [0,1,1,0,0,0|2,0,0]=4 3905 B11R0.148 CCCCCCSCOC(=O)C 62a_100000210314_100000076356 [0,1,1,0,0,0|2,0,0]=4 3906 B11R0.148 CCCCCNCCCC(=O)N 34a_100000739312_100000718602 [0,1,1,0,0,0|1,0,0]=3 3907 B11R0.148 CCCCCNCCCC(C)O 2230a_100000209983_200000718107 [0,1,1,0,0,0|1,0,1]=4 3908 B11R0.148 CCCCCNCCCS(=O)C 2230a_200000753449_100000210326 [0,1,1,0,0,0|2,0,0]=4 3909 B11R0.148 CCCCCNCCNC(=O)C 2230a_100000209853_100000210326 [0,1,1,0,0,0|2,0,0]=4 3910 B11R0.148 CCCCCNCCNC(=O)C 2230a_100000209983_100000189650 [0,1,1,0,0,0|2,0,0]=4 3911 B11R0.148 CCCCCNCCNC(=O)N 2230a_100000209983_200000034859 [0,1,1,0,0,0|2,0,0]=4 3912 B11R0.148 CCCCCNCCNC(=O)N 34a_100020590234_100000718602 [0,1,1,0,0,0|2,0,0]=4 3913 B11R0.148 CCCCCOCCCC(=O)C 34a_100000210253_100000685027 [0,1,1,0,0,0|1,0,0]=3 3914 B11R0.148 CCCCCOCCCC(=O)C 34a_100000759063_100000718602 [0,1,1,0,0,0|1,0,0]=3 3915 B11R0.148 CCCCCOCCCC(=O)C 7a_100000210253_100011215641 [0,1,1,0,0,0|1,0,0]=3 3916 B11R0.148 CCCCCOCCCC(=O)C 7a_100000759063_100000210326 [0,1,1,0,0,0|1,0,0]=3 3917 B11R0.148 CCCCCOCCCC(=O)N 34a_100000210253_100102525003 [0,1,1,0,0,0|1,0,0]=3 3918 B11R0.148 CCCCCOCCCC(=O)N 7a_100000210253_100102525003 [0,1,1,0,0,0|1,0,0]=3 3919 B11R0.148 CCCCCOCCCC(C)O 34a_100000210253_200000718107 [0,1,1,0,0,0|1,0,1]=4 3920 B11R0.148 CCCCCOCCCC(C)O 7a_100000210253_200000718107 [0,1,1,0,0,0|1,0,1]=4 3921 B11R0.148 CCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000718602 [0,1,1,0,0,0|1,0,1]=4 3922 B11R0.148 CCCCCOCCNC(=O)C 34a_100000158858_100000718602 [0,1,1,0,0,0|2,0,0]=4 3923 B11R0.148 CCCCCOCCNC(=O)C 7a_100000210253_100000189650 [0,1,1,0,0,0|2,0,0]=4 3924 B11R0.148 CCCCCOCCNC(=O)N 34a_100000181757_100000718602 [0,1,1,0,0,0|2,0,0]=4 3925 B11R0.148 CCCCCOCCNC(=O)N 7a_100000210253_200000034859 [0,1,1,0,0,0|2,0,0]=4 3926 B11R0.148 CCCCCOCCOC(=O)C 34a_100000210253_100009814007 [0,1,1,0,0,0|2,0,0]=4 3927 B11R0.148 CCCCCOCCOC(=O)C 7a_100000210253_100009814007 [0,1,1,0,0,0|2,0,0]=4 3928 B11R0.148 CCCCCOCCOC(=O)N 34a_100000210253_200011214921 [0,1,1,0,0,0|2,0,0]=4 3929 B11R0.148 CCCCCOCCOC(=O)N 7a_100000210253_200011214921 [0,1,1,0,0,0|2,0,0]=4 3930 B11R0.148 CCCCCOCCOC(=O)N 7a_100000766696_100000210326 [0,1,1,0,0,0|2,0,0]=4 3931 B11R0.148 CCCCCSCCCC(=O)C 62a_100000210326_100011215641 [0,1,1,0,0,0|1,0,0]=3 3932 B11R0.148 CCCCCSCCCC(=O)C 62a_100011215641_100000210326 [0,1,1,0,0,0|1,0,0]=3 3933 B11R0.148 CCCCCSCCCC(=O)N 62a_100000210326_100102525003 [0,1,1,0,0,0|1,0,0]=3 3934 B11R0.148 CCCCCSCCCC(=O)N 62a_100102525003_100000210326 [0,1,1,0,0,0|1,0,0]=3 3935 B11R0.148 CCCCCSCCCC(C)O 62a_100000210326_200000718107 [0,1,1,0,0,0|1,0,1]=4 3936 B11R0.148 CCCCCSCCCC(C)O 62a_200000718107_100000210326 [0,1,1,0,0,0|1,0,1]=4 3937 B11R0.148 CCCCCSCCNC(=O)C 62a_100000189650_100000210326 [0,1,1,0,0,0|2,0,0]=4 3938 B11R0.148 CCCCCSCCNC(=O)C 62a_100000210326_100000189650 [0,1,1,0,0,0|2,0,0]=4 3939 B11R0.148 CCCCCSCCNC(=O)N 62a_100000210326_200000034859 [0,1,1,0,0,0|2,0,0]=4 3940 B11R0.148 CCCCCSCCNC(=O)N 62a_200000034859_100000210326 [0,1,1,0,0,0|2,0,0]=4 3941 B11R0.148 CCCCCSCCOC(=O)C 62a_100000210326_100009814007 [0,1,1,0,0,0|2,0,0]=4 3942 B11R0.148 CCCCCSCCOC(=O)C 62a_100009814007_100000210326 [0,1,1,0,0,0|2,0,0]=4 3943 B11R0.148 CCCCCSCCOC(=O)N 62a_100000210326_200011214921 [0,1,1,0,0,0|2,0,0]=4 3944 B11R0.148 CCCCCSCCOC(=O)N 62a_200011214921_100000210326 [0,1,1,0,0,0|2,0,0]=4 3945 B11R0.148 CCCCNCCCCB(O)O 2230a_100000102301_200009817182 [0,1,1,0,0,0|1,0,1]=4 3946 B11R0.148 CCCCNCCCCB(O)O 7a_106832991798_200009817182 [0,1,1,0,0,0|1,0,1]=4 3947 B11R0.148 CCCCNCCCCC(=O)C 7a_106832991798_100000735457 [0,1,1,0,0,0|1,0,0]=3 3948 B11R0.148 CCCCNCCCCC(=O)N 34a_100000696515_100000210210 [0,1,1,0,0,0|1,0,0]=3 3949 B11R0.148 CCCCNCCCNC(=O)C 34a_100000736810_100000210210 [0,1,1,0,0,0|2,0,0]=4 3950 B11R0.148 CCCCNCCCOC(=O)C 7a_106832991798_100000042594 [0,1,1,0,0,0|2,0,0]=4 3951 B11R0.148 CCCCNCCCSC(=O)C 2230a_100000102301_100000038929 [0,1,1,0,0,0|2,0,0]=4 3952 B11R0.148 CCCCNCCCSC(=O)C 7a_106832991798_100000038929 [0,1,1,0,0,0|2,0,0]=4 3953 B11R0.148 CCCCNCCOCC(=O)N 2230a_100000102301_100000076697 [0,1,1,0,0,0|2,0,0]=4 3954 B11R0.148 CCCCNCCOCC(=O)N 7a_106832991798_100000076697 [0,1,1,0,0,0|2,0,0]=4 3955 B11R0.148 CCCCNCCOCC(=O)O 269956a_100000700818_100000210211 [0,1,1,0,0,0|1,0,0]=3 3956 B11R0.148 CCCCOCCCCB(O)O 34a_100000210227_200009817182 [0,1,1,0,0,0|1,0,1]=4 3957 B11R0.148 CCCCOCCCCB(O)O 7a_100000210227_200009817182 [0,1,1,0,0,0|1,0,1]=4 3958 B11R0.148 CCCCOCCCCC(=O)C 34a_100000210227_100009817362 [0,1,1,0,0,0|1,0,0]=3 3959 B11R0.148 CCCCOCCCCC(=O)C 7a_100000210227_100000735457 [0,1,1,0,0,0|1,0,0]=3 3960 B11R0.148 CCCCOCCCCC(=O)N 34a_100012022536_100000210210 [0,1,1,0,0,0|1,0,0]=3 3961 B11R0.148 CCCCOCCCCC(=O)N 7a_100012022536_100000210211 [0,1,1,0,0,0|1,0,0]=3 3962 B11R0.148 CCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210210 [0,1,1,0,0,0|1,0,1]=4 3963 B11R0.148 CCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210211 [0,1,1,0,0,0|1,0,1]=4 3964 B11R0.148 CCCCOCCCNC(=O)C 1626a_200000211371_100015343762 [0,1,1,0,0,0|2,0,0]=4 3965 B11R0.148 CCCCOCCCNC(=O)C 240690a_200000211371_100015343762 [0,1,1,0,0,0|2,0,0]=4 3966 B11R0.148 CCCCOCCCNC(=O)C 34a_100000752032_100000210210 [0,1,1,0,0,0|2,0,0]=4 3967 B11R0.148 CCCCOCCCNC(=O)C 527a_200000211371_100103153847 [0,1,1,0,0,0|2,0,0]=4 3968 B11R0.148 CCCCOCCCOC(=O)C 34a_100000210227_100000042594 [0,1,1,0,0,0|2,0,0]=4 3969 B11R0.148 CCCCOCCCOC(=O)C 7a_100000210227_100000042594 [0,1,1,0,0,0|2,0,0]=4 3970 B11R0.148 CCCCOCCCSC(=O)C 34a_100000210227_100000038929 [0,1,1,0,0,0|2,0,0]=4 3971 B11R0.148 CCCCOCCCSC(=O)C 7a_100000210227_100000038929 [0,1,1,0,0,0|2,0,0]=4 3972 B11R0.148 CCCCOCCNCC(=O)N 2230a_100000711301_100000743108 [0,1,1,0,0,0|2,0,0]=4 3973 B11R0.148 CCCCOCCNCC(=O)O 269956a_100016091260_100000743108 [0,1,1,0,0,0|1,0,0]=3 3974 B11R0.148 CCCCOCCOCC(=O)C 1458a_100011216887_200000210301 [0,1,1,0,0,0|2,0,0]=4 3975 B11R0.148 CCCCOCCOCC(=O)C 34a_100000211253_100000743108 [0,1,1,0,0,0|2,0,0]=4 3976 B11R0.148 CCCCOCCOCC(=O)N 34a_100000210227_100000076697 [0,1,1,0,0,0|2,0,0]=4 3977 B11R0.148 CCCCOCCOCC(=O)N 34a_100000210238_100000187820 [0,1,1,0,0,0|2,0,0]=4 3978 B11R0.148 CCCCOCCOCC(=O)N 7a_100000210227_100000076697 [0,1,1,0,0,0|2,0,0]=4 3979 B11R0.148 CCCCOCCOCC(=O)N 7a_100000210238_100000187820 [0,1,1,0,0,0|2,0,0]=4 3980 B11R0.148 CCCCOCCOCC(=O)[13CH3] 1458a_100011216887_200025704644 [0,1,1,0,0,0|2,0,0]=4 3981 B11R0.148 CCCCOCCOCC(=O)[O-] 34a_100000210238_100020667443 [0,1,1,0,0,0|1,0,1]=4 3982 B11R0.148 CCCCOCCSCC(=O)N 62a_100000743108_100000747473 [0,1,1,0,0,0|2,0,0]=4 3983 B11R0.148 CCCCOCCSCC(=O)N 62a_100000747473_100000743108 [0,1,1,0,0,0|2,0,0]=4 3984 B11R0.148 CCCCOCCSCC(=O)[O-] 62a_100000743108_100020667443 [0,1,1,0,0,0|1,0,1]=4 3985 B11R0.148 CCCCOCCSCC(=O)[O-] 62a_100020667443_100000743108 [0,1,1,0,0,0|1,0,1]=4 3986 B11R0.148 CCCCOCNOCC(=O)O 269956a_100000106656_100011995733 [0,1,1,0,0,0|2,0,0]=4 3987 B11R0.148 CCCCOCOCCC(=O)C 34a_100000759926_100011995733 [0,1,1,0,0,0|2,0,0]=4 3988 B11R0.148 CCCCOCOCCC(=O)N 34a_100000757172_100011995733 [0,1,1,0,0,0|2,0,0]=4 3989 B11R0.148 CCCCOCSCCC(=O)C 62a_100000053229_100011995733 [0,1,1,0,0,0|2,0,0]=4 3990 B11R0.148 CCCCOCSCCC(=O)C 62a_100011995733_100000053229 [0,1,1,0,0,0|2,0,0]=4 3991 B11R0.148 CCCCOCSCCC(=O)N 62a_100000744528_100011995733 [0,1,1,0,0,0|2,0,0]=4 3992 B11R0.148 CCCCOCSCCC(=O)N 62a_100011995733_100000744528 [0,1,1,0,0,0|2,0,0]=4 3993 B11R0.148 CCCCSCCCCB(O)O 62a_100000210211_200009817182 [0,1,1,0,0,0|1,0,1]=4 3994 B11R0.148 CCCCSCCCCB(O)O 62a_200009817182_100000210210 [0,1,1,0,0,0|1,0,1]=4 3995 B11R0.148 CCCCSCCCCC(=O)C 62a_100000210211_100000735457 [0,1,1,0,0,0|1,0,0]=3 3996 B11R0.148 CCCCSCCCCC(=O)C 62a_100000735457_100000210210 [0,1,1,0,0,0|1,0,0]=3 3997 B11R0.148 CCCCSCCCOC(=O)C 62a_100000042594_100000210210 [0,1,1,0,0,0|2,0,0]=4 3998 B11R0.148 CCCCSCCCOC(=O)C 62a_100000210211_100000042594 [0,1,1,0,0,0|2,0,0]=4 3999 B11R0.148 CCCCSCCCSC(=O)C 62a_100000038929_100000210210 [0,1,1,0,0,0|2,0,0]=4 4000 B11R0.148 CCCCSCCCSC(=O)C 62a_100000210211_100000038929 [0,1,1,0,0,0|2,0,0]=4 4001 B11R0.148 CCCCSCCNCC(=O)N 2230a_100025743550_100000747473 [0,1,1,0,0,0|2,0,0]=4 4002 B11R0.148 CCCCSCCOCC(=O)N 34a_200000230436_100000187820 [0,1,1,0,0,0|2,0,0]=4 4003 B11R0.148 CCCCSCCOCC(=O)N 62a_100000076697_100000210210 [0,1,1,0,0,0|2,0,0]=4 4004 B11R0.148 CCCCSCCOCC(=O)N 62a_100000210211_100000076697 [0,1,1,0,0,0|2,0,0]=4 4005 B11R0.148 CCCCSCCOCC(=O)N 7a_200000230436_100000187820 [0,1,1,0,0,0|2,0,0]=4 4006 B11R0.148 CCCCSCCOCC(=O)[O-] 34a_200000230436_100020667443 [0,1,1,0,0,0|1,0,1]=4 4007 B11R0.148 CCCNCCCCNC(=O)C 2230a_200011368371_100000210303 [0,1,1,0,0,0|2,0,0]=4 4008 B11R0.148 CCCNCCCCNC(=O)C 34a_200011368371_100000210303 [0,1,1,0,0,0|2,0,0]=4 4009 B11R0.148 CCCOCCCCCB(O)O 34a_100000210258_200009817188 [0,1,1,0,0,0|1,0,1]=4 4010 B11R0.148 CCCOCCCCCC(=O)N 34a_100000123541_100000210303 [0,1,1,0,0,0|1,0,0]=3 4011 B11R0.148 CCCOCCCCCC(=O)N 34a_100000210258_100009817443 [0,1,1,0,0,0|1,0,0]=3 4012 B11R0.148 CCCOCCCCCC(=O)N 7a_100000123541_100000210303 [0,1,1,0,0,0|1,0,0]=3 4013 B11R0.148 CCCOCCCCCC(=O)[O-] 7a_100102619762_100000210303 [0,1,1,0,0,0|0,0,1]=3 4014 B11R0.148 CCCOCCCCOC(=O)C 34a_100000073216_100000210303 [0,1,1,0,0,0|2,0,0]=4 4015 B11R0.148 CCCOCCCCOC(=O)C 34a_100000210258_100000033659 [0,1,1,0,0,0|2,0,0]=4 4016 B11R0.148 CCCOCCCCOC(=O)C 7a_100000073216_100000210303 [0,1,1,0,0,0|2,0,0]=4 4017 B11R0.148 CCCOCCCCSC(=O)C 34a_100000210258_200010402107 [0,1,1,0,0,0|2,0,0]=4 4018 B11R0.148 CCCOCCCNCC(=O)N 2230a_100011217757_100000747473 [0,1,1,0,0,0|2,0,0]=4 4019 B11R0.148 CCCOCCCNCC(=O)N 34a_100011217757_100000187820 [0,1,1,0,0,0|2,0,0]=4 4020 B11R0.148 CCCOCCCNCC(=O)[O-] 34a_100011217757_100020667443 [0,1,1,0,0,0|1,0,1]=4 4021 B11R0.148 CCCOCCNCCC(=O)N 2230a_100161115042_100000744528 [0,1,1,0,0,0|2,0,0]=4 4022 B11R0.148 CCCOCCNCCC(=O)N 34a_100161115042_100000731001 [0,1,1,0,0,0|2,0,0]=4 4023 B11R0.148 CCCOCCNOCC(=O)O 269956a_100000106656_100011215938 [0,1,1,0,0,0|2,0,0]=4 4024 B11R0.148 CCCOCCOCCC(=O)C 34a_100000759926_100011215938 [0,1,1,0,0,0|2,0,0]=4 4025 B11R0.148 CCCOCCOCCC(=O)C 7a_100000752267_100000053229 [0,1,1,0,0,0|2,0,0]=4 4026 B11R0.148 CCCOCCOCCC(=O)C 7a_100000759926_100011215938 [0,1,1,0,0,0|2,0,0]=4 4027 B11R0.148 CCCOCCOCCC(=O)N 34a_100000752267_100000731001 [0,1,1,0,0,0|2,0,0]=4 4028 B11R0.148 CCCOCCOCCC(=O)N 34a_100000757172_100011215938 [0,1,1,0,0,0|2,0,0]=4 4029 B11R0.148 CCCOCCOCCC(=O)N 7a_100000752267_100000744528 [0,1,1,0,0,0|2,0,0]=4 4030 B11R0.148 CCCOCCOCCC(=O)N 7a_100000757172_100011215938 [0,1,1,0,0,0|2,0,0]=4 4031 B11R0.148 CCCOCCSCCC(=O)C 62a_100000053229_100011215938 [0,1,1,0,0,0|2,0,0]=4 4032 B11R0.148 CCCOCCSCCC(=O)C 62a_100011215938_100000053229 [0,1,1,0,0,0|2,0,0]=4 4033 B11R0.148 CCCOCCSCCC(=O)N 62a_100000744528_100011215938 [0,1,1,0,0,0|2,0,0]=4 4034 B11R0.148 CCCOCCSCCC(=O)N 62a_100011215938_100000744528 [0,1,1,0,0,0|2,0,0]=4 4035 B11R0.148 CCCSCCCCCB(O)O 62a_100000210303_200009817188 [0,1,1,0,0,0|1,0,1]=4 4036 B11R0.148 CCCSCCCCCB(O)O 62a_200009817188_100000210303 [0,1,1,0,0,0|1,0,1]=4 4037 B11R0.148 CCCSCCCCCC(=O)N 62a_100000210303_100009817443 [0,1,1,0,0,0|1,0,0]=3 4038 B11R0.148 CCCSCCCCCC(=O)N 62a_100009817443_100000210303 [0,1,1,0,0,0|1,0,0]=3 4039 B11R0.148 CCCSCCCCOC(=O)C 62a_100000033659_100000210303 [0,1,1,0,0,0|2,0,0]=4 4040 B11R0.148 CCCSCCCCOC(=O)C 62a_100000210303_100000033659 [0,1,1,0,0,0|2,0,0]=4 4041 B11R0.148 CCCSCCCCSC(=O)C 62a_100000210303_200010402107 [0,1,1,0,0,0|2,0,0]=4 4042 B11R0.148 CCCSCCCCSC(=O)C 62a_200010402107_100000210303 [0,1,1,0,0,0|2,0,0]=4 4043 B11R0.148 CCCSCCNCCC(=O)N 2230a_100020603323_100000744528 [0,1,1,0,0,0|2,0,0]=4 4044 B11R0.148 CCCSCCOCCC(=O)C 7a_200000230433_100000053229 [0,1,1,0,0,0|2,0,0]=4 4045 B11R0.148 CCCSCCOCCC(=O)N 34a_200000230433_100000731001 [0,1,1,0,0,0|2,0,0]=4 4046 B11R0.148 CCCSCCOCCC(=O)N 7a_200000230433_100000744528 [0,1,1,0,0,0|2,0,0]=4 4047 B11R0.148 CCNCCCCCCB(O)O 2230a_100015525214_100009817187 [0,1,1,0,0,0|1,0,1]=4 4048 B11R0.148 CCNCCCCCNC(=O)C 2230a_200012022750_100000210202 [0,1,1,0,0,0|2,0,0]=4 4049 B11R0.148 CCNCCCCCNC(=O)C 34a_200012022750_100000210202 [0,1,1,0,0,0|2,0,0]=4 4050 B11R0.148 CCNCCCCCOC(=O)C 2230a_100015525214_100009813381 [0,1,1,0,0,0|2,0,0]=4 4051 B11R0.148 CCOCCCCCCB(O)O 34a_100121572206_100009817187 [0,1,1,0,0,0|1,0,1]=4 4052 B11R0.148 CCOCCCCCOC(=O)C 34a_100121572206_100000033007 [0,1,1,0,0,0|2,0,0]=4 4053 B11R0.148 CCOCCCNCCC(=O)N 2230a_100000210961_100000744528 [0,1,1,0,0,0|2,0,0]=4 4054 B11R0.148 CCOCCCNCCC(=O)N 34a_100000210961_100000731001 [0,1,1,0,0,0|2,0,0]=4 4055 B11R0.148 CCOCCCNOCC(=O)O 269956a_100000106656_100012232248 [0,1,1,0,0,0|2,0,0]=4 4056 B11R0.148 CCOCCCOCCC(=O)C 34a_100000759926_100012232248 [0,1,1,0,0,0|2,0,0]=4 4057 B11R0.148 CCOCCCOCCC(=O)C 7a_100000757476_100000053229 [0,1,1,0,0,0|2,0,0]=4 4058 B11R0.148 CCOCCCOCCC(=O)C 7a_100000759926_100012232248 [0,1,1,0,0,0|2,0,0]=4 4059 B11R0.148 CCOCCCOCCC(=O)N 34a_100000757172_100012232248 [0,1,1,0,0,0|2,0,0]=4 4060 B11R0.148 CCOCCCOCCC(=O)N 34a_100000757476_100000731001 [0,1,1,0,0,0|2,0,0]=4 4061 B11R0.148 CCOCCCOCCC(=O)N 7a_100000757172_100012232248 [0,1,1,0,0,0|2,0,0]=4 4062 B11R0.148 CCOCCCOCCC(=O)N 7a_100000757476_100000744528 [0,1,1,0,0,0|2,0,0]=4 4063 B11R0.148 CCOCCCSCCC(=O)C 62a_100000053229_100012232248 [0,1,1,0,0,0|2,0,0]=4 4064 B11R0.148 CCOCCCSCCC(=O)C 62a_100012232248_100000053229 [0,1,1,0,0,0|2,0,0]=4 4065 B11R0.148 CCOCCCSCCC(=O)N 62a_100000744528_100012232248 [0,1,1,0,0,0|2,0,0]=4 4066 B11R0.148 CCOCCCSCCC(=O)N 62a_100012232248_100000744528 [0,1,1,0,0,0|2,0,0]=4 4067 B11R0.148 CCOCCNCCCC(=O)C 34a_102516460346_100000685027 [0,1,1,0,0,0|2,0,0]=4 4068 B11R0.148 CCOCCNCCCC(=O)N 34a_100000739312_100000210147 [0,1,1,0,0,0|2,0,0]=4 4069 B11R0.148 CCOCCNCCCC(=O)N 34a_102516460346_100102525003 [0,1,1,0,0,0|2,0,0]=4 4070 B11R0.148 CCOCCOCCCC(=O)C 34a_100000210136_100000685027 [0,1,1,0,0,0|2,0,0]=4 4071 B11R0.148 CCOCCOCCCC(=O)C 34a_100000759063_100000210147 [0,1,1,0,0,0|2,0,0]=4 4072 B11R0.148 CCOCCOCCCC(=O)C 7a_100000210136_100011215641 [0,1,1,0,0,0|2,0,0]=4 4073 B11R0.148 CCOCCOCCCC(=O)C 7a_100000759063_100011215890 [0,1,1,0,0,0|2,0,0]=4 4074 B11R0.148 CCOCCOCCCC(=O)N 34a_100000210136_100102525003 [0,1,1,0,0,0|2,0,0]=4 4075 B11R0.148 CCOCCOCCCC(=O)N 7a_100000210136_100102525003 [0,1,1,0,0,0|2,0,0]=4 4076 B11R0.148 CCOCCSCCCC(=O)C 62a_100000210147_100011215641 [0,1,1,0,0,0|2,0,0]=4 4077 B11R0.148 CCOCCSCCCC(=O)C 62a_100011215641_100011215890 [0,1,1,0,0,0|2,0,0]=4 4078 B11R0.148 CCOCCSCCCC(=O)N 62a_100000210147_100102525003 [0,1,1,0,0,0|2,0,0]=4 4079 B11R0.148 CCOCCSCCCC(=O)N 62a_100102525003_100011215890 [0,1,1,0,0,0|2,0,0]=4 4080 B11R0.148 CCOCNCCOCC(=O)O 269956a_100000700818_100000739092 [0,1,1,0,0,0|2,0,0]=4 4081 B11R0.148 CCOCSCCCCC(=O)C 62a_100000735457_100000739092 [0,1,1,0,0,0|2,0,0]=4 4082 B11R0.148 CCOCSCCCCC(=O)C 62a_100000739092_100000735457 [0,1,1,0,0,0|2,0,0]=4 4083 B11R0.148 CCSCCCCCCB(O)O 62a_100000210202_100009817187 [0,1,1,0,0,0|1,0,1]=4 4084 B11R0.148 CCSCCCCCCB(O)O 62a_100009817187_100000210202 [0,1,1,0,0,0|1,0,1]=4 4085 B11R0.148 CCSCCCCCOC(=O)C 62a_100000033007_100000210202 [0,1,1,0,0,0|2,0,0]=4 4086 B11R0.148 CCSCCCCCOC(=O)C 62a_100000210202_100000033007 [0,1,1,0,0,0|2,0,0]=4 4087 B11R0.148 CCSCCCOCCC(=O)C 7a_100011216438_100000053229 [0,1,1,0,0,0|2,0,0]=4 4088 B11R0.148 CCSCCCOCCC(=O)N 34a_100011216438_100000731001 [0,1,1,0,0,0|2,0,0]=4 4089 B11R0.148 CCSCCCOCCC(=O)N 7a_100011216438_100000744528 [0,1,1,0,0,0|2,0,0]=4 4090 B11R0.148 CCSCCNCCCC(=O)N 34a_100000739312_100000757381 [0,1,1,0,0,0|2,0,0]=4 4091 B11R0.148 CCSCCOCCCC(=O)C 34a_100000212035_100000685027 [0,1,1,0,0,0|2,0,0]=4 4092 B11R0.148 CCSCCOCCCC(=O)C 34a_100000759063_100000757381 [0,1,1,0,0,0|2,0,0]=4 4093 B11R0.148 CCSCCOCCCC(=O)C 7a_100000212035_100011215641 [0,1,1,0,0,0|2,0,0]=4 4094 B11R0.148 CCSCCOCCCC(=O)C 7a_100000759063_100000757381 [0,1,1,0,0,0|2,0,0]=4 4095 B11R0.148 CCSCCOCCCC(=O)N 34a_100000212035_100102525003 [0,1,1,0,0,0|2,0,0]=4 4096 B11R0.148 CCSCCOCCCC(=O)N 7a_100000212035_100102525003 [0,1,1,0,0,0|2,0,0]=4 4097 B11R0.148 CCSCCSCCCC(=O)C 62a_100000757381_100011215641 [0,1,1,0,0,0|2,0,0]=4 4098 B11R0.148 CCSCCSCCCC(=O)C 62a_100011215641_100000757381 [0,1,1,0,0,0|2,0,0]=4 4099 B11R0.148 CCSCCSCCCC(=O)N 62a_100000757381_100102525003 [0,1,1,0,0,0|2,0,0]=4 4100 B11R0.148 CCSCCSCCCC(=O)N 62a_100102525003_100000757381 [0,1,1,0,0,0|2,0,0]=4 4101 B11R0.148 CNCCCCCCNC(=O)C 2230a_200011996284_200000210301 [0,1,1,0,0,0|2,0,0]=4 4102 B11R0.148 CNCCCCCCNC(=O)C 34a_200011996284_200000210301 [0,1,1,0,0,0|2,0,0]=4 4103 B11R0.148 CNCCCCCOCC(=O)N 34a_100000722520_100000187820 [0,1,1,0,0,0|2,0,0]=4 4104 B11R0.148 CNCCCCCOCC(=O)[O-] 34a_100000722520_100020667443 [0,1,1,0,0,0|1,0,1]=4 4105 B11R0.148 CNCCCOCCCC(=O)C 34a_100000213112_100000685027 [0,1,1,0,0,0|2,0,0]=4 4106 B11R0.148 CNCCCOCCCC(=O)N 34a_100000213112_100102525003 [0,1,1,0,0,0|2,0,0]=4 4107 B11R0.148 CNCCOCCOCC(=O)O 269956a_100009854275_200000210301 [0,1,1,0,0,0|2,0,0]=4 4108 B11R0.148 COCCCCCNCC(=O)N 2230a_100000747528_100000747473 [0,1,1,0,0,0|2,0,0]=4 4109 B11R0.148 COCCCCCNCC(=O)N 34a_100000747528_100000187820 [0,1,1,0,0,0|2,0,0]=4 4110 B11R0.148 COCCCCCNCC(=O)[O-] 34a_100000747528_100020667443 [0,1,1,0,0,0|1,0,1]=4 4111 B11R0.148 COCCCCNOCC(=O)O 269956a_100000106656_100000730899 [0,1,1,0,0,0|2,0,0]=4 4112 B11R0.148 COCCCCOCCC(=O)C 34a_100000759926_100000755781 [0,1,1,0,0,0|2,0,0]=4 4113 B11R0.148 COCCCCOCCC(=O)C 7a_100000759926_100000730899 [0,1,1,0,0,0|2,0,0]=4 4114 B11R0.148 COCCCCOCCC(=O)N 34a_100000740925_100000731001 [0,1,1,0,0,0|2,0,0]=4 4115 B11R0.148 COCCCCOCCC(=O)N 34a_100000757172_100000755781 [0,1,1,0,0,0|2,0,0]=4 4116 B11R0.148 COCCCCOCCC(=O)N 7a_100000757172_100000730899 [0,1,1,0,0,0|2,0,0]=4 4117 B11R0.148 COCCCCSCCC(=O)C 62a_100000053229_100000730899 [0,1,1,0,0,0|2,0,0]=4 4118 B11R0.148 COCCCCSCCC(=O)C 62a_100000730899_100000053229 [0,1,1,0,0,0|2,0,0]=4 4119 B11R0.148 COCCCCSCCC(=O)N 62a_100000730899_100000744528 [0,1,1,0,0,0|2,0,0]=4 4120 B11R0.148 COCCCCSCCC(=O)N 62a_100000744528_100000730899 [0,1,1,0,0,0|2,0,0]=4 4121 B11R0.148 COCCCNCCCC(=O)C 34a_100150723488_100000685027 [0,1,1,0,0,0|2,0,0]=4 4122 B11R0.148 COCCCNCCCC(=O)N 34a_100000739312_100000740836 [0,1,1,0,0,0|2,0,0]=4 4123 B11R0.148 COCCCNCCCC(=O)N 34a_100150723488_100102525003 [0,1,1,0,0,0|2,0,0]=4 4124 B11R0.148 COCCCOCCCC(=O)C 34a_100000740835_100000685027 [0,1,1,0,0,0|2,0,0]=4 4125 B11R0.148 COCCCOCCCC(=O)C 34a_100000759063_100000740836 [0,1,1,0,0,0|2,0,0]=4 4126 B11R0.148 COCCCOCCCC(=O)C 7a_100000759063_100000740836 [0,1,1,0,0,0|2,0,0]=4 4127 B11R0.148 COCCCOCCCC(=O)N 34a_100000740835_100102525003 [0,1,1,0,0,0|2,0,0]=4 4128 B11R0.148 COCCCSCCCC(=O)C 62a_100000709357_100011215641 [0,1,1,0,0,0|2,0,0]=4 4129 B11R0.148 COCCCSCCCC(=O)C 62a_100011215641_100000709357 [0,1,1,0,0,0|2,0,0]=4 4130 B11R0.148 COCCCSCCCC(=O)N 62a_100000709357_100102525003 [0,1,1,0,0,0|2,0,0]=4 4131 B11R0.148 COCCCSCCCC(=O)N 62a_100102525003_100000709357 [0,1,1,0,0,0|2,0,0]=4 4132 B11R0.148 COCCNCCCCC(=O)N 34a_100000696515_100011201679 [0,1,1,0,0,0|2,0,0]=4 4133 B11R0.148 COCCNCCOCC(=O)O 269956a_100000700818_100000233755 [0,1,1,0,0,0|2,0,0]=4 4134 B11R0.148 COCCOCCCCC(=O)C 34a_100000210237_100009817362 [0,1,1,0,0,0|2,0,0]=4 4135 B11R0.148 COCCOCCCCC(=O)N 34a_100012022536_100011201679 [0,1,1,0,0,0|2,0,0]=4 4136 B11R0.148 COCCOCCCCC(=O)N 7a_100012022536_100000233755 [0,1,1,0,0,0|2,0,0]=4 4137 B11R0.148 COCCOCCNCC(=O)O 269956a_100016091260_100000695917 [0,1,1,0,0,0|2,0,0]=4 4138 B11R0.148 COCCSCCCCC(=O)C 62a_100000233755_100000735457 [0,1,1,0,0,0|2,0,0]=4 4139 B11R0.148 COCCSCCCCC(=O)C 62a_100000735457_100000233755 [0,1,1,0,0,0|2,0,0]=4 4140 B11R0.148 COCSCCCCCC(=O)N 62a_100000766300_100009817443 [0,1,1,0,0,0|2,0,0]=4 4141 B11R0.148 COCSCCCCCC(=O)N 62a_100009817443_100000766300 [0,1,1,0,0,0|2,0,0]=4 4142 B11R0.148 CSCCCCOCCC(=O)C 7a_100011217163_100000053229 [0,1,1,0,0,0|2,0,0]=4 4143 B11R0.148 CSCCCCOCCC(=O)N 34a_100011217163_100000731001 [0,1,1,0,0,0|2,0,0]=4 4144 B11R0.148 CSCCCCOCCC(=O)N 7a_100011217163_100000744528 [0,1,1,0,0,0|2,0,0]=4 4145 B11R0.148 CSCCCOCCCC(=O)C 34a_100000690336_100000685027 [0,1,1,0,0,0|2,0,0]=4 4146 B11R0.148 CSCCCOCCCC(=O)C 7a_100000690336_100011215641 [0,1,1,0,0,0|2,0,0]=4 4147 B11R0.148 CSCCCOCCCC(=O)N 34a_100000690336_100102525003 [0,1,1,0,0,0|2,0,0]=4 4148 B11R0.148 CSCCCOCCCC(=O)N 7a_100000690336_100102525003 [0,1,1,0,0,0|2,0,0]=4 4149 B11R0.148 CSCCNCCCCC(=O)N 34a_100000696515_100000212216 [0,1,1,0,0,0|2,0,0]=4 4150 B11R0.148 CSCCNCCOCC(=O)O 269956a_100000700818_100000212216 [0,1,1,0,0,0|2,0,0]=4 4151 B11R0.148 CSCCOCCCCC(=O)C 34a_100000230434_100009817362 [0,1,1,0,0,0|2,0,0]=4 4152 B11R0.148 CSCCOCCCCC(=O)C 7a_100000230434_100000735457 [0,1,1,0,0,0|2,0,0]=4 4153 B11R0.148 CSCCOCCCCC(=O)N 34a_100012022536_100000212216 [0,1,1,0,0,0|2,0,0]=4 4154 B11R0.148 CSCCOCCCCC(=O)N 7a_100012022536_100000212216 [0,1,1,0,0,0|2,0,0]=4 4155 B11R0.148 CSCCSCCCCC(=O)C 62a_100000212216_100000735457 [0,1,1,0,0,0|2,0,0]=4 4156 B11R0.148 CSCCSCCCCC(=O)C 62a_100000735457_100000751147 [0,1,1,0,0,0|2,0,0]=4 4157 B11R0.148 CSCOCCCCCC(=O)N 34a_100000123541_100011218213 [0,1,1,0,0,0|2,0,0]=4 4158 B11R0.148 CSCSCCCCCC(=O)N 62a_100009817443_100011218213 [0,1,1,0,0,0|2,0,0]=4 4159 B11R0.148 CSCSCCCCCC(=O)N 62a_100011218213_100009817443 [0,1,1,0,0,0|2,0,0]=4 4160 B11R0.148 N#CCCCCCNCC(=O)O 269956a_100016091260_100009813376 [0,1,1,0,0,0|1,0,1]=4 4161 B11R0.148 NC(=O)CCCCCNCCF 34a_100000724931_100009817443 [0,1,1,0,0,0|2,0,0]=4 4162 B11R0.148 NC(=O)CCCCCNCCO 2230a_100016997473_100009817443 [0,1,1,0,0,0|2,0,0]=4 4163 B11R0.148 NC(=O)CCCCCNCCO 34a_100016990907_100009817443 [0,1,1,0,0,0|2,0,0]=4 4164 B11R0.148 NC(=O)CCCCCOCCBr 34a_100000211926_100009817443 [0,1,1,0,0,0|2,0,0]=4 4165 B11R0.148 NC(=O)CCCCCOCCF 34a_100000123541_100011217306 [0,1,1,0,0,0|2,0,0]=4 4166 B11R0.148 NC(=O)CCCCCOCCF 7a_100000123541_100011217306 [0,1,1,0,0,0|2,0,0]=4 4167 B11R0.148 NC(=O)CCCCCOCCO 34a_100000123541_100000211926 [0,1,1,0,0,0|2,0,0]=4 4168 B11R0.148 NC(=O)CCCCCOCCO 7a_100000123541_100000211926 [0,1,1,0,0,0|2,0,0]=4 4169 B11R0.148 NC(=O)CCCCCSCCF 62a_100009817443_100011217306 [0,1,1,0,0,0|2,0,0]=4 4170 B11R0.148 NC(=O)CCCCCSCCF 62a_100011217306_100009817443 [0,1,1,0,0,0|2,0,0]=4 4171 B11R0.148 NC(=O)CCCCCSCCO 62a_100000211926_100009817443 [0,1,1,0,0,0|2,0,0]=4 4172 B11R0.148 NC(=O)CCCCCSCCO 62a_100009817443_100000211926 [0,1,1,0,0,0|2,0,0]=4 4173 B11R0.148 NC(=O)CCCCNCCCF 34a_100000696515_100011934791 [0,1,1,0,0,0|2,0,0]=4 4174 B11R0.148 NC(=O)CCCCNCCCO 34a_100000696515_100000230001 [0,1,1,0,0,0|2,0,0]=4 4175 B11R0.148 NC(=O)CCCCOCCCF 34a_100012022536_100011934791 [0,1,1,0,0,0|2,0,0]=4 4176 B11R0.148 NC(=O)CCCCOCCCF 7a_100012022536_100011934791 [0,1,1,0,0,0|2,0,0]=4 4177 B11R0.148 NC(=O)CCCCOCCCO 34a_100012022536_100000230001 [0,1,1,0,0,0|2,0,0]=4 4178 B11R0.148 NC(=O)CCCCOCCCO 7a_100012022536_100011215043 [0,1,1,0,0,0|2,0,0]=4 4179 B11R0.148 NC(=O)CCCNCCCCF 34a_100000739312_100000729493 [0,1,1,0,0,0|2,0,0]=4 4180 B11R0.148 NC(=O)CCCNCCCCO 34a_100000739312_100011216708 [0,1,1,0,0,0|2,0,0]=4 4181 B11R0.148 NC(=O)CCCNCCCCO 34a_100000750430_100102525003 [0,1,1,0,0,0|2,0,0]=4 4182 B11R0.148 NC(=O)CCCOCCCCBr 34a_100011216708_100102525003 [0,1,1,0,0,0|2,0,0]=4 4183 B11R0.148 NC(=O)CCCOCCCCCl 34a_100000210776_100102525003 [0,1,1,0,0,0|2,0,0]=4 4184 B11R0.148 NC(=O)CCCOCCCCCl 7a_100000210776_100102525003 [0,1,1,0,0,0|2,0,0]=4 4185 B11R0.148 NC(=O)CCCOCCCCF 34a_100011995726_100102525003 [0,1,1,0,0,0|2,0,0]=4 4186 B11R0.148 NC(=O)CCCOCCCCF 7a_100011995726_100102525003 [0,1,1,0,0,0|2,0,0]=4 4187 B11R0.148 NC(=O)CCCOCCCCI 34a_200012148704_100102525003 [0,1,1,0,0,0|2,0,0]=4 4188 B11R0.148 NC(=O)CCCSCCCCF 62a_100000729493_100102525003 [0,1,1,0,0,0|2,0,0]=4 4189 B11R0.148 NC(=O)CCCSCCCCF 62a_100102525003_100000729493 [0,1,1,0,0,0|2,0,0]=4 4190 B11R0.148 NC(=O)CCCSCCCCO 62a_100000210776_100102525003 [0,1,1,0,0,0|2,0,0]=4 4191 B11R0.148 NC(=O)CCCSCCCCO 62a_100102525003_100000210776 [0,1,1,0,0,0|2,0,0]=4 4192 B11R0.148 NC(=O)CCNCCCCCO 2230a_100000762737_100000744528 [0,1,1,0,0,0|2,0,0]=4 4193 B11R0.148 NC(=O)CCNCCCCCO 34a_100000762737_100000731001 [0,1,1,0,0,0|2,0,0]=4 4194 B11R0.148 NC(=O)CCOCCCCCBr 34a_100000746331_100000731001 [0,1,1,0,0,0|2,0,0]=4 4195 B11R0.148 NC(=O)CCOCCCCCBr 7a_100000746331_100000744528 [0,1,1,0,0,0|2,0,0]=4 4196 B11R0.148 NC(=O)CCOCCCCCCl 34a_100000746330_100000731001 [0,1,1,0,0,0|2,0,0]=4 4197 B11R0.148 NC(=O)CCOCCCCCCl 7a_100000746330_100000744528 [0,1,1,0,0,0|2,0,0]=4 4198 B11R0.148 NC(=O)CCOCCCCCF 34a_100000757172_100000729378 [0,1,1,0,0,0|2,0,0]=4 4199 B11R0.148 NC(=O)CCOCCCCCF 7a_100000757172_100000729378 [0,1,1,0,0,0|2,0,0]=4 4200 B11R0.148 NC(=O)CCOCCCCCI 34a_200012148887_100000731001 [0,1,1,0,0,0|2,0,0]=4 4201 B11R0.148 NC(=O)CCOCCCCCI 7a_200012148887_100000744528 [0,1,1,0,0,0|2,0,0]=4 4202 B11R0.148 NC(=O)CCOCCCCCO 34a_100000757172_100000746330 [0,1,1,0,0,0|2,0,0]=4 4203 B11R0.148 NC(=O)CCOCCCCCO 7a_100000757172_100000746330 [0,1,1,0,0,0|2,0,0]=4 4204 B11R0.148 NC(=O)CCSCCCCCF 62a_100000729378_100000744528 [0,1,1,0,0,0|2,0,0]=4 4205 B11R0.148 NC(=O)CCSCCCCCF 62a_100000744528_100000729378 [0,1,1,0,0,0|2,0,0]=4 4206 B11R0.148 NC(=O)CCSCCCCCO 62a_100000744528_100000746330 [0,1,1,0,0,0|2,0,0]=4 4207 B11R0.148 NC(=O)CCSCCCCCO 62a_100000746330_100000744528 [0,1,1,0,0,0|2,0,0]=4 4208 B11R0.148 NC(=O)CNCCCCCCF 2230a_100000711301_100015922095 [0,1,1,0,0,0|2,0,0]=4 4209 B11R0.148 NC(=O)CNCCCCCCO 2230a_100000686447_100000747473 [0,1,1,0,0,0|2,0,0]=4 4210 B11R0.148 NC(=O)CNCCCCCCO 2230a_100000711301_100000766143 [0,1,1,0,0,0|2,0,0]=4 4211 B11R0.148 NC(=O)CNCCCCCCO 34a_100000686447_100000187820 [0,1,1,0,0,0|2,0,0]=4 4212 B11R0.148 NC(=O)COCCCCCCBr 34a_100011215345_100000187820 [0,1,1,0,0,0|2,0,0]=4 4213 B11R0.148 NC(=O)COCCCCCCBr 7a_100011215345_100000187820 [0,1,1,0,0,0|2,0,0]=4 4214 B11R0.148 NC(=O)COCCCCCCCl 34a_100000766143_100000187820 [0,1,1,0,0,0|2,0,0]=4 4215 B11R0.148 NC(=O)COCCCCCCCl 7a_100000766143_100000187820 [0,1,1,0,0,0|2,0,0]=4 4216 B11R0.148 NC(=O)COCCCCCCF 34a_100000732779_100000187820 [0,1,1,0,0,0|2,0,0]=4 4217 B11R0.148 NC(=O)COCCCCCCF 7a_100000732779_100000187820 [0,1,1,0,0,0|2,0,0]=4 4218 B11R0.148 NC(=O)CSCCCCCCF 62a_100000747473_100015922095 [0,1,1,0,0,0|2,0,0]=4 4219 B11R0.148 NC(=O)CSCCCCCCF 62a_100015922095_100000747473 [0,1,1,0,0,0|2,0,0]=4 4220 B11R0.148 NC(=O)CSCCCCCCO 62a_100000747473_100000766143 [0,1,1,0,0,0|2,0,0]=4 4221 B11R0.148 NC(=O)CSCCCCCCO 62a_100000766143_100000747473 [0,1,1,0,0,0|2,0,0]=4 4222 B11R0.148 NCCCCCCOCC(=O)N 34a_100000686447_100000187820 [0,1,1,0,0,0|2,0,0]=4 4223 B11R0.148 NCCCCCCOCC(=O)[O-] 34a_100000686447_100020667443 [0,1,1,0,0,0|1,0,1]=4 4224 B11R0.148 NCCCCCOCCC(=O)N 34a_100000762737_100000731001 [0,1,1,0,0,0|2,0,0]=4 4225 B11R0.148 NCCCCOCCCC(=O)N 34a_100000750430_100102525003 [0,1,1,0,0,0|2,0,0]=4 4226 B11R0.148 NCCOCCCCCC(=O)N 34a_100000210304_100009817443 [0,1,1,0,0,0|2,0,0]=4 4227 B11R0.148 O=C(O)CNCCCCCCF 269956a_100016091260_100015922095 [0,1,1,0,0,0|1,0,0]=3 4228 B11R0.148 O=C(O)CNCCCCCCO 269956a_100016091260_100000766143 [0,1,1,0,0,0|1,0,0]=3 4229 B11R0.148 O=C(O)COCCNCCCF 269956a_100000700818_100011934791 [0,1,1,0,0,0|2,0,0]=4 4230 B11R0.148 O=C(O)COCCNCCCO 269956a_100000700818_100011215043 [0,1,1,0,0,0|2,0,0]=4 4231 B11R0.148 O=C(O)CONCCCCCF 269956a_100000106656_100000729378 [0,1,1,0,0,0|2,0,0]=4 4232 B11R0.148 O=C(O)CONCCCCCO 269956a_100000106656_100000746330 [0,1,1,0,0,0|2,0,0]=4 4233 B11R0.148 O=C([O-])CCCCCOCCF 7a_100102619762_100011217306 [0,1,1,0,0,0|1,0,1]=4 4234 B11R0.148 O=C([O-])CCCCCOCCO 7a_100102619762_100000211926 [0,1,1,0,0,0|1,0,1]=4 4235 B11R0.148 O=C([O-])CNCCCCCCO 34a_100000686447_100020667443 [0,1,1,0,0,0|1,0,1]=4 4236 B11R0.148 O=C([O-])COCCCCCCBr 34a_100011215345_100020667443 [0,1,1,0,0,0|1,0,1]=4 4237 B11R0.148 O=C([O-])COCCCCCCCl 34a_100000766143_100020667443 [0,1,1,0,0,0|1,0,1]=4 4238 B11R0.148 O=C([O-])COCCCCCCF 34a_100000732779_100020667443 [0,1,1,0,0,0|1,0,1]=4 4239 B11R0.148 O=C([O-])CSCCCCCCF 62a_100015922095_100020667443 [0,1,1,0,0,0|1,0,1]=4 4240 B11R0.148 O=C([O-])CSCCCCCCF 62a_100020667443_100015922095 [0,1,1,0,0,0|1,0,1]=4 4241 B11R0.148 O=C([O-])CSCCCCCCO 62a_100000766143_100020667443 [0,1,1,0,0,0|1,0,1]=4 4242 B11R0.148 O=C([O-])CSCCCCCCO 62a_100020667443_100000766143 [0,1,1,0,0,0|1,0,1]=4 4243 B11R0.148 O=CCCCCCNCC(=O)O 269956a_100016091260_100000139337 [0,1,1,0,0,0|1,0,1]=4 4244 B11R0.148 [13CH3]NCCOCCOCC(=O)O 269956a_100009854275_200025704644 [0,1,1,0,0,0|2,0,0]=4 4245 B11R0.43 CCCC(=O)C(C)NC(=O)CC 1458a_100000194823_100000210303 [0,1,1,0,0,0|1,0,1]=4 4246 B11R0.43 CCCC(C)C(C)OC(C)CC 34a_100000708338_100011215416 [0,1,1,0,0,0|1,0,1]=4 4247 B11R0.43 CCCC(C)C(C)OC(C)CC 7a_100000708338_100000758301 [0,1,1,0,0,0|1,0,1]=4 4248 B11R0.72 C#CC(CC)OC(C)CCCC 34a_100000758843_200011215066 [0,1,1,0,0,0|1,0,1]=4 4249 B11R0.72 C#CC(CC)OC(C)CCCC 7a_100000758843_200011215066 [0,1,1,0,0,0|1,0,1]=4 4250 B11R0.72 C=CC(CC)OC(C)CCCC 34a_100000766422_200011215066 [0,1,1,0,0,0|1,0,1]=4 4251 B11R0.72 C=CC(CC)OC(C)CCCC 7a_100000766422_200011215066 [0,1,1,0,0,0|1,0,1]=4 4252 B11R0.72 CCCCC(C)OC(CC)CC 7a_100000687866_100000210505 [0,1,1,0,0,0|1,0,1]=4 4253 B11R0.72 CCCCC(C)OC(CC)CC 7a_100000688536_200011215066 [0,1,1,0,0,0|1,0,1]=4 4254 B11R0.73 CCCCC(C)C(=O)C(=O)NC 1458a_100011218921_200011215066 [0,1,1,0,0,0|2,0,0]=4 4255 B11R0.73 CCCCN(C)C(C)C(=O)CC 2230a_100000207549_100000742827 [0,1,1,0,0,0|2,0,0]=4 4256 B11R0.73 CCCCN(C)C(C)C(=O)CC 269982a_100000207549_100000742827 [0,1,1,0,0,0|2,0,0]=4 4257 B11R0.83 CCCCC(C)NS(=O)(=O)CC 270084a_100000126638_100000211323 [0,1,1,0,0,0|2,0,0]=4 4258 B11R0.83 CCCCC(C)NS(=O)(=O)CC 274078a_100000126638_100000211323 [0,1,1,0,0,0|2,0,0]=4 4259 B11R0.83 CCCCC(C)NS(=O)(=O)CC 40a_100000126638_100000053943 [0,1,1,0,0,0|2,0,0]=4 4260 B11R0.83 CCCCC(C)OC(C)(C)CC 7a_100000210230_200011215066 [0,1,1,0,0,0|1,0,1]=4 4261 B11R0.83 CCCCC(C)OC(C)(C)CC 7a_100000687866_100000210677 [0,1,1,0,0,0|1,0,1]=4 4262 B11R0.93 CC(C)CCC(C)NC(=O)CO 240690a_100138410893_100000210174 [0,1,1,0,0,0|2,0,0]=4 4263 B11R0.93 CC(C)CCC(C)NC(=O)CO 527a_100138410893_100000210174 [0,1,1,0,0,0|2,0,0]=4 4264 B11R0.93 CCC(=O)CN(C)CCC(C)C 269982a_100000742789_100000747405 [0,1,1,0,0,0|2,0,0]=4 4265 B11R0.93 CCC(=O)NC(C)CCC(C)C 11a_100138410893_100000210414 [0,1,1,0,0,0|1,0,0]=3 4266 B11R0.93 CCC(=O)NC(C)CCC(C)C 1626a_100138410893_100000210414 [0,1,1,0,0,0|1,0,0]=3 4267 B11R0.93 CCC(=O)NC(C)CCC(C)C 240690a_100138410893_100000210414 [0,1,1,0,0,0|1,0,0]=3 4268 B11R0.93 CCC(=O)NC(C)CCC(C)C 527a_100138410893_100000210414 [0,1,1,0,0,0|1,0,0]=3 4269 B11R0.93 CCC(C)OC(C)CCC(C)C 34a_100011215350_100011215416 [0,1,1,0,0,0|1,0,1]=4 4270 B11R0.93 CCC(C)OC(C)CCC(C)C 7a_100011215350_100000758301 [0,1,1,0,0,0|1,0,1]=4 4271 B11R0.93 CNC(=O)NC(C)CCC(C)C 2708a_100102657272_100138410893 [0,1,1,0,0,0|2,0,0]=4 4272 B11R0.93 CNC(=O)NC(C)CCC(C)C 2708a_100138410893_106832991635 [0,1,1,0,0,0|2,0,0]=4 4273 B11R0.93 CNC(=O)NC(C)CCC(C)C 273464a_100138410893_100102657272 [0,1,1,0,0,0|2,0,0]=4 4274 B11R0.93 CNC(=O)NC(C)CCC(C)C 512a_100138410893_100102657272 [0,1,1,0,0,0|2,0,0]=4 4275 B11R0.93 CNC(=O)NC(C)CCC(C)C 512a_106832991638_100138410893 [0,1,1,0,0,0|2,0,0]=4 4276 B11R0.110 CCC(=O)CN(C)CC(C)CC 269982a_100000753921_100000747405 [0,1,1,0,0,0|2,0,0]=4 4277 B11R0.110 CCC(=O)NC(C)CC(C)CC 11a_100000763565_100000210414 [0,1,1,0,0,0|1,0,0]=3 4278 B11R0.110 CCC(=O)NC(C)CC(C)CC 1626a_100000763565_100000210414 [0,1,1,0,0,0|1,0,0]=3 4279 B11R0.110 CCC(=O)NC(C)CC(C)CC 240690a_100000763565_100000210414 [0,1,1,0,0,0|1,0,0]=3 4280 B11R0.110 CCC(=O)NC(C)CC(C)CC 527a_100000763565_100000210414 [0,1,1,0,0,0|1,0,0]=3 4281 B11R0.110 CCC(C)CC(C)NC(=O)CO 240690a_100000763565_100000210174 [0,1,1,0,0,0|2,0,0]=4 4282 B11R0.110 CCC(C)CC(C)NC(=O)CO 527a_100000763565_100000210174 [0,1,1,0,0,0|2,0,0]=4 4283 B11R0.110 CCC(C)CC(C)NC(=O)NC 2708a_100000763565_106832991635 [0,1,1,0,0,0|2,0,0]=4 4284 B11R0.110 CCC(C)CC(C)NC(=O)NC 2708a_100102657272_100000763565 [0,1,1,0,0,0|2,0,0]=4 4285 B11R0.110 CCC(C)CC(C)NC(=O)NC 273464a_100000763565_100102657272 [0,1,1,0,0,0|2,0,0]=4 4286 B11R0.110 CCC(C)CC(C)NC(=O)NC 273464a_100102657272_100000763565 [0,1,1,0,0,0|2,0,0]=4 4287 B11R0.110 CCC(C)CC(C)NC(=O)NC 512a_100000763565_100102657272 [0,1,1,0,0,0|2,0,0]=4 4288 B11R0.110 CCC(C)CC(C)NC(=O)NC 512a_106832991638_100000763565 [0,1,1,0,0,0|2,0,0]=4 4289 B11R0.154 CCC(=O)CN(C)CCCCO 269982a_100000717598_100000747405 [0,1,1,0,0,0|2,0,0]=4 4290 B11R0.154 CCC(=O)CN(C)CCCOC 269982a_100000224831_100000747405 [0,1,1,0,0,0|2,0,0]=4 4291 B11R0.154 CCC(C)OC(C)CCCOC 34a_200011539412_100011215416 [0,1,1,0,0,0|1,0,1]=4 4292 B11R0.154 CCC(C)OC(C)CCCOC 7a_200011539412_100000758301 [0,1,1,0,0,0|1,0,1]=4 4293 B11R0.154 CCCCCC(C)NC(=O)CC 11a_100000211957_100000210414 [0,1,1,0,0,0|1,0,0]=3 4294 B11R0.154 CCCCCC(C)NC(=O)CC 1626a_100000211957_100000210414 [0,1,1,0,0,0|1,0,0]=3 4295 B11R0.154 CCCCCC(C)NC(=O)CC 240690a_100000211957_100000210414 [0,1,1,0,0,0|1,0,0]=3 4296 B11R0.154 CCCCCC(C)NC(=O)CC 527a_100000211957_100000210414 [0,1,1,0,0,0|1,0,0]=3 4297 B11R0.154 CCCCCC(C)NC(=O)CO 240690a_100000211957_100000210174 [0,1,1,0,0,0|2,0,0]=4 4298 B11R0.154 CCCCCC(C)NC(=O)CO 527a_100000211957_100000210174 [0,1,1,0,0,0|2,0,0]=4 4299 B11R0.154 CCCCCC(C)NC(=O)NC 2708a_100000211957_106832991635 [0,1,1,0,0,0|2,0,0]=4 4300 B11R0.154 CCCCCC(C)NC(=O)NC 2708a_100102657272_100000211957 [0,1,1,0,0,0|2,0,0]=4 4301 B11R0.154 CCCCCC(C)NC(=O)NC 273464a_100000211957_100102657272 [0,1,1,0,0,0|2,0,0]=4 4302 B11R0.154 CCCCCC(C)NC(=O)NC 273464a_100102657272_100000211957 [0,1,1,0,0,0|2,0,0]=4 4303 B11R0.154 CCCCCC(C)NC(=O)NC 512a_100000211957_100102657272 [0,1,1,0,0,0|2,0,0]=4 4304 B11R0.154 CCCCCC(C)NC(=O)NC 512a_106832991638_100000211957 [0,1,1,0,0,0|2,0,0]=4 4305 B11R0.154 CCCCCC(C)OC(C)CC 34a_100011215632_100011215416 [0,1,1,0,0,0|1,0,1]=4 4306 B11R0.154 CCCCCC(C)OC(C)CC 7a_100000210228_200011218191 [0,1,1,0,0,0|1,0,1]=4 4307 B11R0.154 CCCCCC(C)OC(C)CC 7a_100011215632_100000758301 [0,1,1,0,0,0|1,0,1]=4 4308 B11R0.154 CCCCCN(C)CC(=O)CC 269982a_100000223495_100000747405 [0,1,1,0,0,0|2,0,0]=4 4309 B11R0.154 CCCCNC(C)CC(=O)OC 2230a_100000102301_100009817358 [0,1,1,0,0,0|2,0,0]=4 4310 B11R0.154 CCCCNC(C)CC(=O)OC 7a_106832991798_100009817358 [0,1,1,0,0,0|2,0,0]=4 4311 B11R0.154 CCCCOC(C)CC(=O)OC 34a_100000210227_100009817358 [0,1,1,0,0,0|2,0,0]=4 4312 B11R0.154 CCCCOC(C)CC(=O)OC 7a_100000210227_100009817358 [0,1,1,0,0,0|2,0,0]=4 4313 B11R0.154 CCCCSC(C)CC(=O)OC 62a_100000210211_100009817358 [0,1,1,0,0,0|2,0,0]=4 4314 B11R0.154 CCCCSC(C)CC(=O)OC 62a_100009817358_100000210210 [0,1,1,0,0,0|2,0,0]=4 4315 B11R0.163 C=C(C)C(=O)NC(C)CCCC 11a_100000126638_100000185857 [0,1,1,0,0,0|1,0,1]=4 4316 B11R0.163 C=C(C)C(=O)NC(C)CCCC 1626a_100000126638_100000185857 [0,1,1,0,0,0|1,0,1]=4 4317 B11R0.163 CCCCC(C)NC(=O)C(C)C 11a_100000126638_100000210198 [0,1,1,0,0,0|1,0,0]=3 4318 B11R0.163 CCCCC(C)NC(=O)C(C)C 1626a_100000126638_100000210198 [0,1,1,0,0,0|1,0,0]=3 4319 B11R0.163 CCCCC(C)NC(=O)C(C)C 240690a_100000126638_100000210198 [0,1,1,0,0,0|1,0,0]=3 4320 B11R0.163 CCCCC(C)NC(=O)C(C)C 527a_100000126638_100000210198 [0,1,1,0,0,0|1,0,0]=3 4321 B11R0.163 CCCCC(C)NC(=O)C(C)F 11a_100000126638_100000062450 [0,1,1,0,0,0|1,0,0]=3 4322 B11R0.163 CCCCC(C)NC(=O)C(C)F 1626a_100000126638_100000062450 [0,1,1,0,0,0|1,0,0]=3 4323 B11R0.163 CCCCC(C)NC(=O)C(C)F 240690a_100000126638_100000062450 [0,1,1,0,0,0|1,0,0]=3 4324 B11R0.163 CCCCC(C)NC(=O)C(C)F 527a_100000126638_100000062450 [0,1,1,0,0,0|1,0,0]=3 4325 B11R0.163 CCCCC(C)NC(=O)C(F)F 11a_100000126638_100000210393 [0,1,1,0,0,0|2,0,0]=4 4326 B11R0.163 CCCCC(C)NC(=O)C(F)F 1626a_100000126638_100000210393 [0,1,1,0,0,0|2,0,0]=4 4327 B11R0.163 CCCCC(C)NC(=O)C(F)F 240690a_100000126638_100000210393 [0,1,1,0,0,0|2,0,0]=4 4328 B11R0.163 CCCCC(C)NC(=O)C(F)F 527a_100000126638_100000210393 [0,1,1,0,0,0|2,0,0]=4 4329 B11R0.163 CCCCC(C)NC(=O)C(O)O 240690a_100000126638_100000233687 [0,1,1,0,0,0|2,0,0]=4 4330 B11R0.163 CCCCC(C)NC(=O)N(C)C 2708a_100000126638_100102631434 [0,1,1,0,0,0|2,0,0]=4 4331 B11R0.163 CCCCC(C)NC(=O)[C@@H](C)O 240690a_100000126638_100000717761 [0,1,1,0,0,0|1,0,0]=3 4332 B11R0.163 CCCCC(C)NC(=O)[C@H](C)O 1626a_100000126638_217856618621 [0,1,1,0,0,0|1,0,0]=3 4333 B11R0.163 CCCCC(C)NC(=O)[C@H](C)O 240690a_100000126638_217856618621 [0,1,1,0,0,0|1,0,0]=3 4334 B11R0.163 CCCCC(C)OC(C)C(C)C 7a_100000748068_200011215066 [0,1,1,0,0,0|1,0,1]=4 4335 B11R0.163 CCCCN(C)CC(=O)C(C)C 2230a_100000207549_100000753385 [0,1,1,0,0,0|2,0,0]=4 4336 B11R0.163 CCCCN(C)CC(=O)C(C)C 269982a_100000207549_100000753385 [0,1,1,0,0,0|2,0,0]=4 4337 B11R0.166 CCC(=O)N[C@H](CO)CCSC 240690a_100011827619_100000210414 [0,1,1,0,0,0|2,0,0]=4 4338 B11R0.166 CCC(=O)N[C@H](CO)CCSC 527a_100011827619_100000210414 [0,1,1,0,0,0|2,0,0]=4 4339 B11R0.166 CCCCC(CC)CC(=O)CC 1458a_100000210414_100000211942 [0,1,1,0,0,0|1,0,0]=3 4340 B11R0.166 CCCCC(CC)CC(=O)CO 1458a_100000210174_100000211942 [0,1,1,0,0,0|2,0,0]=4 4341 B11R0.166 CCCCC(CC)OC(C)CC 34a_100011215227_100011215416 [0,1,1,0,0,0|1,0,1]=4 4342 B11R0.166 CCCCC(CC)OC(C)CC 7a_100000210228_200011216223 [0,1,1,0,0,0|1,0,1]=4 4343 B11R0.166 CCCCC(CC)OC(C)CC 7a_100011215227_100000758301 [0,1,1,0,0,0|1,0,1]=4 4344 B11R0.166 CCCCN(CC)CC(=O)CC 269982a_100000207695_100000747405 [0,1,1,0,0,0|2,0,0]=4 4345 B11R0.166 CCCC[C@@H](CO)NC(=O)CC 240690a_100011934283_100000210414 [0,1,1,0,0,0|1,0,0]=3 4346 B11R0.166 CCCC[C@@H](CO)NC(=O)CC 527a_100011934283_100000210414 [0,1,1,0,0,0|1,0,0]=3 4347 B11R0.166 CCCC[C@@H](CO)NC(=O)CO 240690a_100011934283_100000210174 [0,1,1,0,0,0|2,0,0]=4 4348 B11R0.166 CCCC[C@@H](CO)NC(=O)CO 527a_100011934283_100000210174 [0,1,1,0,0,0|2,0,0]=4 4349 B11R0.166 CCCC[C@@H](CO)NC(=O)NC 2708a_100102657272_100011934283 [0,1,1,0,0,0|2,0,0]=4 4350 B11R0.166 CCCC[C@@H](CO)NC(=O)NC 273464a_100011934283_100102657272 [0,1,1,0,0,0|2,0,0]=4 4351 B11R0.166 CCCC[C@@H](CO)NC(=O)NC 273464a_100102657272_100011934283 [0,1,1,0,0,0|2,0,0]=4 4352 B11R0.166 CCCC[C@@H](CO)NC(=O)NC 512a_100011934283_100102657272 [0,1,1,0,0,0|2,0,0]=4 4353 B11R0.166 CCCC[C@@H](CO)NC(=O)NC 512a_106832991638_100011934283 [0,1,1,0,0,0|2,0,0]=4 4354 B11R0.246 CCCCC(C)(C)OC(C)CC 7a_100011219641_100000758301 [0,1,1,0,0,0|1,0,1]=4 4355 B11R0.246 CCCC[Si](C)(C)CC(=O)CC 1458a_100000210414_200000073895 [0,1,1,0,0,0|1,1,0]=4 4356 B11R0.47 CCCCC(CCC)OC(C)C 34a_100000212225_100000211913 [0,1,1,0,0,0|1,0,1]=4 4357 B11R0.47 CCCCC(CCC)OC(C)C 34a_100011215800_100000210206 [0,1,1,0,0,0|1,0,1]=4 4358 B11R0.47 CCCCC(CCC)OC(C)C 7a_100011215800_100000210206 [0,1,1,0,0,0|1,0,1]=4 4359 B11R0.56 CCCC(=O)C(CC)NC(=O)C 1458a_100000195128_100000210303 [0,1,1,0,0,0|1,0,1]=4 4360 B11R0.56 CCCC(C)C(CC)OC(C)C 34a_200011218412_100000210206 [0,1,1,0,0,0|1,0,1]=4 4361 B11R0.56 CCCC(C)C(CC)OC(C)C 7a_200011218412_100000210206 [0,1,1,0,0,0|1,0,1]=4 4362 B11R0.77 CCCCCC(CC)OC(C)C 34a_100011215405_100000210206 [0,1,1,0,0,0|1,0,1]=4 4363 B11R0.77 CCCCCC(CC)OC(C)C 7a_100011215405_100000210206 [0,1,1,0,0,0|1,0,1]=4 4364 B11R0.77 CCCCN[C@H](CC)CC(=O)O 269956a_100016995926_100000210211 [0,1,1,0,0,0|2,0,0]=4 4365 B11R0.91 CCC(C)CC(CC)OC(C)C 7a_200011216566_100000210206 [0,1,1,0,0,0|1,0,1]=4 4366 B11R0.143 CCC(CCC(C)C)OC(C)C 34a_100011216567_100000210206 [0,1,1,0,0,0|1,0,1]=4 4367 B11R0.143 CCC(CCC(C)C)OC(C)C 7a_100011216567_100000210206 [0,1,1,0,0,0|1,0,1]=4 4368 B11R0.160 CCCCC(NC(=O)C)C(=O)C 1458a_100000194794_200000210301 [0,1,1,0,0,0|1,0,1]=4 4369 B11R0.160 CCCCC(NC(=O)C)C(=O)[13CH3] 1458a_100000194794_200025704644 [0,1,1,0,0,0|1,0,1]=4 4370 B11R0.162 C=C(C)C(=O)C(CC)CCCC 1458a_100000185857_200011216223 [0,1,1,0,0,0|2,0,0]=4 4371 B11R0.162 CCCCN(CC)C(C)C(=O)C 2230a_100000207695_100009814033 [0,1,1,0,0,0|2,0,0]=4 4372 B11R0.162 CCCCN(CC)C(C)C(=O)C 269982a_100000207695_100009814033 [0,1,1,0,0,0|2,0,0]=4 4373 B11R0.190 CCCCC(CC)OC(C)(C)C 34a_100011215227_100000210625 [0,1,1,0,0,0|1,0,1]=4 4374 B11R0.190 CCCCC(CC)OC(C)(C)C 34a_100015890283_200011216223 [0,1,1,0,0,0|1,0,1]=4 4375 B11R0.190 CCCCC(CC)OC(C)(C)C 7a_100015890283_200011216223 [0,1,1,0,0,0|1,0,1]=4 4376 B11R0.216 CCCCC(C)(CC)OC(C)C 7a_200011218725_100000210206 [0,1,1,0,0,0|1,0,1]=4 4377 B11R0.38 C=CC(=O)C(CCC)CCCC 1458a_100000185746_100000211913 [0,1,1,0,0,0|2,0,0]=4 4378 B11R0.38 CCCCN(CC=O)C(C)CC 2230a_100000207357_200015260668 [0,1,1,0,0,0|2,0,0]=4 4379 B11R0.38 CCCCN(CC=O)C(C)CC 269982a_100000207357_200015260668 [0,1,1,0,0,0|2,0,0]=4 4380 B11R0.80 C/C=C/C(CCC)OCCCC 34a_200016264281_100000210210 [0,1,1,0,0,0|2,0,0]=4 4381 B11R0.80 C/C=C/C(CCC)OCCCC 7a_200016264281_100000210211 [0,1,1,0,0,0|2,0,0]=4 4382 B11R0.80 C=CCC(CCC)OCCCC 34a_100011215139_100000210210 [0,1,1,0,0,0|2,0,0]=4 4383 B11R0.80 C=CCC(CCC)OCCCC 7a_100011215139_100000210211 [0,1,1,0,0,0|2,0,0]=4 4384 B11R0.80 CCCCCC(CCC)OCC 34a_200011215058_100000210202 [0,1,1,0,0,0|1,0,1]=4 4385 B11R0.80 CCCCCC(CCC)OCC 7a_200011215058_100000210202 [0,1,1,0,0,0|1,0,1]=4 4386 B11R0.80 CCCCCC(CCC)OCF 34a_200011215058_100015361967 [0,1,1,0,0,0|1,0,1]=4 4387 B11R0.80 CCCCCC(CCC)OCF 7a_200011215058_100015361967 [0,1,1,0,0,0|1,0,1]=4 4388 B11R0.80 CCCCCN(CC=O)CCC 2230a_200000226819_200015260668 [0,1,1,0,0,0|2,0,0]=4 4389 B11R0.80 CCCCCN(CC=O)CCC 269982a_200000226819_200015260668 [0,1,1,0,0,0|2,0,0]=4 4390 B11R0.158 C#CCOC(CCC)CCCC 34a_100000210247_100000211913 [0,1,1,0,0,0|1,0,1]=4 4391 B11R0.158 C#CCOC(CCC)CCCC 34a_100011215800_100000184674 [0,1,1,0,0,0|1,0,1]=4 4392 B11R0.158 C#CCOC(CCC)CCCC 7a_100011215800_100000038162 [0,1,1,0,0,0|1,0,1]=4 4393 B11R0.158 C=CCC(CCCC)OCC=O 34a_200011216941_200009817547 [0,1,1,0,0,0|0,0,2]=4 4394 B11R0.158 C=CCC(CCCC)OCC=O 7a_200011216941_200015260668 [0,1,1,0,0,0|0,0,2]=4 4395 B11R0.158 C=CCC(CCCC)OCCC 34a_200011216941_100000210303 [0,1,1,0,0,0|2,0,0]=4 4396 B11R0.158 C=CCC(CCCC)OCCC 7a_200011216941_100000210303 [0,1,1,0,0,0|2,0,0]=4 4397 B11R0.158 C=CCOC(CCC)CCCC 34a_100011215800_100015514636 [0,1,1,0,0,0|1,0,0]=3 4398 B11R0.158 C=CCOC(CCC)CCCC 34a_200000210373_100000211913 [0,1,1,0,0,0|1,0,0]=3 4399 B11R0.158 C=CCOC(CCC)CCCC 7a_100011215800_100015514636 [0,1,1,0,0,0|1,0,0]=3 4400 B11R0.158 C=CCSC(CCC)CCCC 62a_100000210623_100000211913 [0,1,1,0,0,0|1,1,0]=4 4401 B11R0.158 C=CCSC(CCC)CCCC 62a_100000211913_100000210623 [0,1,1,0,0,0|1,1,0]=4 4402 B11R0.158 CCCCC(CCC)OCC#N 7a_100011215800_100011215382 [0,1,1,0,0,0|1,0,1]=4 4403 B11R0.158 CCCCC(CCC)OCC=O 34a_100011215800_200009817547 [0,1,1,0,0,0|0,0,0]=2 4404 B11R0.158 CCCCC(CCC)OCC=O 7a_100011215800_200015260668 [0,1,1,0,0,0|0,0,0]=2 4405 B11R0.158 CCCCC(CCC)OCCBr 34a_100000211926_100000211913 [0,1,1,0,0,0|1,0,1]=4 4406 B11R0.158 CCCCC(CCC)OCCC 34a_100000210258_100000211913 [0,1,1,0,0,0|1,0,1]=4 4407 B11R0.158 CCCCC(CCC)OCCC 34a_100011215800_100000210303 [0,1,1,0,0,0|1,0,1]=4 4408 B11R0.158 CCCCC(CCC)OCCC 7a_100011215800_100000210303 [0,1,1,0,0,0|1,0,1]=4 4409 B11R0.158 CCCCC(CCC)OCCF 34a_100011215800_100011217306 [0,1,1,0,0,0|1,0,1]=4 4410 B11R0.158 CCCCC(CCC)OCCF 7a_100011215800_100011217306 [0,1,1,0,0,0|1,0,1]=4 4411 B11R0.158 CCCCC(CCC)OCCN 34a_100000210304_100000211913 [0,1,1,0,0,0|1,0,1]=4 4412 B11R0.158 CCCCC(CCC)OCCO 34a_100011215800_100000211926 [0,1,1,0,0,0|0,0,2]=4 4413 B11R0.158 CCCCC(CCC)OCCO 7a_100011215800_100000211926 [0,1,1,0,0,0|0,0,2]=4 4414 B11R0.158 CCCCC(CCC)OCSC 34a_100011215800_100011218213 [0,1,1,0,0,0|0,1,1]=4 4415 B11R0.158 CCCCC(CCC)SCC=O 62a_100000211913_200015260668 [0,1,1,0,0,0|0,1,0]=3 4416 B11R0.158 CCCCC(CCC)SCC=O 62a_200015260668_100000211913 [0,1,1,0,0,0|0,1,0]=3 4417 B11R0.158 CCCCC(CCCC)OCC 34a_200011215786_100000210202 [0,1,1,0,0,0|1,0,1]=4 4418 B11R0.158 CCCCC(CCCC)OCC 7a_200011215786_100000210202 [0,1,1,0,0,0|1,0,1]=4 4419 B11R0.158 CCCCC(CCCC)OCF 34a_200011215786_100015361967 [0,1,1,0,0,0|1,0,1]=4 4420 B11R0.158 CCCCC(CCCC)OCF 7a_200011215786_100015361967 [0,1,1,0,0,0|1,0,1]=4 4421 B11R0.158 CCCCN(CC=O)CCCC 2230a_100000684618_200015260668 [0,1,1,0,0,0|2,0,0]=4 4422 B11R0.158 CCCCN(CC=O)CCCC 269982a_100000684618_200015260668 [0,1,1,0,0,0|2,0,0]=4 4423 B11R0.158 CCCCN(CC=O)CCOC 2230a_100000207391_200015260668 [0,1,1,0,0,0|2,0,0]=4 4424 B11R0.158 CCCCN(CC=O)CCOC 269982a_100000207391_200015260668 [0,1,1,0,0,0|2,0,0]=4 4425 B11R0.11 C=CCCC(=O)C(O)CCCC 1458a_100000720857_100000754431 [0,1,1,0,0,0|1,0,1]=4 4426 B11R0.140 CCCCCN(C)CCCC=O 2230a_100000223495_200011292268 [0,1,1,0,0,0|2,0,0]=4 4427 B11R0.140 CCCCCN(C)CCCC=O 269982a_100000223495_200011292268 [0,1,1,0,0,0|2,0,0]=4 4428 B11R0.140 CN(CCCC=O)CCCCO 2230a_100000717598_200011292268 [0,1,1,0,0,0|2,0,0]=4 4429 B11R0.140 CN(CCCC=O)CCCCO 269982a_100000717598_200011292268 [0,1,1,0,0,0|2,0,0]=4 4430 B11R0.140 COCCCN(C)CCCC=O 2230a_100000224831_200011292268 [0,1,1,0,0,0|2,0,0]=4 4431 B11R0.140 COCCCN(C)CCCC=O 269982a_100000224831_200011292268 [0,1,1,0,0,0|2,0,0]=4 4432 B11R0.140 NCCCC[C@H](N)COCC=O 34a_100016993712_200009817547 [0,1,1,0,0,0|2,0,0]=4 4433 B11R0.152 C=CCCN[C@H](CO)CCCC 2230a_100011934283_100000754431 [0,1,1,0,0,0|2,0,0]=4 4434 B11R0.152 C=CCCN[C@H](CO)CCCC 34a_100011934283_100000754431 [0,1,1,0,0,0|2,0,0]=4 4435 B11R0.152 CCCCC(CC)CNCC=O 2230a_100000209976_200015260668 [0,1,1,0,0,0|2,0,0]=4 4436 B11R0.152 CCCCC(CC)COCC=O 34a_100000210273_200009817547 [0,1,1,0,0,0|2,0,0]=4 4437 B11R0.152 CCCCC(CC)COCC=O 7a_100000210273_200015260668 [0,1,1,0,0,0|2,0,0]=4 4438 B11R0.152 CCCCC(CC)CSCC=O 62a_100000211942_200015260668 [0,1,1,0,0,0|2,0,0]=4 4439 B11R0.152 CCCCC(CC)CSCC=O 62a_200015260668_100000211942 [0,1,1,0,0,0|2,0,0]=4 4440 B11R0.152 CCCCN(CC)CCCC=O 2230a_100000207695_200011292268 [0,1,1,0,0,0|2,0,0]=4 4441 B11R0.152 CCCCN(CC)CCCC=O 269982a_100000207695_200011292268 [0,1,1,0,0,0|2,0,0]=4 4442 B11R0.321 CCCCC(C)(C)COCC=O 7a_200011995781_200015260668 [0,1,1,0,0,0|2,0,0]=4 4443 B11R1.13 CN1C(=O)CCCC1CN[13CH3] 2230a_200010383782_200025704644 [1,1,0,0,0,0|2,0,0]=4 4444 B11R1.13 CN1C(=O)CCCC1CN[13CH3] 34a_200010383782_200025704644 [1,1,0,0,0,0|2,0,0]=4 4445 B11R1.13 CNCC1CCCC(=O)N1C 2230a_200010383782_200000210301 [1,1,0,0,0,0|2,0,0]=4 4446 B11R1.13 CNCC1CCCC(=O)N1C 34a_200010383782_200000210301 [1,1,0,0,0,0|2,0,0]=4 4447 B11R1.23 CCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000210202 [1,1,0,0,0,0|1,0,1]=4 4448 B11R1.157 CC(C)OC1CCCC(=O)C1 34a_100012613340_100000210206 [1,1,0,0,0,0|2,0,0]=4 4449 B11R1.16 CCCC(=O)C1C=CCCC1 1458a_100000211992_100000751183 [1,1,0,0,0,0|1,0,1]=4 4450 B11R1.16 CCCC(=O)C1CCCCO1 1458a_100000748299_100000210303 [1,1,0,0,0,0|0,0,2]=4 4451 B11R1.16 CCCN(C)C1C=CCCC1 2230a_100000747261_100000751183 [1,1,0,0,0,0|2,0,0]=4 4452 B11R1.16 CCCN(C)C1C=CCCC1 269982a_100000747261_100000751183 [1,1,0,0,0,0|2,0,0]=4 4453 B11R1.28 BrCCOCC1CCCCO1 34a_100000211926_100000211543 [1,1,0,0,0,0|1,0,1]=4 4454 B11R1.28 CCCCNC1C=CCCC1 2230a_100000102301_100000751183 [1,1,0,0,0,0|1,0,0]=3 4455 B11R1.28 CCCCNC1C=CCCC1 7a_106832991798_100000751183 [1,1,0,0,0,0|1,0,0]=3 4456 B11R1.28 CCCCNC1CCCCC1 2230a_100000182618_100000210211 [1,1,0,0,0,0|1,0,1]=4 4457 B11R1.28 CCCCNC1CCCCC1 270004a_100000102301_100000210434 [1,1,0,0,0,0|1,0,1]=4 4458 B11R1.28 CCCCNC1CCCCC1 34a_100000182618_100000210210 [1,1,0,0,0,0|1,0,1]=4 4459 B11R1.28 CCCCNC1CCCCC1 7a_106832991798_100000210327 [1,1,0,0,0,0|1,0,1]=4 4460 B11R1.28 CCCCNC1CCCOC1 2230a_100000719290_100000210211 [1,1,0,0,0,0|2,0,0]=4 4461 B11R1.28 CCCCNC1CCCOC1 270004a_100000102301_100000753404 [1,1,0,0,0,0|2,0,0]=4 4462 B11R1.28 CCCCNC1CCCOC1 34a_100000719290_100000210210 [1,1,0,0,0,0|2,0,0]=4 4463 B11R1.28 CCCCNC1CCCOC1 7a_106832991798_100000693364 [1,1,0,0,0,0|2,0,0]=4 4464 B11R1.28 CCCCNC1CCCSC1 270004a_100000102301_100000057913 [1,1,0,0,0,0|2,0,0]=4 4465 B11R1.28 CCCCOC1C=CCCC1 34a_100011215024_100000210210 [1,1,0,0,0,0|1,0,0]=3 4466 B11R1.28 CCCCOC1C=CCCC1 7a_100000210227_100000751183 [1,1,0,0,0,0|1,0,0]=3 4467 B11R1.28 CCCCOC1CC=CCC1 34a_100000073881_100000210210 [1,1,0,0,0,0|1,0,1]=4 4468 B11R1.28 CCCCOC1CCCCC1 34a_100000210227_100000210327 [1,1,0,0,0,0|1,0,1]=4 4469 B11R1.28 CCCCOC1CCCCC1 34a_100000210231_100000210210 [1,1,0,0,0,0|1,0,1]=4 4470 B11R1.28 CCCCOC1CCCCC1 7a_100000210227_100000210327 [1,1,0,0,0,0|1,0,1]=4 4471 B11R1.28 CCCCOC1CCCCC1 7a_100000210231_100000210211 [1,1,0,0,0,0|1,0,1]=4 4472 B11R1.28 CCCCOC1CCCCO1 34a_100000033831_100000210210 [1,1,0,0,0,0|0,0,1]=3 4473 B11R1.28 CCCCOC1CCCOC1 34a_100000210227_100000693364 [1,1,0,0,0,0|2,0,0]=4 4474 B11R1.28 CCCCOC1CCCOC1 34a_100000754041_100000210210 [1,1,0,0,0,0|2,0,0]=4 4475 B11R1.28 CCCCOC1CCCOC1 7a_100000210227_100000693364 [1,1,0,0,0,0|2,0,0]=4 4476 B11R1.28 CCCCOC1CCCSC1 7a_100015962668_100000210211 [1,1,0,0,0,0|2,0,0]=4 4477 B11R1.28 CCCCSC1C=CCCC1 62a_100000210211_100000751183 [1,1,0,0,0,0|1,0,0]=3 4478 B11R1.28 CCCCSC1C=CCCC1 62a_100000751183_100000210210 [1,1,0,0,0,0|1,0,0]=3 4479 B11R1.28 CCCCSC1CCCCC1 62a_100000210211_100000210327 [1,1,0,0,0,0|1,0,1]=4 4480 B11R1.28 CCCCSC1CCCCC1 62a_100000210327_100000210210 [1,1,0,0,0,0|1,0,1]=4 4481 B11R1.28 CCCCSC1CCCOC1 62a_100000210211_100000693364 [1,1,0,0,0,0|2,0,0]=4 4482 B11R1.28 CCCNCC1CC=CCC1 270004a_100020643023_100000189434 [1,1,0,0,0,0|1,0,1]=4 4483 B11R1.28 CCCNCC1CCCCC1 2230a_100000210473_100000210303 [1,1,0,0,0,0|1,0,1]=4 4484 B11R1.28 CCCNCC1CCCCC1 269862a_100020643023_100000211278 [1,1,0,0,0,0|1,0,1]=4 4485 B11R1.28 CCCNCC1CCCCC1 34a_100000210473_100000210303 [1,1,0,0,0,0|1,0,1]=4 4486 B11R1.28 CCCNCC1CCCCO1 2230a_100000174945_100000210303 [1,1,0,0,0,0|0,0,1]=3 4487 B11R1.28 CCCNCC1CCCCO1 34a_100000174945_100000210303 [1,1,0,0,0,0|0,0,1]=3 4488 B11R1.28 CCCNCC1CCCOC1 2230a_100000720124_100000210303 [1,1,0,0,0,0|2,0,0]=4 4489 B11R1.28 CCCNCC1CCCOC1 34a_100000720124_100000210303 [1,1,0,0,0,0|2,0,0]=4 4490 B11R1.28 CCCNC[C@H]1COCCO1 2230a_100010981119_100000210303 [1,1,0,0,0,0|1,0,1]=4 4491 B11R1.28 CCCNC[C@H]1COCCO1 34a_100010981119_100000210303 [1,1,0,0,0,0|1,0,1]=4 4492 B11R1.28 CCCOCC1CC=CCC1 34a_100000210713_100000210303 [1,1,0,0,0,0|1,0,1]=4 4493 B11R1.28 CCCOCC1CCC=CO1 34a_100011217868_100000210303 [1,1,0,0,0,0|0,0,1]=3 4494 B11R1.28 CCCOCC1CCCCC1 34a_100000210258_100000211423 [1,1,0,0,0,0|1,0,1]=4 4495 B11R1.28 CCCOCC1CCCCC1 34a_100000212181_100000210303 [1,1,0,0,0,0|1,0,1]=4 4496 B11R1.28 CCCOCC1CCCCC1 7a_100000212181_100000210303 [1,1,0,0,0,0|1,0,1]=4 4497 B11R1.28 CCCOCC1CCCCN1 34a_100000210821_100000210303 [1,1,0,0,0,0|1,0,1]=4 4498 B11R1.28 CCCOCC1CCCCO1 34a_100000210258_100000211543 [1,1,0,0,0,0|0,0,1]=3 4499 B11R1.28 CCCOCC1CCCCO1 34a_100000211370_100000210303 [1,1,0,0,0,0|0,0,1]=3 4500 B11R1.28 CCCOCC1CCCCO1 7a_100000211370_100000210303 [1,1,0,0,0,0|0,0,1]=3 4501 B11R1.28 CCCOCC1CCCNC1 34a_100000211344_100000210303 [1,1,0,0,0,0|2,0,0]=4 4502 B11R1.28 CCCOCC1CCCOC1 34a_100000210258_100000741521 [1,1,0,0,0,0|2,0,0]=4 4503 B11R1.28 CCCOCC1CCCOC1 34a_100000741520_100000210303 [1,1,0,0,0,0|2,0,0]=4 4504 B11R1.28 CCCOC[C@@H]1CNCCO1 34a_100015189573_100000210303 [1,1,0,0,0,0|1,0,1]=4 4505 B11R1.28 CCCOC[C@H]1COCCO1 34a_100009875890_100000210303 [1,1,0,0,0,0|1,0,1]=4 4506 B11R1.28 CCCSCC1CCCCC1 62a_100000210303_100000211423 [1,1,0,0,0,0|1,0,1]=4 4507 B11R1.28 CCCSCC1CCCCC1 62a_100000211423_100000210303 [1,1,0,0,0,0|1,0,1]=4 4508 B11R1.28 CCCSCC1CCCCO1 62a_100000210303_100000211543 [1,1,0,0,0,0|0,0,1]=3 4509 B11R1.28 CCCSCC1CCCCO1 62a_100000211543_100000210303 [1,1,0,0,0,0|0,0,1]=3 4510 B11R1.28 CCCSCC1CCCOC1 62a_100000210303_100000741521 [1,1,0,0,0,0|2,0,0]=4 4511 B11R1.28 CCCSCC1CCCOC1 62a_100000741521_100000210303 [1,1,0,0,0,0|2,0,0]=4 4512 B11R1.28 CCNCCC1CCCCC1 2230a_100000738074_100000210202 [1,1,0,0,0,0|1,0,1]=4 4513 B11R1.28 CCNCCC1CCCCC1 2230a_100015525214_100012355289 [1,1,0,0,0,0|1,0,1]=4 4514 B11R1.28 CCNCCC1CCCCC1 270004a_100015525214_100011713444 [1,1,0,0,0,0|1,0,1]=4 4515 B11R1.28 CCNCCC1CCCCC1 34a_100000738074_100000210202 [1,1,0,0,0,0|1,0,1]=4 4516 B11R1.28 CCNCCC1CCCCO1 2230a_100015183643_100000210202 [1,1,0,0,0,0|0,0,1]=3 4517 B11R1.28 CCNCCC1CCCCO1 34a_100015183643_100000210202 [1,1,0,0,0,0|0,0,1]=3 4518 B11R1.28 CCNCCC1OCCCO1 2230a_100015525214_100000764188 [1,1,0,0,0,0|1,0,1]=4 4519 B11R1.28 CCOCCC1CCCCC1 34a_100011217863_100000210202 [1,1,0,0,0,0|1,0,1]=4 4520 B11R1.28 CCOCCC1CCCCC1 34a_100121572206_100011209188 [1,1,0,0,0,0|1,0,1]=4 4521 B11R1.28 CCOCCC1CCCCC1 7a_100011217863_100000210202 [1,1,0,0,0,0|1,0,1]=4 4522 B11R1.28 CCOCCC1CCCCN1 34a_100000211664_100000210202 [1,1,0,0,0,0|1,0,1]=4 4523 B11R1.28 CCOCCC1CCCNC1 34a_100000752241_100000210202 [1,1,0,0,0,0|2,0,0]=4 4524 B11R1.28 CCOCCC1OCCCO1 34a_100121572206_100000764188 [1,1,0,0,0,0|1,0,1]=4 4525 B11R1.28 CCOCSC1C=CCCC1 62a_100000739092_100000751183 [1,1,0,0,0,0|2,0,0]=4 4526 B11R1.28 CCOCSC1C=CCCC1 62a_100000751183_100000739092 [1,1,0,0,0,0|2,0,0]=4 4527 B11R1.28 CCSCCC1CCCCC1 62a_100000210202_100012355289 [1,1,0,0,0,0|1,0,1]=4 4528 B11R1.28 CCSCCC1CCCCC1 62a_100012355289_100000210202 [1,1,0,0,0,0|1,0,1]=4 4529 B11R1.28 CCSCCC1OCCCO1 62a_100000210202_100000764188 [1,1,0,0,0,0|1,0,1]=4 4530 B11R1.28 CCSCCC1OCCCO1 62a_100000764188_100000210202 [1,1,0,0,0,0|1,0,1]=4 4531 B11R1.28 CNCCCC1CCCCC1 2230a_100011211642_200000210301 [1,1,0,0,0,0|1,0,1]=4 4532 B11R1.28 CNCCCC1CCCCC1 2230a_106832991635_100011713725 [1,1,0,0,0,0|1,0,1]=4 4533 B11R1.28 CNCCCC1CCCCC1 34a_100011211642_200000210301 [1,1,0,0,0,0|1,0,1]=4 4534 B11R1.28 CNCCCC1CCCCC1 34a_100102657272_100011713725 [1,1,0,0,0,0|1,0,1]=4 4535 B11R1.28 CNCCCC1CCCCC1 7a_106832991635_100011713725 [1,1,0,0,0,0|1,0,1]=4 4536 B11R1.28 CNCCOC1CCCCO1 2230a_106832991635_100000744793 [1,1,0,0,0,0|1,0,1]=4 4537 B11R1.28 CNCCOC1CCCCO1 34a_100102657272_100000744793 [1,1,0,0,0,0|1,0,1]=4 4538 B11R1.28 CNCCOC1CCCCO1 7a_106832991635_100000744793 [1,1,0,0,0,0|1,0,1]=4 4539 B11R1.28 COCCCC1CCCCC1 34a_100000198086_200000210301 [1,1,0,0,0,0|1,0,1]=4 4540 B11R1.28 COCCCC1CCCCC1 34a_100138415774_100011713725 [1,1,0,0,0,0|1,0,1]=4 4541 B11R1.28 COCCCC1CCCCC1 7a_100000198086_200000210301 [1,1,0,0,0,0|1,0,1]=4 4542 B11R1.28 COCCCC1CCCCN1 34a_100011934581_200000210301 [1,1,0,0,0,0|1,0,1]=4 4543 B11R1.28 COCCCC1CCCNC1 34a_100150707839_200000210301 [1,1,0,0,0,0|2,0,0]=4 4544 B11R1.28 COCCNC1C=CCCC1 2230a_100000209980_100000751183 [1,1,0,0,0,0|2,0,0]=4 4545 B11R1.28 COCCOC1C=CCCC1 34a_100011215024_100011201679 [1,1,0,0,0,0|2,0,0]=4 4546 B11R1.28 COCCOC1CCCCO1 34a_100000033831_100011201679 [1,1,0,0,0,0|1,0,1]=4 4547 B11R1.28 COCCOC1CCCCO1 34a_100000034223_200000210301 [1,1,0,0,0,0|1,0,1]=4 4548 B11R1.28 COCCOC1CCCCO1 34a_100138415774_100000744793 [1,1,0,0,0,0|1,0,1]=4 4549 B11R1.28 COCCOC1CCCCO1 7a_100000034223_200000210301 [1,1,0,0,0,0|1,0,1]=4 4550 B11R1.28 COCCSC1C=CCCC1 62a_100000233755_100000751183 [1,1,0,0,0,0|2,0,0]=4 4551 B11R1.28 COCCSC1C=CCCC1 62a_100000751183_100000233755 [1,1,0,0,0,0|2,0,0]=4 4552 B11R1.28 COCNCC1CCCCO1 2230a_100000174945_100000766300 [1,1,0,0,0,0|1,0,1]=4 4553 B11R1.28 COCSCC1CCCCO1 62a_100000211543_100000766300 [1,1,0,0,0,0|1,0,1]=4 4554 B11R1.28 COCSCC1CCCCO1 62a_100000766300_100000211543 [1,1,0,0,0,0|1,0,1]=4 4555 B11R1.28 CSCCCC1CCCCC1 62a_100011713725_200000210301 [1,1,0,0,0,0|1,0,1]=4 4556 B11R1.28 CSCCCC1CCCCC1 62a_200000210301_100011713725 [1,1,0,0,0,0|1,0,1]=4 4557 B11R1.28 CSCCNC1C=CCCC1 2230a_100020590264_100000751183 [1,1,0,0,0,0|2,0,0]=4 4558 B11R1.28 CSCCOC1C=CCCC1 34a_100011215024_100000212216 [1,1,0,0,0,0|2,0,0]=4 4559 B11R1.28 CSCCOC1C=CCCC1 7a_100000230434_100000751183 [1,1,0,0,0,0|2,0,0]=4 4560 B11R1.28 CSCCOC1CCCCO1 34a_100000033831_100000212216 [1,1,0,0,0,0|1,0,1]=4 4561 B11R1.28 CSCCOC1CCCCO1 62a_100000744793_200000210301 [1,1,0,0,0,0|1,0,1]=4 4562 B11R1.28 CSCCOC1CCCCO1 62a_200000210301_100000744793 [1,1,0,0,0,0|1,0,1]=4 4563 B11R1.28 CSCCSC1C=CCCC1 62a_100000212216_100000751183 [1,1,0,0,0,0|2,0,0]=4 4564 B11R1.28 CSCCSC1C=CCCC1 62a_100000751183_100000751147 [1,1,0,0,0,0|2,0,0]=4 4565 B11R1.28 CSCNCC1CCCCO1 2230a_100000174945_100011218213 [1,1,0,0,0,0|1,0,1]=4 4566 B11R1.28 CSCNCC1CCCCO1 34a_100000174945_100011218213 [1,1,0,0,0,0|1,0,1]=4 4567 B11R1.28 CSCOCC1CCC=CO1 34a_100011217868_100011218213 [1,1,0,0,0,0|1,0,1]=4 4568 B11R1.28 CSCOCC1CCCCO1 34a_100000211370_100011218213 [1,1,0,0,0,0|1,0,1]=4 4569 B11R1.28 CSCSCC1CCCCO1 62a_100000211543_100011218213 [1,1,0,0,0,0|1,0,1]=4 4570 B11R1.28 CSCSCC1CCCCO1 62a_100011218213_100000211543 [1,1,0,0,0,0|1,0,1]=4 4571 B11R1.28 FCCCNC1C=CCCC1 2230a_100015189416_100000751183 [1,1,0,0,0,0|2,0,0]=4 4572 B11R1.28 FCCCOC1C=CCCC1 34a_100011215024_100011934791 [1,1,0,0,0,0|2,0,0]=4 4573 B11R1.28 FCCCOC1CCCCO1 34a_100000033831_100011934791 [1,1,0,0,0,0|1,0,1]=4 4574 B11R1.28 FCCCSC1C=CCCC1 62a_100000751183_100011934791 [1,1,0,0,0,0|2,0,0]=4 4575 B11R1.28 FCCCSC1C=CCCC1 62a_100011934791_100000751183 [1,1,0,0,0,0|2,0,0]=4 4576 B11R1.28 FCCNCC1CCCCO1 2230a_100000174945_100011217306 [1,1,0,0,0,0|1,0,1]=4 4577 B11R1.28 FCCNCC1CCCCO1 34a_100000174945_100011217306 [1,1,0,0,0,0|1,0,1]=4 4578 B11R1.28 FCCNCC1CCCCO1 34a_100000724931_100000211543 [1,1,0,0,0,0|1,0,1]=4 4579 B11R1.28 FCCOCC1CCC=CO1 34a_100011217868_100011217306 [1,1,0,0,0,0|1,0,1]=4 4580 B11R1.28 FCCOCC1CCCCO1 34a_100000211370_100011217306 [1,1,0,0,0,0|1,0,1]=4 4581 B11R1.28 FCCOCC1CCCCO1 7a_100000211370_100011217306 [1,1,0,0,0,0|1,0,1]=4 4582 B11R1.28 FCCSCC1CCCCO1 62a_100000211543_100011217306 [1,1,0,0,0,0|1,0,1]=4 4583 B11R1.28 FCCSCC1CCCCO1 62a_100011217306_100000211543 [1,1,0,0,0,0|1,0,1]=4 4584 B11R1.28 FCNCCC1CCCCO1 34a_100015183643_100015361967 [1,1,0,0,0,0|1,0,1]=4 4585 B11R1.28 NCCOCC1CCCCO1 34a_100000210304_100000211543 [1,1,0,0,0,0|1,0,1]=4 4586 B11R1.28 OCCCOC1C=CCCC1 34a_100011215024_100000230001 [1,1,0,0,0,0|2,0,0]=4 4587 B11R1.28 OCCCOC1CCCCO1 34a_100000033831_100000230001 [1,1,0,0,0,0|1,0,1]=4 4588 B11R1.28 OCCCSC1C=CCCC1 62a_100000751183_100011215043 [1,1,0,0,0,0|2,0,0]=4 4589 B11R1.28 OCCCSC1C=CCCC1 62a_100011215043_100000751183 [1,1,0,0,0,0|2,0,0]=4 4590 B11R1.28 OCCNCC1CCCCO1 2230a_100000174945_100000211926 [1,1,0,0,0,0|1,0,1]=4 4591 B11R1.28 OCCNCC1CCCCO1 2230a_100016997473_100000211543 [1,1,0,0,0,0|1,0,1]=4 4592 B11R1.28 OCCNCC1CCCCO1 34a_100000174945_100000211926 [1,1,0,0,0,0|1,0,1]=4 4593 B11R1.28 OCCNCC1CCCCO1 34a_100016990907_100000211543 [1,1,0,0,0,0|1,0,1]=4 4594 B11R1.28 OCCOCC1CCC=CO1 34a_100011217868_100000211926 [1,1,0,0,0,0|1,0,1]=4 4595 B11R1.28 OCCOCC1CCCCO1 34a_100000211370_100000211926 [1,1,0,0,0,0|1,0,1]=4 4596 B11R1.28 OCCOCC1CCCCO1 7a_100000211370_100000211926 [1,1,0,0,0,0|1,0,1]=4 4597 B11R1.28 OCCSCC1CCCCO1 62a_100000211543_100000211926 [1,1,0,0,0,0|1,0,1]=4 4598 B11R1.28 OCCSCC1CCCCO1 62a_100000211926_100000211543 [1,1,0,0,0,0|1,0,1]=4 4599 B11R1.28 [13CH3]NCCCC1CCCCC1 2230a_100011211642_200025704644 [1,1,0,0,0,0|1,0,1]=4 4600 B11R1.28 [13CH3]NCCCC1CCCCC1 34a_100011211642_200025704644 [1,1,0,0,0,0|1,0,1]=4 4601 B11R1.28 [13CH3]OCCCC1CCCCC1 34a_100000198086_200025704644 [1,1,0,0,0,0|1,0,1]=4 4602 B11R1.28 [13CH3]OCCCC1CCCCC1 7a_100000198086_200025704644 [1,1,0,0,0,0|1,0,1]=4 4603 B11R1.28 [13CH3]OCCCC1CCCCN1 34a_100011934581_200025704644 [1,1,0,0,0,0|1,0,1]=4 4604 B11R1.28 [13CH3]OCCCC1CCCNC1 34a_100150707839_200025704644 [1,1,0,0,0,0|2,0,0]=4 4605 B11R1.28 [13CH3]OCCOC1CCCCO1 34a_100000034223_200025704644 [1,1,0,0,0,0|1,0,1]=4 4606 B11R1.28 [13CH3]OCCOC1CCCCO1 7a_100000034223_200025704644 [1,1,0,0,0,0|1,0,1]=4 4607 B11R1.28 [13CH3]SCCCC1CCCCC1 62a_100011713725_200025704644 [1,1,0,0,0,0|1,0,1]=4 4608 B11R1.28 [13CH3]SCCCC1CCCCC1 62a_200025704644_100011713725 [1,1,0,0,0,0|1,0,1]=4 4609 B11R1.28 [13CH3]SCCOC1CCCCO1 62a_100000744793_200025704644 [1,1,0,0,0,0|1,0,1]=4 4610 B11R1.28 [13CH3]SCCOC1CCCCO1 62a_200025704644_100000744793 [1,1,0,0,0,0|1,0,1]=4 4611 B11R1.40 CCC(=O)CC1CCCCO1 1458a_100000210414_100000211543 [1,1,0,0,0,0|0,0,2]=4 4612 B11R1.40 CCC(=O)CC1CCCCO1 1458a_100000238585_100000210202 [1,1,0,0,0,0|0,0,2]=4 4613 B11R1.40 CCC(C)NC1C=CCCC1 2230a_100000209981_100000751183 [1,1,0,0,0,0|2,0,0]=4 4614 B11R1.40 CCC(C)OC1C=CCCC1 34a_100011215024_100011215416 [1,1,0,0,0,0|2,0,0]=4 4615 B11R1.40 CCC(C)OC1C=CCCC1 7a_100000210228_100000751183 [1,1,0,0,0,0|2,0,0]=4 4616 B11R1.40 CCC(C)OC1CCCCO1 34a_100000033831_100011215416 [1,1,0,0,0,0|1,0,1]=4 4617 B11R1.40 CCC(C)SC1C=CCCC1 62a_100000751183_100000758301 [1,1,0,0,0,0|2,0,0]=4 4618 B11R1.40 CCC(C)SC1C=CCCC1 62a_100000758301_100000751183 [1,1,0,0,0,0|2,0,0]=4 4619 B11R1.40 CCN(C)CC1CCCCO1 2230a_100000225621_100000211543 [1,1,0,0,0,0|1,0,1]=4 4620 B11R1.40 CCN(C)CC1CCCCO1 2230a_100000225654_100000210202 [1,1,0,0,0,0|1,0,1]=4 4621 B11R1.40 CCN(C)CC1CCCCO1 2230a_100015185122_200000210301 [1,1,0,0,0,0|1,0,1]=4 4622 B11R1.40 CCN(C)CC1CCCCO1 269982a_100000225621_100000211543 [1,1,0,0,0,0|1,0,1]=4 4623 B11R1.40 CCN(C)CC1CCCCO1 269982a_100000225654_100000204670 [1,1,0,0,0,0|1,0,1]=4 4624 B11R1.40 CCN(C)CC1CCCCO1 269982a_100015185122_200000210301 [1,1,0,0,0,0|1,0,1]=4 4625 B11R1.40 CCN(C)CC1CCCCO1 34a_100000225654_100000210202 [1,1,0,0,0,0|1,0,1]=4 4626 B11R1.40 CCN(C)CC1CCCCO1 34a_100015185122_200000210301 [1,1,0,0,0,0|1,0,1]=4 4627 B11R1.40 CCN([13CH3])CC1CCCCO1 2230a_100015185122_200025704644 [1,1,0,0,0,0|1,0,1]=4 4628 B11R1.40 CCN([13CH3])CC1CCCCO1 269982a_100015185122_200025704644 [1,1,0,0,0,0|1,0,1]=4 4629 B11R1.40 CCN([13CH3])CC1CCCCO1 34a_100015185122_200025704644 [1,1,0,0,0,0|1,0,1]=4 4630 B11R1.91 CC(C)CNC1C=CCCC1 2230a_100000210953_100000751183 [1,1,0,0,0,0|2,0,0]=4 4631 B11R1.91 CC(C)COC1C=CCCC1 34a_100011215024_100000210624 [1,1,0,0,0,0|2,0,0]=4 4632 B11R1.91 CC(C)COC1CCCCO1 34a_100000033831_100000210624 [1,1,0,0,0,0|1,0,1]=4 4633 B11R1.91 CC(C)CSC1C=CCCC1 62a_100000210624_100000751183 [1,1,0,0,0,0|2,0,0]=4 4634 B11R1.91 CC(C)CSC1C=CCCC1 62a_100000751183_100000210760 [1,1,0,0,0,0|2,0,0]=4 4635 B11R1.91 CC(C)NCC1CCCCO1 2230a_100000174945_100000210206 [1,1,0,0,0,0|1,0,1]=4 4636 B11R1.91 CC(C)NCC1CCCCO1 2230a_100138425928_100000211543 [1,1,0,0,0,0|1,0,1]=4 4637 B11R1.91 CC(C)NCC1CCCCO1 34a_100000174945_100000210206 [1,1,0,0,0,0|1,0,1]=4 4638 B11R1.91 CC(C)NCC1CCCCO1 34a_100138425928_100000211543 [1,1,0,0,0,0|1,0,1]=4 4639 B11R1.91 CC(C)OCC1CCC=CO1 34a_100011217868_100000210206 [1,1,0,0,0,0|1,0,1]=4 4640 B11R1.91 CC(C)OCC1CCCCO1 34a_100000211370_100000210206 [1,1,0,0,0,0|1,0,1]=4 4641 B11R1.91 CC(C)OCC1CCCCO1 34a_100000212225_100000211543 [1,1,0,0,0,0|1,0,1]=4 4642 B11R1.91 CC(C)OCC1CCCCO1 7a_100000211370_100000210206 [1,1,0,0,0,0|1,0,1]=4 4643 B11R1.91 CC(C)SCC1CCCCO1 62a_100000210206_100000211543 [1,1,0,0,0,0|1,0,1]=4 4644 B11R1.91 CC(C)SCC1CCCCO1 62a_100000211543_100000210206 [1,1,0,0,0,0|1,0,1]=4 4645 B11R1.91 CC(O)CNC1C=CCCC1 2230a_100000210904_100000751183 [1,1,0,0,0,0|2,0,0]=4 4646 B11R1.91 CC(O)COC1C=CCCC1 34a_100011215024_100011218427 [1,1,0,0,0,0|2,0,0]=4 4647 B11R1.91 CC(O)COC1CCCCO1 34a_100000033831_100011218427 [1,1,0,0,0,0|1,0,1]=4 4648 B11R1.91 CC(O)CSC1C=CCCC1 62a_100000751183_100011218427 [1,1,0,0,0,0|2,0,0]=4 4649 B11R1.91 CC(O)CSC1C=CCCC1 62a_100011218427_100000751183 [1,1,0,0,0,0|2,0,0]=4 4650 B11R1.91 CN(C)CCC1CCCCO1 2230a_100015183322_200000210301 [1,1,0,0,0,0|1,0,1]=4 4651 B11R1.91 CN(C)CCC1CCCCO1 269982a_100015183322_200000210301 [1,1,0,0,0,0|1,0,1]=4 4652 B11R1.91 CN(C)CCC1CCCCO1 34a_100015183322_200000210301 [1,1,0,0,0,0|1,0,1]=4 4653 B11R1.91 CN([13CH3])CCC1CCCCO1 2230a_100015183322_200025704644 [1,1,0,0,0,0|1,0,1]=4 4654 B11R1.91 CN([13CH3])CCC1CCCCO1 269982a_100015183322_200025704644 [1,1,0,0,0,0|1,0,1]=4 4655 B11R1.91 CN([13CH3])CCC1CCCCO1 34a_100015183322_200025704644 [1,1,0,0,0,0|1,0,1]=4 4656 B11R1.91 C[C@@H](O)COC1C=CCCC1 34a_100011215024_100009817552 [1,1,0,0,0,0|2,0,0]=4 4657 B11R1.91 C[C@@H](O)COC1CCCCO1 34a_100000033831_100009817552 [1,1,0,0,0,0|1,0,1]=4 4658 B11R1.91 C[C@@H](O)CSC1C=CCCC1 62a_100000751183_100009817552 [1,1,0,0,0,0|2,0,0]=4 4659 B11R1.91 C[C@@H](O)CSC1C=CCCC1 62a_100009817552_100000751183 [1,1,0,0,0,0|2,0,0]=4 4660 B11R1.15 CCCC(=O)C1CCC(=O)N1 1458a_100000210400_100000210303 [0,1,0,0,1,0|1,0,1]=4 4661 B11R1.15 CCCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000210303 [0,1,0,0,1,0|0,0,1]=3 4662 B11R1.15 CCNC(=O)[C@@H]1CCC(=O)O1 11a_100015525214_100009814974 [0,1,0,0,1,0|1,0,1]=4 4663 B11R1.15 CCNC(=O)[C@@H]1CCC(=O)O1 240690a_100015525214_100009814974 [0,1,0,0,1,0|1,0,1]=4 4664 B11R1.15 CCNC(=O)[C@@H]1CCC(=O)O1 527a_100015525214_100009814974 [0,1,0,0,1,0|1,0,1]=4 4665 B11R1.15 O=C1CC[C@H](O1)C(=O)CCF 1458a_100009814974_100011217306 [0,1,0,0,1,0|1,0,1]=4 4666 B11R1.15 O=C1CC[C@H](O1)C(=O)CCO 1458a_100009814974_100000211926 [0,1,0,0,1,0|1,0,1]=4 4667 B11R1.27 CCCCNC1CNC(=O)C1 2230a_100000697751_100000210211 [0,1,0,0,1,0|2,0,0]=4 4668 B11R1.27 CCCCOC1CCC(=O)C1 34a_100012614533_100000210210 [0,1,0,0,1,0|1,0,0]=3 4669 B11R1.27 CCCCOC1CNC(=O)C1 34a_100000690082_100000210210 [0,1,0,0,1,0|2,0,0]=4 4670 B11R1.27 CCCCOC1COC(=O)O1 34a_100000210227_100000032252 [0,1,0,0,1,0|1,0,0]=3 4671 B11R1.27 CCCCSC1COC(=O)O1 62a_100000210211_100000032252 [0,1,0,0,1,0|1,0,0]=3 4672 B11R1.27 CCCNCC1CNC(=O)C1 2230a_100016993742_100000210303 [0,1,0,0,1,0|2,0,0]=4 4673 B11R1.27 CCCNCC1CNC(=O)C1 34a_100016993742_100000210303 [0,1,0,0,1,0|2,0,0]=4 4674 B11R1.27 CCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210303 [0,1,0,0,1,0|1,0,0]=3 4675 B11R1.27 CCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210303 [0,1,0,0,1,0|1,0,0]=3 4676 B11R1.27 CCCOCC1CCC(=O)N1 34a_100000737831_100000210303 [0,1,0,0,1,0|1,0,0]=3 4677 B11R1.27 CCCOCC1CNC(=O)C1 34a_100016041077_100000210303 [0,1,0,0,1,0|2,0,0]=4 4678 B11R1.27 CCCOCC1CNC(=O)O1 34a_100000210258_100000181169 [0,1,0,0,1,0|1,0,0]=3 4679 B11R1.27 CCCOCC1CNC(=O)O1 34a_100011315639_100000210303 [0,1,0,0,1,0|1,0,0]=3 4680 B11R1.27 CCCOCC1COC(=O)O1 34a_100000210258_100000073702 [0,1,0,0,1,0|1,0,0]=3 4681 B11R1.27 CCCOC[C@H]1COC(=O)N1 34a_100000210258_100015307671 [0,1,0,0,1,0|2,0,0]=4 4682 B11R1.27 CCCSCC1CNC(=O)O1 62a_100000181169_100000210303 [0,1,0,0,1,0|1,0,0]=3 4683 B11R1.27 CCCSCC1CNC(=O)O1 62a_100000210303_100000181169 [0,1,0,0,1,0|1,0,0]=3 4684 B11R1.27 CCCSCC1COC(=O)O1 62a_100000073702_100000210303 [0,1,0,0,1,0|1,0,0]=3 4685 B11R1.27 CCCSCC1COC(=O)O1 62a_100000210303_100000073702 [0,1,0,0,1,0|1,0,0]=3 4686 B11R1.27 CCCSC[C@@H]1CCC(=O)N1 62a_100000210303_100015189358 [0,1,0,0,1,0|1,0,0]=3 4687 B11R1.27 CCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210303 [0,1,0,0,1,0|1,0,0]=3 4688 B11R1.27 CCCSC[C@H]1COC(=O)N1 62a_100000210303_100015307671 [0,1,0,0,1,0|2,0,0]=4 4689 B11R1.27 CCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210303 [0,1,0,0,1,0|2,0,0]=4 4690 B11R1.27 CCOCSC1COC(=O)O1 62a_100000739092_100000032252 [0,1,0,0,1,0|2,0,0]=4 4691 B11R1.27 CCSCCC1COS(=O)O1 62a_100000210202_100009840081 [0,1,0,0,1,0|2,0,0]=4 4692 B11R1.27 COCCOC1CCC(=O)C1 34a_100012614533_100011201679 [0,1,0,0,1,0|2,0,0]=4 4693 B11R1.27 COCCOC1COC(=O)O1 34a_100000210237_100000032252 [0,1,0,0,1,0|2,0,0]=4 4694 B11R1.27 COCCSC1COC(=O)O1 62a_100000233755_100000032252 [0,1,0,0,1,0|2,0,0]=4 4695 B11R1.27 COCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000766300 [0,1,0,0,1,0|2,0,0]=4 4696 B11R1.27 COCSCC1CNC(=O)O1 62a_100000181169_100000766300 [0,1,0,0,1,0|2,0,0]=4 4697 B11R1.27 COCSCC1CNC(=O)O1 62a_100000766300_100000181169 [0,1,0,0,1,0|2,0,0]=4 4698 B11R1.27 COCSCC1COC(=O)O1 62a_100000073702_100000766300 [0,1,0,0,1,0|2,0,0]=4 4699 B11R1.27 COCSCC1COC(=O)O1 62a_100000766300_100000073702 [0,1,0,0,1,0|2,0,0]=4 4700 B11R1.27 COCSC[C@@H]1CCC(=O)N1 62a_100000766300_100015189358 [0,1,0,0,1,0|2,0,0]=4 4701 B11R1.27 COCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000766300 [0,1,0,0,1,0|2,0,0]=4 4702 B11R1.27 CSCCOC1CCC(=O)C1 34a_100012614533_100000212216 [0,1,0,0,1,0|2,0,0]=4 4703 B11R1.27 CSCCOC1COC(=O)O1 34a_100000230434_100000032252 [0,1,0,0,1,0|2,0,0]=4 4704 B11R1.27 CSCCSC1COC(=O)O1 62a_100000212216_100000032252 [0,1,0,0,1,0|2,0,0]=4 4705 B11R1.27 CSCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011218213 [0,1,0,0,1,0|2,0,0]=4 4706 B11R1.27 CSCNC[C@H]1CCC(=O)N1 34a_100015423886_100011218213 [0,1,0,0,1,0|2,0,0]=4 4707 B11R1.27 CSCOCC1CCC(=O)N1 34a_100000737831_100011218213 [0,1,0,0,1,0|2,0,0]=4 4708 B11R1.27 CSCOCC1CNC(=O)O1 34a_100011315639_100011218213 [0,1,0,0,1,0|2,0,0]=4 4709 B11R1.27 CSCSCC1CNC(=O)O1 62a_100000181169_100011218213 [0,1,0,0,1,0|2,0,0]=4 4710 B11R1.27 CSCSCC1CNC(=O)O1 62a_100011218213_100000181169 [0,1,0,0,1,0|2,0,0]=4 4711 B11R1.27 CSCSCC1COC(=O)O1 62a_100000073702_100011218213 [0,1,0,0,1,0|2,0,0]=4 4712 B11R1.27 CSCSCC1COC(=O)O1 62a_100011218213_100000073702 [0,1,0,0,1,0|2,0,0]=4 4713 B11R1.27 CSCSC[C@@H]1CCC(=O)N1 62a_100011218213_100015189358 [0,1,0,0,1,0|2,0,0]=4 4714 B11R1.27 CSCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011218213 [0,1,0,0,1,0|2,0,0]=4 4715 B11R1.27 NCCCOC1COC(=O)O1 34a_100000182051_100000032252 [0,1,0,0,1,0|2,0,0]=4 4716 B11R1.27 NCCOCC1CNC(=O)O1 34a_100000210304_100000181169 [0,1,0,0,1,0|2,0,0]=4 4717 B11R1.27 NCCOCC1COC(=O)O1 34a_100000210304_100000073702 [0,1,0,0,1,0|2,0,0]=4 4718 B11R1.27 O=C1CCC(C1)OCCCF 34a_100012614533_100011934791 [0,1,0,0,1,0|2,0,0]=4 4719 B11R1.27 O=C1CCC(C1)OCCCO 34a_100012614533_100000230001 [0,1,0,0,1,0|2,0,0]=4 4720 B11R1.27 O=C1CCC(N1)COCCF 34a_100000737831_100011217306 [0,1,0,0,1,0|2,0,0]=4 4721 B11R1.27 O=C1CCC(N1)COCCO 34a_100000737831_100000211926 [0,1,0,0,1,0|2,0,0]=4 4722 B11R1.27 O=C1CC[C@@H](N1)CNCCF 2230a_100015423886_100011217306 [0,1,0,0,1,0|2,0,0]=4 4723 B11R1.27 O=C1CC[C@@H](N1)CNCCF 34a_100015423886_100011217306 [0,1,0,0,1,0|2,0,0]=4 4724 B11R1.27 O=C1CC[C@@H](N1)CNCCO 2230a_100015423886_100000211926 [0,1,0,0,1,0|2,0,0]=4 4725 B11R1.27 O=C1CC[C@@H](N1)CNCCO 34a_100015423886_100000211926 [0,1,0,0,1,0|2,0,0]=4 4726 B11R1.27 O=C1CC[C@H](N1)CNCCO 2230a_100016997473_100015189358 [0,1,0,0,1,0|2,0,0]=4 4727 B11R1.27 O=C1CC[C@H](N1)CSCCF 62a_100011217306_100015189358 [0,1,0,0,1,0|2,0,0]=4 4728 B11R1.27 O=C1CC[C@H](N1)CSCCF 62a_100015189358_100011217306 [0,1,0,0,1,0|2,0,0]=4 4729 B11R1.27 O=C1CC[C@H](N1)CSCCO 62a_100000211926_100015189358 [0,1,0,0,1,0|2,0,0]=4 4730 B11R1.27 O=C1CC[C@H](N1)CSCCO 62a_100015189358_100000211926 [0,1,0,0,1,0|2,0,0]=4 4731 B11R1.27 O=C1NCC(O1)CNCCF 34a_100000724931_100000181169 [0,1,0,0,1,0|2,0,0]=4 4732 B11R1.27 O=C1NCC(O1)CNCCO 2230a_100016997473_100000181169 [0,1,0,0,1,0|2,0,0]=4 4733 B11R1.27 O=C1NCC(O1)CNCCO 34a_100016990907_100000181169 [0,1,0,0,1,0|2,0,0]=4 4734 B11R1.27 O=C1NCC(O1)COCCBr 34a_100000211926_100000181169 [0,1,0,0,1,0|2,0,0]=4 4735 B11R1.27 O=C1NCC(O1)COCCF 34a_100011315639_100011217306 [0,1,0,0,1,0|2,0,0]=4 4736 B11R1.27 O=C1NCC(O1)COCCO 34a_100011315639_100000211926 [0,1,0,0,1,0|2,0,0]=4 4737 B11R1.27 O=C1NCC(O1)CSCCF 62a_100000181169_100011217306 [0,1,0,0,1,0|2,0,0]=4 4738 B11R1.27 O=C1NCC(O1)CSCCF 62a_100011217306_100000181169 [0,1,0,0,1,0|2,0,0]=4 4739 B11R1.27 O=C1NCC(O1)CSCCO 62a_100000181169_100000211926 [0,1,0,0,1,0|2,0,0]=4 4740 B11R1.27 O=C1NCC(O1)CSCCO 62a_100000211926_100000181169 [0,1,0,0,1,0|2,0,0]=4 4741 B11R1.27 O=C1OCC(O1)CNCCF 34a_100000724931_100000073702 [0,1,0,0,1,0|2,0,0]=4 4742 B11R1.27 O=C1OCC(O1)CNCCO 34a_100016990907_100000073702 [0,1,0,0,1,0|2,0,0]=4 4743 B11R1.27 O=C1OCC(O1)COCCBr 34a_100000211926_100000073702 [0,1,0,0,1,0|2,0,0]=4 4744 B11R1.27 O=C1OCC(O1)CSCCF 62a_100000073702_100011217306 [0,1,0,0,1,0|2,0,0]=4 4745 B11R1.27 O=C1OCC(O1)CSCCF 62a_100011217306_100000073702 [0,1,0,0,1,0|2,0,0]=4 4746 B11R1.27 O=C1OCC(O1)CSCCO 62a_100000073702_100000211926 [0,1,0,0,1,0|2,0,0]=4 4747 B11R1.27 O=C1OCC(O1)CSCCO 62a_100000211926_100000073702 [0,1,0,0,1,0|2,0,0]=4 4748 B11R1.27 O=C1OCC(O1)NCCCF 34a_100015189416_100000032252 [0,1,0,0,1,0|2,0,0]=4 4749 B11R1.27 O=C1OCC(O1)OCCCBr 34a_100011217188_100000032252 [0,1,0,0,1,0|2,0,0]=4 4750 B11R1.27 O=C1OCC(O1)OCCCCl 34a_100000230001_100000032252 [0,1,0,0,1,0|2,0,0]=4 4751 B11R1.27 O=C1OCC(O1)OCCCF 34a_100000759539_100000032252 [0,1,0,0,1,0|2,0,0]=4 4752 B11R1.27 O=C1OCC(O1)SCCCF 62a_100011934791_100000032252 [0,1,0,0,1,0|2,0,0]=4 4753 B11R1.27 O=C1OCC(O1)SCCCO 62a_100011215043_100000032252 [0,1,0,0,1,0|2,0,0]=4 4754 B11R1.39 CCC(=O)CC1CCC(=O)N1 1458a_100000026770_100000210202 [0,1,0,0,1,0|1,0,1]=4 4755 B11R1.39 CCC(=O)CC1CNC(=O)O1 1458a_100000210414_100000181169 [0,1,0,0,1,0|1,0,1]=4 4756 B11R1.39 CCC(=O)CC1COC(=O)O1 1458a_100000210414_100000073702 [0,1,0,0,1,0|1,0,1]=4 4757 B11R1.39 CCC(=O)C[C@@H]1CCC(=O)N1 1458a_100000210414_100015189358 [0,1,0,0,1,0|1,0,1]=4 4758 B11R1.39 CCC(C)OC1CCC(=O)C1 34a_100012614533_100011215416 [0,1,0,0,1,0|2,0,0]=4 4759 B11R1.39 CCC(C)SC1COC(=O)O1 62a_100000758301_100000032252 [0,1,0,0,1,0|2,0,0]=4 4760 B11R1.39 CCN(C)CC1CNC(=O)O1 2230a_100000225621_100000181169 [0,1,0,0,1,0|2,0,0]=4 4761 B11R1.39 CCN(C)CC1CNC(=O)O1 269982a_100000225621_100000181169 [0,1,0,0,1,0|2,0,0]=4 4762 B11R1.39 CCN(C)CC1COC(=O)O1 269982a_100000225621_100000073702 [0,1,0,0,1,0|2,0,0]=4 4763 B11R1.39 CCN(C)C[C@@H]1CCC(=O)N1 2230a_100000225621_100015189358 [0,1,0,0,1,0|2,0,0]=4 4764 B11R1.39 CCN(C)C[C@@H]1CCC(=O)N1 269982a_100000225621_100015189358 [0,1,0,0,1,0|2,0,0]=4 4765 B11R1.75 CC(Br)COC1COC(=O)O1 34a_100012180447_100000032252 [0,1,0,0,1,0|2,0,0]=4 4766 B11R1.75 CC(C)CNC1COC(=O)O1 34a_100000210953_100000032252 [0,1,0,0,1,0|2,0,0]=4 4767 B11R1.75 CC(C)COC1CCC(=O)C1 34a_100012614533_100000210624 [0,1,0,0,1,0|2,0,0]=4 4768 B11R1.75 CC(C)COC1COC(=O)O1 34a_100000210257_100000032252 [0,1,0,0,1,0|2,0,0]=4 4769 B11R1.75 CC(C)CSC1COC(=O)O1 62a_100000210624_100000032252 [0,1,0,0,1,0|2,0,0]=4 4770 B11R1.75 CC(C)NCC1CNC(=O)O1 2230a_100138425928_100000181169 [0,1,0,0,1,0|2,0,0]=4 4771 B11R1.75 CC(C)NCC1CNC(=O)O1 34a_100138425928_100000181169 [0,1,0,0,1,0|2,0,0]=4 4772 B11R1.75 CC(C)NCC1COC(=O)O1 34a_100138425928_100000073702 [0,1,0,0,1,0|2,0,0]=4 4773 B11R1.75 CC(C)NC[C@@H]1CCC(=O)N1 2230a_100138425928_100015189358 [0,1,0,0,1,0|2,0,0]=4 4774 B11R1.75 CC(C)NC[C@H]1CCC(=O)N1 2230a_100015423886_100000210206 [0,1,0,0,1,0|2,0,0]=4 4775 B11R1.75 CC(C)NC[C@H]1CCC(=O)N1 34a_100015423886_100000210206 [0,1,0,0,1,0|2,0,0]=4 4776 B11R1.75 CC(C)OCC1CCC(=O)N1 34a_100000737831_100000210206 [0,1,0,0,1,0|2,0,0]=4 4777 B11R1.75 CC(C)OCC1CNC(=O)O1 34a_100000212225_100000181169 [0,1,0,0,1,0|2,0,0]=4 4778 B11R1.75 CC(C)OCC1CNC(=O)O1 34a_100011315639_100000210206 [0,1,0,0,1,0|2,0,0]=4 4779 B11R1.75 CC(C)OCC1COC(=O)O1 34a_100000212225_100000073702 [0,1,0,0,1,0|2,0,0]=4 4780 B11R1.75 CC(C)SCC1CNC(=O)O1 62a_100000181169_100000210206 [0,1,0,0,1,0|2,0,0]=4 4781 B11R1.75 CC(C)SCC1CNC(=O)O1 62a_100000210206_100000181169 [0,1,0,0,1,0|2,0,0]=4 4782 B11R1.75 CC(C)SCC1COC(=O)O1 62a_100000073702_100000210206 [0,1,0,0,1,0|2,0,0]=4 4783 B11R1.75 CC(C)SCC1COC(=O)O1 62a_100000210206_100000073702 [0,1,0,0,1,0|2,0,0]=4 4784 B11R1.75 CC(C)SC[C@@H]1CCC(=O)N1 62a_100000210206_100015189358 [0,1,0,0,1,0|2,0,0]=4 4785 B11R1.75 CC(C)SC[C@@H]1CCC(=O)N1 62a_100015189358_100000210206 [0,1,0,0,1,0|2,0,0]=4 4786 B11R1.75 CC(F)COC1COC(=O)O1 34a_100015925927_100000032252 [0,1,0,0,1,0|2,0,0]=4 4787 B11R1.75 CC(O)CNC1COC(=O)O1 34a_100000210904_100000032252 [0,1,0,0,1,0|2,0,0]=4 4788 B11R1.75 CC(O)COC1CCC(=O)C1 34a_100012614533_100011218427 [0,1,0,0,1,0|2,0,0]=4 4789 B11R1.75 CC(O)CSC1COC(=O)O1 62a_100011218427_100000032252 [0,1,0,0,1,0|2,0,0]=4 4790 B11R1.75 C[C@@H](Cl)COC1COC(=O)O1 34a_100016084084_100000032252 [0,1,0,0,1,0|2,0,0]=4 4791 B11R1.75 C[C@@H](N)COC1COC(=O)O1 34a_100000737577_100000032252 [0,1,0,0,1,0|2,0,0]=4 4792 B11R1.75 C[C@@H](O)COC1CCC(=O)C1 34a_100012614533_100009817552 [0,1,0,0,1,0|2,0,0]=4 4793 B11R1.75 C[C@@H](O)CSC1COC(=O)O1 62a_100009817552_100000032252 [0,1,0,0,1,0|2,0,0]=4 4794 B11R1.18 CCCCC1CCCC1NC 269862a_106832991636_100000750825 [0,1,0,0,1,0|1,0,1]=4 4795 B11R1.18 CCCCC1CCCC1NC 270004a_106832991635_100000750825 [0,1,0,0,1,0|1,0,1]=4 4796 B11R1.90 C=C(C)COC1CCCC1=O 34a_100000210245_100000709159 [0,1,0,0,1,0|1,0,1]=4 4797 B11R1.90 C=C(C)COC1CCCC1=O 34a_200000719330_100000748629 [0,1,0,0,1,0|1,0,1]=4 4798 B11R1.90 C=C(C)CSC1CCCC1=O 62a_100000211823_100000211660 [0,1,0,0,1,0|1,0,1]=4 4799 B11R1.90 C=C(C)CSC1CCCC1=O 62a_100000748629_100000211823 [0,1,0,0,1,0|1,0,1]=4 4800 B11R1.90 CC(=O)CCC1CCOC1=O 1458a_100000117037_200000210301 [0,1,0,0,1,0|1,0,1]=4 4801 B11R1.90 CC(=O)CCN1CCCC1=O 1458a_100000070787_100000742232 [0,1,0,0,1,0|1,0,1]=4 4802 B11R1.90 CC(=O)CCN1CCCC1=O 1458a_100000751031_200000210301 [0,1,0,0,1,0|1,0,1]=4 4803 B11R1.90 CC(=O)COC1CCCC1=O 34a_100000211253_100000709159 [0,1,0,0,1,0|1,0,1]=4 4804 B11R1.90 CC(Br)COC1CCCC1=O 34a_100012180447_100000709159 [0,1,0,0,1,0|1,0,0]=3 4805 B11R1.90 CC(Br)COC1CCOC1=O 34a_100012180447_100000211211 [0,1,0,0,1,0|2,0,0]=4 4806 B11R1.90 CC(C)CNC1CCCC1=O 2230a_100000210953_100000211823 [0,1,0,0,1,0|1,0,0]=3 4807 B11R1.90 CC(C)CNC1CCCC1=O 34a_100000210953_100000709159 [0,1,0,0,1,0|1,0,0]=3 4808 B11R1.90 CC(C)CNC1CCNC1=O 2230a_100016995588_100000210760 [0,1,0,0,1,0|2,0,0]=4 4809 B11R1.90 CC(C)CNC1CCNC1=O 270004a_100016995588_100000210432 [0,1,0,0,1,0|2,0,0]=4 4810 B11R1.90 CC(C)CNC1CCNC1=O 34a_100016995588_100000210624 [0,1,0,0,1,0|2,0,0]=4 4811 B11R1.90 CC(C)CNC1CCOC1=O 2230a_100000210953_100000211211 [0,1,0,0,1,0|2,0,0]=4 4812 B11R1.90 CC(C)CNC1CCOC1=O 34a_100000210953_100000211211 [0,1,0,0,1,0|2,0,0]=4 4813 B11R1.90 CC(C)COC1CCCC1=O 34a_100000210257_100000709159 [0,1,0,0,1,0|1,0,0]=3 4814 B11R1.90 CC(C)COC1CCCC1=O 34a_200000719330_100000210624 [0,1,0,0,1,0|1,0,0]=3 4815 B11R1.90 CC(C)COC1CCOC1=O 34a_100000210257_100000211211 [0,1,0,0,1,0|2,0,0]=4 4816 B11R1.90 CC(C)CO[C@H]1CCNC1=O 34a_100000688343_100000210624 [0,1,0,0,1,0|2,0,0]=4 4817 B11R1.90 CC(C)CSC1CCCC1=O 62a_100000210624_100000211823 [0,1,0,0,1,0|1,0,0]=3 4818 B11R1.90 CC(C)CSC1CCCC1=O 62a_100000211823_100000210760 [0,1,0,0,1,0|1,0,0]=3 4819 B11R1.90 CC(C)CSC1CCOC1=O 62a_100000210624_100000211211 [0,1,0,0,1,0|2,0,0]=4 4820 B11R1.90 CC(C)CSC1CCOC1=O 62a_100000211211_100000210760 [0,1,0,0,1,0|2,0,0]=4 4821 B11R1.90 CC(C)OCC1CCNC1=O 34a_100000133458_100000210206 [0,1,0,0,1,0|2,0,0]=4 4822 B11R1.90 CC(C)SCN1CCCC1=O 62a_100000026320_100000210206 [0,1,0,0,1,0|2,0,0]=4 4823 B11R1.90 CC(C)SCN1CCCC1=O 62a_100000210206_100000026320 [0,1,0,0,1,0|2,0,0]=4 4824 B11R1.90 CC(F)COC1CCCC1=O 34a_100015925927_100000709159 [0,1,0,0,1,0|1,0,0]=3 4825 B11R1.90 CC(F)COC1CCOC1=O 34a_100015925927_100000211211 [0,1,0,0,1,0|2,0,0]=4 4826 B11R1.90 CC(O)CNC1CCCC1=O 2230a_100000210904_100000211823 [0,1,0,0,1,0|1,0,0]=3 4827 B11R1.90 CC(O)CNC1CCCC1=O 34a_100000210904_100000709159 [0,1,0,0,1,0|1,0,0]=3 4828 B11R1.90 CC(O)CNC1CCNC1=O 2230a_100016995588_100011218427 [0,1,0,0,1,0|2,0,0]=4 4829 B11R1.90 CC(O)CNC1CCNC1=O 34a_100016995588_100011218427 [0,1,0,0,1,0|2,0,0]=4 4830 B11R1.90 CC(O)CNC1CCOC1=O 2230a_100000210904_100000211211 [0,1,0,0,1,0|2,0,0]=4 4831 B11R1.90 CC(O)CNC1CCOC1=O 34a_100000210904_100000211211 [0,1,0,0,1,0|2,0,0]=4 4832 B11R1.90 CC(O)COC1CCCC1=O 34a_200000719330_100011218427 [0,1,0,0,1,0|1,0,0]=3 4833 B11R1.90 CC(O)CO[C@H]1CCNC1=O 34a_100000688343_100011218427 [0,1,0,0,1,0|2,0,0]=4 4834 B11R1.90 CC(O)CSC1CCCC1=O 62a_100000211823_100011218427 [0,1,0,0,1,0|1,0,0]=3 4835 B11R1.90 CC(O)CSC1CCCC1=O 62a_100011218427_100000211823 [0,1,0,0,1,0|1,0,0]=3 4836 B11R1.90 CC(O)CSC1CCOC1=O 62a_100000211211_100011218427 [0,1,0,0,1,0|2,0,0]=4 4837 B11R1.90 CC(O)CSC1CCOC1=O 62a_100011218427_100000211211 [0,1,0,0,1,0|2,0,0]=4 4838 B11R1.90 CN(C)CCN1CCCC1=O 2230a_100102631434_100000739059 [0,1,0,0,1,0|2,0,0]=4 4839 B11R1.90 CN(C)CCN1CCCC1=O 269982a_100102631434_100000739059 [0,1,0,0,1,0|2,0,0]=4 4840 B11R1.90 C[C@@H](Cl)COC1CCCC1=O 34a_100016084084_100000709159 [0,1,0,0,1,0|1,0,0]=3 4841 B11R1.90 C[C@@H](Cl)COC1CCOC1=O 34a_100016084084_100000211211 [0,1,0,0,1,0|2,0,0]=4 4842 B11R1.90 C[C@@H](N)COC1CCCC1=O 34a_100000737577_100000709159 [0,1,0,0,1,0|1,0,0]=3 4843 B11R1.90 C[C@@H](N)COC1CCOC1=O 34a_100000737577_100000211211 [0,1,0,0,1,0|2,0,0]=4 4844 B11R1.90 C[C@@H](O)CNC1CCNC1=O 2230a_100016995588_100009817552 [0,1,0,0,1,0|2,0,0]=4 4845 B11R1.90 C[C@@H](O)CNC1CCNC1=O 34a_100016995588_100009817552 [0,1,0,0,1,0|2,0,0]=4 4846 B11R1.90 C[C@@H](O)COC1CCCC1=O 34a_200000719330_100009817552 [0,1,0,0,1,0|1,0,0]=3 4847 B11R1.90 C[C@@H](O)CO[C@H]1CCNC1=O 34a_100000688343_100009817552 [0,1,0,0,1,0|2,0,0]=4 4848 B11R1.90 C[C@@H](O)CSC1CCCC1=O 62a_100000211823_100009817552 [0,1,0,0,1,0|1,0,0]=3 4849 B11R1.90 C[C@@H](O)CSC1CCCC1=O 62a_100009817552_100000211823 [0,1,0,0,1,0|1,0,0]=3 4850 B11R1.90 C[C@@H](O)CSC1CCOC1=O 62a_100000211211_100009817552 [0,1,0,0,1,0|2,0,0]=4 4851 B11R1.90 C[C@@H](O)CSC1CCOC1=O 62a_100009817552_100000211211 [0,1,0,0,1,0|2,0,0]=4 4852 B11R1.90 O=C1CCCC1NCC(F)F 34a_100000765723_100000709159 [0,1,0,0,1,0|2,0,0]=4 4853 B11R1.90 O=C1CCCC1OCC(F)F 34a_100000743014_100000709159 [0,1,0,0,1,0|2,0,0]=4 4854 B11R1.90 O=C1CCCC1OCC(F)F 34a_200000719330_100011934356 [0,1,0,0,1,0|2,0,0]=4 4855 B11R1.90 O=C1CCCC1SCC(F)F 62a_100000211823_100011934356 [0,1,0,0,1,0|2,0,0]=4 4856 B11R1.90 O=C1CCCC1SCC(F)F 62a_100011934356_100000211823 [0,1,0,0,1,0|2,0,0]=4 4857 B11R1.90 [13CH3]C(=O)CCC1CCOC1=O 1458a_100000117037_200025704644 [0,1,0,0,1,0|1,0,1]=4 4858 B11R1.90 [13CH3]C(=O)CCN1CCCC1=O 1458a_100000751031_200025704644 [0,1,0,0,1,0|1,0,1]=4 4859 B11R1.180 C#CCCNC1CCCC1=O 34a_100000755551_100000709159 [0,1,0,0,1,0|0,0,2]=4 4860 B11R1.180 C#CCCOC1CCCC1=O 34a_100011215631_100000709159 [0,1,0,0,1,0|0,0,2]=4 4861 B11R1.180 C#CCCOC1CCCC1=O 34a_200000719330_100000688953 [0,1,0,0,1,0|0,0,2]=4 4862 B11R1.180 C#CCCSC1CCCC1=O 62a_100000211823_100000688953 [0,1,0,0,1,0|0,0,2]=4 4863 B11R1.180 C#CCCSC1CCCC1=O 62a_100000688953_100000211823 [0,1,0,0,1,0|0,0,2]=4 4864 B11R1.180 C/C=C/COC1CCCC1=O 34a_100016270725_100000709159 [0,1,0,0,1,0|0,0,2]=4 4865 B11R1.180 C/C=C/COC1CCCC1=O 34a_200000719330_100102629194 [0,1,0,0,1,0|0,0,2]=4 4866 B11R1.180 C/C=C/CSC1CCCC1=O 62a_100000211823_100102629194 [0,1,0,0,1,0|0,0,2]=4 4867 B11R1.180 C/C=C/CSC1CCCC1=O 62a_100102629194_100000211823 [0,1,0,0,1,0|0,0,2]=4 4868 B11R1.180 C=CCCNC1CCCC1=O 2230a_100015191253_100000211823 [0,1,0,0,1,0|0,0,2]=4 4869 B11R1.180 C=CCCOC1CCCC1=O 34a_100011205117_100000709159 [0,1,0,0,1,0|0,0,2]=4 4870 B11R1.180 C=CCCOC1CCCC1=O 34a_200000719330_100000754431 [0,1,0,0,1,0|0,0,2]=4 4871 B11R1.180 C=CCCSC1CCCC1=O 62a_100000211823_100000754431 [0,1,0,0,1,0|0,0,2]=4 4872 B11R1.180 C=CCCSC1CCCC1=O 62a_100000754431_100000211823 [0,1,0,0,1,0|0,0,2]=4 4873 B11R1.180 CC#CCNC1CCCC1=O 2230a_100000685387_100000211823 [0,1,0,0,1,0|0,0,2]=4 4874 B11R1.180 CC#CCNC1CCCC1=O 34a_100000685387_100000709159 [0,1,0,0,1,0|0,0,2]=4 4875 B11R1.180 CC#CCOC1CCCC1=O 34a_100000761923_100000709159 [0,1,0,0,1,0|0,0,2]=4 4876 B11R1.180 CC#CCOC1CCCC1=O 34a_200000719330_100000748600 [0,1,0,0,1,0|0,0,2]=4 4877 B11R1.180 CC#CCSC1CCCC1=O 62a_100000211823_100000748600 [0,1,0,0,1,0|0,0,2]=4 4878 B11R1.180 CC#CCSC1CCCC1=O 62a_100000748600_100000211823 [0,1,0,0,1,0|0,0,2]=4 4879 B11R1.180 CC=CCOC1CCCC1=O 34a_200000719330_100000070051 [0,1,0,0,1,0|0,0,2]=4 4880 B11R1.180 CC=CCSC1CCCC1=O 62a_100000070051_100000211823 [0,1,0,0,1,0|0,0,2]=4 4881 B11R1.180 CC=CCSC1CCCC1=O 62a_100000211823_100000070051 [0,1,0,0,1,0|0,0,2]=4 4882 B11R1.180 CCCCNC1CCCC1=O 2230a_100000102301_100000211823 [0,1,0,0,1,0|0,0,0]=2 4883 B11R1.180 CCCCNC1CCCC1=O 7a_106832991798_100000211823 [0,1,0,0,1,0|0,0,0]=2 4884 B11R1.180 CCCCNC1CCCC1C 269862a_100000102301_100000752053 [0,1,0,0,1,0|1,0,1]=4 4885 B11R1.180 CCCCNC1CCNC1=O 2230a_100016995588_100000210211 [0,1,0,0,1,0|1,0,0]=3 4886 B11R1.180 CCCCNC1CCNC1=O 34a_100016995588_100000210210 [0,1,0,0,1,0|1,0,0]=3 4887 B11R1.180 CCCCNC1CCOC1=O 2230a_100000102301_100000211211 [0,1,0,0,1,0|1,0,0]=3 4888 B11R1.180 CCCCNC1CCOC1=O 7a_106832991798_100000211211 [0,1,0,0,1,0|1,0,0]=3 4889 B11R1.180 CCCCN[C@@H]1CONC1=O 2230a_100000765999_100000210211 [0,1,0,0,1,0|2,0,0]=4 4890 B11R1.180 CCCCN[C@@H]1CONC1=O 34a_100000765999_100000210210 [0,1,0,0,1,0|2,0,0]=4 4891 B11R1.180 CCCCOC1CCCC1=O 34a_100000210227_100000709159 [0,1,0,0,1,0|0,0,0]=2 4892 B11R1.180 CCCCOC1CCCC1=O 34a_200000719330_100000210210 [0,1,0,0,1,0|0,0,0]=2 4893 B11R1.180 CCCCOC1CCCC1=O 7a_100000210227_100000211823 [0,1,0,0,1,0|0,0,0]=2 4894 B11R1.180 CCCCOC1CCCC1C 34a_100011216460_100000210210 [0,1,0,0,1,0|1,0,1]=4 4895 B11R1.180 CCCCOC1CCCC1C 7a_100011216460_100000210211 [0,1,0,0,1,0|1,0,1]=4 4896 B11R1.180 CCCCOC1CCOC1=O 34a_100000210227_100000211211 [0,1,0,0,1,0|1,0,0]=3 4897 B11R1.180 CCCCOC1CCOC1=O 7a_100000210227_100000211211 [0,1,0,0,1,0|1,0,0]=3 4898 B11R1.180 CCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000210210 [0,1,0,0,1,0|1,0,1]=4 4899 B11R1.180 CCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210210 [0,1,0,0,1,0|1,0,1]=4 4900 B11R1.180 CCCCO[C@H]1CCNC1=O 34a_100000688343_100000210210 [0,1,0,0,1,0|1,0,0]=3 4901 B11R1.180 CCCCSC1CCCC1=O 62a_100000210211_100000211823 [0,1,0,0,1,0|0,0,0]=2 4902 B11R1.180 CCCCSC1CCCC1=O 62a_100000211823_100000210210 [0,1,0,0,1,0|0,0,0]=2 4903 B11R1.180 CCCCSC1CCOC1=O 62a_100000210211_100000211211 [0,1,0,0,1,0|1,0,0]=3 4904 B11R1.180 CCCCSC1CCOC1=O 62a_100000211211_100000210210 [0,1,0,0,1,0|1,0,0]=3 4905 B11R1.180 CCCCS[C@@H]1CCC[C@H]1O 62a_100000210211_200016002552 [0,1,0,0,1,0|0,0,2]=4 4906 B11R1.180 CCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210210 [0,1,0,0,1,0|0,0,2]=4 4907 B11R1.180 CCCOCC1=CCCC1=O 34a_100000087531_100000210303 [0,1,0,0,1,0|0,0,2]=4 4908 B11R1.180 CCCOCC1CCCN1C 34a_100000743107_100000210303 [0,1,0,0,1,0|2,0,0]=4 4909 B11R1.180 CCCOCC1CCNC1=O 34a_100000133458_100000210303 [0,1,0,0,1,0|1,0,0]=3 4910 B11R1.180 CCCSCN1CCCC1=O 62a_100000026320_100000210303 [0,1,0,0,1,0|1,0,0]=3 4911 B11R1.180 CCCSCN1CCCC1=O 62a_100000210303_100000026320 [0,1,0,0,1,0|1,0,0]=3 4912 B11R1.180 CCNCCC1CCCN1C 2230a_100015525214_100000005710 [0,1,0,0,1,0|2,0,0]=4 4913 B11R1.180 CCNCCN1CCCC1=O 2230a_100011200922_100000210202 [0,1,0,0,1,0|1,0,0]=3 4914 B11R1.180 CCNCCN1CCCC1=O 2230a_100015525214_100000739059 [0,1,0,0,1,0|1,0,0]=3 4915 B11R1.180 CCNCCN1CCNC1=O 2230a_100011207550_100000210202 [0,1,0,0,1,0|2,0,0]=4 4916 B11R1.180 CCNCCN1CCNC1=O 2230a_100015525214_100000090651 [0,1,0,0,1,0|2,0,0]=4 4917 B11R1.180 CCOCCC1CCCN1C 34a_100011215177_100000210202 [0,1,0,0,1,0|2,0,0]=4 4918 B11R1.180 CCOCCC1CCCN1C 34a_100121572206_100000005710 [0,1,0,0,1,0|2,0,0]=4 4919 B11R1.180 CCOCCC1CCCN1C 7a_100011215177_100000210202 [0,1,0,0,1,0|2,0,0]=4 4920 B11R1.180 CCOCCN1CCCC1=O 34a_100000211209_100000210202 [0,1,0,0,1,0|1,0,0]=3 4921 B11R1.180 CCOCCN1CCCC1=O 34a_100121572206_100000739059 [0,1,0,0,1,0|1,0,0]=3 4922 B11R1.180 CCOCCN1CCCC1=O 7a_100000211209_100000210202 [0,1,0,0,1,0|1,0,0]=3 4923 B11R1.180 CCOCCN1CCNC1=O 34a_100000216532_100000210202 [0,1,0,0,1,0|2,0,0]=4 4924 B11R1.180 CCOCSC1CCCC1=O 62a_100000211823_100000739092 [0,1,0,0,1,0|1,0,0]=3 4925 B11R1.180 CCOCSC1CCCC1=O 62a_100000739092_100000211823 [0,1,0,0,1,0|1,0,0]=3 4926 B11R1.180 CCOCSC1CCOC1=O 62a_100000211211_100000739092 [0,1,0,0,1,0|2,0,0]=4 4927 B11R1.180 CCOCSC1CCOC1=O 62a_100000739092_100000211211 [0,1,0,0,1,0|2,0,0]=4 4928 B11R1.180 CCSCCC1CCCN1C 62a_100000005710_100000210202 [0,1,0,0,1,0|2,0,0]=4 4929 B11R1.180 CCSCCC1CCCN1C 62a_100000210202_100000005710 [0,1,0,0,1,0|2,0,0]=4 4930 B11R1.180 CCSCCN1CCCC1=O 62a_100000210202_100000739059 [0,1,0,0,1,0|1,0,0]=3 4931 B11R1.180 CCSCCN1CCCC1=O 62a_100000739059_100000210202 [0,1,0,0,1,0|1,0,0]=3 4932 B11R1.180 CCSCCN1CCNC1=O 62a_100000090651_100000210202 [0,1,0,0,1,0|2,0,0]=4 4933 B11R1.180 CCSCCN1CCNC1=O 62a_100000210202_100000090651 [0,1,0,0,1,0|2,0,0]=4 4934 B11R1.180 CNCCCN1CCCC1=O 2230a_100000210347_200000210301 [0,1,0,0,1,0|1,0,0]=3 4935 B11R1.180 CNCCCN1CCCC1=O 34a_100000210347_200000210301 [0,1,0,0,1,0|1,0,0]=3 4936 B11R1.180 COCCCN1CCCC1=O 34a_100011216539_200000210301 [0,1,0,0,1,0|1,0,0]=3 4937 B11R1.180 COCCCN1CCCC1=O 7a_100011216539_200000210301 [0,1,0,0,1,0|1,0,0]=3 4938 B11R1.180 COCCNC1CCCC1=O 2230a_100000209980_100000211823 [0,1,0,0,1,0|1,0,0]=3 4939 B11R1.180 COCCNC1CCNC1=O 2230a_100016995588_100011201679 [0,1,0,0,1,0|2,0,0]=4 4940 B11R1.180 COCCNC1CCNC1=O 34a_100016995588_100011201679 [0,1,0,0,1,0|2,0,0]=4 4941 B11R1.180 COCCNC1CCOC1=O 2230a_100000209980_100000211211 [0,1,0,0,1,0|2,0,0]=4 4942 B11R1.180 COCCOC1CCCC1=O 34a_100000210237_100000709159 [0,1,0,0,1,0|1,0,0]=3 4943 B11R1.180 COCCOC1CCCC1=O 34a_200000719330_100011201679 [0,1,0,0,1,0|1,0,0]=3 4944 B11R1.180 COCCOC1CCOC1=O 34a_100000210237_100000211211 [0,1,0,0,1,0|2,0,0]=4 4945 B11R1.180 COCCO[C@H]1CCNC1=O 34a_100000688343_100011201679 [0,1,0,0,1,0|2,0,0]=4 4946 B11R1.180 COCCSC1CCCC1=O 62a_100000211823_100000233755 [0,1,0,0,1,0|1,0,0]=3 4947 B11R1.180 COCCSC1CCCC1=O 62a_100000233755_100000211823 [0,1,0,0,1,0|1,0,0]=3 4948 B11R1.180 COCCSC1CCOC1=O 62a_100000211211_100000233755 [0,1,0,0,1,0|2,0,0]=4 4949 B11R1.180 COCCSC1CCOC1=O 62a_100000233755_100000211211 [0,1,0,0,1,0|2,0,0]=4 4950 B11R1.180 COCSCN1CCCC1=O 62a_100000026320_100000766300 [0,1,0,0,1,0|2,0,0]=4 4951 B11R1.180 COCSCN1CCCC1=O 62a_100000766300_100000026320 [0,1,0,0,1,0|2,0,0]=4 4952 B11R1.180 CSCCNC1CCCC1=O 2230a_100020590264_100000211823 [0,1,0,0,1,0|1,0,0]=3 4953 B11R1.180 CSCCNC1CCNC1=O 2230a_100016995588_100000751147 [0,1,0,0,1,0|2,0,0]=4 4954 B11R1.180 CSCCNC1CCNC1=O 34a_100016995588_100000212216 [0,1,0,0,1,0|2,0,0]=4 4955 B11R1.180 CSCCNC1CCOC1=O 2230a_100020590264_100000211211 [0,1,0,0,1,0|2,0,0]=4 4956 B11R1.180 CSCCOC1CCCC1=O 34a_100000230434_100000709159 [0,1,0,0,1,0|1,0,0]=3 4957 B11R1.180 CSCCOC1CCCC1=O 34a_200000719330_100000212216 [0,1,0,0,1,0|1,0,0]=3 4958 B11R1.180 CSCCOC1CCCC1=O 7a_100000230434_100000211823 [0,1,0,0,1,0|1,0,0]=3 4959 B11R1.180 CSCCOC1CCOC1=O 34a_100000230434_100000211211 [0,1,0,0,1,0|2,0,0]=4 4960 B11R1.180 CSCCOC1CCOC1=O 7a_100000230434_100000211211 [0,1,0,0,1,0|2,0,0]=4 4961 B11R1.180 CSCCO[C@H]1CCNC1=O 34a_100000688343_100000212216 [0,1,0,0,1,0|2,0,0]=4 4962 B11R1.180 CSCCSC1CCCC1=O 62a_100000211823_100000751147 [0,1,0,0,1,0|1,0,0]=3 4963 B11R1.180 CSCCSC1CCCC1=O 62a_100000212216_100000211823 [0,1,0,0,1,0|1,0,0]=3 4964 B11R1.180 CSCCSC1CCOC1=O 62a_100000211211_100000751147 [0,1,0,0,1,0|2,0,0]=4 4965 B11R1.180 CSCCSC1CCOC1=O 62a_100000212216_100000211211 [0,1,0,0,1,0|2,0,0]=4 4966 B11R1.180 CSCOCC1CCNC1=O 34a_100000133458_100011218213 [0,1,0,0,1,0|2,0,0]=4 4967 B11R1.180 CSCSCN1CCCC1=O 62a_100000026320_100011218213 [0,1,0,0,1,0|2,0,0]=4 4968 B11R1.180 CSCSCN1CCCC1=O 62a_100011218213_100000026320 [0,1,0,0,1,0|2,0,0]=4 4969 B11R1.180 N#CCCSC1CCCC1=O 62a_100000211823_100011215226 [0,1,0,0,1,0|1,0,1]=4 4970 B11R1.180 N#CCCSC1CCCC1=O 62a_100011215226_100000211823 [0,1,0,0,1,0|1,0,1]=4 4971 B11R1.180 NCCCOC1CCCC1=O 34a_100000182051_100000709159 [0,1,0,0,1,0|1,0,0]=3 4972 B11R1.180 NCCCOC1CCOC1=O 34a_100000182051_100000211211 [0,1,0,0,1,0|2,0,0]=4 4973 B11R1.180 NOCCOC1CCCC1=O 34a_100000700252_100000709159 [0,1,0,0,1,0|2,0,0]=4 4974 B11R1.180 O=C1CCCC1NCCCF 2230a_100015189416_100000211823 [0,1,0,0,1,0|1,0,0]=3 4975 B11R1.180 O=C1CCCC1NCCCF 34a_100015189416_100000709159 [0,1,0,0,1,0|1,0,0]=3 4976 B11R1.180 O=C1CCCC1OCCCBr 34a_100011217188_100000709159 [0,1,0,0,1,0|1,0,0]=3 4977 B11R1.180 O=C1CCCC1OCCCCl 34a_100000230001_100000709159 [0,1,0,0,1,0|1,0,0]=3 4978 B11R1.180 O=C1CCCC1OCCCF 34a_100000759539_100000709159 [0,1,0,0,1,0|1,0,0]=3 4979 B11R1.180 O=C1CCCC1OCCCF 34a_200000719330_100011934791 [0,1,0,0,1,0|1,0,0]=3 4980 B11R1.180 O=C1CCCC1OCCCO 34a_200000719330_100000230001 [0,1,0,0,1,0|1,0,0]=3 4981 B11R1.180 O=C1CCCC1SCCCF 62a_100000211823_100011934791 [0,1,0,0,1,0|1,0,0]=3 4982 B11R1.180 O=C1CCCC1SCCCF 62a_100011934791_100000211823 [0,1,0,0,1,0|1,0,0]=3 4983 B11R1.180 O=C1CCCC1SCCCO 62a_100000211823_100011215043 [0,1,0,0,1,0|1,0,0]=3 4984 B11R1.180 O=C1CCCC1SCCCO 62a_100011215043_100000211823 [0,1,0,0,1,0|1,0,0]=3 4985 B11R1.180 O=C1CCCN1CCOCF 34a_100000211209_100015361967 [0,1,0,0,1,0|2,0,0]=4 4986 B11R1.180 O=C1CCCN1CCOCF 7a_100000211209_100015361967 [0,1,0,0,1,0|2,0,0]=4 4987 B11R1.180 O=C1CCCN1CCSCF 62a_100000739059_100015361967 [0,1,0,0,1,0|2,0,0]=4 4988 B11R1.180 O=C1CCCN1CCSCF 62a_100015361967_100000739059 [0,1,0,0,1,0|2,0,0]=4 4989 B11R1.180 O=C1CCCN1CSCCF 62a_100000026320_100011217306 [0,1,0,0,1,0|2,0,0]=4 4990 B11R1.180 O=C1CCCN1CSCCF 62a_100011217306_100000026320 [0,1,0,0,1,0|2,0,0]=4 4991 B11R1.180 O=C1CCCN1CSCCO 62a_100000026320_100000211926 [0,1,0,0,1,0|2,0,0]=4 4992 B11R1.180 O=C1CCCN1CSCCO 62a_100000211926_100000026320 [0,1,0,0,1,0|2,0,0]=4 4993 B11R1.180 O=C1NCCC1COCCF 34a_100000133458_100011217306 [0,1,0,0,1,0|2,0,0]=4 4994 B11R1.180 O=C1NCCC1COCCO 34a_100000133458_100000211926 [0,1,0,0,1,0|2,0,0]=4 4995 B11R1.180 O=C1NCCC1NCCCF 2230a_100016995588_100011934791 [0,1,0,0,1,0|2,0,0]=4 4996 B11R1.180 O=C1NCCC1NCCCF 34a_100016995588_100011934791 [0,1,0,0,1,0|2,0,0]=4 4997 B11R1.180 O=C1NCCC1NCCCO 2230a_100016995588_100000230001 [0,1,0,0,1,0|2,0,0]=4 4998 B11R1.180 O=C1NCCC1NCCCO 34a_100016995588_100000230001 [0,1,0,0,1,0|2,0,0]=4 4999 B11R1.180 O=C1NCC[C@@H]1OCCCF 34a_100000688343_100011934791 [0,1,0,0,1,0|2,0,0]=4 5000 B11R1.180 O=C1NCC[C@@H]1OCCCO 34a_100000688343_100000230001 [0,1,0,0,1,0|2,0,0]=4 5001 B11R1.180 O=C1OCCC1NCCCF 2230a_100015189416_100000211211 [0,1,0,0,1,0|2,0,0]=4 5002 B11R1.180 O=C1OCCC1NCCCF 34a_100015189416_100000211211 [0,1,0,0,1,0|2,0,0]=4 5003 B11R1.180 O=C1OCCC1OCCCBr 34a_100011217188_100000211211 [0,1,0,0,1,0|2,0,0]=4 5004 B11R1.180 O=C1OCCC1OCCCCl 34a_100000230001_100000211211 [0,1,0,0,1,0|2,0,0]=4 5005 B11R1.180 O=C1OCCC1OCCCF 34a_100000759539_100000211211 [0,1,0,0,1,0|2,0,0]=4 5006 B11R1.180 O=C1OCCC1SCCCF 62a_100000211211_100011934791 [0,1,0,0,1,0|2,0,0]=4 5007 B11R1.180 O=C1OCCC1SCCCF 62a_100011934791_100000211211 [0,1,0,0,1,0|2,0,0]=4 5008 B11R1.180 O=C1OCCC1SCCCO 62a_100000211211_100011215043 [0,1,0,0,1,0|2,0,0]=4 5009 B11R1.180 O=C1OCCC1SCCCO 62a_100011215043_100000211211 [0,1,0,0,1,0|2,0,0]=4 5010 B11R1.180 [13CH3]NCCCN1CCCC1=O 2230a_100000210347_200025704644 [0,1,0,0,1,0|1,0,0]=3 5011 B11R1.180 [13CH3]NCCCN1CCCC1=O 34a_100000210347_200025704644 [0,1,0,0,1,0|1,0,0]=3 5012 B11R1.180 [13CH3]OCCCN1CCCC1=O 34a_100011216539_200025704644 [0,1,0,0,1,0|1,0,0]=3 5013 B11R1.180 [13CH3]OCCCN1CCCC1=O 7a_100011216539_200025704644 [0,1,0,0,1,0|1,0,0]=3 5014 B11R1.199 CCCC(=O)C1CCCC1=O 1458a_100000211992_100000211823 [0,1,0,0,1,0|0,0,1]=3 5015 B11R1.199 CCCC(=O)C1CCOC1=O 1458a_100000211992_100000211211 [0,1,0,0,1,0|1,0,1]=4 5016 B11R1.199 CCCN(C)C1CCCC1=O 2230a_100000747261_100000211823 [0,1,0,0,1,0|1,0,0]=3 5017 B11R1.199 CCCN(C)C1CCCC1=O 269982a_100000747261_100000211823 [0,1,0,0,1,0|1,0,0]=3 5018 B11R1.199 CCCN(C)C1CCOC1=O 2230a_100000747261_100000211211 [0,1,0,0,1,0|2,0,0]=4 5019 B11R1.199 CCCN(C)C1CCOC1=O 269982a_100000747261_100000211211 [0,1,0,0,1,0|2,0,0]=4 5020 B11R1.199 CN(CCO)C1CCCC1=O 2230a_100000210263_100000211823 [0,1,0,0,1,0|2,0,0]=4 5021 B11R1.199 CN(CCO)C1CCCC1=O 269982a_100000210263_100000211823 [0,1,0,0,1,0|2,0,0]=4 5022 B11R1.199 COCC(=O)C1CCCC1=O 1458a_100000210968_100000211823 [0,1,0,0,1,0|1,0,1]=4 5023 B11R1.199 CSCC(=O)C1CCCC1=O 1458a_100000184570_100000211823 [0,1,0,0,1,0|1,0,1]=4 5024 B11R1.199 O=C(CCO)C1CCCC1=O 1458a_100011216618_100000211823 [0,1,0,0,1,0|1,0,1]=4 5025 B11R1.228 CC(CF)OC1CCCC1=O 34a_100016041109_100000709159 [0,1,0,0,1,0|2,0,0]=4 5026 B11R1.228 CC(CF)OC1CCCC1=O 7a_100016041109_100000211823 [0,1,0,0,1,0|2,0,0]=4 5027 B11R1.228 CC(CN)OC1CCCC1=O 34a_100000210904_100000709159 [0,1,0,0,1,0|2,0,0]=4 5028 B11R1.228 CC(CO)OC1CCCC1=O 34a_200000719330_100012180447 [0,1,0,0,1,0|2,0,0]=4 5029 B11R1.228 CC(CO)SC1CCCC1=O 62a_100012180447_100000211823 [0,1,0,0,1,0|2,0,0]=4 5030 B11R1.228 CCC(=O)CN1CCCC1=O 1458a_100000189602_100000210202 [0,1,0,0,1,0|1,0,1]=4 5031 B11R1.228 CCC(C)NC1CCCC1=O 2230a_100000209981_100000211823 [0,1,0,0,1,0|1,0,0]=3 5032 B11R1.228 CCC(C)NC1CCNC1=O 2230a_100016995588_100000758301 [0,1,0,0,1,0|2,0,0]=4 5033 B11R1.228 CCC(C)NC1CCNC1=O 34a_100016995588_100011215416 [0,1,0,0,1,0|2,0,0]=4 5034 B11R1.228 CCC(C)NC1CCOC1=O 2230a_100000209981_100000211211 [0,1,0,0,1,0|2,0,0]=4 5035 B11R1.228 CCC(C)OC1CCCC1=O 34a_200000719330_100011215416 [0,1,0,0,1,0|1,0,0]=3 5036 B11R1.228 CCC(C)OC1CCCC1=O 7a_100000210228_100000211823 [0,1,0,0,1,0|1,0,0]=3 5037 B11R1.228 CCC(C)OC1CCOC1=O 7a_100000210228_100000211211 [0,1,0,0,1,0|2,0,0]=4 5038 B11R1.228 CCC(C)O[C@H]1CCNC1=O 34a_100000688343_100011215416 [0,1,0,0,1,0|2,0,0]=4 5039 B11R1.228 CCC(C)SC1CCCC1=O 62a_100000211823_100000758301 [0,1,0,0,1,0|1,0,0]=3 5040 B11R1.228 CCC(C)SC1CCCC1=O 62a_100000758301_100000211823 [0,1,0,0,1,0|1,0,0]=3 5041 B11R1.228 CCC(C)SC1CCOC1=O 62a_100000211211_100000758301 [0,1,0,0,1,0|2,0,0]=4 5042 B11R1.228 CCC(C)SC1CCOC1=O 62a_100000758301_100000211211 [0,1,0,0,1,0|2,0,0]=4 5043 B11R1.228 CCN(C)CN1CCCC1=O 269982a_100000225621_100000026320 [0,1,0,0,1,0|2,0,0]=4 5044 B11R1.228 COC(C)SC1CCCC1=O 62a_100000211823_100009879195 [0,1,0,0,1,0|2,0,0]=4 5045 B11R1.228 COC(C)SC1CCCC1=O 62a_100009879195_100000211823 [0,1,0,0,1,0|2,0,0]=4 5046 B11R1.228 C[C@H](CO)NC1CCCC1=O 2230a_100000737577_100000211823 [0,1,0,0,1,0|2,0,0]=4 5047 B11R1.228 C[C@H](CO)SC1CCCC1=O 62a_100000211823_100016084084 [0,1,0,0,1,0|2,0,0]=4 5048 B11R1.228 C[C@H](CO)SC1CCCC1=O 62a_100016084084_100000211823 [0,1,0,0,1,0|2,0,0]=4 5049 B11R1.465 CCCSC1C(=O)CCC1=O 62a_100000210303_100009820769 [0,1,0,0,1,0|1,0,1]=4 5050 B11R1.465 CCCSC1C(=O)CCC1=O 62a_100009820769_100000210303 [0,1,0,0,1,0|1,0,1]=4 5051 B13R1.1148 CCCCCN1CCCNC(=O)C1 2230a_100015190381_100000210326 [0,1,0,0,0,1|2,0,0]=4 5052 B13R1.1148 CCOCCN1CCCNC(=O)C1 2230a_100015190381_100011215890 [0,1,0,0,0,1|2,0,0]=4 5053 B13R1.1148 CCSCCN1CCCNC(=O)C1 2230a_100015190381_100000757381 [0,1,0,0,0,1|2,0,0]=4 5054 B13R1.1148 COCCCN1CCCNC(=O)C1 2230a_100015190381_100000740836 [0,1,0,0,0,1|2,0,0]=4 5055 B13R1.1148 O=C1CN(CCCN1)CCCCF 2230a_100015190381_100000729493 [0,1,0,0,0,1|2,0,0]=4 5056 B13R1.1148 O=C1CN(CCCN1)CCCCO 2230a_100015190381_100000210776 [0,1,0,0,0,1|2,0,0]=4 5057 B13R1.1462 CCCC(C)N1CCCNC(=O)C1 2230a_100015190381_100000766640 [0,1,0,0,0,1|2,0,0]=4 5058 B13R1.1462 CCCC(C)N1CCCNC(=O)C1 270004a_100015190381_100000211909 [0,1,0,0,0,1|2,0,0]=4 5059 B13R1.1868 CCC(C)CN1CCCNC(=O)C1 2230a_100015190381_100000748023 [0,1,0,0,0,1|2,0,0]=4 5060 B13R1.1868 CCC(C)CN1CCCNC(=O)C1 270004a_100015190381_100000243153 [0,1,0,0,0,1|2,0,0]=4 5061 B13R1.1868 CCC(O)CN1CCCNC(=O)C1 2230a_100015190381_100011218378 [0,1,0,0,0,1|2,0,0]=4 5062 B13R1.1868 CC[C@H](C)CN1CCCNC(=O)C1 2230a_100015190381_100009816398 [0,1,0,0,0,1|2,0,0]=4 5063 B13R1.1920 CCCCN1CCCN(C(=O)C1)C 2230a_100000709885_100000210211 [0,1,0,0,0,1|2,0,0]=4 5064 B13R1.1920 CCCCN1CCCN(C(=O)C1)C 269982a_100000709885_100000210211 [0,1,0,0,0,1|2,0,0]=4 5065 B13R1.1920 CCCCN1CCCN(C(=O)C1)C 34a_100000709885_100000210210 [0,1,0,0,0,1|2,0,0]=4 5066 B13R1.3501 CC(C)CCN1CCCNC(=O)C1 2230a_100015190381_100000210312 [0,1,0,0,0,1|2,0,0]=4 5067 B13R1.3501 CC(O)CCN1CCCNC(=O)C1 2230a_100015190381_100012276601 [0,1,0,0,0,1|2,0,0]=4 5068 B13R1.18 CCCCC(=O)C1CCNC(=O)C1 1458a_100000132800_100000210211 [0,2,0,0,0,0|2,0,0]=4 5069 B13R1.18 CCCCC(=O)C1CSCC(=O)N1 1458a_100000045068_100000210211 [0,2,0,0,0,0|2,0,0]=4 5070 B13R1.18 CCCCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000210211 [0,2,0,0,0,0|1,0,0]=3 5071 B13R1.18 CCCNC(=O)[C@H]1CCCC(=O)N1 240690a_100020643023_100000705292 [0,2,0,0,0,0|1,0,1]=4 5072 B13R1.18 CCCNC(=O)[C@H]1CCCC(=O)N1 527a_100020643023_100000705292 [0,2,0,0,0,0|1,0,1]=4 5073 B13R1.18 COCCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000233755 [0,2,0,0,0,0|1,0,1]=4 5074 B13R1.18 CSCCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000751147 [0,2,0,0,0,0|1,0,1]=4 5075 B13R1.18 O=C1CCC[C@@H](N1)C(=O)CCCF 1458a_100000705292_100011934791 [0,2,0,0,0,0|1,0,1]=4 5076 B13R1.18 O=C1CCC[C@@H](N1)C(=O)CCCO 1458a_100000705292_100011215043 [0,2,0,0,0,0|1,0,1]=4 5077 B13R1.22 CCC(C)C(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000758301 [0,2,0,0,0,0|1,0,1]=4 5078 B13R1.147 CC(C)CC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000210624 [0,2,0,0,0,0|1,0,1]=4 5079 B13R1.147 CC(O)CC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100011218427 [0,2,0,0,0,0|1,0,1]=4 5080 B13R1.16 CCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210303 [0,2,0,0,0,0|1,0,0]=3 5081 B13R1.16 CCCNCC1CCCC(=O)N1C 34a_200010383782_100000210303 [0,2,0,0,0,0|1,0,0]=3 5082 B13R1.16 CN1C(=O)CCCC1CNCCF 2230a_200010383782_100011217306 [0,2,0,0,0,0|2,0,0]=4 5083 B13R1.16 CN1C(=O)CCCC1CNCCF 34a_200010383782_100011217306 [0,2,0,0,0,0|2,0,0]=4 5084 B13R1.16 CN1C(=O)CCCC1CNCCO 2230a_200010383782_100000211926 [0,2,0,0,0,0|2,0,0]=4 5085 B13R1.16 CN1C(=O)CCCC1CNCCO 34a_200010383782_100000211926 [0,2,0,0,0,0|2,0,0]=4 5086 B13R1.16 COCNCC1CCCC(=O)N1C 2230a_200010383782_100000766300 [0,2,0,0,0,0|2,0,0]=4 5087 B13R1.16 CSCNCC1CCCC(=O)N1C 2230a_200010383782_100011218213 [0,2,0,0,0,0|2,0,0]=4 5088 B13R1.16 CSCNCC1CCCC(=O)N1C 34a_200010383782_100011218213 [0,2,0,0,0,0|2,0,0]=4 5089 B13R1.150 CC(C)NCC1CCCC(=O)N1C 2230a_200010383782_100000210206 [0,2,0,0,0,0|2,0,0]=4 5090 B13R1.150 CC(C)NCC1CCCC(=O)N1C 34a_200010383782_100000210206 [0,2,0,0,0,0|2,0,0]=4 5091 B13R1.6 C#CCCCOC1CCCC(=O)C1 34a_100012613340_100000695029 [0,2,0,0,0,0|1,0,1]=4 5092 B13R1.6 C#CCCOCC1CCCC(=O)N1 34a_200000102386_100000688953 [0,2,0,0,0,0|1,0,1]=4 5093 B13R1.6 C/C=C/COCC1CCCC(=O)N1 34a_200000102386_100102629194 [0,2,0,0,0,0|1,0,1]=4 5094 B13R1.6 C=CCCCOC1CCCC(=O)C1 34a_100012613340_100000757094 [0,2,0,0,0,0|1,0,1]=4 5095 B13R1.6 C=CCCOCC1CCCC(=O)N1 34a_200000102386_100000754431 [0,2,0,0,0,0|1,0,1]=4 5096 B13R1.6 CC#CCOCC1CCCC(=O)N1 34a_200000102386_100000748600 [0,2,0,0,0,0|1,0,1]=4 5097 B13R1.6 CC/C=C\COC1CCCC(=O)C1 34a_100012613340_100103147603 [0,2,0,0,0,0|1,0,1]=4 5098 B13R1.6 CC1=CC(CCC1)OCCCCF 34a_100011218613_100000729493 [0,2,0,0,0,0|2,0,0]=4 5099 B13R1.6 CC1=CC(CCC1)OCCCCO 34a_100011218613_100011216708 [0,2,0,0,0,0|2,0,0]=4 5100 B13R1.6 CC=CCOCC1CCCC(=O)N1 34a_200000102386_100000070051 [0,2,0,0,0,0|1,0,1]=4 5101 B13R1.6 CCC#CCOC1CCCC(=O)C1 34a_100012613340_100009813939 [0,2,0,0,0,0|1,0,1]=4 5102 B13R1.6 CCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210326 [0,2,0,0,0,0|2,0,0]=4 5103 B13R1.6 CCCCCNC1CCNC(=O)C1 34a_100016994916_100000718602 [0,2,0,0,0,0|2,0,0]=4 5104 B13R1.6 CCCCCOC1C=C(CCC1)C 34a_100011218613_100000718602 [0,2,0,0,0,0|2,0,0]=4 5105 B13R1.6 CCCCCOC1CCCC(=O)C1 34a_100012613340_100000718602 [0,2,0,0,0,0|1,0,0]=3 5106 B13R1.6 CCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000718602 [0,2,0,0,0,0|2,0,0]=4 5107 B13R1.6 CCCCOCC1CCCC(=O)N1 34a_200000102386_100000210210 [0,2,0,0,0,0|1,0,0]=3 5108 B13R1.6 CCCCOCC1CCNC(=O)C1 34a_100009886756_100000210210 [0,2,0,0,0,0|2,0,0]=4 5109 B13R1.6 CCCCOCC1COCC(=O)N1 34a_200000101122_100000210210 [0,2,0,0,0,0|2,0,0]=4 5110 B13R1.6 CCOCCNC1CCNC(=O)C1 2230a_100016994916_100011215890 [0,2,0,0,0,0|2,0,0]=4 5111 B13R1.6 CCOCCNC1CCNC(=O)C1 34a_100016994916_100000210147 [0,2,0,0,0,0|2,0,0]=4 5112 B13R1.6 CCOCCOC1C=C(CCC1)C 34a_100011218613_100000210147 [0,2,0,0,0,0|2,0,0]=4 5113 B13R1.6 CCOCCOC1CCCC(=O)C1 34a_100012613340_100000210147 [0,2,0,0,0,0|1,0,0]=3 5114 B13R1.6 CCOCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210147 [0,2,0,0,0,0|2,0,0]=4 5115 B13R1.6 CCSCCNC1CCNC(=O)C1 2230a_100016994916_100000757381 [0,2,0,0,0,0|2,0,0]=4 5116 B13R1.6 CCSCCNC1CCNC(=O)C1 34a_100016994916_100000757381 [0,2,0,0,0,0|2,0,0]=4 5117 B13R1.6 CCSCCOC1C=C(CCC1)C 34a_100011218613_100000757381 [0,2,0,0,0,0|2,0,0]=4 5118 B13R1.6 CCSCCOC1CCCC(=O)C1 34a_100012613340_100000757381 [0,2,0,0,0,0|1,0,0]=3 5119 B13R1.6 CCSCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000757381 [0,2,0,0,0,0|2,0,0]=4 5120 B13R1.6 COCCCNC1CCNC(=O)C1 2230a_100016994916_100000740836 [0,2,0,0,0,0|2,0,0]=4 5121 B13R1.6 COCCCNC1CCNC(=O)C1 34a_100016994916_100000740836 [0,2,0,0,0,0|2,0,0]=4 5122 B13R1.6 COCCCOC1C=C(CCC1)C 34a_100011218613_100000740836 [0,2,0,0,0,0|2,0,0]=4 5123 B13R1.6 COCCCOC1CCCC(=O)C1 34a_100012613340_100000740836 [0,2,0,0,0,0|1,0,0]=3 5124 B13R1.6 COCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000740836 [0,2,0,0,0,0|2,0,0]=4 5125 B13R1.6 COCCOCC1CCCC(=O)N1 34a_200000102386_100011201679 [0,2,0,0,0,0|1,0,0]=3 5126 B13R1.6 COCCOCC1CCNC(=O)C1 34a_100009886756_100011201679 [0,2,0,0,0,0|2,0,0]=4 5127 B13R1.6 COCCOCC1COCC(=O)N1 34a_200000101122_100011201679 [0,2,0,0,0,0|2,0,0]=4 5128 B13R1.6 CSCCOCC1CCCC(=O)N1 34a_200000102386_100000212216 [0,2,0,0,0,0|1,0,0]=3 5129 B13R1.6 CSCCOCC1CCNC(=O)C1 34a_100009886756_100000212216 [0,2,0,0,0,0|2,0,0]=4 5130 B13R1.6 CSCCOCC1COCC(=O)N1 34a_200000101122_100000212216 [0,2,0,0,0,0|2,0,0]=4 5131 B13R1.6 O=C1CC(CCN1)COCCCF 34a_100009886756_100011934791 [0,2,0,0,0,0|2,0,0]=4 5132 B13R1.6 O=C1CC(CCN1)COCCCO 34a_100009886756_100000230001 [0,2,0,0,0,0|2,0,0]=4 5133 B13R1.6 O=C1CC(CCN1)NCCCCF 2230a_100016994916_100000729493 [0,2,0,0,0,0|2,0,0]=4 5134 B13R1.6 O=C1CC(CCN1)NCCCCF 34a_100016994916_100000729493 [0,2,0,0,0,0|2,0,0]=4 5135 B13R1.6 O=C1CC(CCN1)NCCCCO 2230a_100016994916_100000210776 [0,2,0,0,0,0|2,0,0]=4 5136 B13R1.6 O=C1CC(CCN1)NCCCCO 34a_100016994916_100011216708 [0,2,0,0,0,0|2,0,0]=4 5137 B13R1.6 O=C1CCCC(C1)OCCCCF 34a_100012613340_100000729493 [0,2,0,0,0,0|1,0,0]=3 5138 B13R1.6 O=C1CCCC(C1)OCCCCO 34a_100012613340_100011216708 [0,2,0,0,0,0|1,0,0]=3 5139 B13R1.6 O=C1CCCC(N1)COCCCF 34a_200000102386_100011934791 [0,2,0,0,0,0|1,0,0]=3 5140 B13R1.6 O=C1CCCC(N1)COCCCO 34a_200000102386_100000230001 [0,2,0,0,0,0|1,0,0]=3 5141 B13R1.6 O=C1COCC(N1)COCCCF 34a_200000101122_100011934791 [0,2,0,0,0,0|2,0,0]=4 5142 B13R1.6 O=C1COCC(N1)COCCCO 34a_200000101122_100000230001 [0,2,0,0,0,0|2,0,0]=4 5143 B13R1.6 O=C1C[C@@H](CCN1)OCCCCF 34a_100015189427_100000729493 [0,2,0,0,0,0|2,0,0]=4 5144 B13R1.6 O=C1C[C@@H](CCN1)OCCCCO 34a_100015189427_100011216708 [0,2,0,0,0,0|2,0,0]=4 5145 B13R1.15 C#CC(C)OCC1CCCC(=O)N1 34a_200000102386_200000035995 [0,2,0,0,0,0|2,0,0]=4 5146 B13R1.15 CC(CO)OCC1CCCC(=O)N1 34a_200000102386_100012180447 [0,2,0,0,0,0|2,0,0]=4 5147 B13R1.15 CCC(C)CNC1CCNC(=O)C1 2230a_100016994916_100000748023 [0,2,0,0,0,0|2,0,0]=4 5148 B13R1.15 CCC(C)CNC1CCNC(=O)C1 34a_100016994916_100000748023 [0,2,0,0,0,0|2,0,0]=4 5149 B13R1.15 CCC(C)COC1C=C(CCC1)C 34a_100011218613_100000748023 [0,2,0,0,0,0|2,0,0]=4 5150 B13R1.15 CCC(C)COC1CCCC(=O)C1 34a_100012613340_100000748023 [0,2,0,0,0,0|1,0,0]=3 5151 B13R1.15 CCC(C)CO[C@@H]1CCNC(=O)C1 34a_100015189427_100000748023 [0,2,0,0,0,0|2,0,0]=4 5152 B13R1.15 CCC(C)OCC1CCCC(=O)N1 34a_200000102386_100011215416 [0,2,0,0,0,0|1,0,0]=3 5153 B13R1.15 CCC(C)OCC1CCNC(=O)C1 34a_100009886756_100011215416 [0,2,0,0,0,0|2,0,0]=4 5154 B13R1.15 CCC(C)OCC1COCC(=O)N1 34a_200000101122_100011215416 [0,2,0,0,0,0|2,0,0]=4 5155 B13R1.15 CCC(O)CNC1CCNC(=O)C1 2230a_100016994916_100011218378 [0,2,0,0,0,0|2,0,0]=4 5156 B13R1.15 CCC(O)CNC1CCNC(=O)C1 34a_100016994916_100011218378 [0,2,0,0,0,0|2,0,0]=4 5157 B13R1.15 CCC(O)COC1C=C(CCC1)C 34a_100011218613_100011218378 [0,2,0,0,0,0|2,0,0]=4 5158 B13R1.15 CCC(O)COC1CCCC(=O)C1 34a_100012613340_100011218378 [0,2,0,0,0,0|1,0,0]=3 5159 B13R1.15 CCC(O)CO[C@@H]1CCNC(=O)C1 34a_100015189427_100011218378 [0,2,0,0,0,0|2,0,0]=4 5160 B13R1.15 CC[C@H](C)CNC1CCNC(=O)C1 2230a_100016994916_100009816398 [0,2,0,0,0,0|2,0,0]=4 5161 B13R1.15 CC[C@H](C)CNC1CCNC(=O)C1 34a_100016994916_100009816398 [0,2,0,0,0,0|2,0,0]=4 5162 B13R1.15 CC[C@H](C)COC1C=C(CCC1)C 34a_100011218613_100009816398 [0,2,0,0,0,0|2,0,0]=4 5163 B13R1.15 CC[C@H](C)COC1CCCC(=O)C1 34a_100012613340_100009816398 [0,2,0,0,0,0|1,0,0]=3 5164 B13R1.15 CC[C@H](C)CO[C@@H]1CCNC(=O)C1 34a_100015189427_100009816398 [0,2,0,0,0,0|2,0,0]=4 5165 B13R1.15 C[C@@H](CO)COC1CCCC(=O)C1 34a_100012613340_100000059175 [0,2,0,0,0,0|2,0,0]=4 5166 B13R1.15 O=C1CCCC(C1)OCC(O)CO 34a_100012613340_100011219619 [0,2,0,0,0,0|2,0,0]=4 5167 B13R1.15 O=C1CCCC(C1)OC[C@@H](O)CF 34a_100012613340_100015614560 [0,2,0,0,0,0|2,0,0]=4 5168 B13R1.15 O=C1CCCC(C1)OC[C@@H](O)CO 34a_100012613340_100009815848 [0,2,0,0,0,0|2,0,0]=4 5169 B13R1.20 CC(CCO)OC1CCCC(=O)C1 34a_100012613340_100009893172 [0,2,0,0,0,0|2,0,0]=4 5170 B13R1.20 CCCC(C)NC1CCNC(=O)C1 2230a_100016994916_100000766640 [0,2,0,0,0,0|2,0,0]=4 5171 B13R1.20 CCCC(C)NC1CCNC(=O)C1 34a_100016994916_100000766640 [0,2,0,0,0,0|2,0,0]=4 5172 B13R1.20 CCCC(C)OC1C=C(CCC1)C 34a_100011218613_100000766640 [0,2,0,0,0,0|2,0,0]=4 5173 B13R1.20 CCCC(C)OC1CCCC(=O)C1 34a_100012613340_100000766640 [0,2,0,0,0,0|1,0,0]=3 5174 B13R1.20 CCCC(C)O[C@@H]1CCNC(=O)C1 34a_100015189427_100000766640 [0,2,0,0,0,0|2,0,0]=4 5175 B13R1.20 COCC(C)OC1CCCC(=O)C1 34a_100012613340_100000765312 [0,2,0,0,0,0|2,0,0]=4 5176 B13R1.149 C=C(C)CCOC1CCCC(=O)C1 34a_100012613340_100000730704 [0,2,0,0,0,0|1,0,1]=4 5177 B13R1.149 C=C(C)COCC1CCCC(=O)N1 34a_200000102386_100000748629 [0,2,0,0,0,0|1,0,1]=4 5178 B13R1.149 CC(C)CCNC1CCNC(=O)C1 2230a_100016994916_100000210312 [0,2,0,0,0,0|2,0,0]=4 5179 B13R1.149 CC(C)CCNC1CCNC(=O)C1 269862a_100016994916_100000185833 [0,2,0,0,0,0|2,0,0]=4 5180 B13R1.149 CC(C)CCNC1CCNC(=O)C1 34a_100016994916_100000210312 [0,2,0,0,0,0|2,0,0]=4 5181 B13R1.149 CC(C)CCOC1CCCC(=O)C1 34a_100012613340_100000210312 [0,2,0,0,0,0|1,0,0]=3 5182 B13R1.149 CC(C)CCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210312 [0,2,0,0,0,0|2,0,0]=4 5183 B13R1.149 CC(C)COCC1CCCC(=O)N1 34a_200000102386_100000210624 [0,2,0,0,0,0|1,0,0]=3 5184 B13R1.149 CC(C)COCC1CCNC(=O)C1 34a_100009886756_100000210624 [0,2,0,0,0,0|2,0,0]=4 5185 B13R1.149 CC(C)COCC1COCC(=O)N1 34a_200000101122_100000210624 [0,2,0,0,0,0|2,0,0]=4 5186 B13R1.149 CC(C)OCOC1CCCC(=O)C1 34a_100012613340_100000709892 [0,2,0,0,0,0|2,0,0]=4 5187 B13R1.149 CC(O)CCNC1CCNC(=O)C1 2230a_100016994916_100012276601 [0,2,0,0,0,0|2,0,0]=4 5188 B13R1.149 CC(O)CCNC1CCNC(=O)C1 34a_100016994916_100012276601 [0,2,0,0,0,0|2,0,0]=4 5189 B13R1.149 CC(O)CCOC1CCCC(=O)C1 34a_100012613340_100012276601 [0,2,0,0,0,0|1,0,0]=3 5190 B13R1.149 CC(O)CCO[C@@H]1CCNC(=O)C1 34a_100015189427_100012276601 [0,2,0,0,0,0|2,0,0]=4 5191 B13R1.149 CC(O)COCC1CCCC(=O)N1 34a_200000102386_100011218427 [0,2,0,0,0,0|1,0,0]=3 5192 B13R1.149 CC(O)COCC1CCNC(=O)C1 34a_100009886756_100011218427 [0,2,0,0,0,0|2,0,0]=4 5193 B13R1.149 CC(O)COCC1COCC(=O)N1 34a_200000101122_100011218427 [0,2,0,0,0,0|2,0,0]=4 5194 B13R1.149 CC1=CC(CCC1)OCCC(C)C 34a_100011218613_100000210312 [0,2,0,0,0,0|2,0,0]=4 5195 B13R1.149 CC1=CC(CCC1)OCCC(C)O 34a_100011218613_100012276601 [0,2,0,0,0,0|2,0,0]=4 5196 B13R1.149 C[C@@H](O)COCC1CCCC(=O)N1 34a_200000102386_100009817552 [0,2,0,0,0,0|1,0,0]=3 5197 B13R1.149 C[C@@H](O)COCC1CCNC(=O)C1 34a_100009886756_100009817552 [0,2,0,0,0,0|2,0,0]=4 5198 B13R1.149 C[C@@H](O)COCC1COCC(=O)N1 34a_200000101122_100009817552 [0,2,0,0,0,0|2,0,0]=4 5199 B13R1.149 O=C1CCCC(N1)COCC(F)F 34a_200000102386_100011934356 [0,2,0,0,0,0|2,0,0]=4 5200 B13R1.669 CCCCNC1CCN(C(=O)C1)C 2230a_100000126938_100000210211 [0,2,0,0,0,0|2,0,0]=4 5201 B13R1.669 CCCCNC1CCN(C(=O)C1)C 34a_100000126938_100000210210 [0,2,0,0,0,0|2,0,0]=4 5202 B13R1.838 CC(C)(C)COC1CCCC(=O)C1 34a_100012613340_100011219605 [0,2,0,0,0,0|2,0,0]=4 5203 B13R1.838 CC(C)(C)OCC1CCCC(=O)N1 34a_200000102386_100000210625 [0,2,0,0,0,0|2,0,0]=4 5204 B13R1.838 CC(C)(F)COC1CCCC(=O)C1 34a_100012613340_100011997219 [0,2,0,0,0,0|2,0,0]=4 5205 B13R1.838 CC(C)(O)COC1CCCC(=O)C1 34a_100012613340_100000764493 [0,2,0,0,0,0|2,0,0]=4 5206 B11R1.4 CCCCCOC1CCCC1 34a_100000210253_100000179811 [0,0,1,1,0,0|1,0,1]=4 5207 B11R1.4 CCCCCOC1CCCC1 34a_100000210269_100000718602 [0,0,1,1,0,0|1,0,1]=4 5208 B11R1.4 CCCCCOC1CCCC1 7a_100000210253_100000179811 [0,0,1,1,0,0|1,0,1]=4 5209 B11R1.4 CCCCCOC1CCCC1 7a_100000210269_100000210326 [0,0,1,1,0,0|1,0,1]=4 5210 B11R1.4 CCCCCOC1CCCO1 34a_100000085407_100000718602 [0,0,1,1,0,0|0,0,2]=4 5211 B11R1.30 CCCC(=O)C=C1CCCC1 1458a_100000743260_100000210303 [0,0,1,1,0,0|1,0,1]=4 5212 B11R1.30 CCCC(=O)CC1CCCC1 1458a_100000210891_100000210303 [0,0,1,1,0,0|1,0,0]=3 5213 B11R1.30 CCCC(=O)CC1CCCC1 1458a_100000211992_100000740388 [0,0,1,1,0,0|1,0,0]=3 5214 B11R1.30 CCCC(=O)CC1CCCO1 1458a_100000211992_100000203698 [0,0,1,1,0,0|2,0,0]=4 5215 B11R1.30 CCCC(=O)CC1CCOC1 1458a_100000211992_100000702531 [0,0,1,1,0,0|2,0,0]=4 5216 B11R1.30 CCCC(=O)CC1CCOC1 1458a_100011218419_100000210303 [0,0,1,1,0,0|2,0,0]=4 5217 B11R1.30 CCCC(=O)CN1CCCC1 1458a_100000740243_100000210303 [0,0,1,1,0,0|2,0,0]=4 5218 B11R1.30 CCCC(=O)CN1CCCC1 2230a_100000188435_100000747444 [0,0,1,1,0,0|2,0,0]=4 5219 B11R1.30 CCCC(=O)CN1CCCC1 269982a_100000188435_100000747444 [0,0,1,1,0,0|2,0,0]=4 5220 B11R1.30 CCCC(=O)NC1CCCC1 11a_100000211070_100000211992 [0,0,1,1,0,0|1,0,0]=3 5221 B11R1.30 CCCC(=O)NC1CCCC1 1626a_100000211070_100000211992 [0,0,1,1,0,0|1,0,0]=3 5222 B11R1.30 CCCC(=O)NC1CCCC1 240690a_100000211070_100000211992 [0,0,1,1,0,0|1,0,0]=3 5223 B11R1.30 CCCC(=O)NC1CCCC1 527a_100000211070_100000211992 [0,0,1,1,0,0|1,0,0]=3 5224 B11R1.30 CCCC(=O)N[C@@H]1CCOC1 240690a_200015188469_100000211992 [0,0,1,1,0,0|2,0,0]=4 5225 B11R1.30 CCCC(=O)N[C@@H]1CCOC1 527a_200015188469_100000211992 [0,0,1,1,0,0|2,0,0]=4 5226 B11R1.30 CCCC(=O)N[C@H]1CCOC1 11a_100015188467_100000211992 [0,0,1,1,0,0|2,0,0]=4 5227 B11R1.30 CCCC(=O)N[C@H]1CCOC1 1626a_100015188467_100000211992 [0,0,1,1,0,0|2,0,0]=4 5228 B11R1.30 CCCC(=O)N[C@H]1CCOC1 240690a_100015188467_100000211992 [0,0,1,1,0,0|2,0,0]=4 5229 B11R1.30 CCCC(=O)N[C@H]1CCOC1 527a_100015188467_100000211992 [0,0,1,1,0,0|2,0,0]=4 5230 B11R1.30 CCCC(C)OC1CCCC1 34a_100000210269_100000766640 [0,0,1,1,0,0|1,0,1]=4 5231 B11R1.30 CCCC(C)OC1CCCC1 34a_100000764384_100000179811 [0,0,1,1,0,0|1,0,1]=4 5232 B11R1.30 CCCC(C)OC1CCCC1 7a_100000210269_100000766640 [0,0,1,1,0,0|1,0,1]=4 5233 B11R1.30 CCCC(C)OC1CCCC1 7a_100000764384_100000179811 [0,0,1,1,0,0|1,0,1]=4 5234 B11R1.30 CCNC(=O)CC1CCCC1 11a_100015525214_100000210891 [0,0,1,1,0,0|2,0,0]=4 5235 B11R1.30 CCNC(=O)CC1CCCC1 240690a_100015525214_100000210891 [0,0,1,1,0,0|2,0,0]=4 5236 B11R1.30 CCNC(=O)CC1CCCC1 527a_100015525214_100000210891 [0,0,1,1,0,0|2,0,0]=4 5237 B11R1.30 CCNC(=O)NC1CCCC1 2708a_100000211070_100015525214 [0,0,1,1,0,0|2,0,0]=4 5238 B11R1.30 CCNC(=O)NC1CCCC1 2708a_100015525214_100000211070 [0,0,1,1,0,0|2,0,0]=4 5239 B11R1.30 CCNC(=O)NC1CCCC1 273464a_100000211070_100015525214 [0,0,1,1,0,0|2,0,0]=4 5240 B11R1.30 CCNC(=O)NC1CCCC1 273464a_100015525214_100000211070 [0,0,1,1,0,0|2,0,0]=4 5241 B11R1.30 CCNC(=O)NC1CCCC1 512a_100000211070_100015525214 [0,0,1,1,0,0|2,0,0]=4 5242 B11R1.30 CCNC(=O)NC1CCCC1 512a_100015525214_100000211070 [0,0,1,1,0,0|2,0,0]=4 5243 B11R1.30 CNCC(=O)NC1CCCC1 2230a_100000747513_200000210301 [0,0,1,1,0,0|2,0,0]=4 5244 B11R1.30 CNCC(=O)NC1CCCC1 2230a_106832991635_100000183512 [0,0,1,1,0,0|2,0,0]=4 5245 B11R1.30 CNCC(=O)NC1CCCC1 34a_100102657272_100000183512 [0,0,1,1,0,0|2,0,0]=4 5246 B11R1.30 CNCC(=O)NC1CCCC1 7a_106832991635_100000183512 [0,0,1,1,0,0|2,0,0]=4 5247 B11R1.30 COCC(=O)CC1CCCC1 1458a_100000210968_100000740388 [0,0,1,1,0,0|2,0,0]=4 5248 B11R1.30 COCC(=O)NC1CCCC1 11a_100000211070_100000210968 [0,0,1,1,0,0|2,0,0]=4 5249 B11R1.30 COCC(=O)NC1CCCC1 1626a_100000211070_100000210968 [0,0,1,1,0,0|2,0,0]=4 5250 B11R1.30 COCC(=O)NC1CCCC1 240690a_100000211070_100000210968 [0,0,1,1,0,0|2,0,0]=4 5251 B11R1.30 COCC(=O)NC1CCCC1 34a_100138415774_100000183512 [0,0,1,1,0,0|2,0,0]=4 5252 B11R1.30 COCC(=O)NC1CCCC1 527a_100000211070_100000210968 [0,0,1,1,0,0|2,0,0]=4 5253 B11R1.30 CSCC(=O)CC1CCCC1 1458a_100000184570_100000740388 [0,0,1,1,0,0|2,0,0]=4 5254 B11R1.30 CSCC(=O)NC1CCCC1 11a_100000211070_100000184570 [0,0,1,1,0,0|2,0,0]=4 5255 B11R1.30 CSCC(=O)NC1CCCC1 1626a_100000211070_100000184570 [0,0,1,1,0,0|2,0,0]=4 5256 B11R1.30 CSCC(=O)NC1CCCC1 240690a_100000211070_100000184570 [0,0,1,1,0,0|2,0,0]=4 5257 B11R1.30 CSCC(=O)NC1CCCC1 527a_100000211070_100000184570 [0,0,1,1,0,0|2,0,0]=4 5258 B11R1.30 CSCC(=O)NC1CCCC1 62a_100000183512_200000210301 [0,0,1,1,0,0|2,0,0]=4 5259 B11R1.30 CSCC(=O)NC1CCCC1 62a_200000210301_100000183512 [0,0,1,1,0,0|2,0,0]=4 5260 B11R1.30 O=C(CCF)CC1CCCC1 1458a_100000210891_100011217306 [0,0,1,1,0,0|2,0,0]=4 5261 B11R1.30 O=C(CCO)CC1CCCC1 1458a_100000210891_100000211926 [0,0,1,1,0,0|2,0,0]=4 5262 B11R1.30 O=C(CCO)CC1CCCC1 1458a_100011216618_100000740388 [0,0,1,1,0,0|2,0,0]=4 5263 B11R1.30 O=C(CCO)NC1CCCC1 240690a_100000211070_100011216618 [0,0,1,1,0,0|2,0,0]=4 5264 B11R1.30 [13CH3]NCC(=O)NC1CCCC1 2230a_100000747513_200025704644 [0,0,1,1,0,0|2,0,0]=4 5265 B11R1.30 [13CH3]SCC(=O)NC1CCCC1 62a_100000183512_200025704644 [0,0,1,1,0,0|2,0,0]=4 5266 B11R1.30 [13CH3]SCC(=O)NC1CCCC1 62a_200025704644_100000183512 [0,0,1,1,0,0|2,0,0]=4 5267 B11R1.265 CCC1C(=O)NCCN1CC 2230a_100000187962_100000210202 [0,0,1,1,0,0|2,0,0]=4 5268 B11R1.265 CCC1C(=O)NCCN1CC 269982a_100000187962_100000204670 [0,0,1,1,0,0|2,0,0]=4 5269 B11R1.265 CCC1C(=O)NCCN1CC 34a_100000187962_100000210202 [0,0,1,1,0,0|2,0,0]=4 5270 B11R1.288 CCCC(C)OCC1CC1C 34a_100000744939_100000766640 [0,0,1,1,0,0|1,0,1]=4 5271 B11R1.288 CCCC(C)OCC1CC1C 7a_100000744939_100000766640 [0,0,1,1,0,0|1,0,1]=4 5272 B11R1.289 CCCC(=O)CNC1CCC1 2230a_100000749019_100000747444 [0,0,1,1,0,0|2,0,0]=4 5273 B11R1.289 CCCC(=O)CSC1CCC1 62a_100000747444_100000749161 [0,0,1,1,0,0|2,0,0]=4 5274 B11R1.289 CCCC(=O)NCC1CCC1 11a_100000738700_100000211992 [0,0,1,1,0,0|1,0,0]=3 5275 B11R1.289 CCCC(=O)NCC1CCC1 1626a_100000738700_100000211992 [0,0,1,1,0,0|1,0,0]=3 5276 B11R1.289 CCCC(=O)NCC1CCC1 240690a_100000738700_100000211992 [0,0,1,1,0,0|1,0,0]=3 5277 B11R1.289 CCCC(=O)NCC1CCC1 527a_100000738700_100000211992 [0,0,1,1,0,0|1,0,0]=3 5278 B11R1.289 CCCC(=O)NCC1COC1 11a_100015281925_100000211992 [0,0,1,1,0,0|2,0,0]=4 5279 B11R1.289 CCCC(=O)NCC1COC1 1626a_100015281925_100000211992 [0,0,1,1,0,0|2,0,0]=4 5280 B11R1.289 CCCC(=O)NCC1COC1 240690a_100015281925_100000211992 [0,0,1,1,0,0|2,0,0]=4 5281 B11R1.289 CCCC(=O)NCC1COC1 527a_100015281925_100000211992 [0,0,1,1,0,0|2,0,0]=4 5282 B11R1.289 CCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000211992 [0,0,1,1,0,0|2,0,0]=4 5283 B11R1.289 CCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000211992 [0,0,1,1,0,0|2,0,0]=4 5284 B11R1.289 CCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000211992 [0,0,1,1,0,0|2,0,0]=4 5285 B11R1.289 CCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000211992 [0,0,1,1,0,0|2,0,0]=4 5286 B11R1.289 CCCC(=O)NNC1CCC1 22a_100000736358_100000211992 [0,0,1,1,0,0|2,0,0]=4 5287 B11R1.289 CCCC(=O)OCN1CCC1 269982a_100000754969_100000034017 [0,0,1,1,0,0|1,0,0]=3 5288 B11R1.289 CCCC(C)OCC1CCC1 34a_100000760304_100000766640 [0,0,1,1,0,0|1,0,1]=4 5289 B11R1.289 CCCC(C)OCC1CCC1 34a_100000764384_100000763275 [0,0,1,1,0,0|1,0,1]=4 5290 B11R1.289 CCCC(C)OCC1CCC1 7a_100000764384_100000763275 [0,0,1,1,0,0|1,0,1]=4 5291 B11R1.289 CCNC(=O)NCC1CCC1 2708a_100000738700_100015525214 [0,0,1,1,0,0|2,0,0]=4 5292 B11R1.289 CCNC(=O)NCC1CCC1 2708a_100015525214_100000738700 [0,0,1,1,0,0|2,0,0]=4 5293 B11R1.289 CCNC(=O)NCC1CCC1 273464a_100000738700_100015525214 [0,0,1,1,0,0|2,0,0]=4 5294 B11R1.289 CCNC(=O)NCC1CCC1 273464a_100015525214_100000738700 [0,0,1,1,0,0|2,0,0]=4 5295 B11R1.289 CCNC(=O)NCC1CCC1 512a_100000738700_100015525214 [0,0,1,1,0,0|2,0,0]=4 5296 B11R1.289 CCNC(=O)NCC1CCC1 512a_100015525214_100000738700 [0,0,1,1,0,0|2,0,0]=4 5297 B11R1.289 COCC(=O)NCC1CCC1 11a_100000738700_100000210968 [0,0,1,1,0,0|2,0,0]=4 5298 B11R1.289 COCC(=O)NCC1CCC1 1626a_100000738700_100000210968 [0,0,1,1,0,0|2,0,0]=4 5299 B11R1.289 COCC(=O)NCC1CCC1 240690a_100000738700_100000210968 [0,0,1,1,0,0|2,0,0]=4 5300 B11R1.289 COCC(=O)NCC1CCC1 527a_100000738700_100000210968 [0,0,1,1,0,0|2,0,0]=4 5301 B11R1.289 CSCC(=O)NCC1CCC1 11a_100000738700_100000184570 [0,0,1,1,0,0|2,0,0]=4 5302 B11R1.289 CSCC(=O)NCC1CCC1 1626a_100000738700_100000184570 [0,0,1,1,0,0|2,0,0]=4 5303 B11R1.289 CSCC(=O)NCC1CCC1 240690a_100000738700_100000184570 [0,0,1,1,0,0|2,0,0]=4 5304 B11R1.289 CSCC(=O)NCC1CCC1 527a_100000738700_100000184570 [0,0,1,1,0,0|2,0,0]=4 5305 B11R1.289 O=C(CCO)NCC1CCC1 240690a_100000738700_100011216618 [0,0,1,1,0,0|2,0,0]=4 5306 B11R1.290 CCCC(=O)CCCC1CO1 1458a_100000211992_100000733510 [0,0,1,1,0,0|2,0,0]=4 5307 B11R1.290 CCCC(=O)CNCC1CC1 2230a_100000735609_100000747444 [0,0,1,1,0,0|2,0,0]=4 5308 B11R1.290 CCCC(=O)CSCC1CC1 1458a_200011316215_100000210303 [0,0,1,1,0,0|2,0,0]=4 5309 B11R1.290 CCCC(=O)CSCC1CC1 62a_100000747444_100000742324 [0,0,1,1,0,0|2,0,0]=4 5310 B11R1.290 CCCC(=O)CSCC1CC1 62a_100000756562_100000747444 [0,0,1,1,0,0|2,0,0]=4 5311 B11R1.290 CCCC(=O)NCCC1CC1 1626a_100000764129_100000211992 [0,0,1,1,0,0|1,0,0]=3 5312 B11R1.290 CCCC(=O)NCCC1CC1 240690a_100000764129_100000211992 [0,0,1,1,0,0|1,0,0]=3 5313 B11R1.290 CCCC(=O)NCCC1CC1 527a_100000764129_100000211992 [0,0,1,1,0,0|1,0,0]=3 5314 B11R1.290 CCCC(=O)NNCC1CC1 22a_100000736359_100000211992 [0,0,1,1,0,0|2,0,0]=4 5315 B11R1.290 CCCC(=O)OCNC1CC1 34a_100000212008_100000034017 [0,0,1,1,0,0|1,0,0]=3 5316 B11R1.290 CCCC(C)OCCC1CC1 34a_100000754188_100000766640 [0,0,1,1,0,0|1,0,1]=4 5317 B11R1.290 CCCC(C)OCCC1CC1 34a_100000764384_100000694398 [0,0,1,1,0,0|1,0,1]=4 5318 B11R1.290 CCCC(C)OCCC1CC1 7a_100000754188_100000766640 [0,0,1,1,0,0|1,0,1]=4 5319 B11R1.290 CCCC(C)OCCC1CC1 7a_100000764384_100000764125 [0,0,1,1,0,0|1,0,1]=4 5320 B11R1.290 CCNC(=O)NCCC1CC1 2708a_100000764129_100015525214 [0,0,1,1,0,0|2,0,0]=4 5321 B11R1.290 CCNC(=O)NCCC1CC1 2708a_100015525214_100000764129 [0,0,1,1,0,0|2,0,0]=4 5322 B11R1.290 CCNC(=O)NCCC1CC1 273464a_100000764129_100015525214 [0,0,1,1,0,0|2,0,0]=4 5323 B11R1.290 CCNC(=O)NCCC1CC1 273464a_100015525214_100000764129 [0,0,1,1,0,0|2,0,0]=4 5324 B11R1.290 CCNC(=O)NCCC1CC1 512a_100000764129_100015525214 [0,0,1,1,0,0|2,0,0]=4 5325 B11R1.290 CCNC(=O)NCCC1CC1 512a_100015525214_100000764129 [0,0,1,1,0,0|2,0,0]=4 5326 B11R1.290 COCC(=O)NCCC1CC1 1626a_100000764129_100000210968 [0,0,1,1,0,0|2,0,0]=4 5327 B11R1.290 COCC(=O)NCCC1CC1 240690a_100000764129_100000210968 [0,0,1,1,0,0|2,0,0]=4 5328 B11R1.290 COCC(=O)NCCC1CC1 527a_100000764129_100000210968 [0,0,1,1,0,0|2,0,0]=4 5329 B11R1.290 CSCC(=O)NCCC1CC1 1626a_100000764129_100000184570 [0,0,1,1,0,0|2,0,0]=4 5330 B11R1.290 CSCC(=O)NCCC1CC1 240690a_100000764129_100000184570 [0,0,1,1,0,0|2,0,0]=4 5331 B11R1.290 CSCC(=O)NCCC1CC1 527a_100000764129_100000184570 [0,0,1,1,0,0|2,0,0]=4 5332 B11R1.290 O=C(CCO)NCCC1CC1 240690a_100000764129_100011216618 [0,0,1,1,0,0|2,0,0]=4 5333 B11R1.291 CCCC(=O)CN1CCC1C 269982a_100000755817_100000747444 [0,0,1,1,0,0|2,0,0]=4 5334 B11R1.356 CCCCCCC(=O)C1CC1 1458a_100000210395_100000210757 [0,0,1,1,0,0|1,0,0]=3 5335 B11R1.356 CCCCCCC(=O)C1CO1 1458a_100000701028_100000210757 [0,0,1,1,0,0|2,0,0]=4 5336 B11R1.356 CCCCCNC(=O)C1CC1 11a_100000209983_100000210395 [0,0,1,1,0,0|1,0,0]=3 5337 B11R1.356 CCCCCNC(=O)C1CC1 1626a_100000209983_100000210395 [0,0,1,1,0,0|1,0,0]=3 5338 B11R1.356 CCCCCNC(=O)C1CC1 240690a_100000209983_100000210395 [0,0,1,1,0,0|1,0,0]=3 5339 B11R1.356 CCCCCNC(=O)C1CC1 527a_100000209983_100000210395 [0,0,1,1,0,0|1,0,0]=3 5340 B11R1.356 CCCCCNC(=O)C1CO1 11a_100000209983_100000701028 [0,0,1,1,0,0|2,0,0]=4 5341 B11R1.356 CCCCCNC(=O)C1CO1 1626a_100000209983_100000701028 [0,0,1,1,0,0|2,0,0]=4 5342 B11R1.356 CCCCCNC(=O)C1CO1 240690a_100000209983_100000701028 [0,0,1,1,0,0|2,0,0]=4 5343 B11R1.356 CCCCCNC(=O)C1CO1 527a_100000209983_100000701028 [0,0,1,1,0,0|2,0,0]=4 5344 B11R1.356 CCCCCOC(C)C1CC1 34a_100000744524_100000718602 [0,0,1,1,0,0|1,0,1]=4 5345 B11R1.356 CCCCCOC(C)C1CC1 7a_100000744524_100000210326 [0,0,1,1,0,0|1,0,1]=4 5346 B11R1.356 CCCCNCC(=O)C1CC1 2230a_100000102301_100000746382 [0,0,1,1,0,0|2,0,0]=4 5347 B11R1.356 CCCCNCC(=O)C1CC1 7a_106832991798_100000746382 [0,0,1,1,0,0|2,0,0]=4 5348 B11R1.356 CCCCNNC(=O)C1CC1 22a_100025702795_100000210395 [0,0,1,1,0,0|2,0,0]=4 5349 B11R1.356 CCCCOCC(=O)C1CC1 1458a_100000210395_100011995733 [0,0,1,1,0,0|2,0,0]=4 5350 B11R1.356 CCCCOCC(=O)C1CC1 34a_100000210227_100000746382 [0,0,1,1,0,0|2,0,0]=4 5351 B11R1.356 CCCCOCC(=O)C1CC1 34a_100000686663_100000210210 [0,0,1,1,0,0|2,0,0]=4 5352 B11R1.356 CCCCOCC(=O)C1CC1 7a_100000210227_100000746382 [0,0,1,1,0,0|2,0,0]=4 5353 B11R1.356 CCCCSCC(=O)C1CC1 62a_100000210211_100000746382 [0,0,1,1,0,0|2,0,0]=4 5354 B11R1.356 CCCCSCC(=O)C1CC1 62a_100000746382_100000210210 [0,0,1,1,0,0|2,0,0]=4 5355 B11R1.356 CCCOCCC(=O)C1CC1 1458a_100000210395_100011215938 [0,0,1,1,0,0|2,0,0]=4 5356 B11R1.356 CCCOCOC(=O)C1CC1 34a_100000210258_100000140896 [0,0,1,1,0,0|1,0,0]=3 5357 B11R1.356 CCCSCOC(=O)C1CC1 62a_100000140896_100000210303 [0,0,1,1,0,0|1,0,0]=3 5358 B11R1.356 CCCSCOC(=O)C1CC1 62a_100000210303_100000140896 [0,0,1,1,0,0|1,0,0]=3 5359 B11R1.356 CCOCCCC(=O)C1CC1 1458a_100000210395_100012232248 [0,0,1,1,0,0|2,0,0]=4 5360 B11R1.356 CCOCCNC(=O)C1CC1 11a_100011200944_100000210395 [0,0,1,1,0,0|2,0,0]=4 5361 B11R1.356 CCOCCNC(=O)C1CC1 1626a_102516460346_100000210395 [0,0,1,1,0,0|2,0,0]=4 5362 B11R1.356 CCOCCNC(=O)C1CC1 240690a_100011200944_100000210395 [0,0,1,1,0,0|2,0,0]=4 5363 B11R1.356 CCOCCNC(=O)C1CC1 527a_100011200944_100000210395 [0,0,1,1,0,0|2,0,0]=4 5364 B11R1.356 CCSCCNC(=O)C1CC1 11a_100000106463_100000210395 [0,0,1,1,0,0|2,0,0]=4 5365 B11R1.356 CCSCCNC(=O)C1CC1 1626a_100000106463_100000210395 [0,0,1,1,0,0|2,0,0]=4 5366 B11R1.356 CCSCCNC(=O)C1CC1 240690a_100000106463_100000210395 [0,0,1,1,0,0|2,0,0]=4 5367 B11R1.356 CCSCCNC(=O)C1CC1 527a_100000106463_100000210395 [0,0,1,1,0,0|2,0,0]=4 5368 B11R1.356 COCCCCC(=O)C1CC1 1458a_100000210395_100000755781 [0,0,1,1,0,0|2,0,0]=4 5369 B11R1.356 COCCCNC(=O)C1CC1 1626a_100150723488_100000210395 [0,0,1,1,0,0|2,0,0]=4 5370 B11R1.356 COCCCNC(=O)C1CC1 240690a_100150723488_100000210395 [0,0,1,1,0,0|2,0,0]=4 5371 B11R1.356 COCCCNC(=O)C1CC1 527a_100150723488_100000210395 [0,0,1,1,0,0|2,0,0]=4 5372 B11R1.356 COCSCOC(=O)C1CC1 62a_100000140896_100000766300 [0,0,1,1,0,0|2,0,0]=4 5373 B11R1.356 COCSCOC(=O)C1CC1 62a_100000766300_100000140896 [0,0,1,1,0,0|2,0,0]=4 5374 B11R1.356 CSCCCNC(=O)C1CC1 11a_100000749238_100000210395 [0,0,1,1,0,0|2,0,0]=4 5375 B11R1.356 CSCCCNC(=O)C1CC1 1626a_100000749238_100000210395 [0,0,1,1,0,0|2,0,0]=4 5376 B11R1.356 CSCCCNC(=O)C1CC1 240690a_100000749238_100000210395 [0,0,1,1,0,0|2,0,0]=4 5377 B11R1.356 CSCCCNC(=O)C1CC1 527a_100000749238_100000210395 [0,0,1,1,0,0|2,0,0]=4 5378 B11R1.356 CSCSCOC(=O)C1CC1 62a_100000140896_100011218213 [0,0,1,1,0,0|2,0,0]=4 5379 B11R1.356 CSCSCOC(=O)C1CC1 62a_100011218213_100000140896 [0,0,1,1,0,0|2,0,0]=4 5380 B11R1.356 NCCOCOC(=O)C1CC1 34a_100000210304_100000140896 [0,0,1,1,0,0|2,0,0]=4 5381 B11R1.356 O=C(CCCCCF)C1CC1 1458a_100000210395_100000729378 [0,0,1,1,0,0|2,0,0]=4 5382 B11R1.356 O=C(CCCCCO)C1CC1 1458a_100000210395_100000746330 [0,0,1,1,0,0|2,0,0]=4 5383 B11R1.356 O=C(NCCCCO)C1CC1 240690a_100000750430_100000210395 [0,0,1,1,0,0|2,0,0]=4 5384 B11R1.356 O=C(NCCCCO)C1CC1 527a_100000750430_100000210395 [0,0,1,1,0,0|2,0,0]=4 5385 B11R1.356 O=C(OCNCCF)C1CC1 34a_100000724931_100000140896 [0,0,1,1,0,0|2,0,0]=4 5386 B11R1.356 O=C(OCNCCO)C1CC1 2230a_100016997473_100000140896 [0,0,1,1,0,0|2,0,0]=4 5387 B11R1.356 O=C(OCNCCO)C1CC1 34a_100016990907_100000140896 [0,0,1,1,0,0|2,0,0]=4 5388 B11R1.356 O=C(OCOCCBr)C1CC1 34a_100000211926_100000140896 [0,0,1,1,0,0|2,0,0]=4 5389 B11R1.356 O=C(OCSCCF)C1CC1 62a_100000140896_100011217306 [0,0,1,1,0,0|2,0,0]=4 5390 B11R1.356 O=C(OCSCCF)C1CC1 62a_100011217306_100000140896 [0,0,1,1,0,0|2,0,0]=4 5391 B11R1.356 O=C(OCSCCO)C1CC1 62a_100000140896_100000211926 [0,0,1,1,0,0|2,0,0]=4 5392 B11R1.356 O=C(OCSCCO)C1CC1 62a_100000211926_100000140896 [0,0,1,1,0,0|2,0,0]=4 5393 B11R1.899 CCCCCOC1(CCC1)C 34a_100000759064_100000718602 [0,0,1,1,0,0|1,0,1]=4 5394 B11R1.899 CCCCCOC1(CCC1)C 7a_100000759064_100000210326 [0,0,1,1,0,0|1,0,1]=4 5395 B11R1.53 CCC1CCCCN1C(=O)C 11a_100000210034_100015343762 [0,0,1,1,0,0|2,0,0]=4 5396 B11R1.53 CCC1CCCCN1C(=O)C 1626a_100000210034_100015343762 [0,0,1,1,0,0|2,0,0]=4 5397 B11R1.53 CCC1CCCCN1C(=O)C 240690a_100000210034_100015343762 [0,0,1,1,0,0|2,0,0]=4 5398 B11R1.53 CCC1CCCCN1C(=O)C 527a_100000210034_100103153847 [0,0,1,1,0,0|2,0,0]=4 5399 B11R1.53 CCN1CCCCC1C(=O)C 1458a_100000743832_200000210301 [0,0,1,1,0,0|2,0,0]=4 5400 B11R1.53 CCN1CCCCC1C(=O)N 2230a_100000181395_100000210202 [0,0,1,1,0,0|2,0,0]=4 5401 B11R1.53 CCN1CCCCC1C(=O)N 269982a_100000181395_100000204670 [0,0,1,1,0,0|2,0,0]=4 5402 B11R1.53 CCN1CCCCC1C(=O)N 34a_100000181395_100000210202 [0,0,1,1,0,0|2,0,0]=4 5403 B11R1.53 CCN1CCCCC1C(=O)[13CH3] 1458a_100000743832_200025704644 [0,0,1,1,0,0|2,0,0]=4 5404 B11R1.53 CCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000210202 [0,0,1,1,0,0|1,0,0]=3 5405 B11R1.53 CCN1CCOC[C@@H]1C(=O)O 269956a_100016993156_100000210202 [0,0,1,1,0,0|2,0,0]=4 5406 B11R1.53 CCN1CCSCC1C(=O)O 269956a_100011346106_100000210202 [0,0,1,1,0,0|2,0,0]=4 5407 B11R1.53 CCN1CSCCC1C(=O)O 269956a_100015185162_100000210202 [0,0,1,1,0,0|2,0,0]=4 5408 B11R1.53 CN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_200000210301 [0,0,1,1,0,0|1,0,0]=3 5409 B11R1.53 O=C(O)[C@H]1CCCCN1CF 269956a_100000763471_100015361967 [0,0,1,1,0,0|2,0,0]=4 5410 B11R1.53 [13CH3]N[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_200025704644 [0,0,1,1,0,0|1,0,0]=3 5411 B11R1.57 CCC1CCCN1CC(=O)N 2230a_100000754278_100000747473 [0,0,1,1,0,0|2,0,0]=4 5412 B11R1.57 CCC1CCCN1CC(=O)N 269982a_100000754278_100000187820 [0,0,1,1,0,0|2,0,0]=4 5413 B11R1.57 CCC1CCCN1CC(=O)N 34a_100000754278_100000187820 [0,0,1,1,0,0|2,0,0]=4 5414 B11R1.57 CCC1CCCN1CC(=O)[O-] 269982a_100000754278_100020667443 [0,0,1,1,0,0|1,0,1]=4 5415 B11R1.57 CCC1CCCN1CC(=O)[O-] 34a_100000754278_100020667443 [0,0,1,1,0,0|1,0,1]=4 5416 B11R1.86 CC(=O)CC1CCCCN1C 1458a_100000070787_100015185383 [0,0,1,1,0,0|2,0,0]=4 5417 B11R1.86 CC(=O)NC1CCCCC1C 11a_100000211402_100015343762 [0,0,1,1,0,0|2,0,0]=4 5418 B11R1.86 CC(=O)NC1CCCCC1C 1626a_100000211402_100015343762 [0,0,1,1,0,0|2,0,0]=4 5419 B11R1.86 CC(=O)NC1CCCCC1C 240690a_100000211402_100015343762 [0,0,1,1,0,0|2,0,0]=4 5420 B11R1.86 CC(=O)NC1CCCCC1C 527a_100000211402_100103153847 [0,0,1,1,0,0|2,0,0]=4 5421 B11R1.86 CC1CCCCN1CC(=O)N 2230a_100000211376_100000747473 [0,0,1,1,0,0|2,0,0]=4 5422 B11R1.86 CC1CCCCN1CC(=O)N 269982a_100000211376_100000187820 [0,0,1,1,0,0|2,0,0]=4 5423 B11R1.86 CC1CCCCN1CC(=O)N 34a_100000211376_100000187820 [0,0,1,1,0,0|2,0,0]=4 5424 B11R1.86 CC1CCCCN1CC(=O)[O-] 269982a_100000211376_100020667443 [0,0,1,1,0,0|1,0,1]=4 5425 B11R1.86 CC1CCCCN1CC(=O)[O-] 34a_100000211376_100020667443 [0,0,1,1,0,0|1,0,1]=4 5426 B11R1.86 CN1CCCCC1CC(=O)N 2230a_100015184752_200000210301 [0,0,1,1,0,0|2,0,0]=4 5427 B11R1.86 CN1CCCCC1CC(=O)N 269982a_100015184752_200000210301 [0,0,1,1,0,0|2,0,0]=4 5428 B11R1.86 CN1CCCCC1CC(=O)N 34a_100015184752_200000210301 [0,0,1,1,0,0|2,0,0]=4 5429 B11R1.86 [13CH3]N1CCCCC1CC(=O)N 2230a_100015184752_200025704644 [0,0,1,1,0,0|2,0,0]=4 5430 B11R1.86 [13CH3]N1CCCCC1CC(=O)N 269982a_100015184752_200025704644 [0,0,1,1,0,0|2,0,0]=4 5431 B11R1.86 [13CH3]N1CCCCC1CC(=O)N 34a_100015184752_200025704644 [0,0,1,1,0,0|2,0,0]=4 5432 B11R1.102 CC(=O)CCOCC1CC1C 7a_100000744939_100000053229 [0,0,1,1,0,0|2,0,0]=4 5433 B11R1.102 CC1CC1COCCC(=O)N 34a_100000744939_100000731001 [0,0,1,1,0,0|2,0,0]=4 5434 B11R1.102 CC1CC1COCCC(=O)N 7a_100000744939_100000744528 [0,0,1,1,0,0|2,0,0]=4 5435 B11R1.143 CC(=O)C1CCCCCN1C 1458a_100015187800_200000210301 [0,0,1,1,0,0|2,0,0]=4 5436 B11R1.143 CN1CCCCCC1C(=O)O 269956a_100000758484_200000210301 [0,0,1,1,0,0|1,0,0]=3 5437 B11R1.143 CN1CCCCCC1C(=O)[13CH3] 1458a_100015187800_200025704644 [0,0,1,1,0,0|2,0,0]=4 5438 B11R1.143 [13CH3]N1CCCCCC1C(=O)O 269956a_100000758484_200025704644 [0,0,1,1,0,0|1,0,0]=3 5439 B11R1.161 CC(=O)CCCN1CCC1C 269982a_100000755817_100011215641 [0,0,1,1,0,0|2,0,0]=4 5440 B11R1.161 CC(=O)CCCN1CCC1C 34a_100000755817_100000685027 [0,0,1,1,0,0|2,0,0]=4 5441 B11R1.161 CC1CCN1CCCC(=O)N 269982a_100000755817_100102525003 [0,0,1,1,0,0|2,0,0]=4 5442 B11R1.161 CC1CCN1CCCC(=O)N 34a_100000755817_100102525003 [0,0,1,1,0,0|2,0,0]=4 5443 B11R1.172 CC(=O)CCCC1CCCC1 1458a_100000070787_100011713738 [0,0,1,1,0,0|1,0,0]=3 5444 B11R1.172 CC(=O)CCCN1CCCC1 1458a_100000070787_100011445909 [0,0,1,1,0,0|2,0,0]=4 5445 B11R1.172 CC(=O)CCCN1CCCC1 1458a_100000743284_200000210301 [0,0,1,1,0,0|2,0,0]=4 5446 B11R1.172 CC(=O)CCCN1CCCC1 269982a_100000188435_100011215641 [0,0,1,1,0,0|2,0,0]=4 5447 B11R1.172 CC(=O)CCOC1CCCC1 34a_100000759926_100000179811 [0,0,1,1,0,0|2,0,0]=4 5448 B11R1.172 CC(=O)CCOC1CCCC1 7a_100000210269_100000053229 [0,0,1,1,0,0|2,0,0]=4 5449 B11R1.172 CC(=O)CCOC1CCCC1 7a_100000759926_100000179811 [0,0,1,1,0,0|2,0,0]=4 5450 B11R1.172 CC(=O)CCSC1CCCC1 62a_100000053229_100000179811 [0,0,1,1,0,0|2,0,0]=4 5451 B11R1.172 CC(=O)CCSC1CCCC1 62a_100011217020_100000053229 [0,0,1,1,0,0|2,0,0]=4 5452 B11R1.172 CC(=O)COCC1CCCC1 34a_100000211253_100000740388 [0,0,1,1,0,0|2,0,0]=4 5453 B11R1.172 CC(=O)NCCC1CCCC1 11a_100000739158_100015343762 [0,0,1,1,0,0|2,0,0]=4 5454 B11R1.172 CC(=O)NCCC1CCCC1 1626a_100000739158_100015343762 [0,0,1,1,0,0|2,0,0]=4 5455 B11R1.172 CC(=O)NCCC1CCCC1 240690a_100000739158_100015343762 [0,0,1,1,0,0|2,0,0]=4 5456 B11R1.172 CC(=O)NCCC1CCCC1 527a_100000739158_100103153847 [0,0,1,1,0,0|2,0,0]=4 5457 B11R1.172 NC(=O)CCCN1CCCC1 269982a_100000188435_100102525003 [0,0,1,1,0,0|2,0,0]=4 5458 B11R1.172 NC(=O)CCNC1CCCC1 2230a_100000211070_100000744528 [0,0,1,1,0,0|2,0,0]=4 5459 B11R1.172 NC(=O)CCNC1CCCC1 34a_100000211070_100000731001 [0,0,1,1,0,0|2,0,0]=4 5460 B11R1.172 NC(=O)CCOC1CCCC1 34a_100000210269_100000731001 [0,0,1,1,0,0|2,0,0]=4 5461 B11R1.172 NC(=O)CCOC1CCCC1 34a_100000757172_100000179811 [0,0,1,1,0,0|2,0,0]=4 5462 B11R1.172 NC(=O)CCOC1CCCC1 7a_100000210269_100000744528 [0,0,1,1,0,0|2,0,0]=4 5463 B11R1.172 NC(=O)CCOC1CCCC1 7a_100000757172_100000179811 [0,0,1,1,0,0|2,0,0]=4 5464 B11R1.172 NC(=O)CCSC1CCCC1 62a_100000744528_100000179811 [0,0,1,1,0,0|2,0,0]=4 5465 B11R1.172 NC(=O)CCSC1CCCC1 62a_100011217020_100000744528 [0,0,1,1,0,0|2,0,0]=4 5466 B11R1.172 NC(=O)CNCC1CCCC1 2230a_100000711301_100000740388 [0,0,1,1,0,0|2,0,0]=4 5467 B11R1.172 NC(=O)CNCC1CCCC1 2230a_100000737975_100000747473 [0,0,1,1,0,0|2,0,0]=4 5468 B11R1.172 NC(=O)CNCC1CCCC1 34a_100000737975_100000187820 [0,0,1,1,0,0|2,0,0]=4 5469 B11R1.172 NC(=O)COCC1CCCC1 34a_100000742336_100000187820 [0,0,1,1,0,0|2,0,0]=4 5470 B11R1.172 NC(=O)COCC1CCCC1 7a_100000742336_100000187820 [0,0,1,1,0,0|2,0,0]=4 5471 B11R1.172 NC(=O)CSCC1CCCC1 62a_100000740388_100000747473 [0,0,1,1,0,0|2,0,0]=4 5472 B11R1.172 NC(=O)CSCC1CCCC1 62a_100000747473_100000740388 [0,0,1,1,0,0|2,0,0]=4 5473 B11R1.172 O=C(O)CNCC1CCCC1 269956a_100016091260_100000740388 [0,0,1,1,0,0|1,0,0]=3 5474 B11R1.172 O=C(O)CNCC1CCCO1 269956a_100016091260_100000183445 [0,0,1,1,0,0|2,0,0]=4 5475 B11R1.172 O=C(O)CNCC1CCOC1 269956a_100016091260_100011261433 [0,0,1,1,0,0|2,0,0]=4 5476 B11R1.172 O=C(O)CONC1CCCC1 269956a_100000106656_100000179811 [0,0,1,1,0,0|2,0,0]=4 5477 B11R1.172 O=C([O-])CNCC1CCCC1 34a_100000737975_100020667443 [0,0,1,1,0,0|1,0,1]=4 5478 B11R1.172 O=C([O-])COCC1CCCC1 34a_100000742336_100020667443 [0,0,1,1,0,0|1,0,1]=4 5479 B11R1.172 O=C([O-])CSCC1CCCC1 62a_100000740388_100020667443 [0,0,1,1,0,0|1,0,1]=4 5480 B11R1.172 O=C([O-])CSCC1CCCC1 62a_100020667443_100000740388 [0,0,1,1,0,0|1,0,1]=4 5481 B11R1.172 [13CH3]C(=O)CCCN1CCCC1 1458a_100000743284_200025704644 [0,0,1,1,0,0|2,0,0]=4 5482 B11R1.174 CC(=O)CCCCN1CCC1 269982a_100000754969_100000735457 [0,0,1,1,0,0|2,0,0]=4 5483 B11R1.174 CC(=O)CCCNC1CCC1 34a_100000749019_100000685027 [0,0,1,1,0,0|2,0,0]=4 5484 B11R1.174 CC(=O)CCCOC1CCC1 34a_100000748187_100000685027 [0,0,1,1,0,0|2,0,0]=4 5485 B11R1.174 CC(=O)CCCOC1CCC1 34a_100000759063_100000749161 [0,0,1,1,0,0|2,0,0]=4 5486 B11R1.174 CC(=O)CCCSC1CCC1 62a_100011215641_100000749161 [0,0,1,1,0,0|2,0,0]=4 5487 B11R1.174 CC(=O)CCOCC1CCC1 34a_100000759926_100000763275 [0,0,1,1,0,0|2,0,0]=4 5488 B11R1.174 CC(=O)CCOCC1CCC1 7a_100000759926_100000763275 [0,0,1,1,0,0|2,0,0]=4 5489 B11R1.174 CC(=O)CCSCC1CCC1 62a_100000053229_100000763275 [0,0,1,1,0,0|2,0,0]=4 5490 B11R1.174 CC(=O)CCSCC1CCC1 62a_100000763275_100000053229 [0,0,1,1,0,0|2,0,0]=4 5491 B11R1.174 NC(=O)CCCNC1CCC1 34a_100000739312_100000749161 [0,0,1,1,0,0|2,0,0]=4 5492 B11R1.174 NC(=O)CCCNC1CCC1 34a_100000749019_100102525003 [0,0,1,1,0,0|2,0,0]=4 5493 B11R1.174 NC(=O)CCCOC1CCC1 34a_100000748187_100102525003 [0,0,1,1,0,0|2,0,0]=4 5494 B11R1.174 NC(=O)CCCSC1CCC1 62a_100102525003_100000749161 [0,0,1,1,0,0|2,0,0]=4 5495 B11R1.174 NC(=O)CCNCC1CCC1 2230a_100000738700_100000744528 [0,0,1,1,0,0|2,0,0]=4 5496 B11R1.174 NC(=O)CCNCC1CCC1 269862a_100000740010_100000753134 [0,0,1,1,0,0|2,0,0]=4 5497 B11R1.174 NC(=O)CCNCC1CCC1 34a_100000738700_100000731001 [0,0,1,1,0,0|2,0,0]=4 5498 B11R1.174 NC(=O)CCOCC1CCC1 34a_100000757172_100000763275 [0,0,1,1,0,0|2,0,0]=4 5499 B11R1.174 NC(=O)CCOCC1CCC1 34a_100000760304_100000731001 [0,0,1,1,0,0|2,0,0]=4 5500 B11R1.174 NC(=O)CCOCC1CCC1 7a_100000757172_100000763275 [0,0,1,1,0,0|2,0,0]=4 5501 B11R1.174 NC(=O)CCSCC1CCC1 62a_100000744528_100000763275 [0,0,1,1,0,0|2,0,0]=4 5502 B11R1.174 NC(=O)CCSCC1CCC1 62a_100000763275_100000744528 [0,0,1,1,0,0|2,0,0]=4 5503 B11R1.174 O=C(O)CONCC1CCC1 269956a_100000106656_100000763275 [0,0,1,1,0,0|2,0,0]=4 5504 B11R1.176 CC(=O)CCCCNC1CC1 34a_100000212008_100009817362 [0,0,1,1,0,0|2,0,0]=4 5505 B11R1.176 CC(=O)CCCCSC1CC1 62a_100000735457_100000211595 [0,0,1,1,0,0|2,0,0]=4 5506 B11R1.176 CC(=O)CCCNCC1CC1 34a_100000735609_100000685027 [0,0,1,1,0,0|2,0,0]=4 5507 B11R1.176 CC(=O)CCCOCC1CC1 34a_100000211283_100000685027 [0,0,1,1,0,0|2,0,0]=4 5508 B11R1.176 CC(=O)CCCOCC1CC1 34a_100000759063_100000742324 [0,0,1,1,0,0|2,0,0]=4 5509 B11R1.176 CC(=O)CCCOCC1CC1 7a_100000759063_100000742324 [0,0,1,1,0,0|2,0,0]=4 5510 B11R1.176 CC(=O)CCCSCC1CC1 62a_100000756562_100011215641 [0,0,1,1,0,0|2,0,0]=4 5511 B11R1.176 CC(=O)CCCSCC1CC1 62a_100011215641_100000742324 [0,0,1,1,0,0|2,0,0]=4 5512 B11R1.176 CC(=O)CCOCCC1CC1 34a_100000759926_100000694398 [0,0,1,1,0,0|2,0,0]=4 5513 B11R1.176 CC(=O)CCOCCC1CC1 7a_100000754188_100000053229 [0,0,1,1,0,0|2,0,0]=4 5514 B11R1.176 CC(=O)CCOCCC1CC1 7a_100000759926_100000764125 [0,0,1,1,0,0|2,0,0]=4 5515 B11R1.176 CC(=O)CCSCCC1CC1 62a_100000053229_100000764125 [0,0,1,1,0,0|2,0,0]=4 5516 B11R1.176 CC(=O)CCSCCC1CC1 62a_100000764125_100000053229 [0,0,1,1,0,0|2,0,0]=4 5517 B11R1.176 NC(=O)CCCCNC1CC1 34a_100000696515_100000211595 [0,0,1,1,0,0|2,0,0]=4 5518 B11R1.176 NC(=O)CCCCOC1CC1 34a_100012022536_100000211595 [0,0,1,1,0,0|2,0,0]=4 5519 B11R1.176 NC(=O)CCCNCC1CC1 269862a_100000739312_100000741477 [0,0,1,1,0,0|2,0,0]=4 5520 B11R1.176 NC(=O)CCCNCC1CC1 34a_100000735609_100102525003 [0,0,1,1,0,0|2,0,0]=4 5521 B11R1.176 NC(=O)CCCNCC1CC1 34a_100000739312_100000742324 [0,0,1,1,0,0|2,0,0]=4 5522 B11R1.176 NC(=O)CCCOCC1CC1 34a_100000211283_100102525003 [0,0,1,1,0,0|2,0,0]=4 5523 B11R1.176 NC(=O)CCCSCC1CC1 62a_100000756562_100102525003 [0,0,1,1,0,0|2,0,0]=4 5524 B11R1.176 NC(=O)CCCSCC1CC1 62a_100102525003_100000742324 [0,0,1,1,0,0|2,0,0]=4 5525 B11R1.176 NC(=O)CCNCCC1CC1 34a_100000764129_100000731001 [0,0,1,1,0,0|2,0,0]=4 5526 B11R1.176 NC(=O)CCOCCC1CC1 34a_100000754188_100000731001 [0,0,1,1,0,0|2,0,0]=4 5527 B11R1.176 NC(=O)CCOCCC1CC1 34a_100000757172_100000694398 [0,0,1,1,0,0|2,0,0]=4 5528 B11R1.176 NC(=O)CCOCCC1CC1 7a_100000754188_100000744528 [0,0,1,1,0,0|2,0,0]=4 5529 B11R1.176 NC(=O)CCOCCC1CC1 7a_100000757172_100000764125 [0,0,1,1,0,0|2,0,0]=4 5530 B11R1.176 NC(=O)CCSCCC1CC1 62a_100000744528_100000764125 [0,0,1,1,0,0|2,0,0]=4 5531 B11R1.176 NC(=O)CCSCCC1CC1 62a_100000764125_100000744528 [0,0,1,1,0,0|2,0,0]=4 5532 B11R1.176 O=C(O)CNCCCC1CO1 269956a_100016091260_100000733510 [0,0,1,1,0,0|2,0,0]=4 5533 B11R1.176 O=C(O)COCCNC1CC1 269956a_100000700818_100000211595 [0,0,1,1,0,0|2,0,0]=4 5534 B11R1.176 O=C(O)CONCCC1CC1 269956a_100000106656_100000694398 [0,0,1,1,0,0|2,0,0]=4 5535 B11R1.193 CCCN1CCC[C@H]1C(=O)N 2230a_100000003125_100000210303 [0,0,1,1,0,0|2,0,0]=4 5536 B11R1.193 CCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000210207 [0,0,1,1,0,0|1,0,0]=3 5537 B11R1.193 CCCN1CCSC1C(=O)O 269956a_100000035718_100000210207 [0,0,1,1,0,0|2,0,0]=4 5538 B11R1.193 CCCN1CSC[C@H]1C(=O)O 269956a_100000743924_100000210207 [0,0,1,1,0,0|2,0,0]=4 5539 B11R1.193 COCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000766300 [0,0,1,1,0,0|2,0,0]=4 5540 B11R1.193 CSCN1CCC[C@H]1C(=O)O 269956a_100000743916_100011218213 [0,0,1,1,0,0|2,0,0]=4 5541 B11R1.193 O=C(O)[C@@H]1CCCN1CCF 269956a_100000743916_100011217306 [0,0,1,1,0,0|2,0,0]=4 5542 B11R1.193 O=C(O)[C@@H]1CCCN1CCO 269956a_100000743916_100000211926 [0,0,1,1,0,0|2,0,0]=4 5543 B11R1.204 CCCCN1CCC1C(=O)O 269956a_100000021838_100000210211 [0,0,1,1,0,0|1,0,0]=3 5544 B11R1.204 CCOCN1CCC1C(=O)O 269956a_100000021838_100000739092 [0,0,1,1,0,0|2,0,0]=4 5545 B11R1.204 COCCN1CCC1C(=O)O 269956a_100000021838_100000233755 [0,0,1,1,0,0|2,0,0]=4 5546 B11R1.204 CSCCN1CCC1C(=O)O 269956a_100000021838_100000212216 [0,0,1,1,0,0|2,0,0]=4 5547 B11R1.204 O=C(O)C1CCN1CCCF 269956a_100000021838_100011934791 [0,0,1,1,0,0|2,0,0]=4 5548 B11R1.204 O=C(O)C1CCN1CCCO 269956a_100000021838_100011215043 [0,0,1,1,0,0|2,0,0]=4 5549 B11R1.706 CC(=O)N1CCCCCCC1 11a_100000211400_100015343762 [0,0,1,1,0,0|2,0,0]=4 5550 B11R1.706 CC(=O)N1CCCCCCC1 1626a_100000211400_100015343762 [0,0,1,1,0,0|2,0,0]=4 5551 B11R1.706 CC(=O)N1CCCCCCC1 240690a_100000211400_100015343762 [0,0,1,1,0,0|2,0,0]=4 5552 B11R1.706 CC(=O)N1CCCCCCC1 527a_100000211400_100103153847 [0,0,1,1,0,0|2,0,0]=4 5553 B11R1.742 CC(=O)CC1CCCCCC1 1458a_100000070787_200000696569 [0,0,1,1,0,0|1,0,0]=3 5554 B11R1.742 CC(=O)CC1CCCCCC1 1458a_100000685095_200000210301 [0,0,1,1,0,0|1,0,0]=3 5555 B11R1.742 CC(=O)CN1CCCCCC1 1458a_100000740298_200000210301 [0,0,1,1,0,0|2,0,0]=4 5556 B11R1.742 CC(=O)NC1CCCCCC1 11a_100000210984_100015343762 [0,0,1,1,0,0|2,0,0]=4 5557 B11R1.742 CC(=O)NC1CCCCCC1 1626a_100000210984_100015343762 [0,0,1,1,0,0|2,0,0]=4 5558 B11R1.742 CC(=O)NC1CCCCCC1 240690a_100000210984_100015343762 [0,0,1,1,0,0|2,0,0]=4 5559 B11R1.742 CC(=O)NC1CCCCCC1 527a_100000210984_100103153847 [0,0,1,1,0,0|2,0,0]=4 5560 B11R1.742 NC(=O)CN1CCCCCC1 2230a_100000185865_100000747473 [0,0,1,1,0,0|2,0,0]=4 5561 B11R1.742 NC(=O)CN1CCCCCC1 269982a_100000185865_100000187820 [0,0,1,1,0,0|2,0,0]=4 5562 B11R1.742 NC(=O)CN1CCCCCC1 34a_100000185865_100000187820 [0,0,1,1,0,0|2,0,0]=4 5563 B11R1.742 O=C([O-])CN1CCCCCC1 269982a_100000185865_100020667443 [0,0,1,1,0,0|1,0,1]=4 5564 B11R1.742 O=C([O-])CN1CCCCCC1 34a_100000185865_100020667443 [0,0,1,1,0,0|1,0,1]=4 5565 B11R1.742 [13CH3]C(=O)CC1CCCCCC1 1458a_100000685095_200025704644 [0,0,1,1,0,0|1,0,0]=3 5566 B11R1.742 [13CH3]C(=O)CN1CCCCCC1 1458a_100000740298_200025704644 [0,0,1,1,0,0|2,0,0]=4 5567 B11R1.196 CC(NC(=O)CO)C1CCC1 240690a_100016994624_100000210174 [0,0,1,1,0,0|2,0,0]=4 5568 B11R1.196 CC(NC(=O)CO)C1CCC1 527a_100016994624_100000210174 [0,0,1,1,0,0|2,0,0]=4 5569 B11R1.196 CCC(=O)CN(C)C1CCC1 269982a_100000758072_100000747405 [0,0,1,1,0,0|2,0,0]=4 5570 B11R1.196 CCC(=O)NC(C)C1CCC1 11a_100016994624_100000210414 [0,0,1,1,0,0|1,0,0]=3 5571 B11R1.196 CCC(=O)NC(C)C1CCC1 1626a_100016994624_100000210414 [0,0,1,1,0,0|1,0,0]=3 5572 B11R1.196 CCC(=O)NC(C)C1CCC1 240690a_100016994624_100000210414 [0,0,1,1,0,0|1,0,0]=3 5573 B11R1.196 CCC(=O)NC(C)C1CCC1 527a_100016994624_100000210414 [0,0,1,1,0,0|1,0,0]=3 5574 B11R1.196 CCC(C)OC(C)C1CCC1 34a_100000766398_100011215416 [0,0,1,1,0,0|1,0,1]=4 5575 B11R1.196 CCC(C)OC(C)C1CCC1 7a_100000766398_100000758301 [0,0,1,1,0,0|1,0,1]=4 5576 B11R1.196 CNC(=O)NC(C)C1CCC1 2708a_100016994624_106832991635 [0,0,1,1,0,0|2,0,0]=4 5577 B11R1.196 CNC(=O)NC(C)C1CCC1 2708a_100102657272_100016994624 [0,0,1,1,0,0|2,0,0]=4 5578 B11R1.196 CNC(=O)NC(C)C1CCC1 273464a_100016994624_100102657272 [0,0,1,1,0,0|2,0,0]=4 5579 B11R1.196 CNC(=O)NC(C)C1CCC1 273464a_100102657272_100016994624 [0,0,1,1,0,0|2,0,0]=4 5580 B11R1.196 CNC(=O)NC(C)C1CCC1 512a_100016994624_100102657272 [0,0,1,1,0,0|2,0,0]=4 5581 B11R1.196 CNC(=O)NC(C)C1CCC1 512a_106832991638_100016994624 [0,0,1,1,0,0|2,0,0]=4 5582 B11R1.198 CCC(=O)CN(C)CC1CC1 269982a_100000741881_100000747405 [0,0,1,1,0,0|2,0,0]=4 5583 B11R1.222 CC1CCCCC1C(=O)CF 1458a_100011215568_100015361967 [0,0,1,1,0,0|2,0,0]=4 5584 B11R1.222 CC1CCCCN1C(=O)CO 240690a_100000211376_100000210174 [0,0,1,1,0,0|2,0,0]=4 5585 B11R1.222 CC1CCCCN1C(=O)CO 527a_100000211376_100000210174 [0,0,1,1,0,0|2,0,0]=4 5586 B11R1.222 CCC(=O)C1CCCCC1C 1458a_100011215568_100000210202 [0,0,1,1,0,0|1,0,0]=3 5587 B11R1.222 CCC(=O)C1CCCCC1O 1458a_100011803323_100000210202 [0,0,1,1,0,0|2,0,0]=4 5588 B11R1.222 CCC(=O)N1CCCCC1C 11a_100000211376_100000210414 [0,0,1,1,0,0|1,0,0]=3 5589 B11R1.222 CCC(=O)N1CCCCC1C 1626a_100000211376_100000210414 [0,0,1,1,0,0|1,0,0]=3 5590 B11R1.222 CCC(=O)N1CCCCC1C 240690a_100000211376_100000210414 [0,0,1,1,0,0|1,0,0]=3 5591 B11R1.222 CCC(=O)N1CCCCC1C 527a_100000211376_100000210414 [0,0,1,1,0,0|1,0,0]=3 5592 B11R1.222 CCC(=O)N1CCOC[C@@H]1C 11a_100009815349_100000210414 [0,0,1,1,0,0|2,0,0]=4 5593 B11R1.222 CCC(=O)N1CCOC[C@@H]1C 240690a_100009815349_100000210414 [0,0,1,1,0,0|2,0,0]=4 5594 B11R1.222 CCC(=O)N1CCOC[C@@H]1C 527a_100009815349_100000210414 [0,0,1,1,0,0|2,0,0]=4 5595 B11R1.222 CCC(=O)[C@H]1CCCCN1C 1458a_100000767060_100000210202 [0,0,1,1,0,0|2,0,0]=4 5596 B11R1.222 CNC(=O)C1CCCCC1C 11a_106832991635_100011215568 [0,0,1,1,0,0|2,0,0]=4 5597 B11R1.222 CNC(=O)C1CCCCC1C 1626a_100102657272_100011215568 [0,0,1,1,0,0|2,0,0]=4 5598 B11R1.222 CNC(=O)C1CCCCC1C 240690a_100102657272_100011215568 [0,0,1,1,0,0|2,0,0]=4 5599 B11R1.222 CNC(=O)C1CCCCC1C 527a_100102657272_100011215568 [0,0,1,1,0,0|2,0,0]=4 5600 B11R1.222 CNC(=O)N1CCCCC1C 2708a_100102657272_100000211376 [0,0,1,1,0,0|2,0,0]=4 5601 B11R1.222 CNC(=O)N1CCCCC1C 273464a_100102657272_100000211376 [0,0,1,1,0,0|2,0,0]=4 5602 B11R1.264 CCC(=O)CN1CC(C1)CC 269982a_100015205115_100000747405 [0,0,1,1,0,0|2,0,0]=4 5603 B11R1.264 CCC(=O)NC1CC(C1)CO 240690a_100000095622_100000210414 [0,0,1,1,0,0|2,0,0]=4 5604 B11R1.264 CCC(=O)NC1CC(C1)CO 527a_100000095622_100000210414 [0,0,1,1,0,0|2,0,0]=4 5605 B11R1.264 CCC(=O)NC1CN(C1)CC 11a_200015199589_100000210414 [0,0,1,1,0,0|2,0,0]=4 5606 B11R1.264 CCC(=O)NC1CN(C1)CC 1626a_200015199589_100000210414 [0,0,1,1,0,0|2,0,0]=4 5607 B11R1.264 CCC(=O)NC1CN(C1)CC 240690a_200015199589_100000210414 [0,0,1,1,0,0|2,0,0]=4 5608 B11R1.264 CCC(=O)N[C@H]1C[C@@H](C1)OC 11a_100121570643_100000210414 [0,0,1,1,0,0|2,0,0]=4 5609 B11R1.264 CCC(=O)N[C@H]1C[C@@H](C1)OC 1626a_100121570643_100000210414 [0,0,1,1,0,0|2,0,0]=4 5610 B11R1.264 CCC(=O)N[C@H]1C[C@@H](C1)OC 240690a_100121570643_100000210414 [0,0,1,1,0,0|2,0,0]=4 5611 B11R1.264 CCC(=O)N[C@H]1C[C@@H](C1)OC 527a_100121570643_100000210414 [0,0,1,1,0,0|2,0,0]=4 5612 B11R1.284 CCCCC(C)OC1CCC1 34a_100000687866_100000749161 [0,0,1,1,0,0|1,0,1]=4 5613 B11R1.284 CCCCC(C)OC1CCC1 34a_100000748187_200011215066 [0,0,1,1,0,0|1,0,1]=4 5614 B11R1.286 CCCCN(C)C1CCC1=O 269982a_100000207549_100009892977 [0,0,1,1,0,0|2,0,0]=4 5615 B11R1.345 CCCCC(C)OC1(CC1)C 7a_100011725673_200011215066 [0,0,1,1,0,0|1,0,1]=4 5616 B11R1.875 CC1CCC(N1C(=O)CO)C 240690a_100000687148_100000210174 [0,0,1,1,0,0|2,0,0]=4 5617 B11R1.875 CC1CCC(N1C(=O)CO)C 527a_100000687148_100000210174 [0,0,1,1,0,0|2,0,0]=4 5618 B11R1.875 CCC(=O)N1C(CCC1C)C 11a_100000687148_100000210414 [0,0,1,1,0,0|1,0,0]=3 5619 B11R1.875 CCC(=O)N1C(CCC1C)C 240690a_100000687148_100000210414 [0,0,1,1,0,0|1,0,0]=3 5620 B11R1.875 CCC(=O)N1C(CCC1C)C 527a_100000687148_100000210414 [0,0,1,1,0,0|1,0,0]=3 5621 B11R1.875 CNC(=O)N1C(CCC1C)C 2708a_100102657272_100000687148 [0,0,1,1,0,0|2,0,0]=4 5622 B11R1.875 CNC(=O)N1C(CCC1C)C 273464a_100102657272_100000687148 [0,0,1,1,0,0|2,0,0]=4 5623 B11R1.895 CCC(=O)NC1(CCOC1)C 11a_100000693475_100000210414 [0,0,1,1,0,0|2,0,0]=4 5624 B11R1.895 CCC(=O)NC1(CCOC1)C 1626a_100000693475_100000210414 [0,0,1,1,0,0|2,0,0]=4 5625 B11R1.895 CCC(=O)NC1(CCOC1)C 240690a_100000693475_100000210414 [0,0,1,1,0,0|2,0,0]=4 5626 B11R1.895 CCC(=O)NC1(CCOC1)C 527a_100000693475_100000210414 [0,0,1,1,0,0|2,0,0]=4 5627 B11R1.895 CCC(C)OC1(CCCC1)C 34a_100000751722_100011215416 [0,0,1,1,0,0|1,0,1]=4 5628 B11R1.895 CCC(C)OC1(CCCC1)C 7a_100000751722_100000758301 [0,0,1,1,0,0|1,0,1]=4 5629 B11R1.20 CC(=O)C=C1CCC(CC1)C 1458a_100000756110_200000210301 [0,0,1,1,0,0|1,0,1]=4 5630 B11R1.20 CC(=O)CC1CCC(CC1)C 1458a_100011215564_200000210301 [0,0,1,1,0,0|1,0,0]=3 5631 B11R1.20 CC(=O)CC1CCC(CC1)O 1458a_100012184027_200000210301 [0,0,1,1,0,0|2,0,0]=4 5632 B11R1.20 CC(=O)CC1CCN(CC1)C 1458a_100000700355_200000210301 [0,0,1,1,0,0|2,0,0]=4 5633 B11R1.20 CC(=O)CN1CCC(CC1)C 1458a_100000238061_200000210301 [0,0,1,1,0,0|2,0,0]=4 5634 B11R1.20 CC(=O)NC1CCN(CC1)C 11a_100000198570_100015343762 [0,0,1,1,0,0|2,0,0]=4 5635 B11R1.20 CC(=O)NC1CCN(CC1)C 2230a_100000747453_200000210301 [0,0,1,1,0,0|2,0,0]=4 5636 B11R1.20 CC(=O)NC1CCN(CC1)C 240690a_100000198570_100015343762 [0,0,1,1,0,0|2,0,0]=4 5637 B11R1.20 CC(=O)NC1CCN(CC1)C 269982a_100000747453_200000210301 [0,0,1,1,0,0|2,0,0]=4 5638 B11R1.20 CC(=O)NC1CCN(CC1)C 527a_100000198570_100103153847 [0,0,1,1,0,0|2,0,0]=4 5639 B11R1.20 CC(=O)NC1CCN(CC1)[13CH3] 2230a_100000747453_200025704644 [0,0,1,1,0,0|2,0,0]=4 5640 B11R1.20 CC(=O)NC1CCN(CC1)[13CH3] 269982a_100000747453_200025704644 [0,0,1,1,0,0|2,0,0]=4 5641 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 1626a_100020625639_100015343762 [0,0,1,1,0,0|1,0,0]=3 5642 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_100015343762 [0,0,1,1,0,0|1,0,0]=3 5643 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 527a_100020625639_100103153847 [0,0,1,1,0,0|1,0,0]=3 5644 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)O 1626a_100020628982_100015343762 [0,0,1,1,0,0|2,0,0]=4 5645 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100015343762 [0,0,1,1,0,0|2,0,0]=4 5646 B11R1.20 CC1CCC(=CC(=O)[13CH3])CC1 1458a_100000756110_200025704644 [0,0,1,1,0,0|1,0,1]=4 5647 B11R1.20 CC1CCC(CC1)CC(=O)[13CH3] 1458a_100011215564_200025704644 [0,0,1,1,0,0|1,0,0]=3 5648 B11R1.20 CC1CCC(CC1)OC(C)C 34a_100000210714_100000210206 [0,0,1,1,0,0|1,0,1]=4 5649 B11R1.20 CC1CCC(CC1)OC(C)C 34a_100000212225_200011216234 [0,0,1,1,0,0|1,0,1]=4 5650 B11R1.20 CC1CCC(CC1)OC(C)C 7a_100000210714_100000210206 [0,0,1,1,0,0|1,0,1]=4 5651 B11R1.20 CC1CCN(CC1)CC(=O)[13CH3] 1458a_100000238061_200025704644 [0,0,1,1,0,0|2,0,0]=4 5652 B11R1.20 CN1CCC(CC1)CC(=O)[13CH3] 1458a_100000700355_200025704644 [0,0,1,1,0,0|2,0,0]=4 5653 B11R1.20 [13CH3]C(=O)CC1CCC(CC1)O 1458a_100012184027_200025704644 [0,0,1,1,0,0|2,0,0]=4 5654 B11R1.43 CCN1CCC(C1)CC(=O)C 1458a_100000070787_100015184589 [0,0,1,1,0,0|2,0,0]=4 5655 B11R1.43 CCN1CCC(C1)NC(=O)C 11a_100015188829_100015343762 [0,0,1,1,0,0|2,0,0]=4 5656 B11R1.43 CCN1CCC(C1)NC(=O)C 1626a_100015188829_100015343762 [0,0,1,1,0,0|2,0,0]=4 5657 B11R1.43 CCN1CCC(C1)NC(=O)C 240690a_100015188829_100015343762 [0,0,1,1,0,0|2,0,0]=4 5658 B11R1.43 CCN1CCC(C1)NC(=O)C 527a_100015188829_100103153847 [0,0,1,1,0,0|2,0,0]=4 5659 B11R1.43 CCN1CC[C@@H](C1)NC(=O)C 2230a_100016989438_100000210202 [0,0,1,1,0,0|2,0,0]=4 5660 B11R1.43 CCN1CC[C@@H](C1)NC(=O)C 269982a_100016989438_100000204670 [0,0,1,1,0,0|2,0,0]=4 5661 B11R1.319 CCCCC(CC)OC1CC1 34a_100011215227_100000211595 [0,0,1,1,0,0|1,0,1]=4 5662 B11R1.918 COCCC1(CC1)NC(=O)C 11a_100020603293_100015343762 [0,0,1,1,0,0|2,0,0]=4 5663 B11R1.918 COCCC1(CC1)NC(=O)C 1626a_100020603293_100015343762 [0,0,1,1,0,0|2,0,0]=4 5664 B11R1.918 COCCC1(CC1)NC(=O)C 240690a_100020603293_100015343762 [0,0,1,1,0,0|2,0,0]=4 5665 B11R1.918 COCCC1(CC1)NC(=O)C 527a_100020603293_100103153847 [0,0,1,1,0,0|2,0,0]=4 5666 B11R1.1062 CC(=O)NC1(CCCC1)CO 240690a_100000749328_100015343762 [0,0,1,1,0,0|2,0,0]=4 5667 B11R1.1062 CC(=O)NC1(CCCC1)CO 527a_100000749328_100103153847 [0,0,1,1,0,0|2,0,0]=4 5668 B11R1.1062 CCC1(CCCC1)NC(=O)C 11a_100015183760_100015343762 [0,0,1,1,0,0|1,0,0]=3 5669 B11R1.1062 CCC1(CCCC1)NC(=O)C 1626a_100015183760_100015343762 [0,0,1,1,0,0|1,0,0]=3 5670 B11R1.1062 CCC1(CCCC1)NC(=O)C 240690a_100015183760_100015343762 [0,0,1,1,0,0|1,0,0]=3 5671 B11R1.1062 CCC1(CCCC1)NC(=O)C 527a_100015183760_100103153847 [0,0,1,1,0,0|1,0,0]=3 5672 B11R1.1062 CCC1(CCCC1)OC(C)C 7a_100000752416_100000210206 [0,0,1,1,0,0|1,0,1]=4 5673 B11R1.41 CCC1CCCCC1OCF 34a_100000210738_100015361967 [0,0,1,1,0,0|1,0,1]=4 5674 B11R1.41 CCC1CCCCC1OCF 7a_100000210738_100015361967 [0,0,1,1,0,0|1,0,1]=4 5675 B11R1.41 CCC1CCCCN1CC=O 2230a_100000210034_200015260668 [0,0,1,1,0,0|2,0,0]=4 5676 B11R1.41 CCC1CCCCN1CC=O 269982a_100000210034_200015260668 [0,0,1,1,0,0|2,0,0]=4 5677 B11R1.41 CCC1CCCCN1CC=O 34a_100000210034_200009817547 [0,0,1,1,0,0|2,0,0]=4 5678 B11R1.41 CCOC1CCCCC1CC 34a_100000210738_100000210202 [0,0,1,1,0,0|1,0,1]=4 5679 B11R1.41 CCOC1CCCCC1CC 7a_100000210738_100000210202 [0,0,1,1,0,0|1,0,1]=4 5680 B11R1.799 CCCN(CC=O)CC1CC1 2230a_100000210729_200015260668 [0,0,1,1,0,0|2,0,0]=4 5681 B11R1.799 CCCN(CC=O)CC1CC1 269982a_100000210729_200015260668 [0,0,1,1,0,0|2,0,0]=4 5682 B11R1.799 CCCN(CC=O)CC1CC1 34a_100000210729_200009817547 [0,0,1,1,0,0|2,0,0]=4 5683 B11R1.1242 CCCC1(CCCC1)OCC 34a_200011216196_100000210202 [0,0,1,1,0,0|1,0,1]=4 5684 B11R1.1242 CCCC1(CCCC1)OCC 7a_200011216196_100000210202 [0,0,1,1,0,0|1,0,1]=4 5685 B11R1.1242 CCCC1(CCCC1)OCF 34a_200011216196_100015361967 [0,0,1,1,0,0|1,0,1]=4 5686 B11R1.1242 CCCC1(CCCC1)OCF 7a_200011216196_100015361967 [0,0,1,1,0,0|1,0,1]=4 5687 B11R1.299 CN(CCCC=O)C1CCC1 2230a_100000758072_200011292268 [0,0,1,1,0,0|2,0,0]=4 5688 B11R1.299 CN(CCCC=O)C1CCC1 269982a_100000758072_200011292268 [0,0,1,1,0,0|2,0,0]=4 5689 B11R1.301 CN(CCCC=O)CC1CC1 2230a_100000741881_200011292268 [0,0,1,1,0,0|2,0,0]=4 5690 B11R1.301 CN(CCCC=O)CC1CC1 269982a_100000741881_200011292268 [0,0,1,1,0,0|2,0,0]=4 5691 B11R1.756 C=CCNCC1(CCCC1)O 2230a_100000737848_100000210623 [0,0,1,1,0,0|2,0,0]=4 5692 B11R1.756 NC1(CCCC1)COCC=O 34a_100000749328_200009817547 [0,0,1,1,0,0|2,0,0]=4 5693 B11R1.756 O=CCNCC1(CCCC1)O 2230a_100000737848_200015260668 [0,0,1,1,0,0|1,0,0]=3 5694 B11R1.759 CCC1CN(C1)CCCC=O 2230a_100015205115_200011292268 [0,0,1,1,0,0|2,0,0]=4 5695 B11R1.759 CCC1CN(C1)CCCC=O 269982a_100015205115_200011292268 [0,0,1,1,0,0|2,0,0]=4 5696 B11R2.238 C1=CC(CCC1)OC2CC2 34a_100011215024_100000211595 [1,0,0,1,0,0|2,0,0]=4 5697 B11R2.238 C1=CC(CCC1)SC2CC2 62a_100000751183_100000211595 [1,0,0,1,0,0|2,0,0]=4 5698 B11R2.238 C1CCC(OC1)OC2CC2 34a_100000033831_100000211595 [1,0,0,1,0,0|1,0,1]=4 5699 B11R2.239 C1=CC(CCC1)N2CCC2 269982a_100000754969_100000751183 [1,0,0,1,0,0|2,0,0]=4 5700 B11R2.351 O=C1CCC(C1)OC2CC2 34a_100012614533_100000211595 [0,0,0,1,1,0|2,0,0]=4 5701 B11R2.351 O=C1OCC(O1)NC2CC2 34a_100000212008_100000032252 [0,0,0,1,1,0|2,0,0]=4 5702 B11R2.115 O=C1CCCC1NC2CC2 34a_100000212008_100000709159 [0,0,0,1,1,0|1,0,0]=3 5703 B11R2.115 O=C1CCCC1OC2CC2 34a_200000719330_100000211595 [0,0,0,1,1,0|1,0,0]=3 5704 B11R2.115 O=C1CCCC1SC2CC2 62a_100000211823_100000211595 [0,0,0,1,1,0|1,0,0]=3 5705 B11R2.115 O=C1NCCC1NC2CC2 34a_100016995588_100000211595 [0,0,0,1,1,0|2,0,0]=4 5706 B11R2.115 O=C1NCC[C@@H]1OC2CC2 34a_100000688343_100000211595 [0,0,0,1,1,0|2,0,0]=4 5707 B11R2.115 O=C1OCCC1NC2CC2 34a_100000212008_100000211211 [0,0,0,1,1,0|2,0,0]=4 5708 B11R2.115 O=C1OCCC1SC2CC2 62a_100000211211_100000211595 [0,0,0,1,1,0|2,0,0]=4 5709 B11R2.459 O=C1CCCC1N2CCC2 269982a_100000754969_100000211823 [0,0,0,1,1,0|1,0,0]=3 5710 B11R2.459 O=C1OCCC1N2CCC2 269982a_100000754969_100000211211 [0,0,0,1,1,0|2,0,0]=4 5711 B13R2.10288 O=C1CN(CCCN1)CC2CC2 2230a_100015190381_100000742324 [0,0,0,1,0,1|2,0,0]=4 5712 B13R2.11169 O=C1CN(CCCN1)C2CCC2 270004a_100015190381_100000241760 [0,0,0,1,0,1|2,0,0]=4 5713 B13R2.3021 CC1=CC(CCC1)OC2CCC2 34a_100011218613_100000749161 [0,1,0,1,0,0|2,0,0]=4 5714 B13R2.3021 O=C1CC(CCN1)NC2CCC2 34a_100016994916_100000749161 [0,1,0,1,0,0|2,0,0]=4 5715 B13R2.3021 O=C1CCCC(C1)OC2CCC2 34a_100012613340_100000749161 [0,1,0,1,0,0|1,0,0]=3 5716 B13R2.3021 O=C1CCCC(C1)OC2COC2 34a_100012613340_100009818527 [0,1,0,1,0,0|2,0,0]=4 5717 B13R2.3021 O=C1C[C@@H](CCN1)OC2CCC2 34a_100015189427_100000749161 [0,1,0,1,0,0|2,0,0]=4 5718 B13R2.5331 CC1=CC(CCC1)OCC2CC2 34a_100011218613_100000742324 [0,1,0,1,0,0|2,0,0]=4 5719 B13R2.5331 O=C1CC(CCN1)COC2CC2 34a_100009886756_100000211595 [0,1,0,1,0,0|2,0,0]=4 5720 B13R2.5331 O=C1CC(CCN1)NCC2CC2 2230a_100016994916_100000742324 [0,1,0,1,0,0|2,0,0]=4 5721 B13R2.5331 O=C1CC(CCN1)NCC2CC2 269862a_100016994916_100000741477 [0,1,0,1,0,0|2,0,0]=4 5722 B13R2.5331 O=C1CC(CCN1)NCC2CC2 34a_100016994916_100000742324 [0,1,0,1,0,0|2,0,0]=4 5723 B13R2.5331 O=C1CCCC(C1)OCC2CC2 34a_100012613340_100000742324 [0,1,0,1,0,0|1,0,0]=3 5724 B13R2.5331 O=C1CCCC(C1)OCC2CO2 34a_100012613340_102125554688 [0,1,0,1,0,0|2,0,0]=4 5725 B13R2.5331 O=C1CCCC(N1)COC2CC2 34a_200000102386_100000211595 [0,1,0,1,0,0|1,0,0]=3 5726 B13R2.5331 O=C1COCC(N1)COC2CC2 34a_200000101122_100000211595 [0,1,0,1,0,0|2,0,0]=4 5727 B13R2.5331 O=C1C[C@@H](CCN1)OCC2CC2 34a_100015189427_100000742324 [0,1,0,1,0,0|2,0,0]=4 5728 B9R0.8 C#CC(=O)C(C)CCCC 1458a_100000211873_200011215066 [0,0,1,0,1,0|0,0,2]=4 5729 B9R0.8 C=CC(=O)C(C)CCCC 1458a_100000185746_200011215066 [0,0,1,0,1,0|0,0,2]=4 5730 B9R0.8 CCC(=O)C(C)NCCO 2230a_100016997473_100000742827 [0,0,1,0,1,0|2,0,0]=4 5731 B9R0.8 CCC(=O)C(C)SCCF 62a_100000742827_100011217306 [0,0,1,0,1,0|2,0,0]=4 5732 B9R0.8 CCC(=O)C(C)SCCF 62a_100011217306_100000742827 [0,0,1,0,1,0|2,0,0]=4 5733 B9R0.8 CCC(=O)C(C)SCCO 62a_100000211926_100000742827 [0,0,1,0,1,0|2,0,0]=4 5734 B9R0.8 CCC(=O)C(C)SCCO 62a_100000742827_100000211926 [0,0,1,0,1,0|2,0,0]=4 5735 B9R0.8 CCC(=O)C(C)SCOC 62a_100000742827_100000766300 [0,0,1,0,1,0|2,0,0]=4 5736 B9R0.8 CCC(=O)C(C)SCOC 62a_100000766300_100000742827 [0,0,1,0,1,0|2,0,0]=4 5737 B9R0.8 CCC(=O)C(C)SCSC 62a_100000742827_100011218213 [0,0,1,0,1,0|2,0,0]=4 5738 B9R0.8 CCC(=O)C(C)SCSC 62a_100011218213_100000742827 [0,0,1,0,1,0|2,0,0]=4 5739 B9R0.8 CCC(=O)C(O)CCSC 1458a_100000685904_100000210202 [0,0,1,0,1,0|2,0,0]=4 5740 B9R0.8 CCC(=O)N(C)CCCO 240690a_100000213112_100000210414 [0,0,1,0,1,0|2,0,0]=4 5741 B9R0.8 CCC(=O)N(C)CCCO 527a_100000213112_100000210414 [0,0,1,0,1,0|2,0,0]=4 5742 B9R0.8 CCC(=O)N(C)CCOC 11a_100000743101_100000210414 [0,0,1,0,1,0|2,0,0]=4 5743 B9R0.8 CCC(=O)N(C)CCOC 1626a_100000743101_100000210414 [0,0,1,0,1,0|2,0,0]=4 5744 B9R0.8 CCC(=O)N(C)CCOC 240690a_100000743101_100000210414 [0,0,1,0,1,0|2,0,0]=4 5745 B9R0.8 CCC(=O)N(C)CCOC 527a_100000743101_100000210414 [0,0,1,0,1,0|2,0,0]=4 5746 B9R0.8 CCC(=O)N(C)CCSC 11a_100000686725_100000210414 [0,0,1,0,1,0|2,0,0]=4 5747 B9R0.8 CCC(=O)N(C)CCSC 1626a_100000686725_100000210414 [0,0,1,0,1,0|2,0,0]=4 5748 B9R0.8 CCC(=O)N(C)CCSC 240690a_100000686725_100000210414 [0,0,1,0,1,0|2,0,0]=4 5749 B9R0.8 CCC(=O)N(C)CCSC 527a_100000686725_100000210414 [0,0,1,0,1,0|2,0,0]=4 5750 B9R0.8 CCC/C=C(\C)/C(=O)CC 1458a_200020648666_100000210202 [0,0,1,0,1,0|0,0,2]=4 5751 B9R0.8 CCCCC(C)C(=O)CC 1458a_100000210414_200011215066 [0,0,1,0,1,0|0,0,0]=2 5752 B9R0.8 CCCCC(C)C(=O)CC 1458a_100000725509_100000210202 [0,0,1,0,1,0|0,0,0]=2 5753 B9R0.8 CCCCC(C)C(=O)CF 1458a_100000725509_100015361967 [0,0,1,0,1,0|1,0,0]=3 5754 B9R0.8 CCCCC(C)C(=O)CO 1458a_100000210174_200011215066 [0,0,1,0,1,0|1,0,0]=3 5755 B9R0.8 CCCCC(C)C(=O)NC 11a_106832991635_100000725509 [0,0,1,0,1,0|1,0,0]=3 5756 B9R0.8 CCCCC(C)C(=O)NC 1626a_100102657272_100000725509 [0,0,1,0,1,0|1,0,0]=3 5757 B9R0.8 CCCCC(C)C(=O)NC 240690a_100102657272_100000725509 [0,0,1,0,1,0|1,0,0]=3 5758 B9R0.8 CCCCC(C)C(=O)NC 527a_100102657272_100000725509 [0,0,1,0,1,0|1,0,0]=3 5759 B9R0.8 CCCCC(C)N(C)CC 2230a_100000225621_200011215066 [0,0,1,0,1,0|2,0,0]=4 5760 B9R0.8 CCCCC(C)N(C)CC 269982a_100000225621_200011215066 [0,0,1,0,1,0|2,0,0]=4 5761 B9R0.8 CCCCC(O)C(=O)CC 1458a_100000720857_100000210202 [0,0,1,0,1,0|1,0,0]=3 5762 B9R0.8 CCCCC(O)C(=O)CF 1458a_100000720857_100015361967 [0,0,1,0,1,0|2,0,0]=4 5763 B9R0.8 CCCCC(O)C(=O)NC 240690a_100102657272_100000720857 [0,0,1,0,1,0|2,0,0]=4 5764 B9R0.8 CCCCC(O)C(=O)NC 527a_100102657272_100000720857 [0,0,1,0,1,0|2,0,0]=4 5765 B9R0.8 CCCCN(C)C(=O)CC 11a_100000207549_100000210414 [0,0,1,0,1,0|1,0,0]=3 5766 B9R0.8 CCCCN(C)C(=O)CC 1626a_100000207549_100000210414 [0,0,1,0,1,0|1,0,0]=3 5767 B9R0.8 CCCCN(C)C(=O)CC 240690a_100000207549_100000210414 [0,0,1,0,1,0|1,0,0]=3 5768 B9R0.8 CCCCN(C)C(=O)CC 527a_100000207549_100000210414 [0,0,1,0,1,0|1,0,0]=3 5769 B9R0.8 CCCCN(C)C(=O)CO 240690a_100000207549_100000210174 [0,0,1,0,1,0|2,0,0]=4 5770 B9R0.8 CCCCN(C)C(=O)CO 527a_100000207549_100000210174 [0,0,1,0,1,0|2,0,0]=4 5771 B9R0.8 CCCCN(C)C(=O)NC 2708a_100102657272_100000207549 [0,0,1,0,1,0|2,0,0]=4 5772 B9R0.8 CCCCN(C)C(=O)NC 273464a_100102657272_100000207549 [0,0,1,0,1,0|2,0,0]=4 5773 B9R0.8 CCCN[C@H](C)C(=O)NC 2230a_100000684985_100000210303 [0,0,1,0,1,0|2,0,0]=4 5774 B9R0.8 CCCN[C@H](C)C(=O)NC 34a_100000684985_100000210303 [0,0,1,0,1,0|2,0,0]=4 5775 B9R0.8 CCCOC(C)C(=O)NC 34a_100000210258_100000731044 [0,0,1,0,1,0|2,0,0]=4 5776 B9R0.8 CCCOC(C)C(=O)OC 34a_100000210258_100000211248 [0,0,1,0,1,0|2,0,0]=4 5777 B9R0.8 CCCOC(C)C(=O)OC 34a_100011215400_100000210303 [0,0,1,0,1,0|2,0,0]=4 5778 B9R0.8 CCCSC(C)C(=O)CC 62a_100000210303_100000742827 [0,0,1,0,1,0|1,0,0]=3 5779 B9R0.8 CCCSC(C)C(=O)CC 62a_100000742827_100000210303 [0,0,1,0,1,0|1,0,0]=3 5780 B9R0.8 CCCSC(C)C(=O)NC 62a_100000209862_100000210303 [0,0,1,0,1,0|2,0,0]=4 5781 B9R0.8 CCCSC(C)C(=O)NC 62a_100000210303_100000731044 [0,0,1,0,1,0|2,0,0]=4 5782 B9R0.8 CCCSC(C)C(=O)OC 62a_100000210303_100000211248 [0,0,1,0,1,0|2,0,0]=4 5783 B9R0.8 CCCSC(C)C(=O)OC 62a_100000211248_100000210303 [0,0,1,0,1,0|2,0,0]=4 5784 B9R0.8 CCNCC(C)C(=O)NC 2230a_100015187722_100000210202 [0,0,1,0,1,0|2,0,0]=4 5785 B9R0.8 CCNCC(C)C(=O)NC 34a_100015187722_100000210202 [0,0,1,0,1,0|2,0,0]=4 5786 B9R0.8 CCOCC(C)C(=O)OC 34a_100000749362_100000210202 [0,0,1,0,1,0|2,0,0]=4 5787 B9R0.8 CCOCC(C)C(=O)OC 34a_100121572206_100000698445 [0,0,1,0,1,0|2,0,0]=4 5788 B9R0.8 CCOCC(C)C(=O)OC 7a_100000749362_100000210202 [0,0,1,0,1,0|2,0,0]=4 5789 B9R0.8 CCSCC(C)C(=O)OC 62a_100000210202_100000698445 [0,0,1,0,1,0|2,0,0]=4 5790 B9R0.8 CCSCC(C)C(=O)OC 62a_100000698445_100000210202 [0,0,1,0,1,0|2,0,0]=4 5791 B9R0.8 CNCCC(C)C(=O)OC 2230a_106832991635_100000034942 [0,0,1,0,1,0|2,0,0]=4 5792 B9R0.8 CNCCC(C)C(=O)OC 34a_100102657272_100000034942 [0,0,1,0,1,0|2,0,0]=4 5793 B9R0.8 CNCCC(C)C(=O)OC 7a_106832991635_100000034942 [0,0,1,0,1,0|2,0,0]=4 5794 B9R0.8 COC(=O)C(C)CCSC 62a_100000034942_200000210301 [0,0,1,0,1,0|2,0,0]=4 5795 B9R0.8 COC(=O)C(C)CCSC 62a_200000210301_100000034942 [0,0,1,0,1,0|2,0,0]=4 5796 B9R0.8 COC(=O)C(C)CCS[13CH3] 62a_100000034942_200025704644 [0,0,1,0,1,0|2,0,0]=4 5797 B9R0.8 COC(=O)C(C)CCS[13CH3] 62a_200025704644_100000034942 [0,0,1,0,1,0|2,0,0]=4 5798 B9R0.8 COCCC(C)C(=O)OC 34a_100138415774_100000034942 [0,0,1,0,1,0|2,0,0]=4 5799 B9R0.13 CCCCC(CC)C(=O)C 1458a_100000070787_200011216223 [0,0,1,0,1,0|0,0,0]=2 5800 B9R0.13 CCCCC(CC)C(=O)C 1458a_100000211130_200000210301 [0,0,1,0,1,0|0,0,0]=2 5801 B9R0.13 CCCCC(CC)C(=O)[13CH3] 1458a_100000211130_200025704644 [0,0,1,0,1,0|0,0,0]=2 5802 B9R0.13 CCCCC(CC)N(C)C 269982a_100102631434_200011216223 [0,0,1,0,1,0|2,0,0]=4 5803 B9R0.13 CCCCC(CC)N(C)C 270004a_100102631434_100000753412 [0,0,1,0,1,0|2,0,0]=4 5804 B9R0.13 CCCCC(NC)C(=O)N 2230a_106832991635_100000748834 [0,0,1,0,1,0|2,0,0]=4 5805 B9R0.13 CCCCC(NC)C(=O)N 34a_100102657272_100000748834 [0,0,1,0,1,0|2,0,0]=4 5806 B9R0.13 CCCCC(NC)C(=O)N 7a_106832991635_100000748834 [0,0,1,0,1,0|2,0,0]=4 5807 B9R0.13 CCCCC(OC)C(=O)N 34a_100138415774_100000748834 [0,0,1,0,1,0|2,0,0]=4 5808 B9R0.13 CCCCC(SC)C(=O)N 62a_100000748834_200000210301 [0,0,1,0,1,0|2,0,0]=4 5809 B9R0.13 CCCCC(SC)C(=O)N 62a_200000210301_100000748834 [0,0,1,0,1,0|2,0,0]=4 5810 B9R0.13 CCCCC(S[13CH3])C(=O)N 62a_100000748834_200025704644 [0,0,1,0,1,0|2,0,0]=4 5811 B9R0.13 CCCCC(S[13CH3])C(=O)N 62a_200025704644_100000748834 [0,0,1,0,1,0|2,0,0]=4 5812 B9R0.13 CCCCN(CC)C(=O)C 11a_100000207695_100015343762 [0,0,1,0,1,0|1,0,0]=3 5813 B9R0.13 CCCCN(CC)C(=O)C 1626a_100000207695_100015343762 [0,0,1,0,1,0|1,0,0]=3 5814 B9R0.13 CCCCN(CC)C(=O)C 240690a_100000207695_100015343762 [0,0,1,0,1,0|1,0,0]=3 5815 B9R0.13 CCCCN(CC)C(=O)C 527a_100000207695_100103153847 [0,0,1,0,1,0|1,0,0]=3 5816 B9R0.13 CCCC[C@H](NC)C(=O)N 2230a_100000124899_200000210301 [0,0,1,0,1,0|2,0,0]=4 5817 B9R0.13 CCCC[C@H](NC)C(=O)N 34a_100000124899_200000210301 [0,0,1,0,1,0|2,0,0]=4 5818 B9R0.13 CCCC[C@H](N[13CH3])C(=O)N 2230a_100000124899_200025704644 [0,0,1,0,1,0|2,0,0]=4 5819 B9R0.13 CCCC[C@H](N[13CH3])C(=O)N 34a_100000124899_200025704644 [0,0,1,0,1,0|2,0,0]=4 5820 B9R0.13 CCCNC(CC)C(=O)N 2230a_100000733705_100000210303 [0,0,1,0,1,0|2,0,0]=4 5821 B9R0.13 CCCNC(CC)C(=O)N 34a_100000733705_100000210303 [0,0,1,0,1,0|2,0,0]=4 5822 B9R0.13 CCCN[C@H](CC)C(=O)O 269956a_100000747097_100000210207 [0,0,1,0,1,0|2,0,0]=4 5823 B9R0.13 CCCOC(CC)C(=O)N 34a_100000210258_100000750255 [0,0,1,0,1,0|2,0,0]=4 5824 B9R0.13 CCCSC(CC)C(=O)N 62a_100000210303_100000750255 [0,0,1,0,1,0|2,0,0]=4 5825 B9R0.13 CCCSC(CC)C(=O)N 62a_100000750255_100000210303 [0,0,1,0,1,0|2,0,0]=4 5826 B9R0.13 CCN(CCOC)C(=O)C 11a_100000731262_100015343762 [0,0,1,0,1,0|2,0,0]=4 5827 B9R0.13 CCN(CCOC)C(=O)C 1626a_100000731262_100015343762 [0,0,1,0,1,0|2,0,0]=4 5828 B9R0.13 CCN(CCOC)C(=O)C 240690a_100000731262_100015343762 [0,0,1,0,1,0|2,0,0]=4 5829 B9R0.13 CCN(CCOC)C(=O)C 527a_100000731262_100103153847 [0,0,1,0,1,0|2,0,0]=4 5830 B9R1.7 CCOC1CCC(=O)C1 34a_100012614533_100000210202 [1,0,0,0,1,0|2,0,0]=4 5831 B9R1.7 CCOC1COC(=O)O1 34a_100121572206_100000032252 [1,0,0,0,1,0|2,0,0]=4 5832 B9R1.7 CCSC1COC(=O)O1 62a_100000210202_100000032252 [1,0,0,0,1,0|2,0,0]=4 5833 B9R1.7 CNCC1CNC(=O)O1 2230a_106832991635_100000181169 [1,0,0,0,1,0|2,0,0]=4 5834 B9R1.7 CNCC1CNC(=O)O1 34a_100102657272_100000181169 [1,0,0,0,1,0|2,0,0]=4 5835 B9R1.7 CNCC1CNC(=O)O1 7a_106832991635_100000181169 [1,0,0,0,1,0|2,0,0]=4 5836 B9R1.7 CNCC1COC(=O)O1 34a_100102657272_100000073702 [1,0,0,0,1,0|2,0,0]=4 5837 B9R1.7 CNC[C@@H]1CCC(=O)N1 2230a_106832991635_100015189358 [1,0,0,0,1,0|2,0,0]=4 5838 B9R1.7 CNC[C@@H]1CCC(=O)N1 7a_106832991635_100015189358 [1,0,0,0,1,0|2,0,0]=4 5839 B9R1.7 CNC[C@H]1CCC(=O)N1 2230a_100015423886_200000210301 [1,0,0,0,1,0|2,0,0]=4 5840 B9R1.7 CNC[C@H]1CCC(=O)N1 34a_100015423886_200000210301 [1,0,0,0,1,0|2,0,0]=4 5841 B9R1.7 COCC1CCC(=O)N1 34a_100000737831_200000210301 [1,0,0,0,1,0|2,0,0]=4 5842 B9R1.7 COCC1CNC(=O)O1 34a_100011315639_200000210301 [1,0,0,0,1,0|2,0,0]=4 5843 B9R1.7 COCC1CNC(=O)O1 34a_100138415774_100000181169 [1,0,0,0,1,0|2,0,0]=4 5844 B9R1.7 COCC1COC(=O)O1 34a_100138415774_100000073702 [1,0,0,0,1,0|2,0,0]=4 5845 B9R1.7 CSCC1CNC(=O)O1 62a_100000181169_200000210301 [1,0,0,0,1,0|2,0,0]=4 5846 B9R1.7 CSCC1CNC(=O)O1 62a_200000210301_100000181169 [1,0,0,0,1,0|2,0,0]=4 5847 B9R1.7 CSCC1COC(=O)O1 62a_100000073702_200000210301 [1,0,0,0,1,0|2,0,0]=4 5848 B9R1.7 CSCC1COC(=O)O1 62a_200000210301_100000073702 [1,0,0,0,1,0|2,0,0]=4 5849 B9R1.7 CSC[C@@H]1CCC(=O)N1 62a_100015189358_200000210301 [1,0,0,0,1,0|2,0,0]=4 5850 B9R1.7 CSC[C@@H]1CCC(=O)N1 62a_200000210301_100015189358 [1,0,0,0,1,0|2,0,0]=4 5851 B9R1.7 [13CH3]NC[C@H]1CCC(=O)N1 2230a_100015423886_200025704644 [1,0,0,0,1,0|2,0,0]=4 5852 B9R1.7 [13CH3]NC[C@H]1CCC(=O)N1 34a_100015423886_200025704644 [1,0,0,0,1,0|2,0,0]=4 5853 B9R1.7 [13CH3]OCC1CCC(=O)N1 34a_100000737831_200025704644 [1,0,0,0,1,0|2,0,0]=4 5854 B9R1.7 [13CH3]OCC1CNC(=O)O1 34a_100011315639_200025704644 [1,0,0,0,1,0|2,0,0]=4 5855 B9R1.7 [13CH3]SCC1CNC(=O)O1 62a_100000181169_200025704644 [1,0,0,0,1,0|2,0,0]=4 5856 B9R1.7 [13CH3]SCC1CNC(=O)O1 62a_200025704644_100000181169 [1,0,0,0,1,0|2,0,0]=4 5857 B9R1.7 [13CH3]SCC1COC(=O)O1 62a_100000073702_200025704644 [1,0,0,0,1,0|2,0,0]=4 5858 B9R1.7 [13CH3]SCC1COC(=O)O1 62a_200025704644_100000073702 [1,0,0,0,1,0|2,0,0]=4 5859 B9R1.7 [13CH3]SC[C@@H]1CCC(=O)N1 62a_100015189358_200025704644 [1,0,0,0,1,0|2,0,0]=4 5860 B9R1.7 [13CH3]SC[C@@H]1CCC(=O)N1 62a_200025704644_100015189358 [1,0,0,0,1,0|2,0,0]=4 5861 B9R1.33 CCNC1CCCC1=O 2230a_100015525214_100000211823 [1,0,0,0,1,0|1,0,0]=3 5862 B9R1.33 CCNC1CCNC1=O 2230a_100016995588_100000210202 [1,0,0,0,1,0|2,0,0]=4 5863 B9R1.33 CCNC1CCNC1=O 34a_100016995588_100000210202 [1,0,0,0,1,0|2,0,0]=4 5864 B9R1.33 CCNC1CCOC1=O 2230a_100015525214_100000211211 [1,0,0,0,1,0|2,0,0]=4 5865 B9R1.33 CCOC1CCCC1=O 34a_100121572206_100000709159 [1,0,0,0,1,0|1,0,0]=3 5866 B9R1.33 CCOC1CCCC1=O 34a_200000719330_100000210202 [1,0,0,0,1,0|1,0,0]=3 5867 B9R1.33 CCOC1CCOC1=O 34a_100121572206_100000211211 [1,0,0,0,1,0|2,0,0]=4 5868 B9R1.33 CCO[C@H]1CCNC1=O 34a_100000688343_100000210202 [1,0,0,0,1,0|2,0,0]=4 5869 B9R1.33 CCSC1CCCC1=O 62a_100000210202_100000211823 [1,0,0,0,1,0|1,0,0]=3 5870 B9R1.33 CCSC1CCCC1=O 62a_100000211823_100000210202 [1,0,0,0,1,0|1,0,0]=3 5871 B9R1.33 CCSC1CCOC1=O 62a_100000210202_100000211211 [1,0,0,0,1,0|2,0,0]=4 5872 B9R1.33 CCSC1CCOC1=O 62a_100000211211_100000210202 [1,0,0,0,1,0|2,0,0]=4 5873 B9R1.33 COCC1CCNC1=O 34a_100000133458_200000210301 [1,0,0,0,1,0|2,0,0]=4 5874 B9R1.33 CSCN1CCCC1=O 62a_100000026320_200000210301 [1,0,0,0,1,0|2,0,0]=4 5875 B9R1.33 CSCN1CCCC1=O 62a_200000210301_100000026320 [1,0,0,0,1,0|2,0,0]=4 5876 B9R1.33 O=C1CCCC1OCF 34a_200000719330_100015361967 [1,0,0,0,1,0|2,0,0]=4 5877 B9R1.33 O=C1CCCC1SCF 62a_100000211823_100015361967 [1,0,0,0,1,0|2,0,0]=4 5878 B9R1.33 O=C1CCCC1SCF 62a_100015361967_100000211823 [1,0,0,0,1,0|2,0,0]=4 5879 B9R1.33 [13CH3]OCC1CCNC1=O 34a_100000133458_200025704644 [1,0,0,0,1,0|2,0,0]=4 5880 B9R1.33 [13CH3]SCN1CCCC1=O 62a_100000026320_200025704644 [1,0,0,0,1,0|2,0,0]=4 5881 B9R1.33 [13CH3]SCN1CCCC1=O 62a_200025704644_100000026320 [1,0,0,0,1,0|2,0,0]=4 5882 B9R1.12 CCCCN1CCCC1 2230a_100000188435_100000210211 [1,0,0,0,1,0|1,0,1]=4 5883 B9R1.12 CCCCN1CCCC1 269982a_100000188435_100000210211 [1,0,0,0,1,0|1,0,1]=4 5884 B9R1.12 CCCNC1CCCC1 2230a_100000211070_100000210303 [1,0,0,0,1,0|1,0,1]=4 5885 B9R1.12 CCCNC1CCCC1 270004a_100020643023_100000210133 [1,0,0,0,1,0|1,0,1]=4 5886 B9R1.12 CCCNC1CCCC1 34a_100000211070_100000210303 [1,0,0,0,1,0|1,0,1]=4 5887 B9R1.12 CCCOC1CCCC1 34a_100000210258_100000179811 [1,0,0,0,1,0|1,0,1]=4 5888 B9R1.12 CCCOC1CCCC1 34a_100000210269_100000210303 [1,0,0,0,1,0|1,0,1]=4 5889 B9R1.12 CCCOC1CCCC1 7a_100000210269_100000210303 [1,0,0,0,1,0|1,0,1]=4 5890 B9R1.12 CCCOC1CCCO1 34a_100000085407_100000210303 [1,0,0,0,1,0|1,0,0]=3 5891 B9R1.12 CCCSC1CCCC1 62a_100000210303_100000179811 [1,0,0,0,1,0|1,0,1]=4 5892 B9R1.12 CCCSC1CCCC1 62a_100011217020_100000210303 [1,0,0,0,1,0|1,0,1]=4 5893 B9R1.12 CCNCC1CCCC1 2230a_100000737975_100000210202 [1,0,0,0,1,0|1,0,1]=4 5894 B9R1.12 CCNCC1CCCC1 2230a_100015525214_100000740388 [1,0,0,0,1,0|1,0,1]=4 5895 B9R1.12 CCNCC1CCCC1 269862a_100015525214_100000746403 [1,0,0,0,1,0|1,0,1]=4 5896 B9R1.12 CCNCC1CCCC1 34a_100000737975_100000210202 [1,0,0,0,1,0|1,0,1]=4 5897 B9R1.12 CCNCC1CCCO1 2230a_100015525214_100000203698 [1,0,0,0,1,0|1,0,0]=3 5898 B9R1.12 CCNCC1OCCO1 2230a_100000036311_100000210202 [1,0,0,0,1,0|2,0,0]=4 5899 B9R1.12 CCNCC1OCCO1 2230a_100015525214_100000755774 [1,0,0,0,1,0|2,0,0]=4 5900 B9R1.12 CCNCC1OCCO1 34a_100000036311_100000210202 [1,0,0,0,1,0|2,0,0]=4 5901 B9R1.12 CCNC[C@@H]1CCCO1 2230a_100020590478_100000210202 [1,0,0,0,1,0|1,0,0]=3 5902 B9R1.12 CCNC[C@@H]1CCCO1 34a_100020590478_100000210202 [1,0,0,0,1,0|1,0,0]=3 5903 B9R1.12 CCOCC1CCCC1 34a_100000742336_100000210202 [1,0,0,0,1,0|1,0,1]=4 5904 B9R1.12 CCOCC1CCCC1 34a_100121572206_100000740388 [1,0,0,0,1,0|1,0,1]=4 5905 B9R1.12 CCOCC1CCCC1 7a_100000742336_100000210202 [1,0,0,0,1,0|1,0,1]=4 5906 B9R1.12 CCOCC1CCCO1 34a_100000210270_100000210202 [1,0,0,0,1,0|1,0,0]=3 5907 B9R1.12 CCOCC1CCCO1 7a_100000210270_100000210202 [1,0,0,0,1,0|1,0,0]=3 5908 B9R1.12 CCOCC1COCO1 34a_100011216627_100000210202 [1,0,0,0,1,0|2,0,0]=4 5909 B9R1.12 CCOCC1OCCO1 34a_100000087154_100000210202 [1,0,0,0,1,0|2,0,0]=4 5910 B9R1.12 CCOCC1OCCO1 34a_100121572206_100000755774 [1,0,0,0,1,0|2,0,0]=4 5911 B9R1.12 CCOC[C@H]1CCCN1 34a_100000745186_100000210202 [1,0,0,0,1,0|2,0,0]=4 5912 B9R1.12 CCSCC1CCCC1 62a_100000210202_100000740388 [1,0,0,0,1,0|1,0,1]=4 5913 B9R1.12 CCSCC1CCCC1 62a_100000740388_100000210202 [1,0,0,0,1,0|1,0,1]=4 5914 B9R1.12 CCSCC1CCCO1 62a_100000203698_100000210202 [1,0,0,0,1,0|1,0,0]=3 5915 B9R1.12 CCSCC1CCCO1 62a_100000210202_100000203698 [1,0,0,0,1,0|1,0,0]=3 5916 B9R1.12 CCSCC1OCCO1 62a_100000210202_100000755774 [1,0,0,0,1,0|2,0,0]=4 5917 B9R1.12 CCSCC1OCCO1 62a_100000755774_100000210202 [1,0,0,0,1,0|2,0,0]=4 5918 B9R1.12 CNCCC1CCCC1 2230a_100000739158_200000210301 [1,0,0,0,1,0|1,0,1]=4 5919 B9R1.12 CNCCC1CCCC1 2230a_106832991635_100000760354 [1,0,0,0,1,0|1,0,1]=4 5920 B9R1.12 CNCCC1CCCC1 34a_100000739158_200000210301 [1,0,0,0,1,0|1,0,1]=4 5921 B9R1.12 CNCCC1CCCC1 34a_100102657272_100000760354 [1,0,0,0,1,0|1,0,1]=4 5922 B9R1.12 CNCCC1CCCC1 7a_106832991635_100000760354 [1,0,0,0,1,0|1,0,1]=4 5923 B9R1.12 CNCCC1OCCO1 2230a_100000034215_200000210301 [1,0,0,0,1,0|2,0,0]=4 5924 B9R1.12 CNCCC1OCCO1 2230a_106832991635_100000740749 [1,0,0,0,1,0|2,0,0]=4 5925 B9R1.12 CNCCC1OCCO1 34a_100000034215_200000210301 [1,0,0,0,1,0|2,0,0]=4 5926 B9R1.12 CNCCC1OCCO1 34a_100102657272_100000740749 [1,0,0,0,1,0|2,0,0]=4 5927 B9R1.12 CNCCC1OCCO1 7a_106832991635_100000740749 [1,0,0,0,1,0|2,0,0]=4 5928 B9R1.12 COCCC1CCCC1 34a_100000749090_200000210301 [1,0,0,0,1,0|1,0,1]=4 5929 B9R1.12 COCCC1CCCC1 34a_100138415774_100000760354 [1,0,0,0,1,0|1,0,1]=4 5930 B9R1.12 COCCC1CCCC1 7a_100000749090_200000210301 [1,0,0,0,1,0|1,0,1]=4 5931 B9R1.12 COCCC1OCCO1 34a_100138415774_100000740749 [1,0,0,0,1,0|2,0,0]=4 5932 B9R1.12 CSCCC1CCCC1 62a_100000760354_200000210301 [1,0,0,0,1,0|1,0,1]=4 5933 B9R1.12 CSCCC1CCCC1 62a_200000210301_100000760354 [1,0,0,0,1,0|1,0,1]=4 5934 B9R1.12 CSCCC1OCCO1 62a_200000210301_100000740749 [1,0,0,0,1,0|2,0,0]=4 5935 B9R1.12 CSCOC1CCCO1 34a_100000085407_100011218213 [1,0,0,0,1,0|2,0,0]=4 5936 B9R1.12 FCCOC1CCCO1 34a_100000085407_100011217306 [1,0,0,0,1,0|2,0,0]=4 5937 B9R1.12 FCNC[C@@H]1CCCO1 34a_100020590478_100015361967 [1,0,0,0,1,0|2,0,0]=4 5938 B9R1.12 FCOCC1CCCO1 34a_100000210270_100015361967 [1,0,0,0,1,0|2,0,0]=4 5939 B9R1.12 FCOCC1CCCO1 7a_100000210270_100015361967 [1,0,0,0,1,0|2,0,0]=4 5940 B9R1.12 FCSCC1CCCO1 62a_100000203698_100015361967 [1,0,0,0,1,0|2,0,0]=4 5941 B9R1.12 FCSCC1CCCO1 62a_100015361967_100000203698 [1,0,0,0,1,0|2,0,0]=4 5942 B9R1.12 OCCOC1CCCO1 34a_100000085407_100000211926 [1,0,0,0,1,0|2,0,0]=4 5943 B9R1.12 [13CH3]NCCC1CCCC1 2230a_100000739158_200025704644 [1,0,0,0,1,0|1,0,1]=4 5944 B9R1.12 [13CH3]NCCC1CCCC1 34a_100000739158_200025704644 [1,0,0,0,1,0|1,0,1]=4 5945 B9R1.12 [13CH3]NCCC1OCCO1 2230a_100000034215_200025704644 [1,0,0,0,1,0|2,0,0]=4 5946 B9R1.12 [13CH3]NCCC1OCCO1 34a_100000034215_200025704644 [1,0,0,0,1,0|2,0,0]=4 5947 B9R1.12 [13CH3]OCCC1CCCC1 34a_100000749090_200025704644 [1,0,0,0,1,0|1,0,1]=4 5948 B9R1.12 [13CH3]OCCC1CCCC1 7a_100000749090_200025704644 [1,0,0,0,1,0|1,0,1]=4 5949 B9R1.12 [13CH3]SCCC1CCCC1 62a_100000760354_200025704644 [1,0,0,0,1,0|1,0,1]=4 5950 B9R1.12 [13CH3]SCCC1CCCC1 62a_200025704644_100000760354 [1,0,0,0,1,0|1,0,1]=4 5951 B9R1.12 [13CH3]SCCC1OCCO1 62a_200025704644_100000740749 [1,0,0,0,1,0|2,0,0]=4 5952 B9R1.9 CCCSC1CC(=O)C1 62a_100009894365_100000210303 [0,0,0,0,2,0|2,0,0]=4 5953 B9R1.9 CCNCC1CC(=O)C1 2230a_100015525214_100009874392 [0,0,0,0,2,0|2,0,0]=4 5954 B9R1.9 CCOCC1CC(=O)C1 34a_100000101936_100000210202 [0,0,0,0,2,0|2,0,0]=4 5955 B9R1.9 CCSCC1CC(=O)C1 62a_100000210202_100009874392 [0,0,0,0,2,0|2,0,0]=4 5956 B9R1.9 CCSCC1CC(=O)C1 62a_100009874392_100000210202 [0,0,0,0,2,0|2,0,0]=4 5957 B9R1.39 CCCOC1CCC1=O 34a_100000210258_100009892977 [0,0,0,0,2,0|1,0,0]=3 5958 B9R1.39 CCCSC1CCC1=O 62a_100000210303_100009892977 [0,0,0,0,2,0|1,0,0]=3 5959 B9R1.39 CCCSC1CCC1=O 62a_100009892977_100000210303 [0,0,0,0,2,0|1,0,0]=3 5960 B9R1.39 CNCCC1CCC1=O 2230a_106832991635_200016118888 [0,0,0,0,2,0|1,0,0]=3 5961 B9R1.39 CNCCC1CCC1=O 7a_106832991635_200016118888 [0,0,0,0,2,0|1,0,0]=3 5962 B9R1.39 COCSC1CCC1=O 62a_100000766300_100009892977 [0,0,0,0,2,0|2,0,0]=4 5963 B9R1.39 COCSC1CCC1=O 62a_100009892977_100000766300 [0,0,0,0,2,0|2,0,0]=4 5964 B9R1.39 CSCCC1CCC1=O 62a_200000210301_200016118888 [0,0,0,0,2,0|1,0,0]=3 5965 B9R1.39 CSCCC1CCC1=O 62a_200016118888_200000210301 [0,0,0,0,2,0|1,0,0]=3 5966 B9R1.39 CSCSC1CCC1=O 62a_100009892977_100011218213 [0,0,0,0,2,0|2,0,0]=4 5967 B9R1.39 CSCSC1CCC1=O 62a_100011218213_100009892977 [0,0,0,0,2,0|2,0,0]=4 5968 B9R1.39 NCCOC1CCC1=O 34a_100000210304_100009892977 [0,0,0,0,2,0|2,0,0]=4 5969 B9R1.39 O=C1CCC1NCCF 34a_100000724931_100009892977 [0,0,0,0,2,0|2,0,0]=4 5970 B9R1.39 O=C1CCC1NCCO 34a_100016990907_100009892977 [0,0,0,0,2,0|2,0,0]=4 5971 B9R1.39 O=C1CCC1OCCBr 34a_100000211926_100009892977 [0,0,0,0,2,0|2,0,0]=4 5972 B9R1.39 O=C1CCC1SCCF 62a_100009892977_100011217306 [0,0,0,0,2,0|2,0,0]=4 5973 B9R1.39 O=C1CCC1SCCF 62a_100011217306_100009892977 [0,0,0,0,2,0|2,0,0]=4 5974 B9R1.39 O=C1CCC1SCCO 62a_100000211926_100009892977 [0,0,0,0,2,0|2,0,0]=4 5975 B9R1.39 O=C1CCC1SCCO 62a_100009892977_100000211926 [0,0,0,0,2,0|2,0,0]=4 5976 B9R1.39 [13CH3]SCCC1CCC1=O 62a_200016118888_200025704644 [0,0,0,0,2,0|1,0,0]=3 5977 B9R1.39 [13CH3]SCCC1CCC1=O 62a_200025704644_200016118888 [0,0,0,0,2,0|1,0,0]=3 5978 B11R0.164 C=C(C)COC(CC)CCCC 34a_100000210245_200011216223 [0,0,1,0,0,1|1,0,0]=3 5979 B11R0.164 C=C(C)COC(CC)CCCC 34a_100011215227_100000748629 [0,0,1,0,0,1|1,0,0]=3 5980 B11R0.164 C=C(C)COC(CC)CCCC 7a_100011215227_100000748629 [0,0,1,0,0,1|1,0,0]=3 5981 B11R0.164 C=C(C)CSC(CC)CCCC 62a_100000748629_200011216223 [0,0,1,0,0,1|1,1,0]=4 5982 B11R0.164 C=C(C)CSC(CC)CCCC 62a_200011216223_100000211660 [0,0,1,0,0,1|1,1,0]=4 5983 B11R0.164 C=C(F)COC(CC)CCCC 34a_100011215227_100009893438 [0,0,1,0,0,1|1,0,1]=4 5984 B11R0.164 C=C(F)COC(CC)CCCC 34a_200010262243_200011216223 [0,0,1,0,0,1|1,0,1]=4 5985 B11R0.164 C=C(F)COC(CC)CCCC 7a_100011215227_100000042424 [0,0,1,0,0,1|1,0,1]=4 5986 B11R0.164 CCCCC(=NNC(=O)C)CC 4a_100000189765_100000753412 [0,0,1,0,0,1|1,0,1]=4 5987 B11R0.164 CCCCC(CC)CCC(=O)C 1458a_100011216959_200000210301 [0,0,1,0,0,1|1,0,0]=3 5988 B11R0.164 CCCCC(CC)CCC(=O)[13CH3] 1458a_100011216959_200025704644 [0,0,1,0,0,1|1,0,0]=3 5989 B11R0.164 CCCCC(CC)CNC(=O)C 11a_100000209976_100015343762 [0,0,1,0,0,1|1,0,0]=3 5990 B11R0.164 CCCCC(CC)CNC(=O)C 1626a_100000209976_100015343762 [0,0,1,0,0,1|1,0,0]=3 5991 B11R0.164 CCCCC(CC)CNC(=O)C 240690a_100000209976_100015343762 [0,0,1,0,0,1|1,0,0]=3 5992 B11R0.164 CCCCC(CC)CNC(=O)C 527a_100000209976_100103153847 [0,0,1,0,0,1|1,0,0]=3 5993 B11R0.164 CCCCC(CC)COC(C)C 34a_100000210273_100000210206 [0,0,1,0,0,1|1,0,1]=4 5994 B11R0.164 CCCCC(CC)COC(C)C 34a_100000212225_100000211942 [0,0,1,0,0,1|1,0,1]=4 5995 B11R0.164 CCCCC(CC)COC(C)C 7a_100000210273_100000210206 [0,0,1,0,0,1|1,0,1]=4 5996 B11R0.164 CCCCC(CC)NCC(=O)O 269956a_100016091260_200011216223 [0,0,1,0,0,1|2,0,0]=4 5997 B11R0.164 CCCCC(CC)OCC(=O)C 34a_100000211253_200011216223 [0,0,1,0,0,1|0,0,0]=2 5998 B11R0.164 CCCCC(CC)OCC(=O)N 34a_100011215227_100000187820 [0,0,1,0,0,1|1,0,0]=3 5999 B11R0.164 CCCCC(CC)OCC(=O)N 7a_100011215227_100000187820 [0,0,1,0,0,1|1,0,0]=3 6000 B11R0.164 CCCCC(CC)OCC(=O)[O-] 34a_100011215227_100020667443 [0,0,1,0,0,1|1,0,0]=3 6001 B11R0.164 CCCCC(CC)OCC(C)Br 34a_100012180447_200011216223 [0,0,1,0,0,1|1,0,1]=4 6002 B11R0.164 CCCCC(CC)OCC(C)C 34a_100000210257_200011216223 [0,0,1,0,0,1|1,0,1]=4 6003 B11R0.164 CCCCC(CC)OCC(C)C 34a_100011215227_100000210624 [0,0,1,0,0,1|1,0,1]=4 6004 B11R0.164 CCCCC(CC)OCC(C)C 7a_100011215227_100000210760 [0,0,1,0,0,1|1,0,1]=4 6005 B11R0.164 CCCCC(CC)OCC(C)F 34a_100015925927_200011216223 [0,0,1,0,0,1|1,0,1]=4 6006 B11R0.164 CCCCC(CC)OCC(C)O 34a_100011215227_100011218427 [0,0,1,0,0,1|0,0,2]=4 6007 B11R0.164 CCCCC(CC)OCC(C)O 7a_100011215227_100011218427 [0,0,1,0,0,1|0,0,2]=4 6008 B11R0.164 CCCCC(CC)OC[C@@H](C)Cl 34a_100016084084_200011216223 [0,0,1,0,0,1|1,0,1]=4 6009 B11R0.164 CCCCC(CC)OC[C@@H](C)N 34a_100000737577_200011216223 [0,0,1,0,0,1|1,0,1]=4 6010 B11R0.164 CCCCC(CC)OC[C@@H](C)O 34a_100011215227_100009817552 [0,0,1,0,0,1|0,0,2]=4 6011 B11R0.164 CCCCC(CC)OC[C@@H](C)O 7a_100011215227_100009817552 [0,0,1,0,0,1|0,0,2]=4 6012 B11R0.164 CCCCC(CC)OC[N+](=O)[O-] 34a_100011215227_100000761209 [0,0,1,0,0,1|2,0,0]=4 6013 B11R0.164 CCCCC(CC)SCC(=O)N 62a_100000747473_200011216223 [0,0,1,0,0,1|1,1,0]=4 6014 B11R0.164 CCCCC(CC)SCC(=O)N 62a_200011216223_100000747473 [0,0,1,0,0,1|1,1,0]=4 6015 B11R0.164 CCCCC(CC)SCC(=O)[O-] 62a_100020667443_200011216223 [0,0,1,0,0,1|1,1,0]=4 6016 B11R0.164 CCCCC(CC)SCC(=O)[O-] 62a_200011216223_100020667443 [0,0,1,0,0,1|1,1,0]=4 6017 B11R0.164 CCCCN(CC)CCC(=O)C 269982a_100000207695_100000053229 [0,0,1,0,0,1|2,0,0]=4 6018 B11R0.164 CCCCN(CC)COC(=O)C 269982a_100000207695_100000076356 [0,0,1,0,0,1|1,0,0]=3 6019 B11R0.164 CCCOC(CCl)COC(=O)C 7a_200000139349_100000210303 [0,0,1,0,0,1|2,0,0]=4 6020 B11R0.164 CCN(CCOC)COC(=O)C 269982a_100000731262_100000076356 [0,0,1,0,0,1|2,0,0]=4