0 B11R1.16 C#CCC(=O)C1CCCCC1 1458a_100000210647_100000184674 [0,0,0,0,0,0|1,0,2]=3 1 B11R1.16 C#CCC(=O)C1CCCCC1 1458a_100011220946_100000210327 [0,0,0,0,0,0|1,0,2]=3 2 B11R1.16 C#CCC(=O)C1CCCCO1 1458a_100000748299_100000184674 [0,0,0,0,0,0|2,0,2]=4 3 B11R1.16 C#CCC(=O)C1CCCOC1 1458a_100000741522_100000184674 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.16 C#CCC(=O)C1CCCOC1 1458a_100011220946_100000693364 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.16 C#CCC(=O)C1CCOCC1 1458a_100000195482_100000184674 [0,0,0,0,0,0|2,0,2]=4 6 B11R1.16 C#CCC(=O)C1CCOCC1 1458a_100011220946_100011324220 [0,0,0,0,0,0|2,0,2]=4 7 B11R1.16 C#CCC(=O)C1CCSCC1 1458a_100000755232_100000184674 [0,0,0,0,0,0|2,0,2]=4 8 B11R1.16 C=CCC(=O)C1CCCCC1 1458a_100000210193_100000210327 [0,0,0,0,0,0|1,0,2]=3 9 B11R1.16 C=CCC(=O)C1CCCCC1 1458a_100000210647_100000210623 [0,0,0,0,0,0|1,0,2]=3 10 B11R1.16 C=CCC(=O)C1CCCCO1 1458a_100000748299_100000210623 [0,0,0,0,0,0|2,0,2]=4 11 B11R1.16 C=CCC(=O)C1CCCOC1 1458a_100000210193_100000693364 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.16 C=CCC(=O)C1CCCOC1 1458a_100000741522_100000210623 [0,0,0,0,0,0|2,0,2]=4 13 B11R1.16 C=CCC(=O)C1CCOCC1 1458a_100000195482_100000210623 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.16 C=CCC(=O)C1CCOCC1 1458a_100000210193_100011324220 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.16 C=CCC(=O)C1CCSCC1 1458a_100000755232_100000210623 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.16 CC#CC(=O)C1C=CCCC1 1458a_100000763181_100000751183 [0,0,0,0,0,0|1,0,3]=4 17 B11R1.16 CC#CC(=O)C1CCCCC1 1458a_100000763181_100000210327 [0,0,0,0,0,0|1,0,1]=2 18 B11R1.16 CC#CC(=O)C1CCCOC1 1458a_100000763181_100000693364 [0,0,0,0,0,0|2,0,1]=3 19 B11R1.16 CC#CC(=O)C1CCOCC1 1458a_100000763181_100011324220 [0,0,0,0,0,0|2,0,1]=3 20 B11R1.16 CC(OCF)C1CCCCC1 34a_100011216961_100015361967 [0,0,0,0,0,0|2,0,1]=3 21 B11R1.16 CC(OCF)C1CCCCC1 7a_100011216961_100015361967 [0,0,0,0,0,0|2,0,1]=3 22 B11R1.16 CC(OCF)C1CCCNC1 34a_100000740858_100015361967 [0,0,0,0,0,0|3,0,1]=4 23 B11R1.16 CC(OCF)C1CCNCC1 34a_100011728446_100015361967 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.16 CC=CC(=O)C1C=CCCC1 1458a_100000210699_100000751183 [0,0,0,0,0,0|1,0,3]=4 25 B11R1.16 CC=CC(=O)C1CCCCC1 1458a_100000210699_100000210327 [0,0,0,0,0,0|1,0,1]=2 26 B11R1.16 CC=CC(=O)C1CCCOC1 1458a_100000210699_100000693364 [0,0,0,0,0,0|2,0,1]=3 27 B11R1.16 CC=CC(=O)C1CCOCC1 1458a_100000210699_100011324220 [0,0,0,0,0,0|2,0,1]=3 28 B11R1.16 CC=CC(=O)N1CCCOC1 11a_100000131196_100000210699 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.16 CC=CC(=O)N1CCCOC1 240690a_100000131196_100000210699 [0,0,0,0,0,0|3,0,1]=4 30 B11R1.16 CC=CC(=O)N1CCOCC1 11a_100015191051_100000210699 [0,0,0,0,0,0|3,0,1]=4 31 B11R1.16 CC=CC(=O)N1CCOCC1 1626a_100015191051_100000210699 [0,0,0,0,0,0|3,0,1]=4 32 B11R1.16 CC=CC(=O)N1CCOCC1 240690a_100015191051_100000210699 [0,0,0,0,0,0|3,0,1]=4 33 B11R1.16 CC=CC(=O)N1CCSCC1 11a_100000737611_100000210699 [0,0,0,0,0,0|3,0,1]=4 34 B11R1.16 CC=CC(=O)N1CCSCC1 240690a_100000737611_100000210699 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.16 CCCC(=O)C1=CCCCC1 1458a_100000765259_100000210303 [0,0,0,0,0,0|1,0,2]=3 36 B11R1.16 CCCC(=O)C1=CCCCO1 1458a_100000764163_100000210303 [0,0,0,0,0,0|2,0,2]=4 37 B11R1.16 CCCC(=O)C1=COCCC1 1458a_100000749935_100000210303 [0,0,0,0,0,0|2,0,2]=4 38 B11R1.16 CCCC(=O)C1C=CCCC1 1458a_100000211992_100000751183 [0,0,0,0,0,0|1,0,2]=3 39 B11R1.16 CCCC(=O)C1CCCCC1 1458a_100000210647_100000210303 [0,0,0,0,0,0|1,0,0]=1 40 B11R1.16 CCCC(=O)C1CCCCC1 1458a_100000211992_100000210327 [0,0,0,0,0,0|1,0,0]=1 41 B11R1.16 CCCC(=O)C1CCCCO1 1458a_100000748299_100000210303 [0,0,0,0,0,0|2,0,0]=2 42 B11R1.16 CCCC(=O)C1CCCOC1 1458a_100000211992_100000693364 [0,0,0,0,0,0|2,0,0]=2 43 B11R1.16 CCCC(=O)C1CCCOC1 1458a_100000741522_100000210303 [0,0,0,0,0,0|2,0,0]=2 44 B11R1.16 CCCC(=O)C1CCOCC1 1458a_100000195482_100000210303 [0,0,0,0,0,0|2,0,0]=2 45 B11R1.16 CCCC(=O)C1CCOCC1 1458a_100000211992_100011324220 [0,0,0,0,0,0|2,0,0]=2 46 B11R1.16 CCCC(=O)C1CCSCC1 1458a_100000755232_100000210303 [0,0,0,0,0,0|2,0,0]=2 47 B11R1.16 CCCC(=O)C1COCCO1 1458a_100000045528_100000210303 [0,0,0,0,0,0|3,0,0]=3 48 B11R1.16 CCCC(=O)C1SCCCS1 1458a_100000028545_100000210303 [0,0,0,0,0,0|3,0,0]=3 49 B11R1.16 CCCC(=O)N1CC=CCC1 11a_100000698166_100000211992 [0,0,0,0,0,0|2,0,2]=4 50 B11R1.16 CCCC(=O)N1CC=CCC1 1626a_100000698166_100000211992 [0,0,0,0,0,0|2,0,2]=4 51 B11R1.16 CCCC(=O)N1CC=CCC1 240690a_100000698166_100000211992 [0,0,0,0,0,0|2,0,2]=4 52 B11R1.16 CCCC(=O)N1CC=CCC1 527a_100000698166_100000211992 [0,0,0,0,0,0|2,0,2]=4 53 B11R1.16 CCCC(=O)N1CCCOC1 11a_100000131196_100000211992 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.16 CCCC(=O)N1CCCOC1 240690a_100000131196_100000211992 [0,0,0,0,0,0|3,0,0]=3 55 B11R1.16 CCCC(=O)N1CCOCC1 11a_100015191051_100000211992 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.16 CCCC(=O)N1CCOCC1 1626a_100015191051_100000211992 [0,0,0,0,0,0|3,0,0]=3 57 B11R1.16 CCCC(=O)N1CCOCC1 240690a_100015191051_100000211992 [0,0,0,0,0,0|3,0,0]=3 58 B11R1.16 CCCC(=O)N1CCOCC1 527a_100015191051_100000211992 [0,0,0,0,0,0|3,0,0]=3 59 B11R1.16 CCCC(=O)N1CCSCC1 11a_100000737611_100000211992 [0,0,0,0,0,0|3,0,0]=3 60 B11R1.16 CCCC(=O)N1CCSCC1 240690a_100000737611_100000211992 [0,0,0,0,0,0|3,0,0]=3 61 B11R1.16 CCCC(=O)N1CCSCC1 527a_100000737611_100000211992 [0,0,0,0,0,0|3,0,0]=3 62 B11R1.16 CCCC(=O)[C@H]1CC=CCC1 1458a_100009820709_100000210303 [0,0,0,0,0,0|1,0,2]=3 63 B11R1.16 CCCN(C)C1CCCCC1 2230a_100000207522_100000210303 [0,0,0,0,0,0|3,0,0]=3 64 B11R1.16 CCCN(C)C1CCCCC1 2230a_100000750343_200000210301 [0,0,0,0,0,0|3,0,0]=3 65 B11R1.16 CCCN(C)C1CCCCC1 269982a_100000207522_100000210303 [0,0,0,0,0,0|3,0,0]=3 66 B11R1.16 CCCN(C)C1CCCCC1 269982a_100000747261_100000210327 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.16 CCCN(C)C1CCCCC1 269982a_100000750343_200000210301 [0,0,0,0,0,0|3,0,0]=3 68 B11R1.16 CCCN(C)C1CCCCC1 270004a_100000747261_100000210434 [0,0,0,0,0,0|3,0,0]=3 69 B11R1.16 CCCN(C)C1CCCCC1 34a_100000207522_100000210303 [0,0,0,0,0,0|3,0,0]=3 70 B11R1.16 CCCN(C)C1CCCCC1 34a_100000750343_200000210301 [0,0,0,0,0,0|3,0,0]=3 71 B11R1.16 CCCN(C)C1CCCOC1 269982a_100000747261_100000693364 [0,0,0,0,0,0|4,0,0]=4 72 B11R1.16 CCCN(C)C1CCCOC1 270004a_100000747261_100000753404 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.16 CCCN(C)C1CCCSC1 270004a_100000747261_100000057913 [0,0,0,0,0,0|4,0,0]=4 74 B11R1.16 CCCN(C)C1CCNCC1 270004a_100000747261_100015192401 [0,0,0,0,0,0|4,0,0]=4 75 B11R1.16 CCCN(C)C1CCOCC1 2230a_100020587155_100000210303 [0,0,0,0,0,0|4,0,0]=4 76 B11R1.16 CCCN(C)C1CCOCC1 269982a_100000747261_100011324220 [0,0,0,0,0,0|4,0,0]=4 77 B11R1.16 CCCN(C)C1CCOCC1 269982a_100020587155_100000210303 [0,0,0,0,0,0|4,0,0]=4 78 B11R1.16 CCCN(C)C1CCOCC1 270004a_100000747261_100011217826 [0,0,0,0,0,0|4,0,0]=4 79 B11R1.16 CCCN(C)C1CCOCC1 34a_100020587155_100000210303 [0,0,0,0,0,0|4,0,0]=4 80 B11R1.16 CCCN(C)C1CCSCC1 2230a_100015184757_100000210303 [0,0,0,0,0,0|4,0,0]=4 81 B11R1.16 CCCN(C)C1CCSCC1 269982a_100000747261_100000069128 [0,0,0,0,0,0|4,0,0]=4 82 B11R1.16 CCCN(C)C1CCSCC1 269982a_100015184757_100000210303 [0,0,0,0,0,0|4,0,0]=4 83 B11R1.16 CCCN(C)C1CCSCC1 270004a_100000747261_100000203788 [0,0,0,0,0,0|4,0,0]=4 84 B11R1.16 CCCN(C)C1CCSCC1 34a_100015184757_100000210303 [0,0,0,0,0,0|4,0,0]=4 85 B11R1.16 CCCN([13CH3])C1CCCCC1 2230a_100000750343_200025704644 [0,0,0,0,0,0|3,0,0]=3 86 B11R1.16 CCCN([13CH3])C1CCCCC1 269982a_100000750343_200025704644 [0,0,0,0,0,0|3,0,0]=3 87 B11R1.16 CCCN([13CH3])C1CCCCC1 34a_100000750343_200025704644 [0,0,0,0,0,0|3,0,0]=3 88 B11R1.16 CCNC(=O)C1=CCCCC1 11a_100015525214_100000765259 [0,0,0,0,0,0|1,0,2]=3 89 B11R1.16 CCNC(=O)C1=CCCCC1 240690a_100015525214_100000765259 [0,0,0,0,0,0|1,0,2]=3 90 B11R1.16 CCNC(=O)C1=CCCCC1 527a_100015525214_100000765259 [0,0,0,0,0,0|1,0,2]=3 91 B11R1.16 CCNC(=O)C1=CCCCO1 11a_100015525214_100000764163 [0,0,0,0,0,0|2,0,2]=4 92 B11R1.16 CCNC(=O)C1=CCCCO1 240690a_100015525214_100000764163 [0,0,0,0,0,0|2,0,2]=4 93 B11R1.16 CCNC(=O)C1=CCCCO1 527a_100015525214_100000764163 [0,0,0,0,0,0|2,0,2]=4 94 B11R1.16 CCNC(=O)C1=COCCC1 527a_100015525214_100000749935 [0,0,0,0,0,0|2,0,2]=4 95 B11R1.16 CCNC(=O)C1CCCCC1 11a_100015525214_100000210647 [0,0,0,0,0,0|1,0,0]=1 96 B11R1.16 CCNC(=O)C1CCCCC1 240690a_100015525214_100000210647 [0,0,0,0,0,0|1,0,0]=1 97 B11R1.16 CCNC(=O)C1CCCCC1 527a_100015525214_100000210647 [0,0,0,0,0,0|1,0,0]=1 98 B11R1.16 CCNC(=O)C1CCCCO1 11a_100015525214_100000748299 [0,0,0,0,0,0|2,0,0]=2 99 B11R1.16 CCNC(=O)C1CCCCO1 240690a_100015525214_100000748299 [0,0,0,0,0,0|2,0,0]=2 100 B11R1.16 CCNC(=O)C1CCCCO1 527a_100015525214_100000748299 [0,0,0,0,0,0|2,0,0]=2 101 B11R1.16 CCNC(=O)C1CCCOC1 11a_100015525214_100000741522 [0,0,0,0,0,0|2,0,0]=2 102 B11R1.16 CCNC(=O)C1CCCOC1 240690a_100015525214_100000741522 [0,0,0,0,0,0|2,0,0]=2 103 B11R1.16 CCNC(=O)C1CCCOC1 527a_100015525214_100000741522 [0,0,0,0,0,0|2,0,0]=2 104 B11R1.16 CCNC(=O)C1CCOCC1 11a_100015525214_100000195482 [0,0,0,0,0,0|2,0,0]=2 105 B11R1.16 CCNC(=O)C1CCOCC1 240690a_100015525214_100000195482 [0,0,0,0,0,0|2,0,0]=2 106 B11R1.16 CCNC(=O)C1CCOCC1 527a_100015525214_100000195482 [0,0,0,0,0,0|2,0,0]=2 107 B11R1.16 CCNC(=O)C1CCSCC1 11a_100015525214_100000755232 [0,0,0,0,0,0|2,0,0]=2 108 B11R1.16 CCNC(=O)C1CCSCC1 240690a_100015525214_100000755232 [0,0,0,0,0,0|2,0,0]=2 109 B11R1.16 CCNC(=O)C1CCSCC1 527a_100015525214_100000755232 [0,0,0,0,0,0|2,0,0]=2 110 B11R1.16 CCNC(=O)C1COCCO1 11a_100015525214_100000045528 [0,0,0,0,0,0|3,0,0]=3 111 B11R1.16 CCNC(=O)C1COCCO1 240690a_100015525214_100000045528 [0,0,0,0,0,0|3,0,0]=3 112 B11R1.16 CCNC(=O)C1COCCO1 527a_100015525214_100000045528 [0,0,0,0,0,0|3,0,0]=3 113 B11R1.16 CCNC(=O)C1SCCCS1 11a_100015525214_100000028545 [0,0,0,0,0,0|3,0,0]=3 114 B11R1.16 CCNC(=O)C1SCCCS1 240690a_100015525214_100000028545 [0,0,0,0,0,0|3,0,0]=3 115 B11R1.16 CCNC(=O)C1SCCCS1 527a_100015525214_100000028545 [0,0,0,0,0,0|3,0,0]=3 116 B11R1.16 CCNC(=O)N1CC=CCC1 2708a_100015525214_100000698166 [0,0,0,0,0,0|2,0,2]=4 117 B11R1.16 CCNC(=O)N1CC=CCC1 273464a_100015525214_100000698166 [0,0,0,0,0,0|2,0,2]=4 118 B11R1.16 CCNC(=O)N1CCCOC1 2708a_100015525214_100000131196 [0,0,0,0,0,0|3,0,0]=3 119 B11R1.16 CCNC(=O)N1CCCOC1 273464a_100015525214_100000131196 [0,0,0,0,0,0|3,0,0]=3 120 B11R1.16 CCNC(=O)N1CCOCC1 2708a_100015525214_100015191051 [0,0,0,0,0,0|3,0,0]=3 121 B11R1.16 CCNC(=O)N1CCOCC1 273464a_100015525214_100015191051 [0,0,0,0,0,0|3,0,0]=3 122 B11R1.16 CCNC(=O)N1CCSCC1 2708a_100015525214_100000737611 [0,0,0,0,0,0|3,0,0]=3 123 B11R1.16 CCNC(=O)N1CCSCC1 273464a_100015525214_100000737611 [0,0,0,0,0,0|3,0,0]=3 124 B11R1.16 CCNC(=O)[C@H]1CC=CCC1 11a_100015525214_100009820709 [0,0,0,0,0,0|1,0,2]=3 125 B11R1.16 CCNC(=O)[C@H]1CC=CCC1 240690a_100015525214_100009820709 [0,0,0,0,0,0|1,0,2]=3 126 B11R1.16 CCNC(=O)[C@H]1CC=CCC1 527a_100015525214_100009820709 [0,0,0,0,0,0|1,0,2]=3 127 B11R1.16 CCNC(C)C1CCCCC1 269862a_100015525214_100000210989 [0,0,0,0,0,0|2,0,1]=3 128 B11R1.16 CCNC(C)C1CCCCN1 269862a_100015525214_200011997754 [0,0,0,0,0,0|3,0,1]=4 129 B11R1.16 CCNC(C)C1CCCNC1 269862a_100015525214_100011320585 [0,0,0,0,0,0|3,0,1]=4 130 B11R1.16 CCNC(C)C1CCNCC1 269862a_100015525214_100015204191 [0,0,0,0,0,0|3,0,1]=4 131 B11R1.16 CCNC(C)C1CCOCC1 269862a_100015525214_100000759496 [0,0,0,0,0,0|3,0,1]=4 132 B11R1.16 CCN[C@H](C)C1CCCCC1 2230a_100025707633_100000210202 [0,0,0,0,0,0|2,0,1]=3 133 B11R1.16 CCN[C@H](C)C1CCCCC1 34a_100025707633_100000210202 [0,0,0,0,0,0|2,0,1]=3 134 B11R1.16 CCOC(C)C1CCCCC1 34a_100011216961_100000210202 [0,0,0,0,0,0|1,0,1]=2 135 B11R1.16 CCOC(C)C1CCCCC1 7a_100011216961_100000210202 [0,0,0,0,0,0|1,0,1]=2 136 B11R1.16 CCOC(C)C1CCCNC1 34a_100000740858_100000210202 [0,0,0,0,0,0|2,0,1]=3 137 B11R1.16 CCOC(C)C1CCNCC1 34a_100011728446_100000210202 [0,0,0,0,0,0|2,0,1]=3 138 B11R1.16 CCO[C@H](C)C1CCOCC1 34a_100000703848_100000210202 [0,0,0,0,0,0|2,0,1]=3 139 B11R1.16 CCO[C@H](C)C1CCOCC1 7a_100000703848_100000210202 [0,0,0,0,0,0|2,0,1]=3 140 B11R1.16 CN(CCF)C1CCCCC1 2230a_100000207522_100011217306 [0,0,0,0,0,0|4,0,0]=4 141 B11R1.16 CN(CCF)C1CCCCC1 269982a_100000207522_100011217306 [0,0,0,0,0,0|4,0,0]=4 142 B11R1.16 CN(CCF)C1CCCCC1 34a_100000207522_100011217306 [0,0,0,0,0,0|4,0,0]=4 143 B11R1.16 CN(CCO)C1CCCCC1 2230a_100000200466_200000210301 [0,0,0,0,0,0|4,0,0]=4 144 B11R1.16 CN(CCO)C1CCCCC1 2230a_100000207522_100000211926 [0,0,0,0,0,0|4,0,0]=4 145 B11R1.16 CN(CCO)C1CCCCC1 269982a_100000200466_200000210301 [0,0,0,0,0,0|4,0,0]=4 146 B11R1.16 CN(CCO)C1CCCCC1 269982a_100000207522_100000211926 [0,0,0,0,0,0|4,0,0]=4 147 B11R1.16 CN(CCO)C1CCCCC1 269982a_100000210263_100000210327 [0,0,0,0,0,0|4,0,0]=4 148 B11R1.16 CN(CCO)C1CCCCC1 270004a_100000210263_100000210434 [0,0,0,0,0,0|4,0,0]=4 149 B11R1.16 CN(CCO)C1CCCCC1 34a_100000200466_200000210301 [0,0,0,0,0,0|4,0,0]=4 150 B11R1.16 CN(CCO)C1CCCCC1 34a_100000207522_100000211926 [0,0,0,0,0,0|4,0,0]=4 151 B11R1.16 CNCC(=O)C1CCCCC1 2230a_106832991635_100000241979 [0,0,0,0,0,0|2,0,0]=2 152 B11R1.16 CNCC(=O)C1CCCCC1 34a_100102657272_100000241979 [0,0,0,0,0,0|2,0,0]=2 153 B11R1.16 CNCC(=O)C1CCCCC1 7a_106832991635_100000241979 [0,0,0,0,0,0|2,0,0]=2 154 B11R1.16 CNCC(=O)C1CCOCC1 2230a_106832991635_100000689883 [0,0,0,0,0,0|3,0,0]=3 155 B11R1.16 CNCC(=O)C1CCOCC1 34a_100102657272_100000689883 [0,0,0,0,0,0|3,0,0]=3 156 B11R1.16 CNCC(=O)C1CCOCC1 7a_106832991635_100000689883 [0,0,0,0,0,0|3,0,0]=3 157 B11R1.16 CNCC(=O)N1CCCCC1 2230a_100000751303_200000210301 [0,0,0,0,0,0|3,0,0]=3 158 B11R1.16 CNCC(=O)N1CCCCC1 2230a_106832991635_100000183409 [0,0,0,0,0,0|3,0,0]=3 159 B11R1.16 CNCC(=O)N1CCCCC1 34a_100102657272_100000183409 [0,0,0,0,0,0|3,0,0]=3 160 B11R1.16 CNCC(=O)N1CCCCC1 7a_106832991635_100000183409 [0,0,0,0,0,0|3,0,0]=3 161 B11R1.16 CNCC(=O)N1CCOCC1 2230a_100000697423_200000210301 [0,0,0,0,0,0|4,0,0]=4 162 B11R1.16 CNCC(=O)N1CCOCC1 2230a_106832991635_100000183410 [0,0,0,0,0,0|4,0,0]=4 163 B11R1.16 CNCC(=O)N1CCOCC1 34a_100102657272_100000183410 [0,0,0,0,0,0|4,0,0]=4 164 B11R1.16 CNCC(=O)N1CCOCC1 7a_106832991635_100000183410 [0,0,0,0,0,0|4,0,0]=4 165 B11R1.16 CNNC(=O)C1=CCCCC1 22a_100016993582_100000765259 [0,0,0,0,0,0|2,0,2]=4 166 B11R1.16 CNNC(=O)C1CCCCC1 22a_100016993582_100000210647 [0,0,0,0,0,0|2,0,0]=2 167 B11R1.16 CNNC(=O)C1CCCCO1 22a_100016993582_100000748299 [0,0,0,0,0,0|3,0,0]=3 168 B11R1.16 CNNC(=O)C1CCCOC1 22a_100016993582_100000741522 [0,0,0,0,0,0|3,0,0]=3 169 B11R1.16 CNNC(=O)C1CCOCC1 22a_100016993582_100000195482 [0,0,0,0,0,0|3,0,0]=3 170 B11R1.16 CNNC(=O)C1CCSCC1 22a_100016993582_100000755232 [0,0,0,0,0,0|3,0,0]=3 171 B11R1.16 CNNC(=O)C1COCCO1 22a_100016993582_100000045528 [0,0,0,0,0,0|4,0,0]=4 172 B11R1.16 CNNC(=O)C1SCCCS1 22a_100016993582_100000028545 [0,0,0,0,0,0|4,0,0]=4 173 B11R1.16 CNNC(=O)[C@H]1CC=CCC1 22a_100016993582_100009820709 [0,0,0,0,0,0|2,0,2]=4 174 B11R1.16 COCC(=O)C1C=CCCC1 1458a_100000210968_100000751183 [0,0,0,0,0,0|2,0,2]=4 175 B11R1.16 COCC(=O)C1CCCCC1 1458a_100000210968_100000210327 [0,0,0,0,0,0|2,0,0]=2 176 B11R1.16 COCC(=O)C1CCCCC1 34a_100138415774_100000241979 [0,0,0,0,0,0|2,0,0]=2 177 B11R1.16 COCC(=O)C1CCCOC1 1458a_100000210968_100000693364 [0,0,0,0,0,0|3,0,0]=3 178 B11R1.16 COCC(=O)C1CCOCC1 1458a_100000210968_100011324220 [0,0,0,0,0,0|3,0,0]=3 179 B11R1.16 COCC(=O)C1CCOCC1 34a_100138415774_100000689883 [0,0,0,0,0,0|3,0,0]=3 180 B11R1.16 COCC(=O)N1CCCCC1 34a_100138415774_100000183409 [0,0,0,0,0,0|3,0,0]=3 181 B11R1.16 COCC(=O)N1CCCCC1 7a_100011315646_200000210301 [0,0,0,0,0,0|3,0,0]=3 182 B11R1.16 COCC(=O)N1CCCOC1 11a_100000131196_100000210968 [0,0,0,0,0,0|4,0,0]=4 183 B11R1.16 COCC(=O)N1CCCOC1 240690a_100000131196_100000210968 [0,0,0,0,0,0|4,0,0]=4 184 B11R1.16 COCC(=O)N1CCOCC1 11a_100015191051_100000210968 [0,0,0,0,0,0|4,0,0]=4 185 B11R1.16 COCC(=O)N1CCOCC1 1626a_100015191051_100000210968 [0,0,0,0,0,0|4,0,0]=4 186 B11R1.16 COCC(=O)N1CCOCC1 240690a_100015191051_100000210968 [0,0,0,0,0,0|4,0,0]=4 187 B11R1.16 COCC(=O)N1CCOCC1 34a_100138415774_100000183410 [0,0,0,0,0,0|4,0,0]=4 188 B11R1.16 COCC(=O)N1CCOCC1 527a_100015191051_100000210968 [0,0,0,0,0,0|4,0,0]=4 189 B11R1.16 COCC(=O)N1CCOCC1 7a_100000752472_200000210301 [0,0,0,0,0,0|4,0,0]=4 190 B11R1.16 COCC(=O)N1CCSCC1 11a_100000737611_100000210968 [0,0,0,0,0,0|4,0,0]=4 191 B11R1.16 COCC(=O)N1CCSCC1 240690a_100000737611_100000210968 [0,0,0,0,0,0|4,0,0]=4 192 B11R1.16 COCC(=O)N1CCSCC1 527a_100000737611_100000210968 [0,0,0,0,0,0|4,0,0]=4 193 B11R1.16 COCN(C)C1CCCCC1 2230a_100000207522_100000766300 [0,0,0,0,0,0|4,0,0]=4 194 B11R1.16 COCN(C)C1CCCCC1 269982a_100000207522_100000766300 [0,0,0,0,0,0|4,0,0]=4 195 B11R1.16 COC[C@H](N)C1CCCCC1 34a_100009817630_200000210301 [0,0,0,0,0,0|3,0,1]=4 196 B11R1.16 CSCC(=O)C1C=CCCC1 1458a_100000184570_100000751183 [0,0,0,0,0,0|2,0,2]=4 197 B11R1.16 CSCC(=O)C1CCCCC1 1458a_100000184570_100000210327 [0,0,0,0,0,0|2,0,0]=2 198 B11R1.16 CSCC(=O)C1CCCCC1 62a_100000241979_200000210301 [0,0,0,0,0,0|2,0,0]=2 199 B11R1.16 CSCC(=O)C1CCCCC1 62a_200000210301_100000241979 [0,0,0,0,0,0|2,0,0]=2 200 B11R1.16 CSCC(=O)C1CCCOC1 1458a_100000184570_100000693364 [0,0,0,0,0,0|3,0,0]=3 201 B11R1.16 CSCC(=O)C1CCOCC1 1458a_100000184570_100011324220 [0,0,0,0,0,0|3,0,0]=3 202 B11R1.16 CSCC(=O)C1CCOCC1 62a_100000689883_200000210301 [0,0,0,0,0,0|3,0,0]=3 203 B11R1.16 CSCC(=O)C1CCOCC1 62a_200000210301_100000689883 [0,0,0,0,0,0|3,0,0]=3 204 B11R1.16 CSCC(=O)N1CCCCC1 62a_100000183409_200000210301 [0,0,0,0,0,0|3,0,0]=3 205 B11R1.16 CSCC(=O)N1CCCCC1 62a_200000210301_100000183409 [0,0,0,0,0,0|3,0,0]=3 206 B11R1.16 CSCC(=O)N1CCCOC1 11a_100000131196_100000184570 [0,0,0,0,0,0|4,0,0]=4 207 B11R1.16 CSCC(=O)N1CCCOC1 240690a_100000131196_100000184570 [0,0,0,0,0,0|4,0,0]=4 208 B11R1.16 CSCC(=O)N1CCOCC1 11a_100015191051_100000184570 [0,0,0,0,0,0|4,0,0]=4 209 B11R1.16 CSCC(=O)N1CCOCC1 1626a_100015191051_100000184570 [0,0,0,0,0,0|4,0,0]=4 210 B11R1.16 CSCC(=O)N1CCOCC1 240690a_100015191051_100000184570 [0,0,0,0,0,0|4,0,0]=4 211 B11R1.16 CSCC(=O)N1CCOCC1 527a_100015191051_100000184570 [0,0,0,0,0,0|4,0,0]=4 212 B11R1.16 CSCC(=O)N1CCOCC1 62a_100000183410_200000210301 [0,0,0,0,0,0|4,0,0]=4 213 B11R1.16 CSCC(=O)N1CCOCC1 62a_200000210301_100000183410 [0,0,0,0,0,0|4,0,0]=4 214 B11R1.16 CSCC(=O)N1CCSCC1 11a_100000737611_100000184570 [0,0,0,0,0,0|4,0,0]=4 215 B11R1.16 CSCC(=O)N1CCSCC1 240690a_100000737611_100000184570 [0,0,0,0,0,0|4,0,0]=4 216 B11R1.16 CSCC(=O)N1CCSCC1 527a_100000737611_100000184570 [0,0,0,0,0,0|4,0,0]=4 217 B11R1.16 CSCN(C)C1CCCCC1 2230a_100000207522_100011218213 [0,0,0,0,0,0|4,0,0]=4 218 B11R1.16 CSCN(C)C1CCCCC1 269982a_100000207522_100011218213 [0,0,0,0,0,0|4,0,0]=4 219 B11R1.16 CSCN(C)C1CCCCC1 34a_100000207522_100011218213 [0,0,0,0,0,0|4,0,0]=4 220 B11R1.16 C[C@@H](NCF)C1CCCCC1 34a_100025707633_100015361967 [0,0,0,0,0,0|3,0,1]=4 221 B11R1.16 C[C@@H](OCF)C1CCOCC1 34a_100000703848_100015361967 [0,0,0,0,0,0|3,0,1]=4 222 B11R1.16 C[C@@H](OCF)C1CCOCC1 7a_100000703848_100015361967 [0,0,0,0,0,0|3,0,1]=4 223 B11R1.16 N#CCC(=O)C1CCCCC1 1458a_100000210647_100011214920 [0,0,0,0,0,0|2,0,1]=3 224 B11R1.16 N#CCC(=O)C1CCCCC1 1458a_100051588842_100000210327 [0,0,0,0,0,0|2,0,1]=3 225 B11R1.16 N#CCC(=O)C1CCCCO1 1458a_100000748299_100011214920 [0,0,0,0,0,0|3,0,1]=4 226 B11R1.16 N#CCC(=O)C1CCCOC1 1458a_100000741522_100011214920 [0,0,0,0,0,0|3,0,1]=4 227 B11R1.16 N#CCC(=O)C1CCCOC1 1458a_100051588842_100000693364 [0,0,0,0,0,0|3,0,1]=4 228 B11R1.16 N#CCC(=O)C1CCOCC1 1458a_100000195482_100011214920 [0,0,0,0,0,0|3,0,1]=4 229 B11R1.16 N#CCC(=O)C1CCOCC1 1458a_100051588842_100011324220 [0,0,0,0,0,0|3,0,1]=4 230 B11R1.16 N#CCC(=O)C1CCSCC1 1458a_100000755232_100011214920 [0,0,0,0,0,0|3,0,1]=4 231 B11R1.16 O=C(C=CBr)C1CCCCC1 1458a_100016273825_100000210327 [0,0,0,0,0,0|2,0,1]=3 232 B11R1.16 O=C(C=CBr)C1CCCOC1 1458a_100016273825_100000693364 [0,0,0,0,0,0|3,0,1]=4 233 B11R1.16 O=C(C=CBr)C1CCOCC1 1458a_100016273825_100011324220 [0,0,0,0,0,0|3,0,1]=4 234 B11R1.16 O=C(C=CCl)C1CCCCC1 1458a_200016279998_100000210327 [0,0,0,0,0,0|2,0,1]=3 235 B11R1.16 O=C(C=CCl)C1CCCOC1 1458a_200016279998_100000693364 [0,0,0,0,0,0|3,0,1]=4 236 B11R1.16 O=C(C=CCl)C1CCOCC1 1458a_200016279998_100011324220 [0,0,0,0,0,0|3,0,1]=4 237 B11R1.16 O=C(C=CI)C1CCCCC1 1458a_100016256311_100000210327 [0,0,0,0,0,0|2,0,1]=3 238 B11R1.16 O=C(C=CI)C1CCCOC1 1458a_100016256311_100000693364 [0,0,0,0,0,0|3,0,1]=4 239 B11R1.16 O=C(C=CI)C1CCOCC1 1458a_100016256311_100011324220 [0,0,0,0,0,0|3,0,1]=4 240 B11R1.16 O=C(CCF)C1=CCCCC1 1458a_100000765259_100011217306 [0,0,0,0,0,0|2,0,2]=4 241 B11R1.16 O=C(CCF)C1CCCCC1 1458a_100000210647_100011217306 [0,0,0,0,0,0|2,0,0]=2 242 B11R1.16 O=C(CCF)C1CCCCO1 1458a_100000748299_100011217306 [0,0,0,0,0,0|3,0,0]=3 243 B11R1.16 O=C(CCF)C1CCCOC1 1458a_100000741522_100011217306 [0,0,0,0,0,0|3,0,0]=3 244 B11R1.16 O=C(CCF)C1CCOCC1 1458a_100000195482_100011217306 [0,0,0,0,0,0|3,0,0]=3 245 B11R1.16 O=C(CCF)C1CCSCC1 1458a_100000755232_100011217306 [0,0,0,0,0,0|3,0,0]=3 246 B11R1.16 O=C(CCF)C1COCCO1 1458a_100000045528_100011217306 [0,0,0,0,0,0|4,0,0]=4 247 B11R1.16 O=C(CCF)C1SCCCS1 1458a_100000028545_100011217306 [0,0,0,0,0,0|4,0,0]=4 248 B11R1.16 O=C(CCF)[C@H]1CC=CCC1 1458a_100009820709_100011217306 [0,0,0,0,0,0|2,0,2]=4 249 B11R1.16 O=C(CCO)C1=CCCCC1 1458a_100000765259_100000211926 [0,0,0,0,0,0|2,0,2]=4 250 B11R1.16 O=C(CCO)C1C=CCCC1 1458a_100011216618_100000751183 [0,0,0,0,0,0|2,0,2]=4 251 B11R1.16 O=C(CCO)C1CCCCC1 1458a_100000210647_100000211926 [0,0,0,0,0,0|2,0,0]=2 252 B11R1.16 O=C(CCO)C1CCCCC1 1458a_100011216618_100000210327 [0,0,0,0,0,0|2,0,0]=2 253 B11R1.16 O=C(CCO)C1CCCCO1 1458a_100000748299_100000211926 [0,0,0,0,0,0|3,0,0]=3 254 B11R1.16 O=C(CCO)C1CCCOC1 1458a_100000741522_100000211926 [0,0,0,0,0,0|3,0,0]=3 255 B11R1.16 O=C(CCO)C1CCCOC1 1458a_100011216618_100000693364 [0,0,0,0,0,0|3,0,0]=3 256 B11R1.16 O=C(CCO)C1CCOCC1 1458a_100000195482_100000211926 [0,0,0,0,0,0|3,0,0]=3 257 B11R1.16 O=C(CCO)C1CCOCC1 1458a_100011216618_100011324220 [0,0,0,0,0,0|3,0,0]=3 258 B11R1.16 O=C(CCO)C1CCSCC1 1458a_100000755232_100000211926 [0,0,0,0,0,0|3,0,0]=3 259 B11R1.16 O=C(CCO)C1COCCO1 1458a_100000045528_100000211926 [0,0,0,0,0,0|4,0,0]=4 260 B11R1.16 O=C(CCO)C1SCCCS1 1458a_100000028545_100000211926 [0,0,0,0,0,0|4,0,0]=4 261 B11R1.16 O=C(CCO)N1CCCOC1 240690a_100000131196_100011216618 [0,0,0,0,0,0|4,0,0]=4 262 B11R1.16 O=C(CCO)N1CCOCC1 240690a_100015191051_100011216618 [0,0,0,0,0,0|4,0,0]=4 263 B11R1.16 O=C(CCO)N1CCSCC1 240690a_100000737611_100011216618 [0,0,0,0,0,0|4,0,0]=4 264 B11R1.16 O=C(CCO)[C@H]1CC=CCC1 1458a_100009820709_100000211926 [0,0,0,0,0,0|2,0,2]=4 265 B11R1.16 [13CH3]N(CCO)C1CCCCC1 2230a_100000200466_200025704644 [0,0,0,0,0,0|4,0,0]=4 266 B11R1.16 [13CH3]N(CCO)C1CCCCC1 269982a_100000200466_200025704644 [0,0,0,0,0,0|4,0,0]=4 267 B11R1.16 [13CH3]N(CCO)C1CCCCC1 34a_100000200466_200025704644 [0,0,0,0,0,0|4,0,0]=4 268 B11R1.16 [13CH3]NCC(=O)N1CCCCC1 2230a_100000751303_200025704644 [0,0,0,0,0,0|3,0,0]=3 269 B11R1.16 [13CH3]NCC(=O)N1CCOCC1 2230a_100000697423_200025704644 [0,0,0,0,0,0|4,0,0]=4 270 B11R1.16 [13CH3]OCC(=O)N1CCCCC1 7a_100011315646_200025704644 [0,0,0,0,0,0|3,0,0]=3 271 B11R1.16 [13CH3]OCC(=O)N1CCOCC1 7a_100000752472_200025704644 [0,0,0,0,0,0|4,0,0]=4 272 B11R1.16 [13CH3]OC[C@H](N)C1CCCCC1 34a_100009817630_200025704644 [0,0,0,0,0,0|3,0,1]=4 273 B11R1.16 [13CH3]SCC(=O)C1CCCCC1 62a_100000241979_200025704644 [0,0,0,0,0,0|2,0,0]=2 274 B11R1.16 [13CH3]SCC(=O)C1CCCCC1 62a_200025704644_100000241979 [0,0,0,0,0,0|2,0,0]=2 275 B11R1.16 [13CH3]SCC(=O)C1CCOCC1 62a_100000689883_200025704644 [0,0,0,0,0,0|3,0,0]=3 276 B11R1.16 [13CH3]SCC(=O)C1CCOCC1 62a_200025704644_100000689883 [0,0,0,0,0,0|3,0,0]=3 277 B11R1.16 [13CH3]SCC(=O)N1CCCCC1 62a_100000183409_200025704644 [0,0,0,0,0,0|3,0,0]=3 278 B11R1.16 [13CH3]SCC(=O)N1CCCCC1 62a_200025704644_100000183409 [0,0,0,0,0,0|3,0,0]=3 279 B11R1.16 [13CH3]SCC(=O)N1CCOCC1 62a_100000183410_200025704644 [0,0,0,0,0,0|4,0,0]=4 280 B11R1.16 [13CH3]SCC(=O)N1CCOCC1 62a_200025704644_100000183410 [0,0,0,0,0,0|4,0,0]=4 281 B10R1.15 C#CC(=O)C1CCCCC1 1458a_100000211873_100000210327 [1,0,0,0,0,0|0,0,2]=3 282 B10R1.15 C#CC(=O)C1CCCOC1 1458a_100000211873_100000693364 [1,0,0,0,0,0|1,0,2]=4 283 B10R1.15 C#CC(=O)C1CCOCC1 1458a_100000211873_100011324220 [1,0,0,0,0,0|1,0,2]=4 284 B10R1.15 C=CC(=O)C1CCCCC1 1458a_100000185746_100000210327 [1,0,0,0,0,0|0,0,2]=3 285 B10R1.15 C=CC(=O)C1CCCOC1 1458a_100000185746_100000693364 [1,0,0,0,0,0|1,0,2]=4 286 B10R1.15 C=CC(=O)C1CCOCC1 1458a_100000185746_100011324220 [1,0,0,0,0,0|1,0,2]=4 287 B10R1.15 CC(O[13CH3])C1CCCCC1 34a_100011216961_200025704644 [1,0,0,0,0,0|1,0,1]=3 288 B10R1.15 CC(O[13CH3])C1CCCCC1 7a_100011216961_200025704644 [1,0,0,0,0,0|1,0,1]=3 289 B10R1.15 CC(O[13CH3])C1CCCNC1 34a_100000740858_200025704644 [1,0,0,0,0,0|2,0,1]=4 290 B10R1.15 CC(O[13CH3])C1CCNCC1 34a_100011728446_200025704644 [1,0,0,0,0,0|2,0,1]=4 291 B10R1.15 CCC(=O)C1=CCCCC1 1458a_100000765259_100000210202 [1,0,0,0,0,0|0,0,2]=3 292 B10R1.15 CCC(=O)C1=CCCCO1 1458a_100000764163_100000210202 [1,0,0,0,0,0|1,0,2]=4 293 B10R1.15 CCC(=O)C1=COCCC1 1458a_100000749935_100000210202 [1,0,0,0,0,0|1,0,2]=4 294 B10R1.15 CCC(=O)C1C=CCCC1 1458a_100000210414_100000751183 [1,0,0,0,0,0|0,0,2]=3 295 B10R1.15 CCC(=O)C1CCCCC1 1458a_100000210414_100000210327 [1,0,0,0,0,0|0,0,0]=1 296 B10R1.15 CCC(=O)C1CCCCC1 1458a_100000210647_100000210202 [1,0,0,0,0,0|0,0,0]=1 297 B10R1.15 CCC(=O)C1CCCCO1 1458a_100000748299_100000210202 [1,0,0,0,0,0|1,0,0]=2 298 B10R1.15 CCC(=O)C1CCCOC1 1458a_100000210414_100000693364 [1,0,0,0,0,0|1,0,0]=2 299 B10R1.15 CCC(=O)C1CCCOC1 1458a_100000741522_100000210202 [1,0,0,0,0,0|1,0,0]=2 300 B10R1.15 CCC(=O)C1CCOCC1 1458a_100000195482_100000210202 [1,0,0,0,0,0|1,0,0]=2 301 B10R1.15 CCC(=O)C1CCOCC1 1458a_100000210414_100011324220 [1,0,0,0,0,0|1,0,0]=2 302 B10R1.15 CCC(=O)C1CCSCC1 1458a_100000755232_100000210202 [1,0,0,0,0,0|1,0,0]=2 303 B10R1.15 CCC(=O)C1COCCO1 1458a_100000045528_100000210202 [1,0,0,0,0,0|2,0,0]=3 304 B10R1.15 CCC(=O)C1SCCCS1 1458a_100000028545_100000210202 [1,0,0,0,0,0|2,0,0]=3 305 B10R1.15 CCC(=O)N1CC=CCC1 11a_100000698166_100000210414 [1,0,0,0,0,0|1,0,2]=4 306 B10R1.15 CCC(=O)N1CC=CCC1 1626a_100000698166_100000210414 [1,0,0,0,0,0|1,0,2]=4 307 B10R1.15 CCC(=O)N1CC=CCC1 240690a_100000698166_100000210414 [1,0,0,0,0,0|1,0,2]=4 308 B10R1.15 CCC(=O)N1CC=CCC1 527a_100000698166_100000210414 [1,0,0,0,0,0|1,0,2]=4 309 B10R1.15 CCC(=O)N1CCCOC1 11a_100000131196_100000210414 [1,0,0,0,0,0|2,0,0]=3 310 B10R1.15 CCC(=O)N1CCCOC1 240690a_100000131196_100000210414 [1,0,0,0,0,0|2,0,0]=3 311 B10R1.15 CCC(=O)N1CCOCC1 11a_100015191051_100000210414 [1,0,0,0,0,0|2,0,0]=3 312 B10R1.15 CCC(=O)N1CCOCC1 1626a_100015191051_100000210414 [1,0,0,0,0,0|2,0,0]=3 313 B10R1.15 CCC(=O)N1CCOCC1 240690a_100015191051_100000210414 [1,0,0,0,0,0|2,0,0]=3 314 B10R1.15 CCC(=O)N1CCOCC1 527a_100015191051_100000210414 [1,0,0,0,0,0|2,0,0]=3 315 B10R1.15 CCC(=O)N1CCSCC1 11a_100000737611_100000210414 [1,0,0,0,0,0|2,0,0]=3 316 B10R1.15 CCC(=O)N1CCSCC1 240690a_100000737611_100000210414 [1,0,0,0,0,0|2,0,0]=3 317 B10R1.15 CCC(=O)N1CCSCC1 527a_100000737611_100000210414 [1,0,0,0,0,0|2,0,0]=3 318 B10R1.15 CCC(=O)[C@H]1CC=CCC1 1458a_100009820709_100000210202 [1,0,0,0,0,0|0,0,2]=3 319 B10R1.15 CCN(C)C1CCCCC1 2230a_100000201195_200000210301 [1,0,0,0,0,0|2,0,0]=3 320 B10R1.15 CCN(C)C1CCCCC1 2230a_100000207522_100000210202 [1,0,0,0,0,0|2,0,0]=3 321 B10R1.15 CCN(C)C1CCCCC1 269982a_100000201195_200000210301 [1,0,0,0,0,0|2,0,0]=3 322 B10R1.15 CCN(C)C1CCCCC1 269982a_100000207522_100000204670 [1,0,0,0,0,0|2,0,0]=3 323 B10R1.15 CCN(C)C1CCCCC1 269982a_100000225621_100000210327 [1,0,0,0,0,0|2,0,0]=3 324 B10R1.15 CCN(C)C1CCCCC1 34a_100000201195_200000210301 [1,0,0,0,0,0|2,0,0]=3 325 B10R1.15 CCN(C)C1CCCCC1 34a_100000207522_100000210202 [1,0,0,0,0,0|2,0,0]=3 326 B10R1.15 CCN(C)C1CCCOC1 269982a_100000225621_100000693364 [1,0,0,0,0,0|3,0,0]=4 327 B10R1.15 CCN(C)C1CCOCC1 2230a_100011324086_200000210301 [1,0,0,0,0,0|3,0,0]=4 328 B10R1.15 CCN(C)C1CCOCC1 2230a_100020587155_100000210202 [1,0,0,0,0,0|3,0,0]=4 329 B10R1.15 CCN(C)C1CCOCC1 269982a_100000225621_100011324220 [1,0,0,0,0,0|3,0,0]=4 330 B10R1.15 CCN(C)C1CCOCC1 269982a_100011324086_200000210301 [1,0,0,0,0,0|3,0,0]=4 331 B10R1.15 CCN(C)C1CCOCC1 269982a_100020587155_100000204670 [1,0,0,0,0,0|3,0,0]=4 332 B10R1.15 CCN(C)C1CCOCC1 34a_100011324086_200000210301 [1,0,0,0,0,0|3,0,0]=4 333 B10R1.15 CCN(C)C1CCOCC1 34a_100020587155_100000210202 [1,0,0,0,0,0|3,0,0]=4 334 B10R1.15 CCN(C)C1CCSCC1 2230a_100015184757_100000210202 [1,0,0,0,0,0|3,0,0]=4 335 B10R1.15 CCN(C)C1CCSCC1 269982a_100000225621_100000069128 [1,0,0,0,0,0|3,0,0]=4 336 B10R1.15 CCN(C)C1CCSCC1 269982a_100015184757_100000204670 [1,0,0,0,0,0|3,0,0]=4 337 B10R1.15 CCN(C)C1CCSCC1 34a_100015184757_100000210202 [1,0,0,0,0,0|3,0,0]=4 338 B10R1.15 CCN([13CH3])C1CCCCC1 2230a_100000201195_200025704644 [1,0,0,0,0,0|2,0,0]=3 339 B10R1.15 CCN([13CH3])C1CCCCC1 269982a_100000201195_200025704644 [1,0,0,0,0,0|2,0,0]=3 340 B10R1.15 CCN([13CH3])C1CCCCC1 34a_100000201195_200025704644 [1,0,0,0,0,0|2,0,0]=3 341 B10R1.15 CCN([13CH3])C1CCOCC1 2230a_100011324086_200025704644 [1,0,0,0,0,0|3,0,0]=4 342 B10R1.15 CCN([13CH3])C1CCOCC1 269982a_100011324086_200025704644 [1,0,0,0,0,0|3,0,0]=4 343 B10R1.15 CCN([13CH3])C1CCOCC1 34a_100011324086_200025704644 [1,0,0,0,0,0|3,0,0]=4 344 B10R1.15 CN(CF)C1CCCCC1 269982a_100000207522_100015361967 [1,0,0,0,0,0|3,0,0]=4 345 B10R1.15 CN(CF)C1CCCCC1 34a_100000207522_100015361967 [1,0,0,0,0,0|3,0,0]=4 346 B10R1.15 CNC(=O)C1=CCCCC1 11a_106832991635_100000765259 [1,0,0,0,0,0|1,0,2]=4 347 B10R1.15 CNC(=O)C1=CCCCC1 1626a_100102657272_100000765259 [1,0,0,0,0,0|1,0,2]=4 348 B10R1.15 CNC(=O)C1=CCCCC1 240690a_100102657272_100000765259 [1,0,0,0,0,0|1,0,2]=4 349 B10R1.15 CNC(=O)C1=CCCCC1 527a_100102657272_100000765259 [1,0,0,0,0,0|1,0,2]=4 350 B10R1.15 CNC(=O)C1CCCCC1 11a_106832991635_100000210647 [1,0,0,0,0,0|1,0,0]=2 351 B10R1.15 CNC(=O)C1CCCCC1 1626a_100102657272_100000210647 [1,0,0,0,0,0|1,0,0]=2 352 B10R1.15 CNC(=O)C1CCCCC1 240690a_100102657272_100000210647 [1,0,0,0,0,0|1,0,0]=2 353 B10R1.15 CNC(=O)C1CCCCC1 527a_100102657272_100000210647 [1,0,0,0,0,0|1,0,0]=2 354 B10R1.15 CNC(=O)C1CCCCO1 11a_106832991635_100000748299 [1,0,0,0,0,0|2,0,0]=3 355 B10R1.15 CNC(=O)C1CCCCO1 1626a_100102657272_100000748299 [1,0,0,0,0,0|2,0,0]=3 356 B10R1.15 CNC(=O)C1CCCCO1 240690a_100102657272_100000748299 [1,0,0,0,0,0|2,0,0]=3 357 B10R1.15 CNC(=O)C1CCCCO1 527a_100102657272_100000748299 [1,0,0,0,0,0|2,0,0]=3 358 B10R1.15 CNC(=O)C1CCCOC1 11a_106832991635_100000741522 [1,0,0,0,0,0|2,0,0]=3 359 B10R1.15 CNC(=O)C1CCCOC1 1626a_100102657272_100000741522 [1,0,0,0,0,0|2,0,0]=3 360 B10R1.15 CNC(=O)C1CCCOC1 240690a_100102657272_100000741522 [1,0,0,0,0,0|2,0,0]=3 361 B10R1.15 CNC(=O)C1CCCOC1 527a_100102657272_100000741522 [1,0,0,0,0,0|2,0,0]=3 362 B10R1.15 CNC(=O)C1CCOCC1 11a_106832991635_100000195482 [1,0,0,0,0,0|2,0,0]=3 363 B10R1.15 CNC(=O)C1CCOCC1 1626a_100102657272_100000195482 [1,0,0,0,0,0|2,0,0]=3 364 B10R1.15 CNC(=O)C1CCOCC1 240690a_100102657272_100000195482 [1,0,0,0,0,0|2,0,0]=3 365 B10R1.15 CNC(=O)C1CCOCC1 527a_100102657272_100000195482 [1,0,0,0,0,0|2,0,0]=3 366 B10R1.15 CNC(=O)C1CCSCC1 11a_106832991635_100000755232 [1,0,0,0,0,0|2,0,0]=3 367 B10R1.15 CNC(=O)C1CCSCC1 1626a_100102657272_100000755232 [1,0,0,0,0,0|2,0,0]=3 368 B10R1.15 CNC(=O)C1CCSCC1 240690a_100102657272_100000755232 [1,0,0,0,0,0|2,0,0]=3 369 B10R1.15 CNC(=O)C1CCSCC1 527a_100102657272_100000755232 [1,0,0,0,0,0|2,0,0]=3 370 B10R1.15 CNC(=O)C1COCCO1 11a_106832991635_100000045528 [1,0,0,0,0,0|3,0,0]=4 371 B10R1.15 CNC(=O)C1COCCO1 1626a_100102657272_100000045528 [1,0,0,0,0,0|3,0,0]=4 372 B10R1.15 CNC(=O)C1COCCO1 240690a_100102657272_100000045528 [1,0,0,0,0,0|3,0,0]=4 373 B10R1.15 CNC(=O)C1COCCO1 527a_100102657272_100000045528 [1,0,0,0,0,0|3,0,0]=4 374 B10R1.15 CNC(=O)C1SCCCS1 11a_106832991635_100000028545 [1,0,0,0,0,0|3,0,0]=4 375 B10R1.15 CNC(=O)C1SCCCS1 1626a_100102657272_100000028545 [1,0,0,0,0,0|3,0,0]=4 376 B10R1.15 CNC(=O)C1SCCCS1 240690a_100102657272_100000028545 [1,0,0,0,0,0|3,0,0]=4 377 B10R1.15 CNC(=O)C1SCCCS1 527a_100102657272_100000028545 [1,0,0,0,0,0|3,0,0]=4 378 B10R1.15 CNC(=O)N1CCCOC1 2708a_100102657272_100000131196 [1,0,0,0,0,0|3,0,0]=4 379 B10R1.15 CNC(=O)N1CCCOC1 273464a_100102657272_100000131196 [1,0,0,0,0,0|3,0,0]=4 380 B10R1.15 CNC(=O)N1CCOCC1 2708a_100102657272_100015191051 [1,0,0,0,0,0|3,0,0]=4 381 B10R1.15 CNC(=O)N1CCOCC1 273464a_100102657272_100015191051 [1,0,0,0,0,0|3,0,0]=4 382 B10R1.15 CNC(=O)N1CCSCC1 2708a_100102657272_100000737611 [1,0,0,0,0,0|3,0,0]=4 383 B10R1.15 CNC(=O)N1CCSCC1 273464a_100102657272_100000737611 [1,0,0,0,0,0|3,0,0]=4 384 B10R1.15 CNC(=O)[C@H]1CC=CCC1 11a_106832991635_100009820709 [1,0,0,0,0,0|1,0,2]=4 385 B10R1.15 CNC(=O)[C@H]1CC=CCC1 1626a_100102657272_100009820709 [1,0,0,0,0,0|1,0,2]=4 386 B10R1.15 CNC(=O)[C@H]1CC=CCC1 240690a_100102657272_100009820709 [1,0,0,0,0,0|1,0,2]=4 387 B10R1.15 CNC(=O)[C@H]1CC=CCC1 527a_100102657272_100009820709 [1,0,0,0,0,0|1,0,2]=4 388 B10R1.15 CNC(C)C1CCCCC1 269862a_106832991636_100000210989 [1,0,0,0,0,0|2,0,1]=4 389 B10R1.15 CN[C@H](C)C1CCCCC1 2230a_100025707633_200000210301 [1,0,0,0,0,0|2,0,1]=4 390 B10R1.15 CN[C@H](C)C1CCCCC1 34a_100025707633_200000210301 [1,0,0,0,0,0|2,0,1]=4 391 B10R1.15 COC(C)C1CCCCC1 34a_100011216961_200000210301 [1,0,0,0,0,0|1,0,1]=3 392 B10R1.15 COC(C)C1CCCCC1 7a_100011216961_200000210301 [1,0,0,0,0,0|1,0,1]=3 393 B10R1.15 COC(C)C1CCCNC1 34a_100000740858_200000210301 [1,0,0,0,0,0|2,0,1]=4 394 B10R1.15 COC(C)C1CCNCC1 34a_100011728446_200000210301 [1,0,0,0,0,0|2,0,1]=4 395 B10R1.15 CO[C@H](C)C1CCOCC1 34a_100000703848_200000210301 [1,0,0,0,0,0|2,0,1]=4 396 B10R1.15 CO[C@H](C)C1CCOCC1 7a_100000703848_200000210301 [1,0,0,0,0,0|2,0,1]=4 397 B10R1.15 C[C@@H](N[13CH3])C1CCCCC1 2230a_100025707633_200025704644 [1,0,0,0,0,0|2,0,1]=4 398 B10R1.15 C[C@@H](N[13CH3])C1CCCCC1 34a_100025707633_200025704644 [1,0,0,0,0,0|2,0,1]=4 399 B10R1.15 C[C@@H](O[13CH3])C1CCOCC1 34a_100000703848_200025704644 [1,0,0,0,0,0|2,0,1]=4 400 B10R1.15 C[C@@H](O[13CH3])C1CCOCC1 7a_100000703848_200025704644 [1,0,0,0,0,0|2,0,1]=4 401 B10R1.15 O=C(CF)C1=CCCCC1 1458a_100000765259_100015361967 [1,0,0,0,0,0|1,0,2]=4 402 B10R1.15 O=C(CF)C1CCCCC1 1458a_100000210647_100015361967 [1,0,0,0,0,0|1,0,0]=2 403 B10R1.15 O=C(CF)C1CCCCO1 1458a_100000748299_100015361967 [1,0,0,0,0,0|2,0,0]=3 404 B10R1.15 O=C(CF)C1CCCOC1 1458a_100000741522_100015361967 [1,0,0,0,0,0|2,0,0]=3 405 B10R1.15 O=C(CF)C1CCOCC1 1458a_100000195482_100015361967 [1,0,0,0,0,0|2,0,0]=3 406 B10R1.15 O=C(CF)C1CCSCC1 1458a_100000755232_100015361967 [1,0,0,0,0,0|2,0,0]=3 407 B10R1.15 O=C(CF)C1COCCO1 1458a_100000045528_100015361967 [1,0,0,0,0,0|3,0,0]=4 408 B10R1.15 O=C(CF)C1SCCCS1 1458a_100000028545_100015361967 [1,0,0,0,0,0|3,0,0]=4 409 B10R1.15 O=C(CF)[C@H]1CC=CCC1 1458a_100009820709_100015361967 [1,0,0,0,0,0|1,0,2]=4 410 B10R1.15 O=C(CO)C1C=CCCC1 1458a_100000210174_100000751183 [1,0,0,0,0,0|1,0,2]=4 411 B10R1.15 O=C(CO)C1CCCCC1 1458a_100000210174_100000210327 [1,0,0,0,0,0|1,0,0]=2 412 B10R1.15 O=C(CO)C1CCCOC1 1458a_100000210174_100000693364 [1,0,0,0,0,0|2,0,0]=3 413 B10R1.15 O=C(CO)C1CCOCC1 1458a_100000210174_100011324220 [1,0,0,0,0,0|2,0,0]=3 414 B10R1.15 O=C(CO)N1CCCOC1 240690a_100000131196_100000210174 [1,0,0,0,0,0|3,0,0]=4 415 B10R1.15 O=C(CO)N1CCOCC1 240690a_100015191051_100000210174 [1,0,0,0,0,0|3,0,0]=4 416 B10R1.15 O=C(CO)N1CCOCC1 527a_100015191051_100000210174 [1,0,0,0,0,0|3,0,0]=4 417 B10R1.15 O=C(CO)N1CCSCC1 240690a_100000737611_100000210174 [1,0,0,0,0,0|3,0,0]=4 418 B10R1.15 O=C(CO)N1CCSCC1 527a_100000737611_100000210174 [1,0,0,0,0,0|3,0,0]=4 419 B10R1.17 BrCCOC1CCCCC1 34a_100000211926_100000210327 [1,0,0,0,0,0|3,0,0]=4 420 B10R1.17 CC=NNC1CCCCC1 4a_100000709804_200000210099 [1,0,0,0,0,0|2,0,1]=4 421 B10R1.17 CCCNC1CCCCC1 2230a_100000182618_100000210303 [1,0,0,0,0,0|2,0,0]=3 422 B10R1.17 CCCNC1CCCCC1 270004a_100020643023_100000210434 [1,0,0,0,0,0|2,0,0]=3 423 B10R1.17 CCCNC1CCCCC1 34a_100000182618_100000210303 [1,0,0,0,0,0|2,0,0]=3 424 B10R1.17 CCCNC1CCCOC1 2230a_100000719290_100000210303 [1,0,0,0,0,0|3,0,0]=4 425 B10R1.17 CCCNC1CCCOC1 270004a_100020643023_100000753404 [1,0,0,0,0,0|3,0,0]=4 426 B10R1.17 CCCNC1CCCOC1 34a_100000719290_100000210303 [1,0,0,0,0,0|3,0,0]=4 427 B10R1.17 CCCNC1CCCSC1 270004a_100020643023_100000057913 [1,0,0,0,0,0|3,0,0]=4 428 B10R1.17 CCCNC1CCNCC1 270004a_100020643023_100015192401 [1,0,0,0,0,0|3,0,0]=4 429 B10R1.17 CCCNC1CCOCC1 2230a_100000741149_100000210303 [1,0,0,0,0,0|3,0,0]=4 430 B10R1.17 CCCNC1CCOCC1 270004a_100020643023_100011217826 [1,0,0,0,0,0|3,0,0]=4 431 B10R1.17 CCCNC1CCOCC1 34a_100000741149_100000210303 [1,0,0,0,0,0|3,0,0]=4 432 B10R1.17 CCCNC1CCSCC1 2230a_100000748639_100000210303 [1,0,0,0,0,0|3,0,0]=4 433 B10R1.17 CCCNC1CCSCC1 270004a_100020643023_100000203788 [1,0,0,0,0,0|3,0,0]=4 434 B10R1.17 CCCNC1CCSCC1 34a_100000748639_100000210303 [1,0,0,0,0,0|3,0,0]=4 435 B10R1.17 CCCOC1CCCCC1 34a_100000210231_100000210303 [1,0,0,0,0,0|2,0,0]=3 436 B10R1.17 CCCOC1CCCCC1 34a_100000210258_100000210327 [1,0,0,0,0,0|2,0,0]=3 437 B10R1.17 CCCOC1CCCCC1 7a_100000210231_100000210303 [1,0,0,0,0,0|2,0,0]=3 438 B10R1.17 CCCOC1CCCCO1 34a_100000033831_100000210303 [1,0,0,0,0,0|3,0,0]=4 439 B10R1.17 CCCOC1CCCOC1 34a_100000210258_100000693364 [1,0,0,0,0,0|3,0,0]=4 440 B10R1.17 CCCOC1CCCOC1 34a_100000754041_100000210303 [1,0,0,0,0,0|3,0,0]=4 441 B10R1.17 CCCOC1CCCSC1 7a_100015962668_100000210303 [1,0,0,0,0,0|3,0,0]=4 442 B10R1.17 CCCOC1CCOCC1 34a_100000744328_100000210303 [1,0,0,0,0,0|3,0,0]=4 443 B10R1.17 CCCOC1CCSCC1 34a_100000210258_100000069128 [1,0,0,0,0,0|3,0,0]=4 444 B10R1.17 CCCOC1CCSCC1 34a_100000731022_100000210303 [1,0,0,0,0,0|3,0,0]=4 445 B10R1.17 CCCOC1CCSCC1 7a_100000731022_100000210303 [1,0,0,0,0,0|3,0,0]=4 446 B10R1.17 CCCSC1CCCCC1 62a_100000210303_100000210327 [1,0,0,0,0,0|2,0,0]=3 447 B10R1.17 CCCSC1CCCCC1 62a_100000210327_100000210303 [1,0,0,0,0,0|2,0,0]=3 448 B10R1.17 CCCSC1CCCOC1 62a_100000210303_100000693364 [1,0,0,0,0,0|3,0,0]=4 449 B10R1.17 CCCSC1CCOCC1 62a_100000210303_100011324220 [1,0,0,0,0,0|3,0,0]=4 450 B10R1.17 CCCSC1CCSCC1 62a_100000210303_100000069128 [1,0,0,0,0,0|3,0,0]=4 451 B10R1.17 CCNCC1CCCCC1 2230a_100000210473_100000210202 [1,0,0,0,0,0|1,0,1]=3 452 B10R1.17 CCNCC1CCCCC1 2230a_100015525214_100000211423 [1,0,0,0,0,0|1,0,1]=3 453 B10R1.17 CCNCC1CCCCC1 269862a_100015525214_100000211278 [1,0,0,0,0,0|1,0,1]=3 454 B10R1.17 CCNCC1CCCCC1 34a_100000210473_100000210202 [1,0,0,0,0,0|1,0,1]=3 455 B10R1.17 CCNCC1CCCCO1 2230a_100000174945_100000210202 [1,0,0,0,0,0|2,0,1]=4 456 B10R1.17 CCNCC1CCCCO1 2230a_100015525214_100000211543 [1,0,0,0,0,0|2,0,1]=4 457 B10R1.17 CCNCC1CCCCO1 34a_100000174945_100000210202 [1,0,0,0,0,0|2,0,1]=4 458 B10R1.17 CCNCC1CCCOC1 2230a_100000720124_100000210202 [1,0,0,0,0,0|2,0,1]=4 459 B10R1.17 CCNCC1CCCOC1 2230a_100015525214_100000741521 [1,0,0,0,0,0|2,0,1]=4 460 B10R1.17 CCNCC1CCCOC1 34a_100000720124_100000210202 [1,0,0,0,0,0|2,0,1]=4 461 B10R1.17 CCNCC1CCOCC1 2230a_100000746373_100000210202 [1,0,0,0,0,0|2,0,1]=4 462 B10R1.17 CCNCC1CCOCC1 2230a_100015525214_100000754603 [1,0,0,0,0,0|2,0,1]=4 463 B10R1.17 CCNCC1CCOCC1 269862a_100015525214_100000749017 [1,0,0,0,0,0|2,0,1]=4 464 B10R1.17 CCNCC1CCOCC1 34a_100000746373_100000210202 [1,0,0,0,0,0|2,0,1]=4 465 B10R1.17 CCNCC1CCSCC1 2230a_100015188806_100000210202 [1,0,0,0,0,0|2,0,1]=4 466 B10R1.17 CCNCC1CCSCC1 269862a_100015525214_100000067145 [1,0,0,0,0,0|2,0,1]=4 467 B10R1.17 CCNCC1CCSCC1 270004a_100015525214_100000067145 [1,0,0,0,0,0|2,0,1]=4 468 B10R1.17 CCNCC1CCSCC1 34a_100015188806_100000210202 [1,0,0,0,0,0|2,0,1]=4 469 B10R1.17 CCNN=C1CCCCC1 4a_100000756455_100000210434 [1,0,0,0,0,0|2,0,1]=4 470 B10R1.17 CCOCC1CC=CCC1 34a_100000210713_100000210202 [1,0,0,0,0,0|0,0,3]=4 471 B10R1.17 CCOCC1CCCCC1 34a_100000212181_100000210202 [1,0,0,0,0,0|0,0,1]=2 472 B10R1.17 CCOCC1CCCCC1 34a_100121572206_100000211423 [1,0,0,0,0,0|0,0,1]=2 473 B10R1.17 CCOCC1CCCCC1 7a_100000212181_100000210202 [1,0,0,0,0,0|0,0,1]=2 474 B10R1.17 CCOCC1CCCCN1 34a_100000210821_100000210202 [1,0,0,0,0,0|1,0,1]=3 475 B10R1.17 CCOCC1CCCCO1 34a_100000211370_100000210202 [1,0,0,0,0,0|1,0,1]=3 476 B10R1.17 CCOCC1CCCCO1 34a_100121572206_100000211543 [1,0,0,0,0,0|1,0,1]=3 477 B10R1.17 CCOCC1CCCCO1 7a_100000211370_100000210202 [1,0,0,0,0,0|1,0,1]=3 478 B10R1.17 CCOCC1CCCNC1 34a_100000211344_100000210202 [1,0,0,0,0,0|1,0,1]=3 479 B10R1.17 CCOCC1CCCOC1 34a_100000741520_100000210202 [1,0,0,0,0,0|1,0,1]=3 480 B10R1.17 CCOCC1CCCOC1 34a_100121572206_100000741521 [1,0,0,0,0,0|1,0,1]=3 481 B10R1.17 CCOCC1CCNCC1 34a_100000738675_100000210202 [1,0,0,0,0,0|1,0,1]=3 482 B10R1.17 CCOCC1CCOCC1 34a_100000749013_100000210202 [1,0,0,0,0,0|1,0,1]=3 483 B10R1.17 CCOCC1CCOCC1 34a_100121572206_100000754603 [1,0,0,0,0,0|1,0,1]=3 484 B10R1.17 CCOCC1CCSCC1 34a_100000070558_100000210202 [1,0,0,0,0,0|1,0,1]=3 485 B10R1.17 CCOCC1CCSCC1 7a_100000070558_100000210202 [1,0,0,0,0,0|1,0,1]=3 486 B10R1.17 CCOCN1CCCOC1 269982a_100000131196_100000739092 [1,0,0,0,0,0|2,0,1]=4 487 B10R1.17 CCOCN1CCOCC1 269982a_100015191051_100000739092 [1,0,0,0,0,0|2,0,1]=4 488 B10R1.17 CCOCN1CCSCC1 269982a_100000737611_100000739092 [1,0,0,0,0,0|2,0,1]=4 489 B10R1.17 CCOC[C@@H]1CNCCO1 34a_100015189573_100000210202 [1,0,0,0,0,0|2,0,1]=4 490 B10R1.17 CCOC[C@@H]1COCCN1 34a_100000717676_100000210202 [1,0,0,0,0,0|2,0,1]=4 491 B10R1.17 CCOC[C@H]1COCCO1 34a_100009875890_100000210202 [1,0,0,0,0,0|2,0,1]=4 492 B10R1.17 CCSCC1CCCCC1 62a_100000210202_100000211423 [1,0,0,0,0,0|0,1,1]=3 493 B10R1.17 CCSCC1CCCCC1 62a_100000211423_100000210202 [1,0,0,0,0,0|0,1,1]=3 494 B10R1.17 CCSCC1CCCCO1 62a_100000210202_100000211543 [1,0,0,0,0,0|1,1,1]=4 495 B10R1.17 CCSCC1CCCCO1 62a_100000211543_100000210202 [1,0,0,0,0,0|1,1,1]=4 496 B10R1.17 CCSCC1CCCOC1 62a_100000210202_100000741521 [1,0,0,0,0,0|1,1,1]=4 497 B10R1.17 CCSCC1CCCOC1 62a_100000741521_100000210202 [1,0,0,0,0,0|1,1,1]=4 498 B10R1.17 CCSCC1CCOCC1 62a_100000210202_100000749018 [1,0,0,0,0,0|1,1,1]=4 499 B10R1.17 CCSCC1CCOCC1 62a_100000754603_100000210202 [1,0,0,0,0,0|1,1,1]=4 500 B10R1.17 CNCCC1CCCCC1 2230a_100000738074_200000210301 [1,0,0,0,0,0|2,0,1]=4 501 B10R1.17 CNCCC1CCCCC1 2230a_106832991635_100012355289 [1,0,0,0,0,0|2,0,1]=4 502 B10R1.17 CNCCC1CCCCC1 270004a_106832991635_100011713444 [1,0,0,0,0,0|2,0,1]=4 503 B10R1.17 CNCCC1CCCCC1 34a_100000738074_200000210301 [1,0,0,0,0,0|2,0,1]=4 504 B10R1.17 CNCCC1CCCCC1 34a_100102657272_100011209188 [1,0,0,0,0,0|2,0,1]=4 505 B10R1.17 CNCCC1CCCCC1 7a_106832991635_100011273959 [1,0,0,0,0,0|2,0,1]=4 506 B10R1.17 CNCOC1CCCCC1 2230a_106832991635_100011935260 [1,0,0,0,0,0|3,0,0]=4 507 B10R1.17 CNCOC1CCCCC1 34a_100102657272_100011935260 [1,0,0,0,0,0|3,0,0]=4 508 B10R1.17 CNCOC1CCCCC1 7a_106832991635_100011935260 [1,0,0,0,0,0|3,0,0]=4 509 B10R1.17 COCCC1CCCCC1 34a_100011217863_200000210301 [1,0,0,0,0,0|2,0,1]=4 510 B10R1.17 COCCC1CCCCC1 34a_100138415774_100011209188 [1,0,0,0,0,0|2,0,1]=4 511 B10R1.17 COCCC1CCCCC1 7a_100011217863_200000210301 [1,0,0,0,0,0|2,0,1]=4 512 B10R1.17 COCNC1CCCCC1 2230a_100000182618_100000766300 [1,0,0,0,0,0|3,0,0]=4 513 B10R1.17 COCOC1CCCCC1 34a_100138415774_100011935260 [1,0,0,0,0,0|3,0,0]=4 514 B10R1.17 COCSC1CCCCC1 62a_100000210327_100000766300 [1,0,0,0,0,0|3,0,0]=4 515 B10R1.17 COCSC1CCCCC1 62a_100000766300_100000210327 [1,0,0,0,0,0|3,0,0]=4 516 B10R1.17 CSCCC1CCCCC1 62a_100012355289_200000210301 [1,0,0,0,0,0|2,0,1]=4 517 B10R1.17 CSCCC1CCCCC1 62a_200000210301_100012355289 [1,0,0,0,0,0|2,0,1]=4 518 B10R1.17 CSCNC1CCCCC1 2230a_100000182618_100011218213 [1,0,0,0,0,0|3,0,0]=4 519 B10R1.17 CSCNC1CCCCC1 34a_100000182618_100011218213 [1,0,0,0,0,0|3,0,0]=4 520 B10R1.17 CSCOC1CCCCC1 34a_100000210231_100011218213 [1,0,0,0,0,0|3,0,0]=4 521 B10R1.17 CSCOC1CCCCC1 62a_100011935260_200000210301 [1,0,0,0,0,0|3,0,0]=4 522 B10R1.17 CSCOC1CCCCC1 62a_200000210301_100011935260 [1,0,0,0,0,0|3,0,0]=4 523 B10R1.17 CSCSC1CCCCC1 62a_100000210327_100011218213 [1,0,0,0,0,0|3,0,0]=4 524 B10R1.17 CSCSC1CCCCC1 62a_100011218213_100000210327 [1,0,0,0,0,0|3,0,0]=4 525 B10R1.17 FCCNC1CCCCC1 2230a_100000182618_100011217306 [1,0,0,0,0,0|3,0,0]=4 526 B10R1.17 FCCNC1CCCCC1 34a_100000182618_100011217306 [1,0,0,0,0,0|3,0,0]=4 527 B10R1.17 FCCNC1CCCCC1 34a_100000724931_100000210327 [1,0,0,0,0,0|3,0,0]=4 528 B10R1.17 FCCOC1CCCCC1 34a_100000210231_100011217306 [1,0,0,0,0,0|3,0,0]=4 529 B10R1.17 FCCOC1CCCCC1 7a_100000210231_100011217306 [1,0,0,0,0,0|3,0,0]=4 530 B10R1.17 FCCSC1CCCCC1 62a_100000210327_100011217306 [1,0,0,0,0,0|3,0,0]=4 531 B10R1.17 FCCSC1CCCCC1 62a_100011217306_100000210327 [1,0,0,0,0,0|3,0,0]=4 532 B10R1.17 FCNCC1CCCCC1 34a_100000210473_100015361967 [1,0,0,0,0,0|2,0,1]=4 533 B10R1.17 FCOCC1CCCCC1 34a_100000212181_100015361967 [1,0,0,0,0,0|1,0,1]=3 534 B10R1.17 FCOCC1CCCCC1 7a_100000212181_100015361967 [1,0,0,0,0,0|1,0,1]=3 535 B10R1.17 FCOCC1CCCCN1 34a_100000210821_100015361967 [1,0,0,0,0,0|2,0,1]=4 536 B10R1.17 FCOCC1CCCCO1 34a_100000211370_100015361967 [1,0,0,0,0,0|2,0,1]=4 537 B10R1.17 FCOCC1CCCCO1 7a_100000211370_100015361967 [1,0,0,0,0,0|2,0,1]=4 538 B10R1.17 FCOCC1CCCNC1 34a_100000211344_100015361967 [1,0,0,0,0,0|2,0,1]=4 539 B10R1.17 FCOCC1CCCOC1 34a_100000741520_100015361967 [1,0,0,0,0,0|2,0,1]=4 540 B10R1.17 FCOCC1CCNCC1 34a_100000738675_100015361967 [1,0,0,0,0,0|2,0,1]=4 541 B10R1.17 FCOCC1CCOCC1 34a_100000749013_100015361967 [1,0,0,0,0,0|2,0,1]=4 542 B10R1.17 FCOCC1CCSCC1 34a_100000070558_100015361967 [1,0,0,0,0,0|2,0,1]=4 543 B10R1.17 FCOCC1CCSCC1 7a_100000070558_100015361967 [1,0,0,0,0,0|2,0,1]=4 544 B10R1.17 FCSCC1CCCCC1 62a_100000211423_100015361967 [1,0,0,0,0,0|1,1,1]=4 545 B10R1.17 FCSCC1CCCCC1 62a_100015361967_100000211423 [1,0,0,0,0,0|1,1,1]=4 546 B10R1.17 NCCOC1CCCCC1 34a_100000210304_100000210327 [1,0,0,0,0,0|3,0,0]=4 547 B10R1.17 OCCNC1CCCCC1 2230a_100000182618_100000211926 [1,0,0,0,0,0|3,0,0]=4 548 B10R1.17 OCCNC1CCCCC1 270004a_100000210304_100000210434 [1,0,0,0,0,0|3,0,0]=4 549 B10R1.17 OCCNC1CCCCC1 34a_100000182618_100000211926 [1,0,0,0,0,0|3,0,0]=4 550 B10R1.17 OCCNC1CCCCC1 34a_100016990907_100000210327 [1,0,0,0,0,0|3,0,0]=4 551 B10R1.17 OCCOC1CCCCC1 34a_100000210231_100000211926 [1,0,0,0,0,0|3,0,0]=4 552 B10R1.17 OCCOC1CCCCC1 7a_100000210231_100000211926 [1,0,0,0,0,0|3,0,0]=4 553 B10R1.17 OCCSC1CCCCC1 62a_100000210327_100000211926 [1,0,0,0,0,0|3,0,0]=4 554 B10R1.17 OCCSC1CCCCC1 62a_100000211926_100000210327 [1,0,0,0,0,0|3,0,0]=4 555 B10R1.17 [13CH3]NCCC1CCCCC1 2230a_100000738074_200025704644 [1,0,0,0,0,0|2,0,1]=4 556 B10R1.17 [13CH3]NCCC1CCCCC1 34a_100000738074_200025704644 [1,0,0,0,0,0|2,0,1]=4 557 B10R1.17 [13CH3]OCCC1CCCCC1 34a_100011217863_200025704644 [1,0,0,0,0,0|2,0,1]=4 558 B10R1.17 [13CH3]OCCC1CCCCC1 7a_100011217863_200025704644 [1,0,0,0,0,0|2,0,1]=4 559 B10R1.17 [13CH3]SCCC1CCCCC1 62a_100012355289_200025704644 [1,0,0,0,0,0|2,0,1]=4 560 B10R1.17 [13CH3]SCCC1CCCCC1 62a_200025704644_100012355289 [1,0,0,0,0,0|2,0,1]=4 561 B10R1.17 [13CH3]SCOC1CCCCC1 62a_100011935260_200025704644 [1,0,0,0,0,0|3,0,0]=4 562 B10R1.17 [13CH3]SCOC1CCCCC1 62a_200025704644_100011935260 [1,0,0,0,0,0|3,0,0]=4 563 B12R1.3 CCC(OCF)C1CCCCC1 34a_100011215090_100015361967 [0,1,0,0,0,0|2,0,1]=4 564 B12R1.3 CCC(OCF)C1CCCCC1 7a_100011215090_100015361967 [0,1,0,0,0,0|2,0,1]=4 565 B12R1.3 CCCC(OC)C1CCCCC1 34a_100011218000_200000210301 [0,1,0,0,0,0|1,0,2]=4 566 B12R1.3 CCCC(OC)C1CCCCC1 7a_100011218000_200000210301 [0,1,0,0,0,0|1,0,2]=4 567 B12R1.3 CCCC(O[13CH3])C1CCCCC1 34a_100011218000_200025704644 [0,1,0,0,0,0|1,0,2]=4 568 B12R1.3 CCCC(O[13CH3])C1CCCCC1 7a_100011218000_200025704644 [0,1,0,0,0,0|1,0,2]=4 569 B12R1.3 CCCN(CC)C1CCCCC1 2230a_100000201195_100000210303 [0,1,0,0,0,0|3,0,0]=4 570 B12R1.3 CCCN(CC)C1CCCCC1 2230a_100000750343_100000210202 [0,1,0,0,0,0|3,0,0]=4 571 B12R1.3 CCCN(CC)C1CCCCC1 269982a_100000201195_100000210303 [0,1,0,0,0,0|3,0,0]=4 572 B12R1.3 CCCN(CC)C1CCCCC1 269982a_100000226822_100000210327 [0,1,0,0,0,0|3,0,0]=4 573 B12R1.3 CCCN(CC)C1CCCCC1 269982a_100000750343_100000204670 [0,1,0,0,0,0|3,0,0]=4 574 B12R1.3 CCCN(CC)C1CCCCC1 270004a_100000226822_100000210434 [0,1,0,0,0,0|3,0,0]=4 575 B12R1.3 CCCN(CC)C1CCCCC1 34a_100000201195_100000210303 [0,1,0,0,0,0|3,0,0]=4 576 B12R1.3 CCCN(CC)C1CCCCC1 34a_100000750343_100000210202 [0,1,0,0,0,0|3,0,0]=4 577 B12R1.3 CCCN(CF)C1CCCCC1 269982a_100000750343_100015361967 [0,1,0,0,0,0|3,0,0]=4 578 B12R1.3 CCCN(CF)C1CCCCC1 34a_100000750343_100015361967 [0,1,0,0,0,0|3,0,0]=4 579 B12R1.3 CCNC(C#N)C1CCCCC1 2230a_100000767018_100000210202 [0,1,0,0,0,0|2,0,1]=4 580 B12R1.3 CCNC(C#N)C1CCCCC1 34a_100000767018_100000210202 [0,1,0,0,0,0|2,0,1]=4 581 B12R1.3 CCNC(CC)C1CCCCC1 269862a_100015525214_100011216311 [0,1,0,0,0,0|2,0,1]=4 582 B12R1.3 CCN[C@@H](CC)C1CCCCC1 2230a_100020639352_100000210202 [0,1,0,0,0,0|2,0,1]=4 583 B12R1.3 CCN[C@@H](CC)C1CCCCC1 34a_100020639352_100000210202 [0,1,0,0,0,0|2,0,1]=4 584 B12R1.3 CCN[C@@H](CO)C1CCCCC1 2230a_100009817630_100000210202 [0,1,0,0,0,0|1,0,2]=4 585 B12R1.3 CCN[C@@H](CO)C1CCCCC1 34a_100009817630_100000210202 [0,1,0,0,0,0|1,0,2]=4 586 B12R1.3 CCOC(CC)C1CCCCC1 34a_100011215090_100000210202 [0,1,0,0,0,0|1,0,1]=3 587 B12R1.3 CCOC(CC)C1CCCCC1 7a_100011215090_100000210202 [0,1,0,0,0,0|1,0,1]=3 588 B12R1.3 CCOC(CC)C1CCNCC1 34a_100011935121_100000210202 [0,1,0,0,0,0|2,0,1]=4 589 B12R1.16 C#CCC(=O)C1CCC(CC1)C 1458a_100011220946_200011216234 [0,1,0,0,0,0|1,0,2]=4 590 B12R1.16 C#CCC(=O)C1CCC(CC1)O 1458a_100000743365_100000184674 [0,1,0,0,0,0|1,0,2]=4 591 B12R1.16 C#CCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000184674 [0,1,0,0,0,0|1,0,2]=4 592 B12R1.16 C=C1CCC(CC1)C(=O)CCC 1458a_200000138047_100000210303 [0,1,0,0,0,0|1,0,1]=3 593 B12R1.16 C=C1CCC(CC1)C(=O)CCF 1458a_200000138047_100011217306 [0,1,0,0,0,0|2,0,1]=4 594 B12R1.16 C=C1CCC(CC1)C(=O)CCO 1458a_200000138047_100000211926 [0,1,0,0,0,0|2,0,1]=4 595 B12R1.16 C=C1CCC(CC1)C(=O)NCC 11a_100015525214_200000138047 [0,1,0,0,0,0|1,0,1]=3 596 B12R1.16 C=C1CCC(CC1)C(=O)NCC 240690a_100015525214_200000138047 [0,1,0,0,0,0|1,0,1]=3 597 B12R1.16 C=C1CCC(CC1)C(=O)NCC 527a_100015525214_200000138047 [0,1,0,0,0,0|1,0,1]=3 598 B12R1.16 C=C1CCC(CC1)C(=O)NNC 22a_100016993582_200000138047 [0,1,0,0,0,0|2,0,1]=4 599 B12R1.16 C=C1CCN(CC1)C(=O)CCC 11a_100000752442_100000211992 [0,1,0,0,0,0|2,0,1]=4 600 B12R1.16 C=C1CCN(CC1)C(=O)CCC 1626a_100000752442_100000211992 [0,1,0,0,0,0|2,0,1]=4 601 B12R1.16 C=C1CCN(CC1)C(=O)CCC 240690a_100000752442_100000211992 [0,1,0,0,0,0|2,0,1]=4 602 B12R1.16 C=C1CCN(CC1)C(=O)CCC 527a_100000752442_100000211992 [0,1,0,0,0,0|2,0,1]=4 603 B12R1.16 C=C1CCN(CC1)C(=O)NCC 2708a_100015525214_100000752442 [0,1,0,0,0,0|2,0,1]=4 604 B12R1.16 C=C1CCN(CC1)C(=O)NCC 273464a_100015525214_100000752442 [0,1,0,0,0,0|2,0,1]=4 605 B12R1.16 C=CCC(=O)C1CCC(CC1)C 1458a_100000210193_200011216234 [0,1,0,0,0,0|1,0,2]=4 606 B12R1.16 C=CCC(=O)C1CCC(CC1)O 1458a_100000743365_100000210623 [0,1,0,0,0,0|1,0,2]=4 607 B12R1.16 C=CCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000210623 [0,1,0,0,0,0|1,0,2]=4 608 B12R1.16 CC#CC(=O)C1CCC(CC1)C 1458a_100000763181_200011216234 [0,1,0,0,0,0|1,0,1]=3 609 B12R1.16 CC1CCC(CC1)C(=O)C=CBr 1458a_100016273825_200011216234 [0,1,0,0,0,0|2,0,1]=4 610 B12R1.16 CC1CCC(CC1)C(=O)C=CCl 1458a_200016279998_200011216234 [0,1,0,0,0,0|2,0,1]=4 611 B12R1.16 CC1CCC(CC1)C(=O)C=CI 1458a_100016256311_200011216234 [0,1,0,0,0,0|2,0,1]=4 612 B12R1.16 CC1CCC(CC1)C(=O)CC#N 1458a_100051588842_200011216234 [0,1,0,0,0,0|2,0,1]=4 613 B12R1.16 CC1CCC(CC1)C(=O)CCO 1458a_100011216618_200011216234 [0,1,0,0,0,0|2,0,0]=3 614 B12R1.16 CC1CCN(CC1)C(=O)CCO 240690a_100000188429_100011216618 [0,1,0,0,0,0|3,0,0]=4 615 B12R1.16 CC1CCN(CC1)C(=O)CS[13CH3] 62a_100000182867_200025704644 [0,1,0,0,0,0|3,0,0]=4 616 B12R1.16 CC1CCN(CC1)C(=O)CS[13CH3] 62a_200025704644_100000182867 [0,1,0,0,0,0|3,0,0]=4 617 B12R1.16 CC=CC(=O)C1CCC(CC1)C 1458a_100000210699_200011216234 [0,1,0,0,0,0|1,0,1]=3 618 B12R1.16 CC=CC(=O)N1CCC(CC1)C 240690a_100000188429_100000210699 [0,1,0,0,0,0|2,0,1]=4 619 B12R1.16 CC=CC(=O)N1CCC(CC1)F 11a_100015193889_100000210699 [0,1,0,0,0,0|2,0,1]=4 620 B12R1.16 CC=CC(=O)N1CCC(CC1)F 1626a_100015193889_100000210699 [0,1,0,0,0,0|2,0,1]=4 621 B12R1.16 CC=CC(=O)N1CCC(CC1)F 240690a_100015193889_100000210699 [0,1,0,0,0,0|2,0,1]=4 622 B12R1.16 CC=CC(=O)N1CCC(CC1)O 240690a_100025773856_100000210699 [0,1,0,0,0,0|2,0,1]=4 623 B12R1.16 CCCC(=O)C1CC=C(CC1)C 1458a_100000137427_100000210303 [0,1,0,0,0,0|1,0,2]=4 624 B12R1.16 CCCC(=O)C1CCC(=O)NC1 1458a_100000740907_100000210303 [0,1,0,0,0,0|2,0,1]=4 625 B12R1.16 CCCC(=O)C1CCC(CC1)C 1458a_100000211992_200011216234 [0,1,0,0,0,0|1,0,0]=2 626 B12R1.16 CCCC(=O)C1CCC(CC1)O 1458a_100000743365_100000210303 [0,1,0,0,0,0|1,0,0]=2 627 B12R1.16 CCCC(=O)C1CCN(CC1)C 1458a_100000743488_100000210303 [0,1,0,0,0,0|2,0,0]=3 628 B12R1.16 CCCC(=O)N1CCC(CC1)C 240690a_100000188429_100000211992 [0,1,0,0,0,0|2,0,0]=3 629 B12R1.16 CCCC(=O)N1CCC(CC1)C 527a_100000188429_100000211992 [0,1,0,0,0,0|2,0,0]=3 630 B12R1.16 CCCC(=O)N1CCC(CC1)F 11a_100015193889_100000211992 [0,1,0,0,0,0|2,0,0]=3 631 B12R1.16 CCCC(=O)N1CCC(CC1)F 1626a_100015193889_100000211992 [0,1,0,0,0,0|2,0,0]=3 632 B12R1.16 CCCC(=O)N1CCC(CC1)F 240690a_100015193889_100000211992 [0,1,0,0,0,0|2,0,0]=3 633 B12R1.16 CCCC(=O)N1CCC(CC1)F 527a_100015193889_100000211992 [0,1,0,0,0,0|2,0,0]=3 634 B12R1.16 CCCC(=O)N1CCC(CC1)O 240690a_100025773856_100000211992 [0,1,0,0,0,0|2,0,0]=3 635 B12R1.16 CCCC(=O)N1CCC(CC1)O 527a_100025773856_100000211992 [0,1,0,0,0,0|2,0,0]=3 636 B12R1.16 CCCC(=O)N1CCN(CC1)C 11a_100000188432_100000211992 [0,1,0,0,0,0|3,0,0]=4 637 B12R1.16 CCCC(=O)N1CCN(CC1)C 2230a_102495365011_200000210301 [0,1,0,0,0,0|3,0,0]=4 638 B12R1.16 CCCC(=O)N1CCN(CC1)C 240690a_100000188432_100000211992 [0,1,0,0,0,0|3,0,0]=4 639 B12R1.16 CCCC(=O)N1CCN(CC1)C 269982a_102495365011_200000210301 [0,1,0,0,0,0|3,0,0]=4 640 B12R1.16 CCCC(=O)N1CCN(CC1)C 527a_100000188432_100000211992 [0,1,0,0,0,0|3,0,0]=4 641 B12R1.16 CCCC(=O)N1CCN(CC1)[13CH3] 2230a_102495365011_200025704644 [0,1,0,0,0,0|3,0,0]=4 642 B12R1.16 CCCC(=O)N1CCN(CC1)[13CH3] 269982a_102495365011_200025704644 [0,1,0,0,0,0|3,0,0]=4 643 B12R1.16 CCCC(=O)N1CCS(=O)CC1 240690a_100000752083_100000211992 [0,1,0,0,0,0|3,0,0]=4 644 B12R1.16 CCCC(=O)N1CCS(=O)CC1 527a_100000752083_100000211992 [0,1,0,0,0,0|3,0,0]=4 645 B12R1.16 CCCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000210303 [0,1,0,0,0,0|1,0,0]=2 646 B12R1.16 CCCN(C)C1CCC(CC1)C 269982a_100000747261_200011216234 [0,1,0,0,0,0|3,0,0]=4 647 B12R1.16 CCCN(C)C1CCC(CC1)C 270004a_100000747261_100000185489 [0,1,0,0,0,0|3,0,0]=4 648 B12R1.16 CCCN(C)C1CCC(CC1)O 270004a_100000747261_100000764474 [0,1,0,0,0,0|3,0,0]=4 649 B12R1.16 CCCN(C)[C@H]1CC[C@H](CC1)O 2230a_100020636401_100000210303 [0,1,0,0,0,0|3,0,0]=4 650 B12R1.16 CCCN(C)[C@H]1CC[C@H](CC1)O 269982a_100020636401_100000210303 [0,1,0,0,0,0|3,0,0]=4 651 B12R1.16 CCNC(=O)C1CC=C(CC1)C 11a_100015525214_100000137427 [0,1,0,0,0,0|1,0,2]=4 652 B12R1.16 CCNC(=O)C1CC=C(CC1)C 240690a_100015525214_100000137427 [0,1,0,0,0,0|1,0,2]=4 653 B12R1.16 CCNC(=O)C1CC=C(CC1)C 527a_100015525214_100000137427 [0,1,0,0,0,0|1,0,2]=4 654 B12R1.16 CCNC(=O)C1CCC(=O)NC1 11a_100015525214_100000740907 [0,1,0,0,0,0|2,0,1]=4 655 B12R1.16 CCNC(=O)C1CCC(=O)NC1 240690a_100015525214_100000740907 [0,1,0,0,0,0|2,0,1]=4 656 B12R1.16 CCNC(=O)C1CCC(=O)NC1 527a_100015525214_100000740907 [0,1,0,0,0,0|2,0,1]=4 657 B12R1.16 CCNC(=O)C1CCC(CC1)O 240690a_100015525214_100000743365 [0,1,0,0,0,0|1,0,0]=2 658 B12R1.16 CCNC(=O)C1CCC(CC1)O 527a_100015525214_100000743365 [0,1,0,0,0,0|1,0,0]=2 659 B12R1.16 CCNC(=O)C1CCN(CC1)C 240690a_100015525214_100000743488 [0,1,0,0,0,0|2,0,0]=3 660 B12R1.16 CCNC(=O)C1CCN(CC1)C 527a_100015525214_100000743488 [0,1,0,0,0,0|2,0,0]=3 661 B12R1.16 CCNC(=O)N1CCC(CC1)C 2708a_100015525214_100000188429 [0,1,0,0,0,0|2,0,0]=3 662 B12R1.16 CCNC(=O)N1CCC(CC1)C 273464a_100015525214_100000188429 [0,1,0,0,0,0|2,0,0]=3 663 B12R1.16 CCNC(=O)N1CCC(CC1)F 2708a_100015525214_100015193889 [0,1,0,0,0,0|2,0,0]=3 664 B12R1.16 CCNC(=O)N1CCC(CC1)F 273464a_100015525214_100015193889 [0,1,0,0,0,0|2,0,0]=3 665 B12R1.16 CCNC(=O)N1CCC(CC1)O 2708a_100015525214_100025773856 [0,1,0,0,0,0|2,0,0]=3 666 B12R1.16 CCNC(=O)N1CCC(CC1)O 273464a_100015525214_100025773856 [0,1,0,0,0,0|2,0,0]=3 667 B12R1.16 CCNC(=O)N1CCN(CC1)C 2708a_100015525214_100000188432 [0,1,0,0,0,0|3,0,0]=4 668 B12R1.16 CCNC(=O)N1CCN(CC1)C 273464a_100015525214_100000188432 [0,1,0,0,0,0|3,0,0]=4 669 B12R1.16 CCNC(=O)N1CCS(=O)CC1 2708a_100015525214_100000752083 [0,1,0,0,0,0|3,0,0]=4 670 B12R1.16 CCNC(=O)N1CCS(=O)CC1 273464a_100015525214_100000752083 [0,1,0,0,0,0|3,0,0]=4 671 B12R1.16 CCNC(=O)[C@H]1CC[C@@H](CC1)C 11a_100015525214_100009815934 [0,1,0,0,0,0|1,0,0]=2 672 B12R1.16 CCNC(=O)[C@H]1CC[C@@H](CC1)C 240690a_100015525214_100009815934 [0,1,0,0,0,0|1,0,0]=2 673 B12R1.16 CCNC(=O)[C@H]1CC[C@@H](CC1)C 527a_100015525214_100009815934 [0,1,0,0,0,0|1,0,0]=2 674 B12R1.16 CCOC(=O)C1CCN(CC1)C 2230a_100000210402_200000210301 [0,1,0,0,0,0|1,0,0]=2 675 B12R1.16 CCOC(=O)C1CCN(CC1)C 269982a_100000210402_200000210301 [0,1,0,0,0,0|1,0,0]=2 676 B12R1.16 CCOC(=O)C1CCN(CC1)[13CH3] 2230a_100000210402_200025704644 [0,1,0,0,0,0|1,0,0]=2 677 B12R1.16 CCOC(=O)C1CCN(CC1)[13CH3] 269982a_100000210402_200025704644 [0,1,0,0,0,0|1,0,0]=2 678 B12R1.16 CCOC(=O)N1CCN(CC1)C 2230a_100000210854_200000210301 [0,1,0,0,0,0|2,0,0]=3 679 B12R1.16 CCOC(=O)N1CCN(CC1)C 269982a_100000210854_200000210301 [0,1,0,0,0,0|2,0,0]=3 680 B12R1.16 CCOC(=O)N1CCN(CC1)[13CH3] 2230a_100000210854_200025704644 [0,1,0,0,0,0|2,0,0]=3 681 B12R1.16 CCOC(=O)N1CCN(CC1)[13CH3] 269982a_100000210854_200025704644 [0,1,0,0,0,0|2,0,0]=3 682 B12R1.16 CN1CCC(CC1)C(=O)CCF 1458a_100000743488_100011217306 [0,1,0,0,0,0|3,0,0]=4 683 B12R1.16 CN1CCC(CC1)C(=O)CCO 1458a_100000743488_100000211926 [0,1,0,0,0,0|3,0,0]=4 684 B12R1.16 CNCC(=O)N1CCC(CC1)C 2230a_106832991635_100000182867 [0,1,0,0,0,0|3,0,0]=4 685 B12R1.16 CNCC(=O)N1CCC(CC1)C 34a_100102657272_100000182867 [0,1,0,0,0,0|3,0,0]=4 686 B12R1.16 CNCC(=O)N1CCC(CC1)C 7a_106832991635_100000182867 [0,1,0,0,0,0|3,0,0]=4 687 B12R1.16 CNNC(=O)C1CCC(CC1)O 22a_100016993582_100000743365 [0,1,0,0,0,0|2,0,0]=3 688 B12R1.16 CNNC(=O)C1CCN(CC1)C 22a_100016993582_100000743488 [0,1,0,0,0,0|3,0,0]=4 689 B12R1.16 CNNC(=O)[C@H]1CC[C@@H](CC1)C 22a_100016993582_100009815934 [0,1,0,0,0,0|2,0,0]=3 690 B12R1.16 COCC(=O)C1CCC(CC1)C 1458a_100000210968_200011216234 [0,1,0,0,0,0|2,0,0]=3 691 B12R1.16 COCC(=O)N1CCC(CC1)C 240690a_100000188429_100000210968 [0,1,0,0,0,0|3,0,0]=4 692 B12R1.16 COCC(=O)N1CCC(CC1)C 34a_100138415774_100000182867 [0,1,0,0,0,0|3,0,0]=4 693 B12R1.16 COCC(=O)N1CCC(CC1)C 527a_100000188429_100000210968 [0,1,0,0,0,0|3,0,0]=4 694 B12R1.16 COCC(=O)N1CCC(CC1)F 11a_100015193889_100000210968 [0,1,0,0,0,0|3,0,0]=4 695 B12R1.16 COCC(=O)N1CCC(CC1)F 1626a_100015193889_100000210968 [0,1,0,0,0,0|3,0,0]=4 696 B12R1.16 COCC(=O)N1CCC(CC1)F 240690a_100015193889_100000210968 [0,1,0,0,0,0|3,0,0]=4 697 B12R1.16 COCC(=O)N1CCC(CC1)F 527a_100015193889_100000210968 [0,1,0,0,0,0|3,0,0]=4 698 B12R1.16 COCC(=O)N1CCC(CC1)O 240690a_100025773856_100000210968 [0,1,0,0,0,0|3,0,0]=4 699 B12R1.16 COCC(=O)N1CCC(CC1)O 527a_100025773856_100000210968 [0,1,0,0,0,0|3,0,0]=4 700 B12R1.16 CSCC(=O)C1CCC(CC1)C 1458a_100000184570_200011216234 [0,1,0,0,0,0|2,0,0]=3 701 B12R1.16 CSCC(=O)N1CCC(CC1)C 240690a_100000188429_100000184570 [0,1,0,0,0,0|3,0,0]=4 702 B12R1.16 CSCC(=O)N1CCC(CC1)C 527a_100000188429_100000184570 [0,1,0,0,0,0|3,0,0]=4 703 B12R1.16 CSCC(=O)N1CCC(CC1)C 62a_100000182867_200000210301 [0,1,0,0,0,0|3,0,0]=4 704 B12R1.16 CSCC(=O)N1CCC(CC1)C 62a_200000210301_100000182867 [0,1,0,0,0,0|3,0,0]=4 705 B12R1.16 CSCC(=O)N1CCC(CC1)F 11a_100015193889_100000184570 [0,1,0,0,0,0|3,0,0]=4 706 B12R1.16 CSCC(=O)N1CCC(CC1)F 1626a_100015193889_100000184570 [0,1,0,0,0,0|3,0,0]=4 707 B12R1.16 CSCC(=O)N1CCC(CC1)F 240690a_100015193889_100000184570 [0,1,0,0,0,0|3,0,0]=4 708 B12R1.16 CSCC(=O)N1CCC(CC1)F 527a_100015193889_100000184570 [0,1,0,0,0,0|3,0,0]=4 709 B12R1.16 CSCC(=O)N1CCC(CC1)O 240690a_100025773856_100000184570 [0,1,0,0,0,0|3,0,0]=4 710 B12R1.16 CSCC(=O)N1CCC(CC1)O 527a_100025773856_100000184570 [0,1,0,0,0,0|3,0,0]=4 711 B12R1.16 C[C@H]1CC[C@@H](CC1)C(=O)CC#N 1458a_100009815934_100011214920 [0,1,0,0,0,0|2,0,1]=4 712 B12R1.16 C[C@H]1CC[C@@H](CC1)C(=O)CCF 1458a_100009815934_100011217306 [0,1,0,0,0,0|2,0,0]=3 713 B12R1.16 C[C@H]1CC[C@@H](CC1)C(=O)CCO 1458a_100009815934_100000211926 [0,1,0,0,0,0|2,0,0]=3 714 B12R1.16 N#CCC(=O)C1CCC(CC1)O 1458a_100000743365_100011214920 [0,1,0,0,0,0|2,0,1]=4 715 B12R1.16 O=C(CCF)C1CCC(CC1)O 1458a_100000743365_100011217306 [0,1,0,0,0,0|2,0,0]=3 716 B12R1.16 O=C(CCO)C1CCC(CC1)O 1458a_100000743365_100000211926 [0,1,0,0,0,0|2,0,0]=3 717 B12R1.16 O=C(CCO)N1CCC(CC1)F 240690a_100015193889_100011216618 [0,1,0,0,0,0|3,0,0]=4 718 B12R1.16 O=C(CCO)N1CCC(CC1)O 240690a_100025773856_100011216618 [0,1,0,0,0,0|3,0,0]=4 719 B12R1.17 C#CCC(=O)C1CCCC(C1)C 1458a_100011215569_100000184674 [0,1,0,0,0,0|1,0,2]=4 720 B12R1.17 C#CCC(=O)C1CCCC(C1)O 1458a_100000707227_100000184674 [0,1,0,0,0,0|1,0,2]=4 721 B12R1.17 C=CCC(=O)C1CCCC(C1)C 1458a_100011215569_100000210623 [0,1,0,0,0,0|1,0,2]=4 722 B12R1.17 C=CCC(=O)C1CCCC(C1)O 1458a_100000707227_100000210623 [0,1,0,0,0,0|1,0,2]=4 723 B12R1.17 CC1CCCC(C1)C(=O)CC#N 1458a_100011215569_100011214920 [0,1,0,0,0,0|2,0,1]=4 724 B12R1.17 CC1CCCC(C1)C(=O)CCF 1458a_100011215569_100011217306 [0,1,0,0,0,0|2,0,0]=3 725 B12R1.17 CC1CCCC(C1)C(=O)CCO 1458a_100011215569_100000211926 [0,1,0,0,0,0|2,0,0]=3 726 B12R1.17 CC1CCCN(C1)C(=O)CS[13CH3] 62a_100000182890_200025704644 [0,1,0,0,0,0|3,0,0]=4 727 B12R1.17 CC=CC(=O)N1CCCC(C1)F 11a_100000697950_100000210699 [0,1,0,0,0,0|2,0,1]=4 728 B12R1.17 CC=CC(=O)N1CCCC(C1)F 1626a_100000697950_100000210699 [0,1,0,0,0,0|2,0,1]=4 729 B12R1.17 CC=CC(=O)N1CCCC(C1)F 240690a_100000697950_100000210699 [0,1,0,0,0,0|2,0,1]=4 730 B12R1.17 CC=CC(=O)N1CCCC(C1)O 240690a_100000211013_100000210699 [0,1,0,0,0,0|2,0,1]=4 731 B12R1.17 CC=CC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000210699 [0,1,0,0,0,0|2,0,1]=4 732 B12R1.17 CC=CC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000210699 [0,1,0,0,0,0|2,0,1]=4 733 B12R1.17 CCCC(=O)C1CCCC(C1)C 1458a_100011215569_100000210303 [0,1,0,0,0,0|1,0,0]=2 734 B12R1.17 CCCC(=O)C1CCCC(C1)O 1458a_100000707227_100000210303 [0,1,0,0,0,0|1,0,0]=2 735 B12R1.17 CCCC(=O)C1CCCN(C1)C 1458a_100015257587_100000210303 [0,1,0,0,0,0|2,0,0]=3 736 B12R1.17 CCCC(=O)C1CCNC(=O)C1 1458a_100000132800_100000210303 [0,1,0,0,0,0|2,0,1]=4 737 B12R1.17 CCCC(=O)C1CN(CCO1)C 1458a_100011543126_100000210303 [0,1,0,0,0,0|3,0,0]=4 738 B12R1.17 CCCC(=O)N1CCCC(C1)F 11a_100000697950_100000211992 [0,1,0,0,0,0|2,0,0]=3 739 B12R1.17 CCCC(=O)N1CCCC(C1)F 1626a_100000697950_100000211992 [0,1,0,0,0,0|2,0,0]=3 740 B12R1.17 CCCC(=O)N1CCCC(C1)F 240690a_100000697950_100000211992 [0,1,0,0,0,0|2,0,0]=3 741 B12R1.17 CCCC(=O)N1CCCC(C1)F 527a_100000697950_100000211992 [0,1,0,0,0,0|2,0,0]=3 742 B12R1.17 CCCC(=O)N1CCCC(C1)O 240690a_100000211013_100000211992 [0,1,0,0,0,0|2,0,0]=3 743 B12R1.17 CCCC(=O)N1CCCC(C1)O 527a_100000211013_100000211992 [0,1,0,0,0,0|2,0,0]=3 744 B12R1.17 CCCC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000211992 [0,1,0,0,0,0|2,0,0]=3 745 B12R1.17 CCCC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000211992 [0,1,0,0,0,0|2,0,0]=3 746 B12R1.17 CCCC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000211992 [0,1,0,0,0,0|2,0,0]=3 747 B12R1.17 CCCC(=O)N1CCOC(C1)C 11a_100000729577_100000211992 [0,1,0,0,0,0|3,0,0]=4 748 B12R1.17 CCCC(=O)N1CCOC(C1)C 1626a_100000729577_100000211992 [0,1,0,0,0,0|3,0,0]=4 749 B12R1.17 CCCC(=O)N1CCOC(C1)C 240690a_100000729577_100000211992 [0,1,0,0,0,0|3,0,0]=4 750 B12R1.17 CCCC(=O)N1CCOC(C1)C 527a_100000729577_100000211992 [0,1,0,0,0,0|3,0,0]=4 751 B12R1.17 CCCC(=O)N1CCOC(C1)O 11a_100000688207_100000211992 [0,1,0,0,0,0|3,0,0]=4 752 B12R1.17 CCCC(=O)N1CCOC(C1)O 240690a_100000688207_100000211992 [0,1,0,0,0,0|3,0,0]=4 753 B12R1.17 CCCC(=O)N1CCOC(C1)O 527a_100000688207_100000211992 [0,1,0,0,0,0|3,0,0]=4 754 B12R1.17 CCCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000210303 [0,1,0,0,0,0|2,0,1]=4 755 B12R1.17 CCCN(C)C1CCCC(C1)C 2230a_100015187790_200000210301 [0,1,0,0,0,0|3,0,0]=4 756 B12R1.17 CCCN(C)C1CCCC(C1)C 269982a_100015187790_200000210301 [0,1,0,0,0,0|3,0,0]=4 757 B12R1.17 CCCN(C)C1CCCC(C1)C 270004a_100000747261_100000183594 [0,1,0,0,0,0|3,0,0]=4 758 B12R1.17 CCCN(C)C1CCCC(C1)C 34a_100015187790_200000210301 [0,1,0,0,0,0|3,0,0]=4 759 B12R1.17 CCCN(C)C1CCCC(C1)O 270004a_100000747261_100012613340 [0,1,0,0,0,0|3,0,0]=4 760 B12R1.17 CCCN([13CH3])C1CCCC(C1)C 2230a_100015187790_200025704644 [0,1,0,0,0,0|3,0,0]=4 761 B12R1.17 CCCN([13CH3])C1CCCC(C1)C 269982a_100015187790_200025704644 [0,1,0,0,0,0|3,0,0]=4 762 B12R1.17 CCCN([13CH3])C1CCCC(C1)C 34a_100015187790_200025704644 [0,1,0,0,0,0|3,0,0]=4 763 B12R1.17 CCNC(=O)C1CCCC(C1)C 11a_100015525214_100011215569 [0,1,0,0,0,0|1,0,0]=2 764 B12R1.17 CCNC(=O)C1CCCC(C1)C 240690a_100015525214_100011215569 [0,1,0,0,0,0|1,0,0]=2 765 B12R1.17 CCNC(=O)C1CCCC(C1)C 527a_100015525214_100011215569 [0,1,0,0,0,0|1,0,0]=2 766 B12R1.17 CCNC(=O)C1CCCC(C1)O 240690a_100015525214_100000707227 [0,1,0,0,0,0|1,0,0]=2 767 B12R1.17 CCNC(=O)C1CCCN(C1)C 11a_100015525214_100015257587 [0,1,0,0,0,0|2,0,0]=3 768 B12R1.17 CCNC(=O)C1CCCN(C1)C 240690a_100015525214_100015257587 [0,1,0,0,0,0|2,0,0]=3 769 B12R1.17 CCNC(=O)C1CCNC(=O)C1 11a_100015525214_100000132800 [0,1,0,0,0,0|2,0,1]=4 770 B12R1.17 CCNC(=O)C1CCNC(=O)C1 240690a_100015525214_100000132800 [0,1,0,0,0,0|2,0,1]=4 771 B12R1.17 CCNC(=O)C1CCNC(=O)C1 527a_100015525214_100000132800 [0,1,0,0,0,0|2,0,1]=4 772 B12R1.17 CCNC(=O)C1CN(CCO1)C 11a_100015525214_100011543126 [0,1,0,0,0,0|3,0,0]=4 773 B12R1.17 CCNC(=O)C1CN(CCO1)C 240690a_100015525214_100011543126 [0,1,0,0,0,0|3,0,0]=4 774 B12R1.17 CCNC(=O)C1CN(CCO1)C 527a_100015525214_100011543126 [0,1,0,0,0,0|3,0,0]=4 775 B12R1.17 CCNC(=O)N1CCCC(C1)F 2708a_100015525214_100000697950 [0,1,0,0,0,0|2,0,0]=3 776 B12R1.17 CCNC(=O)N1CCCC(C1)F 273464a_100015525214_100000697950 [0,1,0,0,0,0|2,0,0]=3 777 B12R1.17 CCNC(=O)N1CCCC(C1)O 2708a_100015525214_100000211013 [0,1,0,0,0,0|2,0,0]=3 778 B12R1.17 CCNC(=O)N1CCCC(C1)O 273464a_100015525214_100000211013 [0,1,0,0,0,0|2,0,0]=3 779 B12R1.17 CCNC(=O)N1CCC[C@@H](C1)C 2708a_100015525214_100000717927 [0,1,0,0,0,0|2,0,0]=3 780 B12R1.17 CCNC(=O)N1CCC[C@@H](C1)C 273464a_100015525214_100000717927 [0,1,0,0,0,0|2,0,0]=3 781 B12R1.17 CCNC(=O)N1CCOC(C1)C 2708a_100015525214_100000729577 [0,1,0,0,0,0|3,0,0]=4 782 B12R1.17 CCNC(=O)N1CCOC(C1)C 273464a_100015525214_100000729577 [0,1,0,0,0,0|3,0,0]=4 783 B12R1.17 CCNC(=O)N1CCOC(C1)O 2708a_100015525214_100000688207 [0,1,0,0,0,0|3,0,0]=4 784 B12R1.17 CCNC(=O)N1CCOC(C1)O 273464a_100015525214_100000688207 [0,1,0,0,0,0|3,0,0]=4 785 B12R1.17 CCNC(=O)[C@H]1CCCC(=O)N1 240690a_100015525214_100000705292 [0,1,0,0,0,0|2,0,1]=4 786 B12R1.17 CCNC(=O)[C@H]1CCCC(=O)N1 527a_100015525214_100000705292 [0,1,0,0,0,0|2,0,1]=4 787 B12R1.17 CCOC(=O)C1CN(CCO1)C 2230a_100016995033_200000210301 [0,1,0,0,0,0|2,0,0]=3 788 B12R1.17 CCOC(=O)C1CN(CCO1)C 269982a_100016995033_200000210301 [0,1,0,0,0,0|2,0,0]=3 789 B12R1.17 CCOC(=O)C1CN(CCO1)[13CH3] 2230a_100016995033_200025704644 [0,1,0,0,0,0|2,0,0]=3 790 B12R1.17 CCOC(=O)C1CN(CCO1)[13CH3] 269982a_100016995033_200025704644 [0,1,0,0,0,0|2,0,0]=3 791 B12R1.17 CCOC(=O)[C@H]1CCCN(C1)C 2230a_100000759086_200000210301 [0,1,0,0,0,0|1,0,0]=2 792 B12R1.17 CCOC(=O)[C@H]1CCCN(C1)C 269982a_100000759086_200000210301 [0,1,0,0,0,0|1,0,0]=2 793 B12R1.17 CCOC(=O)[C@H]1CCCN(C1)[13CH3] 2230a_100000759086_200025704644 [0,1,0,0,0,0|1,0,0]=2 794 B12R1.17 CCOC(=O)[C@H]1CCCN(C1)[13CH3] 269982a_100000759086_200025704644 [0,1,0,0,0,0|1,0,0]=2 795 B12R1.17 CN1CCCC(C1)C(=O)CCF 1458a_100015257587_100011217306 [0,1,0,0,0,0|3,0,0]=4 796 B12R1.17 CN1CCCC(C1)C(=O)CCO 1458a_100015257587_100000211926 [0,1,0,0,0,0|3,0,0]=4 797 B12R1.17 CNCC(=O)N1CCCC(C1)C 2230a_106832991635_100000182890 [0,1,0,0,0,0|3,0,0]=4 798 B12R1.17 CNCC(=O)N1CCCC(C1)C 34a_100102657272_100000182890 [0,1,0,0,0,0|3,0,0]=4 799 B12R1.17 CNCC(=O)N1CCCC(C1)C 7a_106832991635_100000182890 [0,1,0,0,0,0|3,0,0]=4 800 B12R1.17 CNNC(=O)C1CCCC(C1)C 22a_100016993582_100011215569 [0,1,0,0,0,0|2,0,0]=3 801 B12R1.17 CNNC(=O)C1CCCC(C1)O 22a_100016993582_100000707227 [0,1,0,0,0,0|2,0,0]=3 802 B12R1.17 CNNC(=O)C1CCCN(C1)C 22a_100016993582_100015257587 [0,1,0,0,0,0|3,0,0]=4 803 B12R1.17 COCC(=O)N1CCCC(C1)C 34a_100138415774_100000182890 [0,1,0,0,0,0|3,0,0]=4 804 B12R1.17 COCC(=O)N1CCCC(C1)F 11a_100000697950_100000210968 [0,1,0,0,0,0|3,0,0]=4 805 B12R1.17 COCC(=O)N1CCCC(C1)F 1626a_100000697950_100000210968 [0,1,0,0,0,0|3,0,0]=4 806 B12R1.17 COCC(=O)N1CCCC(C1)F 240690a_100000697950_100000210968 [0,1,0,0,0,0|3,0,0]=4 807 B12R1.17 COCC(=O)N1CCCC(C1)F 527a_100000697950_100000210968 [0,1,0,0,0,0|3,0,0]=4 808 B12R1.17 COCC(=O)N1CCCC(C1)O 240690a_100000211013_100000210968 [0,1,0,0,0,0|3,0,0]=4 809 B12R1.17 COCC(=O)N1CCCC(C1)O 527a_100000211013_100000210968 [0,1,0,0,0,0|3,0,0]=4 810 B12R1.17 COCC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000210968 [0,1,0,0,0,0|3,0,0]=4 811 B12R1.17 COCC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000210968 [0,1,0,0,0,0|3,0,0]=4 812 B12R1.17 COCC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000210968 [0,1,0,0,0,0|3,0,0]=4 813 B12R1.17 CSCC(=O)N1CCCC(C1)C 62a_100000182890_200000210301 [0,1,0,0,0,0|3,0,0]=4 814 B12R1.17 CSCC(=O)N1CCCC(C1)F 11a_100000697950_100000184570 [0,1,0,0,0,0|3,0,0]=4 815 B12R1.17 CSCC(=O)N1CCCC(C1)F 1626a_100000697950_100000184570 [0,1,0,0,0,0|3,0,0]=4 816 B12R1.17 CSCC(=O)N1CCCC(C1)F 240690a_100000697950_100000184570 [0,1,0,0,0,0|3,0,0]=4 817 B12R1.17 CSCC(=O)N1CCCC(C1)F 527a_100000697950_100000184570 [0,1,0,0,0,0|3,0,0]=4 818 B12R1.17 CSCC(=O)N1CCCC(C1)O 240690a_100000211013_100000184570 [0,1,0,0,0,0|3,0,0]=4 819 B12R1.17 CSCC(=O)N1CCCC(C1)O 527a_100000211013_100000184570 [0,1,0,0,0,0|3,0,0]=4 820 B12R1.17 CSCC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000184570 [0,1,0,0,0,0|3,0,0]=4 821 B12R1.17 CSCC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000184570 [0,1,0,0,0,0|3,0,0]=4 822 B12R1.17 CSCC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000184570 [0,1,0,0,0,0|3,0,0]=4 823 B12R1.17 C[C@H]1CCCN(C1)C(=O)CCO 240690a_100000717927_100011216618 [0,1,0,0,0,0|3,0,0]=4 824 B12R1.17 N#CCC(=O)C1CCCC(C1)O 1458a_100000707227_100011214920 [0,1,0,0,0,0|2,0,1]=4 825 B12R1.17 O=C(CCF)C1CCCC(C1)O 1458a_100000707227_100011217306 [0,1,0,0,0,0|2,0,0]=3 826 B12R1.17 O=C(CCO)C1CCCC(C1)O 1458a_100000707227_100000211926 [0,1,0,0,0,0|2,0,0]=3 827 B12R1.17 O=C(CCO)N1CCCC(C1)F 240690a_100000697950_100011216618 [0,1,0,0,0,0|3,0,0]=4 828 B12R1.17 O=C(CCO)N1CCCC(C1)O 240690a_100000211013_100011216618 [0,1,0,0,0,0|3,0,0]=4 829 B12R1.30 C#CCCC(=O)C1CCCCC1 1458a_100000210647_100000753159 [0,1,0,0,0,0|1,0,1]=3 830 B12R1.30 C#CCCC(=O)C1CCCCC1 1458a_100000692101_100000210327 [0,1,0,0,0,0|1,0,1]=3 831 B12R1.30 C#CCCC(=O)C1CCCCO1 1458a_100000748299_100000753159 [0,1,0,0,0,0|2,0,1]=4 832 B12R1.30 C#CCCC(=O)C1CCCOC1 1458a_100000692101_100000693364 [0,1,0,0,0,0|2,0,1]=4 833 B12R1.30 C#CCCC(=O)C1CCCOC1 1458a_100000741522_100000753159 [0,1,0,0,0,0|2,0,1]=4 834 B12R1.30 C#CCCC(=O)C1CCOCC1 1458a_100000195482_100000753159 [0,1,0,0,0,0|2,0,1]=4 835 B12R1.30 C#CCCC(=O)C1CCOCC1 1458a_100000692101_100011324220 [0,1,0,0,0,0|2,0,1]=4 836 B12R1.30 C#CCCC(=O)C1CCSCC1 1458a_100000755232_100000753159 [0,1,0,0,0,0|2,0,1]=4 837 B12R1.30 C#CCNC(=O)C1CCCCC1 11a_100000212058_100000210647 [0,1,0,0,0,0|1,0,1]=3 838 B12R1.30 C#CCNC(=O)C1CCCCC1 1626a_100000212058_100000210647 [0,1,0,0,0,0|1,0,1]=3 839 B12R1.30 C#CCNC(=O)C1CCCCC1 240690a_100000212058_100000210647 [0,1,0,0,0,0|1,0,1]=3 840 B12R1.30 C#CCNC(=O)C1CCCCC1 527a_100000212058_100000210647 [0,1,0,0,0,0|1,0,1]=3 841 B12R1.30 C#CCNC(=O)C1CCCCO1 11a_100000212058_100000748299 [0,1,0,0,0,0|2,0,1]=4 842 B12R1.30 C#CCNC(=O)C1CCCCO1 1626a_100000212058_100000748299 [0,1,0,0,0,0|2,0,1]=4 843 B12R1.30 C#CCNC(=O)C1CCCCO1 240690a_100000212058_100000748299 [0,1,0,0,0,0|2,0,1]=4 844 B12R1.30 C#CCNC(=O)C1CCCCO1 527a_100000212058_100000748299 [0,1,0,0,0,0|2,0,1]=4 845 B12R1.30 C#CCNC(=O)C1CCCOC1 11a_100000212058_100000741522 [0,1,0,0,0,0|2,0,1]=4 846 B12R1.30 C#CCNC(=O)C1CCCOC1 1626a_100000212058_100000741522 [0,1,0,0,0,0|2,0,1]=4 847 B12R1.30 C#CCNC(=O)C1CCCOC1 240690a_100000212058_100000741522 [0,1,0,0,0,0|2,0,1]=4 848 B12R1.30 C#CCNC(=O)C1CCCOC1 527a_100000212058_100000741522 [0,1,0,0,0,0|2,0,1]=4 849 B12R1.30 C#CCNC(=O)C1CCOCC1 11a_100000212058_100000195482 [0,1,0,0,0,0|2,0,1]=4 850 B12R1.30 C#CCNC(=O)C1CCOCC1 1626a_100000212058_100000195482 [0,1,0,0,0,0|2,0,1]=4 851 B12R1.30 C#CCNC(=O)C1CCOCC1 240690a_100000212058_100000195482 [0,1,0,0,0,0|2,0,1]=4 852 B12R1.30 C#CCNC(=O)C1CCOCC1 527a_100000212058_100000195482 [0,1,0,0,0,0|2,0,1]=4 853 B12R1.30 C#CCNC(=O)C1CCSCC1 11a_100000212058_100000755232 [0,1,0,0,0,0|2,0,1]=4 854 B12R1.30 C#CCNC(=O)C1CCSCC1 1626a_100000212058_100000755232 [0,1,0,0,0,0|2,0,1]=4 855 B12R1.30 C#CCNC(=O)C1CCSCC1 240690a_100000212058_100000755232 [0,1,0,0,0,0|2,0,1]=4 856 B12R1.30 C#CCNC(=O)C1CCSCC1 527a_100000212058_100000755232 [0,1,0,0,0,0|2,0,1]=4 857 B12R1.30 C#CCOC(C)C1CCCCC1 34a_100011216961_100000184674 [0,1,0,0,0,0|1,0,2]=4 858 B12R1.30 C#CCOC(C)C1CCCCC1 7a_100011216961_100000038162 [0,1,0,0,0,0|1,0,2]=4 859 B12R1.30 C/C=C/CC(=O)C1CCCCC1 1458a_100000210647_100102629194 [0,1,0,0,0,0|1,0,1]=3 860 B12R1.30 C/C=C/CC(=O)C1CCCCO1 1458a_100000748299_100102629194 [0,1,0,0,0,0|2,0,1]=4 861 B12R1.30 C/C=C/CC(=O)C1CCCOC1 1458a_100000741522_100102629194 [0,1,0,0,0,0|2,0,1]=4 862 B12R1.30 C/C=C/CC(=O)C1CCOCC1 1458a_100000195482_100102629194 [0,1,0,0,0,0|2,0,1]=4 863 B12R1.30 C/C=C/CC(=O)C1CCSCC1 1458a_100000755232_100102629194 [0,1,0,0,0,0|2,0,1]=4 864 B12R1.30 C=CC=CC(=O)C1CCCCC1 1458a_100016291481_100000210327 [0,1,0,0,0,0|1,0,2]=4 865 B12R1.30 C=CCCC(=O)C1CCCCC1 1458a_100000210647_100000754431 [0,1,0,0,0,0|1,0,1]=3 866 B12R1.30 C=CCCC(=O)C1CCCCC1 1458a_100000749702_100000210327 [0,1,0,0,0,0|1,0,1]=3 867 B12R1.30 C=CCCC(=O)C1CCCCO1 1458a_100000748299_100000754431 [0,1,0,0,0,0|2,0,1]=4 868 B12R1.30 C=CCCC(=O)C1CCCOC1 1458a_100000741522_100000754431 [0,1,0,0,0,0|2,0,1]=4 869 B12R1.30 C=CCCC(=O)C1CCCOC1 1458a_100000749702_100000693364 [0,1,0,0,0,0|2,0,1]=4 870 B12R1.30 C=CCCC(=O)C1CCOCC1 1458a_100000195482_100000754431 [0,1,0,0,0,0|2,0,1]=4 871 B12R1.30 C=CCCC(=O)C1CCOCC1 1458a_100000749702_100011324220 [0,1,0,0,0,0|2,0,1]=4 872 B12R1.30 C=CCCC(=O)C1CCSCC1 1458a_100000755232_100000754431 [0,1,0,0,0,0|2,0,1]=4 873 B12R1.30 C=CCNC(=O)C1CCCCC1 1626a_100020586998_100000210647 [0,1,0,0,0,0|1,0,1]=3 874 B12R1.30 C=CCNC(=O)C1CCCCC1 240690a_100020586998_100000210647 [0,1,0,0,0,0|1,0,1]=3 875 B12R1.30 C=CCNC(=O)C1CCCCC1 527a_100020586998_100000210647 [0,1,0,0,0,0|1,0,1]=3 876 B12R1.30 C=CCNC(=O)C1CCCCO1 1626a_100020586998_100000748299 [0,1,0,0,0,0|2,0,1]=4 877 B12R1.30 C=CCNC(=O)C1CCCCO1 240690a_100020586998_100000748299 [0,1,0,0,0,0|2,0,1]=4 878 B12R1.30 C=CCNC(=O)C1CCCCO1 527a_100020586998_100000748299 [0,1,0,0,0,0|2,0,1]=4 879 B12R1.30 C=CCNC(=O)C1CCCOC1 1626a_100020586998_100000741522 [0,1,0,0,0,0|2,0,1]=4 880 B12R1.30 C=CCNC(=O)C1CCCOC1 240690a_100020586998_100000741522 [0,1,0,0,0,0|2,0,1]=4 881 B12R1.30 C=CCNC(=O)C1CCCOC1 527a_100020586998_100000741522 [0,1,0,0,0,0|2,0,1]=4 882 B12R1.30 C=CCNC(=O)C1CCOCC1 1626a_100020586998_100000195482 [0,1,0,0,0,0|2,0,1]=4 883 B12R1.30 C=CCNC(=O)C1CCOCC1 240690a_100020586998_100000195482 [0,1,0,0,0,0|2,0,1]=4 884 B12R1.30 C=CCNC(=O)C1CCOCC1 527a_100020586998_100000195482 [0,1,0,0,0,0|2,0,1]=4 885 B12R1.30 C=CCNC(=O)C1CCSCC1 1626a_100020586998_100000755232 [0,1,0,0,0,0|2,0,1]=4 886 B12R1.30 C=CCNC(=O)C1CCSCC1 240690a_100020586998_100000755232 [0,1,0,0,0,0|2,0,1]=4 887 B12R1.30 C=CCNC(=O)C1CCSCC1 527a_100020586998_100000755232 [0,1,0,0,0,0|2,0,1]=4 888 B12R1.30 C=CCOC(C)C1CCCCC1 34a_100011216961_100015514636 [0,1,0,0,0,0|1,0,2]=4 889 B12R1.30 C=CCOC(C)C1CCCCC1 7a_100011216961_100015514636 [0,1,0,0,0,0|1,0,2]=4 890 B12R1.30 CC#CCC(=O)C1CCCCC1 1458a_100000210647_100000748600 [0,1,0,0,0,0|1,0,1]=3 891 B12R1.30 CC#CCC(=O)C1CCCCO1 1458a_100000748299_100000748600 [0,1,0,0,0,0|2,0,1]=4 892 B12R1.30 CC#CCC(=O)C1CCCOC1 1458a_100000741522_100000748600 [0,1,0,0,0,0|2,0,1]=4 893 B12R1.30 CC#CCC(=O)C1CCOCC1 1458a_100000195482_100000748600 [0,1,0,0,0,0|2,0,1]=4 894 B12R1.30 CC#CCC(=O)C1CCSCC1 1458a_100000755232_100000748600 [0,1,0,0,0,0|2,0,1]=4 895 B12R1.30 CC(NCCF)C1CCCCC1 269862a_100000724931_100000210989 [0,1,0,0,0,0|2,0,1]=4 896 B12R1.30 CC(NCCO)C1CCCCC1 269862a_100000210304_100000210989 [0,1,0,0,0,0|2,0,1]=4 897 B12R1.30 CC(OCC#N)C1CCCCC1 7a_100011216961_100011215382 [0,1,0,0,0,0|1,0,2]=4 898 B12R1.30 CC(OCC=O)C1CCCCC1 34a_100011216961_200009817547 [0,1,0,0,0,0|1,0,2]=4 899 B12R1.30 CC(OCC=O)C1CCCCC1 7a_100011216961_200015260668 [0,1,0,0,0,0|1,0,2]=4 900 B12R1.30 CC(OCCF)C1CCCCC1 34a_100011216961_100011217306 [0,1,0,0,0,0|1,0,1]=3 901 B12R1.30 CC(OCCF)C1CCCCC1 7a_100011216961_100011217306 [0,1,0,0,0,0|1,0,1]=3 902 B12R1.30 CC(OCCF)C1CCCNC1 34a_100000740858_100011217306 [0,1,0,0,0,0|2,0,1]=4 903 B12R1.30 CC(OCCF)C1CCNCC1 34a_100011728446_100011217306 [0,1,0,0,0,0|2,0,1]=4 904 B12R1.30 CC(OCCO)C1CCCCC1 34a_100011216961_100000211926 [0,1,0,0,0,0|1,0,1]=3 905 B12R1.30 CC(OCCO)C1CCCCC1 7a_100011216961_100000211926 [0,1,0,0,0,0|1,0,1]=3 906 B12R1.30 CC(OCCO)C1CCCNC1 34a_100000740858_100000211926 [0,1,0,0,0,0|2,0,1]=4 907 B12R1.30 CC(OCCO)C1CCNCC1 34a_100011728446_100000211926 [0,1,0,0,0,0|2,0,1]=4 908 B12R1.30 CC=CCC(=O)C1CCCCC1 1458a_100000210647_100000070051 [0,1,0,0,0,0|1,0,1]=3 909 B12R1.30 CC=CCC(=O)C1CCCCC1 1458a_100121576822_100000210327 [0,1,0,0,0,0|1,0,1]=3 910 B12R1.30 CC=CCC(=O)C1CCCCO1 1458a_100000748299_100000070051 [0,1,0,0,0,0|2,0,1]=4 911 B12R1.30 CC=CCC(=O)C1CCCOC1 1458a_100000741522_100000070051 [0,1,0,0,0,0|2,0,1]=4 912 B12R1.30 CC=CCC(=O)C1CCCOC1 1458a_100121576822_100000693364 [0,1,0,0,0,0|2,0,1]=4 913 B12R1.30 CC=CCC(=O)C1CCOCC1 1458a_100000195482_100000070051 [0,1,0,0,0,0|2,0,1]=4 914 B12R1.30 CC=CCC(=O)C1CCOCC1 1458a_100121576822_100011324220 [0,1,0,0,0,0|2,0,1]=4 915 B12R1.30 CC=CCC(=O)C1CCSCC1 1458a_100000755232_100000070051 [0,1,0,0,0,0|2,0,1]=4 916 B12R1.30 CC=NNC(=O)C1CCCCC1 4a_100000184180_200000210099 [0,1,0,0,0,0|1,0,1]=3 917 B12R1.30 CC=NNC(=O)C1CCOCC1 4a_100000193481_200000210099 [0,1,0,0,0,0|2,0,1]=4 918 B12R1.30 CCC#CC(=O)C1C=CCCC1 1458a_100011827653_100000751183 [0,1,0,0,0,0|1,0,2]=4 919 B12R1.30 CCC#CC(=O)C1CCCCC1 1458a_100011827653_100000210327 [0,1,0,0,0,0|1,0,0]=2 920 B12R1.30 CCC#CC(=O)C1CCCOC1 1458a_100011827653_100000693364 [0,1,0,0,0,0|2,0,0]=3 921 B12R1.30 CCC#CC(=O)C1CCOCC1 1458a_100011827653_100011324220 [0,1,0,0,0,0|2,0,0]=3 922 B12R1.30 CCC=CC(=O)C1C=CCCC1 1458a_100000212282_100000751183 [0,1,0,0,0,0|1,0,2]=4 923 B12R1.30 CCC=CC(=O)C1CCCCC1 1458a_100000212282_100000210327 [0,1,0,0,0,0|1,0,0]=2 924 B12R1.30 CCC=CC(=O)C1CCCOC1 1458a_100000212282_100000693364 [0,1,0,0,0,0|2,0,0]=3 925 B12R1.30 CCC=CC(=O)C1CCOCC1 1458a_100000212282_100011324220 [0,1,0,0,0,0|2,0,0]=3 926 B12R1.30 CCC=CC(=O)N1CCCOC1 11a_100000131196_100000212282 [0,1,0,0,0,0|3,0,0]=4 927 B12R1.30 CCC=CC(=O)N1CCCOC1 240690a_100000131196_100000212282 [0,1,0,0,0,0|3,0,0]=4 928 B12R1.30 CCC=CC(=O)N1CCOCC1 11a_100015191051_100000212282 [0,1,0,0,0,0|3,0,0]=4 929 B12R1.30 CCC=CC(=O)N1CCOCC1 1626a_100015191051_100000212282 [0,1,0,0,0,0|3,0,0]=4 930 B12R1.30 CCC=CC(=O)N1CCOCC1 240690a_100015191051_100000212282 [0,1,0,0,0,0|3,0,0]=4 931 B12R1.30 CCC=CC(=O)N1CCSCC1 11a_100000737611_100000212282 [0,1,0,0,0,0|3,0,0]=4 932 B12R1.30 CCC=CC(=O)N1CCSCC1 240690a_100000737611_100000212282 [0,1,0,0,0,0|3,0,0]=4 933 B12R1.30 CCCCC(=O)C1=CCCCC1 1458a_100000765259_100000210211 [0,1,0,0,0,0|1,0,2]=4 934 B12R1.30 CCCCC(=O)C1C=CCCC1 1458a_100000210183_100000751183 [0,1,0,0,0,0|1,0,2]=4 935 B12R1.30 CCCCC(=O)C1CCCCC1 1458a_100000210183_100000210327 [0,1,0,0,0,0|1,0,0]=2 936 B12R1.30 CCCCC(=O)C1CCCCC1 1458a_100000210647_100000210211 [0,1,0,0,0,0|1,0,0]=2 937 B12R1.30 CCCCC(=O)C1CCCCO1 1458a_100000748299_100000210211 [0,1,0,0,0,0|2,0,0]=3 938 B12R1.30 CCCCC(=O)C1CCCOC1 1458a_100000210183_100000693364 [0,1,0,0,0,0|2,0,0]=3 939 B12R1.30 CCCCC(=O)C1CCCOC1 1458a_100000741522_100000210211 [0,1,0,0,0,0|2,0,0]=3 940 B12R1.30 CCCCC(=O)C1CCOCC1 1458a_100000195482_100000210211 [0,1,0,0,0,0|2,0,0]=3 941 B12R1.30 CCCCC(=O)C1CCOCC1 1458a_100000210183_100011324220 [0,1,0,0,0,0|2,0,0]=3 942 B12R1.30 CCCCC(=O)C1CCSCC1 1458a_100000755232_100000210211 [0,1,0,0,0,0|2,0,0]=3 943 B12R1.30 CCCCC(=O)C1COCCO1 1458a_100000045528_100000210211 [0,1,0,0,0,0|3,0,0]=4 944 B12R1.30 CCCCC(=O)C1SCCCS1 1458a_100000028545_100000210211 [0,1,0,0,0,0|3,0,0]=4 945 B12R1.30 CCCCC(=O)N1CCCOC1 11a_100000131196_100000210183 [0,1,0,0,0,0|3,0,0]=4 946 B12R1.30 CCCCC(=O)N1CCCOC1 240690a_100000131196_100000210183 [0,1,0,0,0,0|3,0,0]=4 947 B12R1.30 CCCCC(=O)N1CCOCC1 11a_100015191051_100000210183 [0,1,0,0,0,0|3,0,0]=4 948 B12R1.30 CCCCC(=O)N1CCOCC1 1626a_100015191051_100000210183 [0,1,0,0,0,0|3,0,0]=4 949 B12R1.30 CCCCC(=O)N1CCOCC1 240690a_100015191051_100000210183 [0,1,0,0,0,0|3,0,0]=4 950 B12R1.30 CCCCC(=O)N1CCOCC1 527a_100015191051_100000210183 [0,1,0,0,0,0|3,0,0]=4 951 B12R1.30 CCCCC(=O)N1CCSCC1 11a_100000737611_100000210183 [0,1,0,0,0,0|3,0,0]=4 952 B12R1.30 CCCCC(=O)N1CCSCC1 240690a_100000737611_100000210183 [0,1,0,0,0,0|3,0,0]=4 953 B12R1.30 CCCCC(=O)N1CCSCC1 527a_100000737611_100000210183 [0,1,0,0,0,0|3,0,0]=4 954 B12R1.30 CCCCC(=O)[C@H]1CC=CCC1 1458a_100009820709_100000210211 [0,1,0,0,0,0|1,0,2]=4 955 B12R1.30 CCCCN(C)C1CCCCC1 2230a_100000207522_100000210211 [0,1,0,0,0,0|3,0,0]=4 956 B12R1.30 CCCCN(C)C1CCCCC1 269982a_100000207522_100000210211 [0,1,0,0,0,0|3,0,0]=4 957 B12R1.30 CCCCN(C)C1CCCCC1 269982a_100000207549_100000210327 [0,1,0,0,0,0|3,0,0]=4 958 B12R1.30 CCCCN(C)C1CCCCC1 270004a_100000207549_100000210434 [0,1,0,0,0,0|3,0,0]=4 959 B12R1.30 CCCCN(C)C1CCCCC1 34a_100000207522_100000210210 [0,1,0,0,0,0|3,0,0]=4 960 B12R1.30 CCCNC(=O)C1=CCCCC1 11a_100020643023_100000765259 [0,1,0,0,0,0|1,0,2]=4 961 B12R1.30 CCCNC(=O)C1=CCCCC1 1626a_100020643023_100000765259 [0,1,0,0,0,0|1,0,2]=4 962 B12R1.30 CCCNC(=O)C1=CCCCC1 240690a_100020643023_100000765259 [0,1,0,0,0,0|1,0,2]=4 963 B12R1.30 CCCNC(=O)C1=CCCCC1 527a_100020643023_100000765259 [0,1,0,0,0,0|1,0,2]=4 964 B12R1.30 CCCNC(=O)C1CCCCC1 11a_100020643023_100000210647 [0,1,0,0,0,0|1,0,0]=2 965 B12R1.30 CCCNC(=O)C1CCCCC1 1626a_100020643023_100000210647 [0,1,0,0,0,0|1,0,0]=2 966 B12R1.30 CCCNC(=O)C1CCCCC1 240690a_100020643023_100000210647 [0,1,0,0,0,0|1,0,0]=2 967 B12R1.30 CCCNC(=O)C1CCCCC1 527a_100020643023_100000210647 [0,1,0,0,0,0|1,0,0]=2 968 B12R1.30 CCCNC(=O)C1CCCCO1 11a_100020643023_100000748299 [0,1,0,0,0,0|2,0,0]=3 969 B12R1.30 CCCNC(=O)C1CCCCO1 1626a_100020643023_100000748299 [0,1,0,0,0,0|2,0,0]=3 970 B12R1.30 CCCNC(=O)C1CCCCO1 240690a_100020643023_100000748299 [0,1,0,0,0,0|2,0,0]=3 971 B12R1.30 CCCNC(=O)C1CCCCO1 527a_100020643023_100000748299 [0,1,0,0,0,0|2,0,0]=3 972 B12R1.30 CCCNC(=O)C1CCCOC1 11a_100020643023_100000741522 [0,1,0,0,0,0|2,0,0]=3 973 B12R1.30 CCCNC(=O)C1CCCOC1 1626a_100020643023_100000741522 [0,1,0,0,0,0|2,0,0]=3 974 B12R1.30 CCCNC(=O)C1CCCOC1 240690a_100020643023_100000741522 [0,1,0,0,0,0|2,0,0]=3 975 B12R1.30 CCCNC(=O)C1CCCOC1 527a_100020643023_100000741522 [0,1,0,0,0,0|2,0,0]=3 976 B12R1.30 CCCNC(=O)C1CCOCC1 11a_100020643023_100000195482 [0,1,0,0,0,0|2,0,0]=3 977 B12R1.30 CCCNC(=O)C1CCOCC1 1626a_100020643023_100000195482 [0,1,0,0,0,0|2,0,0]=3 978 B12R1.30 CCCNC(=O)C1CCOCC1 240690a_100020643023_100000195482 [0,1,0,0,0,0|2,0,0]=3 979 B12R1.30 CCCNC(=O)C1CCOCC1 527a_100020643023_100000195482 [0,1,0,0,0,0|2,0,0]=3 980 B12R1.30 CCCNC(=O)C1CCSCC1 11a_100020643023_100000755232 [0,1,0,0,0,0|2,0,0]=3 981 B12R1.30 CCCNC(=O)C1CCSCC1 1626a_100020643023_100000755232 [0,1,0,0,0,0|2,0,0]=3 982 B12R1.30 CCCNC(=O)C1CCSCC1 240690a_100020643023_100000755232 [0,1,0,0,0,0|2,0,0]=3 983 B12R1.30 CCCNC(=O)C1CCSCC1 527a_100020643023_100000755232 [0,1,0,0,0,0|2,0,0]=3 984 B12R1.30 CCCNC(=O)C1COCCO1 11a_100020643023_100000045528 [0,1,0,0,0,0|3,0,0]=4 985 B12R1.30 CCCNC(=O)C1COCCO1 1626a_100020643023_100000045528 [0,1,0,0,0,0|3,0,0]=4 986 B12R1.30 CCCNC(=O)C1COCCO1 240690a_100020643023_100000045528 [0,1,0,0,0,0|3,0,0]=4 987 B12R1.30 CCCNC(=O)C1COCCO1 527a_100020643023_100000045528 [0,1,0,0,0,0|3,0,0]=4 988 B12R1.30 CCCNC(=O)C1SCCCS1 11a_100020643023_100000028545 [0,1,0,0,0,0|3,0,0]=4 989 B12R1.30 CCCNC(=O)C1SCCCS1 1626a_100020643023_100000028545 [0,1,0,0,0,0|3,0,0]=4 990 B12R1.30 CCCNC(=O)C1SCCCS1 240690a_100020643023_100000028545 [0,1,0,0,0,0|3,0,0]=4 991 B12R1.30 CCCNC(=O)C1SCCCS1 527a_100020643023_100000028545 [0,1,0,0,0,0|3,0,0]=4 992 B12R1.30 CCCNC(=O)N1CCCOC1 2708a_100020643023_100000131196 [0,1,0,0,0,0|3,0,0]=4 993 B12R1.30 CCCNC(=O)N1CCCOC1 273464a_100020643023_100000131196 [0,1,0,0,0,0|3,0,0]=4 994 B12R1.30 CCCNC(=O)N1CCOCC1 2708a_100020643023_100015191051 [0,1,0,0,0,0|3,0,0]=4 995 B12R1.30 CCCNC(=O)N1CCOCC1 273464a_100020643023_100015191051 [0,1,0,0,0,0|3,0,0]=4 996 B12R1.30 CCCNC(=O)N1CCSCC1 2708a_100020643023_100000737611 [0,1,0,0,0,0|3,0,0]=4 997 B12R1.30 CCCNC(=O)N1CCSCC1 273464a_100020643023_100000737611 [0,1,0,0,0,0|3,0,0]=4 998 B12R1.30 CCCNC(=O)[C@H]1CC=CCC1 11a_100020643023_100009820709 [0,1,0,0,0,0|1,0,2]=4 999 B12R1.30 CCCNC(=O)[C@H]1CC=CCC1 1626a_100020643023_100009820709 [0,1,0,0,0,0|1,0,2]=4 1000 B12R1.30 CCCNC(=O)[C@H]1CC=CCC1 240690a_100020643023_100009820709 [0,1,0,0,0,0|1,0,2]=4 1001 B12R1.30 CCCNC(=O)[C@H]1CC=CCC1 527a_100020643023_100009820709 [0,1,0,0,0,0|1,0,2]=4 1002 B12R1.30 CCCNC(C)C1CCCCC1 269862a_100020643023_100000210989 [0,1,0,0,0,0|2,0,1]=4 1003 B12R1.30 CCCN[C@H](C)C1CCCCC1 2230a_100025707633_100000210303 [0,1,0,0,0,0|2,0,1]=4 1004 B12R1.30 CCCN[C@H](C)C1CCCCC1 34a_100025707633_100000210303 [0,1,0,0,0,0|2,0,1]=4 1005 B12R1.30 CCCOC(C)C1CCCCC1 34a_100011216961_100000210303 [0,1,0,0,0,0|1,0,1]=3 1006 B12R1.30 CCCOC(C)C1CCCCC1 7a_100011216961_100000210303 [0,1,0,0,0,0|1,0,1]=3 1007 B12R1.30 CCCOC(C)C1CCCNC1 34a_100000740858_100000210303 [0,1,0,0,0,0|2,0,1]=4 1008 B12R1.30 CCCOC(C)C1CCNCC1 34a_100011728446_100000210303 [0,1,0,0,0,0|2,0,1]=4 1009 B12R1.30 CCCO[C@H](C)C1CCOCC1 34a_100000703848_100000210303 [0,1,0,0,0,0|2,0,1]=4 1010 B12R1.30 CCCO[C@H](C)C1CCOCC1 7a_100000703848_100000210303 [0,1,0,0,0,0|2,0,1]=4 1011 B12R1.30 CCNCC(=O)C1CCCCC1 2230a_100015525214_100000241979 [0,1,0,0,0,0|1,0,0]=2 1012 B12R1.30 CCNCC(=O)C1CCOCC1 2230a_100015525214_100000689883 [0,1,0,0,0,0|2,0,0]=3 1013 B12R1.30 CCNCC(=O)N1CCCCC1 2230a_100000751303_100000210202 [0,1,0,0,0,0|2,0,0]=3 1014 B12R1.30 CCNCC(=O)N1CCCCC1 2230a_100015525214_100000183409 [0,1,0,0,0,0|2,0,0]=3 1015 B12R1.30 CCNCC(=O)N1CCOCC1 2230a_100000697423_100000210202 [0,1,0,0,0,0|3,0,0]=4 1016 B12R1.30 CCNCC(=O)N1CCOCC1 2230a_100015525214_100000183410 [0,1,0,0,0,0|3,0,0]=4 1017 B12R1.30 CCNN=C(C)C1CCCCC1 4a_100000756455_100000210989 [0,1,0,0,0,0|2,0,0]=3 1018 B12R1.30 CCNN=C(C)C1CCOCC1 4a_100000756455_100000759496 [0,1,0,0,0,0|3,0,0]=4 1019 B12R1.30 CCNNC(=O)C1=CCCCC1 22a_100000756455_100000765259 [0,1,0,0,0,0|1,0,2]=4 1020 B12R1.30 CCNNC(=O)C1CCCCC1 22a_100000756455_100000210647 [0,1,0,0,0,0|1,0,0]=2 1021 B12R1.30 CCNNC(=O)C1CCCCO1 22a_100000756455_100000748299 [0,1,0,0,0,0|2,0,0]=3 1022 B12R1.30 CCNNC(=O)C1CCCOC1 22a_100000756455_100000741522 [0,1,0,0,0,0|2,0,0]=3 1023 B12R1.30 CCNNC(=O)C1CCOCC1 22a_100000756455_100000195482 [0,1,0,0,0,0|2,0,0]=3 1024 B12R1.30 CCNNC(=O)C1CCSCC1 22a_100000756455_100000755232 [0,1,0,0,0,0|2,0,0]=3 1025 B12R1.30 CCNNC(=O)C1COCCO1 22a_100000756455_100000045528 [0,1,0,0,0,0|3,0,0]=4 1026 B12R1.30 CCNNC(=O)C1SCCCS1 22a_100000756455_100000028545 [0,1,0,0,0,0|3,0,0]=4 1027 B12R1.30 CCNNC(=O)[C@H]1CC=CCC1 22a_100000756455_100009820709 [0,1,0,0,0,0|1,0,2]=4 1028 B12R1.30 CCOCC(=O)C1C=CCCC1 1458a_100000211967_100000751183 [0,1,0,0,0,0|0,0,2]=3 1029 B12R1.30 CCOCC(=O)C1CCCCC1 1458a_100000211967_100000210327 [0,1,0,0,0,0|0,0,0]=1 1030 B12R1.30 CCOCC(=O)C1CCCCC1 34a_100121572206_100000241979 [0,1,0,0,0,0|0,0,0]=1 1031 B12R1.30 CCOCC(=O)C1CCCOC1 1458a_100000211967_100000693364 [0,1,0,0,0,0|1,0,0]=2 1032 B12R1.30 CCOCC(=O)C1CCOCC1 1458a_100000211967_100011324220 [0,1,0,0,0,0|1,0,0]=2 1033 B12R1.30 CCOCC(=O)C1CCOCC1 34a_100121572206_100000689883 [0,1,0,0,0,0|1,0,0]=2 1034 B12R1.30 CCOCC(=O)N1CC=CCC1 11a_100000698166_100000211967 [0,1,0,0,0,0|1,0,2]=4 1035 B12R1.30 CCOCC(=O)N1CC=CCC1 1626a_100000698166_100000211967 [0,1,0,0,0,0|1,0,2]=4 1036 B12R1.30 CCOCC(=O)N1CC=CCC1 240690a_100000698166_100000211967 [0,1,0,0,0,0|1,0,2]=4 1037 B12R1.30 CCOCC(=O)N1CC=CCC1 527a_100000698166_100000211967 [0,1,0,0,0,0|1,0,2]=4 1038 B12R1.30 CCOCC(=O)N1CCCCC1 34a_100121572206_100000183409 [0,1,0,0,0,0|1,0,0]=2 1039 B12R1.30 CCOCC(=O)N1CCCCC1 7a_100011315646_100000210202 [0,1,0,0,0,0|1,0,0]=2 1040 B12R1.30 CCOCC(=O)N1CCCOC1 11a_100000131196_100000211967 [0,1,0,0,0,0|2,0,0]=3 1041 B12R1.30 CCOCC(=O)N1CCCOC1 240690a_100000131196_100000211967 [0,1,0,0,0,0|2,0,0]=3 1042 B12R1.30 CCOCC(=O)N1CCOCC1 11a_100015191051_100000211967 [0,1,0,0,0,0|2,0,0]=3 1043 B12R1.30 CCOCC(=O)N1CCOCC1 1626a_100015191051_100000211967 [0,1,0,0,0,0|2,0,0]=3 1044 B12R1.30 CCOCC(=O)N1CCOCC1 240690a_100015191051_100000211967 [0,1,0,0,0,0|2,0,0]=3 1045 B12R1.30 CCOCC(=O)N1CCOCC1 34a_100121572206_100000183410 [0,1,0,0,0,0|2,0,0]=3 1046 B12R1.30 CCOCC(=O)N1CCOCC1 527a_100015191051_100000211967 [0,1,0,0,0,0|2,0,0]=3 1047 B12R1.30 CCOCC(=O)N1CCOCC1 7a_100000752472_100000210202 [0,1,0,0,0,0|2,0,0]=3 1048 B12R1.30 CCOCC(=O)N1CCSCC1 11a_100000737611_100000211967 [0,1,0,0,0,0|2,0,0]=3 1049 B12R1.30 CCOCC(=O)N1CCSCC1 240690a_100000737611_100000211967 [0,1,0,0,0,0|2,0,0]=3 1050 B12R1.30 CCOCC(=O)N1CCSCC1 527a_100000737611_100000211967 [0,1,0,0,0,0|2,0,0]=3 1051 B12R1.30 CCOCN(C)C1CCCCC1 269982a_100000207522_100000739092 [0,1,0,0,0,0|2,0,0]=3 1052 B12R1.30 CCOCN(C)C1CCOCC1 269982a_100020587155_100000739092 [0,1,0,0,0,0|3,0,0]=4 1053 B12R1.30 CCOCN(C)C1CCSCC1 269982a_100015184757_100000739092 [0,1,0,0,0,0|3,0,0]=4 1054 B12R1.30 CCOC[C@H](N)C1CCCCC1 34a_100009817630_100000210202 [0,1,0,0,0,0|1,0,1]=3 1055 B12R1.30 CCSCC(=O)C1C=CCCC1 1458a_100000230394_100000751183 [0,1,0,0,0,0|0,1,2]=4 1056 B12R1.30 CCSCC(=O)C1CCCCC1 1458a_100000230394_100000210327 [0,1,0,0,0,0|0,1,0]=2 1057 B12R1.30 CCSCC(=O)C1CCCCC1 62a_100000210202_100000241979 [0,1,0,0,0,0|0,1,0]=2 1058 B12R1.30 CCSCC(=O)C1CCCCC1 62a_100000241979_100000210202 [0,1,0,0,0,0|0,1,0]=2 1059 B12R1.30 CCSCC(=O)C1CCCOC1 1458a_100000230394_100000693364 [0,1,0,0,0,0|1,1,0]=3 1060 B12R1.30 CCSCC(=O)C1CCOCC1 1458a_100000230394_100011324220 [0,1,0,0,0,0|1,1,0]=3 1061 B12R1.30 CCSCC(=O)C1CCOCC1 62a_100000210202_100000689883 [0,1,0,0,0,0|1,1,0]=3 1062 B12R1.30 CCSCC(=O)C1CCOCC1 62a_100000689883_100000210202 [0,1,0,0,0,0|1,1,0]=3 1063 B12R1.30 CCSCC(=O)N1CCCCC1 62a_100000183409_100000210202 [0,1,0,0,0,0|1,1,0]=3 1064 B12R1.30 CCSCC(=O)N1CCCCC1 62a_100000210202_100000183409 [0,1,0,0,0,0|1,1,0]=3 1065 B12R1.30 CCSCC(=O)N1CCCOC1 11a_100000131196_100000230394 [0,1,0,0,0,0|2,1,0]=4 1066 B12R1.30 CCSCC(=O)N1CCCOC1 240690a_100000131196_100000230394 [0,1,0,0,0,0|2,1,0]=4 1067 B12R1.30 CCSCC(=O)N1CCOCC1 11a_100015191051_100000230394 [0,1,0,0,0,0|2,1,0]=4 1068 B12R1.30 CCSCC(=O)N1CCOCC1 1626a_100015191051_100000230394 [0,1,0,0,0,0|2,1,0]=4 1069 B12R1.30 CCSCC(=O)N1CCOCC1 240690a_100015191051_100000230394 [0,1,0,0,0,0|2,1,0]=4 1070 B12R1.30 CCSCC(=O)N1CCOCC1 527a_100015191051_100000230394 [0,1,0,0,0,0|2,1,0]=4 1071 B12R1.30 CCSCC(=O)N1CCOCC1 62a_100000183410_100000210202 [0,1,0,0,0,0|2,1,0]=4 1072 B12R1.30 CCSCC(=O)N1CCOCC1 62a_100000210202_100000183410 [0,1,0,0,0,0|2,1,0]=4 1073 B12R1.30 CCSCC(=O)N1CCSCC1 11a_100000737611_100000230394 [0,1,0,0,0,0|2,1,0]=4 1074 B12R1.30 CCSCC(=O)N1CCSCC1 240690a_100000737611_100000230394 [0,1,0,0,0,0|2,1,0]=4 1075 B12R1.30 CCSCC(=O)N1CCSCC1 527a_100000737611_100000230394 [0,1,0,0,0,0|2,1,0]=4 1076 B12R1.30 CN(CCCF)C1CCCCC1 2230a_100000207522_100011934791 [0,1,0,0,0,0|3,0,0]=4 1077 B12R1.30 CN(CCCF)C1CCCCC1 269982a_100000207522_100011934791 [0,1,0,0,0,0|3,0,0]=4 1078 B12R1.30 CN(CCCF)C1CCCCC1 34a_100000207522_100011934791 [0,1,0,0,0,0|3,0,0]=4 1079 B12R1.30 CN(CCCO)C1CCCCC1 2230a_100000207522_100000230001 [0,1,0,0,0,0|3,0,0]=4 1080 B12R1.30 CN(CCCO)C1CCCCC1 269982a_100000207522_100011215043 [0,1,0,0,0,0|3,0,0]=4 1081 B12R1.30 CN(CCCO)C1CCCCC1 269982a_100000213112_100000210327 [0,1,0,0,0,0|3,0,0]=4 1082 B12R1.30 CN(CCCO)C1CCCCC1 270004a_100000213112_100000210434 [0,1,0,0,0,0|3,0,0]=4 1083 B12R1.30 CN(CCCO)C1CCCCC1 34a_100000207522_100000230001 [0,1,0,0,0,0|3,0,0]=4 1084 B12R1.30 CNCCC(=O)N1CCCCC1 2230a_106832991635_100102558178 [0,1,0,0,0,0|2,0,0]=3 1085 B12R1.30 CNCCC(=O)N1CCCCC1 34a_100102657272_100102558178 [0,1,0,0,0,0|2,0,0]=3 1086 B12R1.30 CNCCC(=O)N1CCCCC1 7a_106832991635_100102558178 [0,1,0,0,0,0|2,0,0]=3 1087 B12R1.30 CNCCC(=O)N1CCOCC1 2230a_100000735667_200000210301 [0,1,0,0,0,0|3,0,0]=4 1088 B12R1.30 CNCCC(=O)N1CCOCC1 2230a_106832991635_100000739706 [0,1,0,0,0,0|3,0,0]=4 1089 B12R1.30 CNCCC(=O)N1CCOCC1 7a_106832991635_100000739706 [0,1,0,0,0,0|3,0,0]=4 1090 B12R1.30 CNCOC(=O)C1CCCCC1 2230a_106832991635_100009893799 [0,1,0,0,0,0|0,0,0]=1 1091 B12R1.30 CNCOC(=O)C1CCCCC1 34a_100102657272_100009893799 [0,1,0,0,0,0|0,0,0]=1 1092 B12R1.30 CNCOC(=O)N1CCOCC1 2230a_106832991635_100009898760 [0,1,0,0,0,0|2,0,0]=3 1093 B12R1.30 COC=CC(=O)C1CCCCC1 1458a_100016268678_100000210327 [0,1,0,0,0,0|1,0,1]=3 1094 B12R1.30 COC=CC(=O)C1CCCOC1 1458a_100016268678_100000693364 [0,1,0,0,0,0|2,0,1]=4 1095 B12R1.30 COC=CC(=O)C1CCOCC1 1458a_100016268678_100011324220 [0,1,0,0,0,0|2,0,1]=4 1096 B12R1.30 COCCC(=O)C1=CCCCC1 1458a_100000765259_100000233755 [0,1,0,0,0,0|1,0,2]=4 1097 B12R1.30 COCCC(=O)C1C=CCCC1 1458a_100000749529_100000751183 [0,1,0,0,0,0|1,0,2]=4 1098 B12R1.30 COCCC(=O)C1CCCCC1 1458a_100000210647_100000233755 [0,1,0,0,0,0|1,0,0]=2 1099 B12R1.30 COCCC(=O)C1CCCCC1 1458a_100000749529_100000210327 [0,1,0,0,0,0|1,0,0]=2 1100 B12R1.30 COCCC(=O)C1CCCCO1 1458a_100000748299_100000233755 [0,1,0,0,0,0|2,0,0]=3 1101 B12R1.30 COCCC(=O)C1CCCOC1 1458a_100000741522_100000233755 [0,1,0,0,0,0|2,0,0]=3 1102 B12R1.30 COCCC(=O)C1CCCOC1 1458a_100000749529_100000693364 [0,1,0,0,0,0|2,0,0]=3 1103 B12R1.30 COCCC(=O)C1CCOCC1 1458a_100000195482_100000233755 [0,1,0,0,0,0|2,0,0]=3 1104 B12R1.30 COCCC(=O)C1CCOCC1 1458a_100000749529_100011324220 [0,1,0,0,0,0|2,0,0]=3 1105 B12R1.30 COCCC(=O)C1CCSCC1 1458a_100000755232_100000233755 [0,1,0,0,0,0|2,0,0]=3 1106 B12R1.30 COCCC(=O)C1COCCO1 1458a_100000045528_100000233755 [0,1,0,0,0,0|3,0,0]=4 1107 B12R1.30 COCCC(=O)C1SCCCS1 1458a_100000028545_100000233755 [0,1,0,0,0,0|3,0,0]=4 1108 B12R1.30 COCCC(=O)N1CCCCC1 34a_100138415774_100102558178 [0,1,0,0,0,0|2,0,0]=3 1109 B12R1.30 COCCC(=O)N1CCCOC1 11a_100000131196_100000749529 [0,1,0,0,0,0|3,0,0]=4 1110 B12R1.30 COCCC(=O)N1CCCOC1 240690a_100000131196_100000749529 [0,1,0,0,0,0|3,0,0]=4 1111 B12R1.30 COCCC(=O)N1CCOCC1 11a_100015191051_100000749529 [0,1,0,0,0,0|3,0,0]=4 1112 B12R1.30 COCCC(=O)N1CCOCC1 1626a_100015191051_100000749529 [0,1,0,0,0,0|3,0,0]=4 1113 B12R1.30 COCCC(=O)N1CCOCC1 240690a_100015191051_100000749529 [0,1,0,0,0,0|3,0,0]=4 1114 B12R1.30 COCCC(=O)N1CCOCC1 527a_100015191051_100000749529 [0,1,0,0,0,0|3,0,0]=4 1115 B12R1.30 COCCC(=O)N1CCSCC1 11a_100000737611_100000749529 [0,1,0,0,0,0|3,0,0]=4 1116 B12R1.30 COCCC(=O)N1CCSCC1 240690a_100000737611_100000749529 [0,1,0,0,0,0|3,0,0]=4 1117 B12R1.30 COCCC(=O)N1CCSCC1 527a_100000737611_100000749529 [0,1,0,0,0,0|3,0,0]=4 1118 B12R1.30 COCCC(=O)[C@H]1CC=CCC1 1458a_100009820709_100000233755 [0,1,0,0,0,0|1,0,2]=4 1119 B12R1.30 COCCC(N)C1CCCCC1 34a_200020622111_200000210301 [0,1,0,0,0,0|2,0,1]=4 1120 B12R1.30 COCCN(C)C1CCCCC1 2230a_100000207522_100011201679 [0,1,0,0,0,0|3,0,0]=4 1121 B12R1.30 COCCN(C)C1CCCCC1 269982a_100000207522_100000233755 [0,1,0,0,0,0|3,0,0]=4 1122 B12R1.30 COCCN(C)C1CCCCC1 269982a_100000743101_100000210327 [0,1,0,0,0,0|3,0,0]=4 1123 B12R1.30 COCCN(C)C1CCCCC1 270004a_100000743101_100000210434 [0,1,0,0,0,0|3,0,0]=4 1124 B12R1.30 COCCN(C)C1CCCCC1 34a_100000207522_100011201679 [0,1,0,0,0,0|3,0,0]=4 1125 B12R1.30 COCN[C@H](C)C1CCCCC1 2230a_100025707633_100000766300 [0,1,0,0,0,0|2,0,1]=4 1126 B12R1.30 COCOC(=O)C1CCCCC1 34a_100138415774_100009893799 [0,1,0,0,0,0|0,0,0]=1 1127 B12R1.30 CSCCC(=O)C1=CCCCC1 1458a_100000765259_100000751147 [0,1,0,0,0,0|1,0,2]=4 1128 B12R1.30 CSCCC(=O)C1C=CCCC1 1458a_100000174002_100000751183 [0,1,0,0,0,0|1,0,2]=4 1129 B12R1.30 CSCCC(=O)C1CCCCC1 1458a_100000174002_100000210327 [0,1,0,0,0,0|1,0,0]=2 1130 B12R1.30 CSCCC(=O)C1CCCCC1 1458a_100000210647_100000751147 [0,1,0,0,0,0|1,0,0]=2 1131 B12R1.30 CSCCC(=O)C1CCCCO1 1458a_100000748299_100000751147 [0,1,0,0,0,0|2,0,0]=3 1132 B12R1.30 CSCCC(=O)C1CCCOC1 1458a_100000174002_100000693364 [0,1,0,0,0,0|2,0,0]=3 1133 B12R1.30 CSCCC(=O)C1CCCOC1 1458a_100000741522_100000751147 [0,1,0,0,0,0|2,0,0]=3 1134 B12R1.30 CSCCC(=O)C1CCOCC1 1458a_100000174002_100011324220 [0,1,0,0,0,0|2,0,0]=3 1135 B12R1.30 CSCCC(=O)C1CCOCC1 1458a_100000195482_100000751147 [0,1,0,0,0,0|2,0,0]=3 1136 B12R1.30 CSCCC(=O)C1CCSCC1 1458a_100000755232_100000751147 [0,1,0,0,0,0|2,0,0]=3 1137 B12R1.30 CSCCC(=O)C1COCCO1 1458a_100000045528_100000751147 [0,1,0,0,0,0|3,0,0]=4 1138 B12R1.30 CSCCC(=O)C1SCCCS1 1458a_100000028545_100000751147 [0,1,0,0,0,0|3,0,0]=4 1139 B12R1.30 CSCCC(=O)N1CCCCC1 62a_100102558178_200000210301 [0,1,0,0,0,0|2,0,0]=3 1140 B12R1.30 CSCCC(=O)N1CCCCC1 62a_200000210301_100102558178 [0,1,0,0,0,0|2,0,0]=3 1141 B12R1.30 CSCCC(=O)N1CCCOC1 11a_100000131196_100000174002 [0,1,0,0,0,0|3,0,0]=4 1142 B12R1.30 CSCCC(=O)N1CCCOC1 240690a_100000131196_100000174002 [0,1,0,0,0,0|3,0,0]=4 1143 B12R1.30 CSCCC(=O)N1CCOCC1 11a_100015191051_100000174002 [0,1,0,0,0,0|3,0,0]=4 1144 B12R1.30 CSCCC(=O)N1CCOCC1 1626a_100015191051_100000174002 [0,1,0,0,0,0|3,0,0]=4 1145 B12R1.30 CSCCC(=O)N1CCOCC1 240690a_100015191051_100000174002 [0,1,0,0,0,0|3,0,0]=4 1146 B12R1.30 CSCCC(=O)N1CCOCC1 527a_100015191051_100000174002 [0,1,0,0,0,0|3,0,0]=4 1147 B12R1.30 CSCCC(=O)N1CCOCC1 62a_100000739706_200000210301 [0,1,0,0,0,0|3,0,0]=4 1148 B12R1.30 CSCCC(=O)N1CCOCC1 62a_200000210301_100000739706 [0,1,0,0,0,0|3,0,0]=4 1149 B12R1.30 CSCCC(=O)N1CCSCC1 11a_100000737611_100000174002 [0,1,0,0,0,0|3,0,0]=4 1150 B12R1.30 CSCCC(=O)N1CCSCC1 240690a_100000737611_100000174002 [0,1,0,0,0,0|3,0,0]=4 1151 B12R1.30 CSCCC(=O)N1CCSCC1 527a_100000737611_100000174002 [0,1,0,0,0,0|3,0,0]=4 1152 B12R1.30 CSCCC(=O)[C@H]1CC=CCC1 1458a_100009820709_100000751147 [0,1,0,0,0,0|1,0,2]=4 1153 B12R1.30 CSCCN(C)C1CCCCC1 2230a_100000207522_100000751147 [0,1,0,0,0,0|3,0,0]=4 1154 B12R1.30 CSCCN(C)C1CCCCC1 269982a_100000207522_100000212216 [0,1,0,0,0,0|3,0,0]=4 1155 B12R1.30 CSCCN(C)C1CCCCC1 269982a_100000686725_100000210327 [0,1,0,0,0,0|3,0,0]=4 1156 B12R1.30 CSCCN(C)C1CCCCC1 270004a_100000686725_100000210434 [0,1,0,0,0,0|3,0,0]=4 1157 B12R1.30 CSCCN(C)C1CCCCC1 34a_100000207522_100000212216 [0,1,0,0,0,0|3,0,0]=4 1158 B12R1.30 CSCN[C@H](C)C1CCCCC1 2230a_100025707633_100011218213 [0,1,0,0,0,0|2,0,1]=4 1159 B12R1.30 CSCN[C@H](C)C1CCCCC1 34a_100025707633_100011218213 [0,1,0,0,0,0|2,0,1]=4 1160 B12R1.30 CSCOC(=O)C1CCCCC1 62a_100009893799_200000210301 [0,1,0,0,0,0|0,0,0]=1 1161 B12R1.30 CSCOC(=O)C1CCCCC1 62a_200000210301_100009893799 [0,1,0,0,0,0|0,0,0]=1 1162 B12R1.30 CSCOC(=O)N1CCOCC1 62a_100009898760_200000210301 [0,1,0,0,0,0|2,0,0]=3 1163 B12R1.30 CSCOC(=O)N1CCOCC1 62a_200000210301_100009898760 [0,1,0,0,0,0|2,0,0]=3 1164 B12R1.30 CSCOC(C)C1CCCCC1 34a_100011216961_100011218213 [0,1,0,0,0,0|1,0,1]=3 1165 B12R1.30 CSCOC(C)C1CCCNC1 34a_100000740858_100011218213 [0,1,0,0,0,0|2,0,1]=4 1166 B12R1.30 CSCOC(C)C1CCNCC1 34a_100011728446_100011218213 [0,1,0,0,0,0|2,0,1]=4 1167 B12R1.30 CSCO[C@H](C)C1CCOCC1 34a_100000703848_100011218213 [0,1,0,0,0,0|2,0,1]=4 1168 B12R1.30 C[C@@H](NCCF)C1CCCCC1 2230a_100025707633_100011217306 [0,1,0,0,0,0|2,0,1]=4 1169 B12R1.30 C[C@@H](NCCF)C1CCCCC1 34a_100025707633_100011217306 [0,1,0,0,0,0|2,0,1]=4 1170 B12R1.30 C[C@@H](NCCO)C1CCCCC1 2230a_100025707633_100000211926 [0,1,0,0,0,0|2,0,1]=4 1171 B12R1.30 C[C@@H](NCCO)C1CCCCC1 34a_100025707633_100000211926 [0,1,0,0,0,0|2,0,1]=4 1172 B12R1.30 C[C@@H](OCCF)C1CCOCC1 34a_100000703848_100011217306 [0,1,0,0,0,0|2,0,1]=4 1173 B12R1.30 C[C@@H](OCCF)C1CCOCC1 7a_100000703848_100011217306 [0,1,0,0,0,0|2,0,1]=4 1174 B12R1.30 C[C@@H](OCCO)C1CCOCC1 34a_100000703848_100000211926 [0,1,0,0,0,0|2,0,1]=4 1175 B12R1.30 C[C@@H](OCCO)C1CCOCC1 7a_100000703848_100000211926 [0,1,0,0,0,0|2,0,1]=4 1176 B12R1.30 N#CCCC(=O)C1CCCCC1 1458a_100000210647_100011215226 [0,1,0,0,0,0|1,0,1]=3 1177 B12R1.30 N#CCCC(=O)C1CCCCC1 1458a_100011934036_100000210327 [0,1,0,0,0,0|1,0,1]=3 1178 B12R1.30 N#CCCC(=O)C1CCCCO1 1458a_100000748299_100011215226 [0,1,0,0,0,0|2,0,1]=4 1179 B12R1.30 N#CCCC(=O)C1CCCOC1 1458a_100000741522_100011215226 [0,1,0,0,0,0|2,0,1]=4 1180 B12R1.30 N#CCCC(=O)C1CCCOC1 1458a_100011934036_100000693364 [0,1,0,0,0,0|2,0,1]=4 1181 B12R1.30 N#CCCC(=O)C1CCOCC1 1458a_100000195482_100011215226 [0,1,0,0,0,0|2,0,1]=4 1182 B12R1.30 N#CCCC(=O)C1CCOCC1 1458a_100011934036_100011324220 [0,1,0,0,0,0|2,0,1]=4 1183 B12R1.30 N#CCCC(=O)C1CCSCC1 1458a_100000755232_100011215226 [0,1,0,0,0,0|2,0,1]=4 1184 B12R1.30 N#CCNC(=O)C1CCCCC1 1626a_100000734998_100000210647 [0,1,0,0,0,0|1,0,1]=3 1185 B12R1.30 N#CCNC(=O)C1CCCCC1 527a_100000734998_100000210647 [0,1,0,0,0,0|1,0,1]=3 1186 B12R1.30 N#CCNC(=O)C1CCCCO1 1626a_100000734998_100000748299 [0,1,0,0,0,0|2,0,1]=4 1187 B12R1.30 N#CCNC(=O)C1CCCCO1 527a_100000734998_100000748299 [0,1,0,0,0,0|2,0,1]=4 1188 B12R1.30 N#CCNC(=O)C1CCCOC1 1626a_100000734998_100000741522 [0,1,0,0,0,0|2,0,1]=4 1189 B12R1.30 N#CCNC(=O)C1CCCOC1 527a_100000734998_100000741522 [0,1,0,0,0,0|2,0,1]=4 1190 B12R1.30 N#CCNC(=O)C1CCOCC1 1626a_100000734998_100000195482 [0,1,0,0,0,0|2,0,1]=4 1191 B12R1.30 N#CCNC(=O)C1CCOCC1 527a_100000734998_100000195482 [0,1,0,0,0,0|2,0,1]=4 1192 B12R1.30 N#CCNC(=O)C1CCSCC1 1626a_100000734998_100000755232 [0,1,0,0,0,0|2,0,1]=4 1193 B12R1.30 N#CCNC(=O)C1CCSCC1 527a_100000734998_100000755232 [0,1,0,0,0,0|2,0,1]=4 1194 B12R1.30 N[C@@H](COCF)C1CCCCC1 34a_100009817630_100015361967 [0,1,0,0,0,0|2,0,1]=4 1195 B12R1.30 O=C(C#CCO)C1CCCCC1 1458a_100000049017_100000210327 [0,1,0,0,0,0|1,0,1]=3 1196 B12R1.30 O=C(C#CCO)C1CCCOC1 1458a_100000049017_100000693364 [0,1,0,0,0,0|2,0,1]=4 1197 B12R1.30 O=C(C#CCO)C1CCOCC1 1458a_100000049017_100011324220 [0,1,0,0,0,0|2,0,1]=4 1198 B12R1.30 O=C(CCCF)C1=CCCCC1 1458a_100000765259_100011934791 [0,1,0,0,0,0|1,0,2]=4 1199 B12R1.30 O=C(CCCF)C1CCCCC1 1458a_100000210647_100011934791 [0,1,0,0,0,0|1,0,0]=2 1200 B12R1.30 O=C(CCCF)C1CCCCO1 1458a_100000748299_100011934791 [0,1,0,0,0,0|2,0,0]=3 1201 B12R1.30 O=C(CCCF)C1CCCOC1 1458a_100000741522_100011934791 [0,1,0,0,0,0|2,0,0]=3 1202 B12R1.30 O=C(CCCF)C1CCOCC1 1458a_100000195482_100011934791 [0,1,0,0,0,0|2,0,0]=3 1203 B12R1.30 O=C(CCCF)C1CCSCC1 1458a_100000755232_100011934791 [0,1,0,0,0,0|2,0,0]=3 1204 B12R1.30 O=C(CCCF)C1COCCO1 1458a_100000045528_100011934791 [0,1,0,0,0,0|3,0,0]=4 1205 B12R1.30 O=C(CCCF)C1SCCCS1 1458a_100000028545_100011934791 [0,1,0,0,0,0|3,0,0]=4 1206 B12R1.30 O=C(CCCF)[C@H]1CC=CCC1 1458a_100009820709_100011934791 [0,1,0,0,0,0|1,0,2]=4 1207 B12R1.30 O=C(CCCO)C1=CCCCC1 1458a_100000765259_100011215043 [0,1,0,0,0,0|1,0,2]=4 1208 B12R1.30 O=C(CCCO)C1CCCCC1 1458a_100000210647_100011215043 [0,1,0,0,0,0|1,0,0]=2 1209 B12R1.30 O=C(CCCO)C1CCCCO1 1458a_100000748299_100011215043 [0,1,0,0,0,0|2,0,0]=3 1210 B12R1.30 O=C(CCCO)C1CCCOC1 1458a_100000741522_100011215043 [0,1,0,0,0,0|2,0,0]=3 1211 B12R1.30 O=C(CCCO)C1CCOCC1 1458a_100000195482_100011215043 [0,1,0,0,0,0|2,0,0]=3 1212 B12R1.30 O=C(CCCO)C1CCSCC1 1458a_100000755232_100011215043 [0,1,0,0,0,0|2,0,0]=3 1213 B12R1.30 O=C(CCCO)C1COCCO1 1458a_100000045528_100011215043 [0,1,0,0,0,0|3,0,0]=4 1214 B12R1.30 O=C(CCCO)C1SCCCS1 1458a_100000028545_100011215043 [0,1,0,0,0,0|3,0,0]=4 1215 B12R1.30 O=C(CCCO)[C@H]1CC=CCC1 1458a_100009820709_100011215043 [0,1,0,0,0,0|1,0,2]=4 1216 B12R1.30 O=C(COCF)N1CCCCC1 7a_100011315646_100015361967 [0,1,0,0,0,0|2,0,0]=3 1217 B12R1.30 O=C(COCF)N1CCOCC1 7a_100000752472_100015361967 [0,1,0,0,0,0|3,0,0]=4 1218 B12R1.30 O=C(CSCF)C1CCCCC1 62a_100000241979_100015361967 [0,1,0,0,0,0|1,1,0]=3 1219 B12R1.30 O=C(CSCF)C1CCCCC1 62a_100015361967_100000241979 [0,1,0,0,0,0|1,1,0]=3 1220 B12R1.30 O=C(CSCF)C1CCOCC1 62a_100000689883_100015361967 [0,1,0,0,0,0|2,1,0]=4 1221 B12R1.30 O=C(CSCF)C1CCOCC1 62a_100015361967_100000689883 [0,1,0,0,0,0|2,1,0]=4 1222 B12R1.30 O=C(CSCF)N1CCCCC1 62a_100000183409_100015361967 [0,1,0,0,0,0|2,1,0]=4 1223 B12R1.30 O=C(CSCF)N1CCCCC1 62a_100015361967_100000183409 [0,1,0,0,0,0|2,1,0]=4 1224 B12R1.30 O=C(NCCF)C1=CCCCC1 11a_100000724931_100000765259 [0,1,0,0,0,0|1,0,2]=4 1225 B12R1.30 O=C(NCCF)C1=CCCCC1 1626a_100000724931_100000765259 [0,1,0,0,0,0|1,0,2]=4 1226 B12R1.30 O=C(NCCF)C1=CCCCC1 240690a_100000724931_100000765259 [0,1,0,0,0,0|1,0,2]=4 1227 B12R1.30 O=C(NCCF)C1=CCCCC1 527a_100000724931_100000765259 [0,1,0,0,0,0|1,0,2]=4 1228 B12R1.30 O=C(NCCF)C1CCCCC1 11a_100000724931_100000210647 [0,1,0,0,0,0|1,0,0]=2 1229 B12R1.30 O=C(NCCF)C1CCCCC1 1626a_100000724931_100000210647 [0,1,0,0,0,0|1,0,0]=2 1230 B12R1.30 O=C(NCCF)C1CCCCC1 240690a_100000724931_100000210647 [0,1,0,0,0,0|1,0,0]=2 1231 B12R1.30 O=C(NCCF)C1CCCCC1 527a_100000724931_100000210647 [0,1,0,0,0,0|1,0,0]=2 1232 B12R1.30 O=C(NCCF)C1CCCCO1 11a_100000724931_100000748299 [0,1,0,0,0,0|2,0,0]=3 1233 B12R1.30 O=C(NCCF)C1CCCCO1 1626a_100000724931_100000748299 [0,1,0,0,0,0|2,0,0]=3 1234 B12R1.30 O=C(NCCF)C1CCCCO1 240690a_100000724931_100000748299 [0,1,0,0,0,0|2,0,0]=3 1235 B12R1.30 O=C(NCCF)C1CCCCO1 527a_100000724931_100000748299 [0,1,0,0,0,0|2,0,0]=3 1236 B12R1.30 O=C(NCCF)C1CCCOC1 11a_100000724931_100000741522 [0,1,0,0,0,0|2,0,0]=3 1237 B12R1.30 O=C(NCCF)C1CCCOC1 1626a_100000724931_100000741522 [0,1,0,0,0,0|2,0,0]=3 1238 B12R1.30 O=C(NCCF)C1CCCOC1 240690a_100000724931_100000741522 [0,1,0,0,0,0|2,0,0]=3 1239 B12R1.30 O=C(NCCF)C1CCCOC1 527a_100000724931_100000741522 [0,1,0,0,0,0|2,0,0]=3 1240 B12R1.30 O=C(NCCF)C1CCOCC1 11a_100000724931_100000195482 [0,1,0,0,0,0|2,0,0]=3 1241 B12R1.30 O=C(NCCF)C1CCOCC1 1626a_100000724931_100000195482 [0,1,0,0,0,0|2,0,0]=3 1242 B12R1.30 O=C(NCCF)C1CCOCC1 240690a_100000724931_100000195482 [0,1,0,0,0,0|2,0,0]=3 1243 B12R1.30 O=C(NCCF)C1CCOCC1 527a_100000724931_100000195482 [0,1,0,0,0,0|2,0,0]=3 1244 B12R1.30 O=C(NCCF)C1CCSCC1 11a_100000724931_100000755232 [0,1,0,0,0,0|2,0,0]=3 1245 B12R1.30 O=C(NCCF)C1CCSCC1 1626a_100000724931_100000755232 [0,1,0,0,0,0|2,0,0]=3 1246 B12R1.30 O=C(NCCF)C1CCSCC1 240690a_100000724931_100000755232 [0,1,0,0,0,0|2,0,0]=3 1247 B12R1.30 O=C(NCCF)C1CCSCC1 527a_100000724931_100000755232 [0,1,0,0,0,0|2,0,0]=3 1248 B12R1.30 O=C(NCCF)C1COCCO1 11a_100000724931_100000045528 [0,1,0,0,0,0|3,0,0]=4 1249 B12R1.30 O=C(NCCF)C1COCCO1 1626a_100000724931_100000045528 [0,1,0,0,0,0|3,0,0]=4 1250 B12R1.30 O=C(NCCF)C1COCCO1 240690a_100000724931_100000045528 [0,1,0,0,0,0|3,0,0]=4 1251 B12R1.30 O=C(NCCF)C1COCCO1 527a_100000724931_100000045528 [0,1,0,0,0,0|3,0,0]=4 1252 B12R1.30 O=C(NCCF)C1SCCCS1 11a_100000724931_100000028545 [0,1,0,0,0,0|3,0,0]=4 1253 B12R1.30 O=C(NCCF)C1SCCCS1 1626a_100000724931_100000028545 [0,1,0,0,0,0|3,0,0]=4 1254 B12R1.30 O=C(NCCF)C1SCCCS1 240690a_100000724931_100000028545 [0,1,0,0,0,0|3,0,0]=4 1255 B12R1.30 O=C(NCCF)C1SCCCS1 527a_100000724931_100000028545 [0,1,0,0,0,0|3,0,0]=4 1256 B12R1.30 O=C(NCCF)N1CCCOC1 273464a_100000724931_100000131196 [0,1,0,0,0,0|3,0,0]=4 1257 B12R1.30 O=C(NCCF)N1CCOCC1 273464a_100000724931_100015191051 [0,1,0,0,0,0|3,0,0]=4 1258 B12R1.30 O=C(NCCF)N1CCSCC1 273464a_100000724931_100000737611 [0,1,0,0,0,0|3,0,0]=4 1259 B12R1.30 O=C(NCCF)[C@H]1CC=CCC1 11a_100000724931_100009820709 [0,1,0,0,0,0|1,0,2]=4 1260 B12R1.30 O=C(NCCF)[C@H]1CC=CCC1 1626a_100000724931_100009820709 [0,1,0,0,0,0|1,0,2]=4 1261 B12R1.30 O=C(NCCF)[C@H]1CC=CCC1 240690a_100000724931_100009820709 [0,1,0,0,0,0|1,0,2]=4 1262 B12R1.30 O=C(NCCF)[C@H]1CC=CCC1 527a_100000724931_100009820709 [0,1,0,0,0,0|1,0,2]=4 1263 B12R1.30 O=C(NCCO)C1=CCCCC1 240690a_100000210304_100000765259 [0,1,0,0,0,0|1,0,2]=4 1264 B12R1.30 O=C(NCCO)C1=CCCCC1 527a_100000210304_100000765259 [0,1,0,0,0,0|1,0,2]=4 1265 B12R1.30 O=C(NCCO)C1CCCCC1 240690a_100000210304_100000210647 [0,1,0,0,0,0|1,0,0]=2 1266 B12R1.30 O=C(NCCO)C1CCCCC1 527a_100000210304_100000210647 [0,1,0,0,0,0|1,0,0]=2 1267 B12R1.30 O=C(NCCO)C1CCCCO1 240690a_100000210304_100000748299 [0,1,0,0,0,0|2,0,0]=3 1268 B12R1.30 O=C(NCCO)C1CCCCO1 527a_100000210304_100000748299 [0,1,0,0,0,0|2,0,0]=3 1269 B12R1.30 O=C(NCCO)C1CCCOC1 240690a_100000210304_100000741522 [0,1,0,0,0,0|2,0,0]=3 1270 B12R1.30 O=C(NCCO)C1CCCOC1 527a_100000210304_100000741522 [0,1,0,0,0,0|2,0,0]=3 1271 B12R1.30 O=C(NCCO)C1CCOCC1 240690a_100000210304_100000195482 [0,1,0,0,0,0|2,0,0]=3 1272 B12R1.30 O=C(NCCO)C1CCOCC1 527a_100000210304_100000195482 [0,1,0,0,0,0|2,0,0]=3 1273 B12R1.30 O=C(NCCO)C1CCSCC1 240690a_100000210304_100000755232 [0,1,0,0,0,0|2,0,0]=3 1274 B12R1.30 O=C(NCCO)C1CCSCC1 527a_100000210304_100000755232 [0,1,0,0,0,0|2,0,0]=3 1275 B12R1.30 O=C(NCCO)C1COCCO1 240690a_100000210304_100000045528 [0,1,0,0,0,0|3,0,0]=4 1276 B12R1.30 O=C(NCCO)C1COCCO1 527a_100000210304_100000045528 [0,1,0,0,0,0|3,0,0]=4 1277 B12R1.30 O=C(NCCO)C1SCCCS1 240690a_100000210304_100000028545 [0,1,0,0,0,0|3,0,0]=4 1278 B12R1.30 O=C(NCCO)C1SCCCS1 527a_100000210304_100000028545 [0,1,0,0,0,0|3,0,0]=4 1279 B12R1.30 O=C(NCCO)N1CCCOC1 273464a_100000210304_100000131196 [0,1,0,0,0,0|3,0,0]=4 1280 B12R1.30 O=C(NCCO)N1CCOCC1 273464a_100000210304_100015191051 [0,1,0,0,0,0|3,0,0]=4 1281 B12R1.30 O=C(NCCO)N1CCSCC1 273464a_100000210304_100000737611 [0,1,0,0,0,0|3,0,0]=4 1282 B12R1.30 O=C(NCCO)[C@H]1CC=CCC1 240690a_100000210304_100009820709 [0,1,0,0,0,0|1,0,2]=4 1283 B12R1.30 O=C(NCCO)[C@H]1CC=CCC1 527a_100000210304_100009820709 [0,1,0,0,0,0|1,0,2]=4 1284 B12R1.30 [13CH3]NCCC(=O)N1CCOCC1 2230a_100000735667_200025704644 [0,1,0,0,0,0|3,0,0]=4 1285 B12R1.30 [13CH3]OCCC(N)C1CCCCC1 34a_200020622111_200025704644 [0,1,0,0,0,0|2,0,1]=4 1286 B12R1.30 [13CH3]SCCC(=O)N1CCCCC1 62a_100102558178_200025704644 [0,1,0,0,0,0|2,0,0]=3 1287 B12R1.30 [13CH3]SCCC(=O)N1CCCCC1 62a_200025704644_100102558178 [0,1,0,0,0,0|2,0,0]=3 1288 B12R1.30 [13CH3]SCCC(=O)N1CCOCC1 62a_100000739706_200025704644 [0,1,0,0,0,0|3,0,0]=4 1289 B12R1.30 [13CH3]SCCC(=O)N1CCOCC1 62a_200025704644_100000739706 [0,1,0,0,0,0|3,0,0]=4 1290 B12R1.30 [13CH3]SCOC(=O)C1CCCCC1 62a_100009893799_200025704644 [0,1,0,0,0,0|0,0,0]=1 1291 B12R1.30 [13CH3]SCOC(=O)C1CCCCC1 62a_200025704644_100009893799 [0,1,0,0,0,0|0,0,0]=1 1292 B12R1.30 [13CH3]SCOC(=O)N1CCOCC1 62a_100009898760_200025704644 [0,1,0,0,0,0|2,0,0]=3 1293 B12R1.30 [13CH3]SCOC(=O)N1CCOCC1 62a_200025704644_100009898760 [0,1,0,0,0,0|2,0,0]=3 1294 B12R1.34 C#CC(C)C(=O)C1CCCCC1 1458a_100000210647_200000035995 [0,1,0,0,0,0|1,0,2]=4 1295 B12R1.34 C/C=C(\C)/C(=O)C1CCCCC1 1458a_100020587367_100000210327 [0,1,0,0,0,0|1,0,1]=3 1296 B12R1.34 C/C=C(\C)/C(=O)C1CCCOC1 1458a_100020587367_100000693364 [0,1,0,0,0,0|2,0,1]=4 1297 B12R1.34 C/C=C(\C)/C(=O)C1CCOCC1 1458a_100020587367_100011324220 [0,1,0,0,0,0|2,0,1]=4 1298 B12R1.34 C=CC(C)C(=O)C1CCCCC1 1458a_100011216780_100000210327 [0,1,0,0,0,0|1,0,2]=4 1299 B12R1.34 CC(C#N)C(=O)C1CCCCC1 1458a_100000210647_100000703298 [0,1,0,0,0,0|2,0,1]=4 1300 B12R1.34 CC(C#N)C(=O)C1CCCCC1 1458a_100000753662_100000210327 [0,1,0,0,0,0|2,0,1]=4 1301 B12R1.34 CC(S[13CH3])C(=O)N1CCCCC1 62a_100000183932_200025704644 [0,1,0,0,0,0|3,0,0]=4 1302 B12R1.34 CC(S[13CH3])C(=O)N1CCCCC1 62a_200025704644_100000183932 [0,1,0,0,0,0|3,0,0]=4 1303 B12R1.34 CCC(=O)C(=O)N1CCCCC1 1458a_200011297168_100000210202 [0,1,0,0,0,0|2,0,0]=3 1304 B12R1.34 CCC(=O)C(C)C1CCCCC1 1458a_100011435303_100000210202 [0,1,0,0,0,0|2,0,1]=4 1305 B12R1.34 CCC(=O)C(O)C1CCCCC1 1458a_100000242593_100000210202 [0,1,0,0,0,0|1,0,2]=4 1306 B12R1.34 CCC(=O)N(C)C1CCCCC1 11a_100000207522_100000210414 [0,1,0,0,0,0|3,0,0]=4 1307 B12R1.34 CCC(=O)N(C)C1CCCCC1 1626a_100000207522_100000210414 [0,1,0,0,0,0|3,0,0]=4 1308 B12R1.34 CCC(=O)N(C)C1CCCCC1 240690a_100000207522_100000210414 [0,1,0,0,0,0|3,0,0]=4 1309 B12R1.34 CCC(=O)N(C)C1CCCCC1 527a_100000207522_100000210414 [0,1,0,0,0,0|3,0,0]=4 1310 B12R1.34 CCC(C)C(=O)C1=CCCCC1 1458a_100000765259_100000758301 [0,1,0,0,0,0|1,0,2]=4 1311 B12R1.34 CCC(C)C(=O)C1C=CCCC1 1458a_100011192722_100000751183 [0,1,0,0,0,0|1,0,2]=4 1312 B12R1.34 CCC(C)C(=O)C1CCCCC1 1458a_100000210647_100000758301 [0,1,0,0,0,0|1,0,0]=2 1313 B12R1.34 CCC(C)C(=O)C1CCCCC1 1458a_100011192722_100000210327 [0,1,0,0,0,0|1,0,0]=2 1314 B12R1.34 CCC(C)C(=O)C1CCCCO1 1458a_100000748299_100000758301 [0,1,0,0,0,0|2,0,0]=3 1315 B12R1.34 CCC(C)C(=O)C1CCCOC1 1458a_100000741522_100000758301 [0,1,0,0,0,0|2,0,0]=3 1316 B12R1.34 CCC(C)C(=O)C1CCCOC1 1458a_100011192722_100000693364 [0,1,0,0,0,0|2,0,0]=3 1317 B12R1.34 CCC(C)C(=O)C1CCOCC1 1458a_100000195482_100000758301 [0,1,0,0,0,0|2,0,0]=3 1318 B12R1.34 CCC(C)C(=O)C1CCOCC1 1458a_100011192722_100011324220 [0,1,0,0,0,0|2,0,0]=3 1319 B12R1.34 CCC(C)C(=O)C1CCSCC1 1458a_100000755232_100000758301 [0,1,0,0,0,0|2,0,0]=3 1320 B12R1.34 CCC(C)C(=O)C1COCCO1 1458a_100000045528_100000758301 [0,1,0,0,0,0|3,0,0]=4 1321 B12R1.34 CCC(C)C(=O)C1SCCCS1 1458a_100000028545_100000758301 [0,1,0,0,0,0|3,0,0]=4 1322 B12R1.34 CCC(C)C(=O)N1CCCOC1 11a_100000131196_100011192722 [0,1,0,0,0,0|3,0,0]=4 1323 B12R1.34 CCC(C)C(=O)N1CCCOC1 240690a_100000131196_100011192722 [0,1,0,0,0,0|3,0,0]=4 1324 B12R1.34 CCC(C)C(=O)N1CCOCC1 11a_100015191051_100011192722 [0,1,0,0,0,0|3,0,0]=4 1325 B12R1.34 CCC(C)C(=O)N1CCOCC1 1626a_100015191051_100011192722 [0,1,0,0,0,0|3,0,0]=4 1326 B12R1.34 CCC(C)C(=O)N1CCOCC1 240690a_100015191051_100011192722 [0,1,0,0,0,0|3,0,0]=4 1327 B12R1.34 CCC(C)C(=O)N1CCOCC1 527a_100015191051_100011192722 [0,1,0,0,0,0|3,0,0]=4 1328 B12R1.34 CCC(C)C(=O)N1CCSCC1 11a_100000737611_100011192722 [0,1,0,0,0,0|3,0,0]=4 1329 B12R1.34 CCC(C)C(=O)N1CCSCC1 240690a_100000737611_100011192722 [0,1,0,0,0,0|3,0,0]=4 1330 B12R1.34 CCC(C)C(=O)N1CCSCC1 527a_100000737611_100011192722 [0,1,0,0,0,0|3,0,0]=4 1331 B12R1.34 CCC(C)C(=O)[C@H]1CC=CCC1 1458a_100009820709_100000758301 [0,1,0,0,0,0|1,0,2]=4 1332 B12R1.34 CCC(C)N(C)C1CCCCC1 2230a_100000207522_100000758301 [0,1,0,0,0,0|3,0,0]=4 1333 B12R1.34 CCC(C)N(C)C1CCCCC1 269982a_100000207522_100000758301 [0,1,0,0,0,0|3,0,0]=4 1334 B12R1.34 CCC(C)N(C)C1CCCCC1 269982a_100000741768_100000210327 [0,1,0,0,0,0|3,0,0]=4 1335 B12R1.34 CCC(C)N(C)C1CCCCC1 270004a_100000741768_100000210434 [0,1,0,0,0,0|3,0,0]=4 1336 B12R1.34 CCC(C)N(C)C1CCCCC1 34a_100000207522_100011215416 [0,1,0,0,0,0|3,0,0]=4 1337 B12R1.34 CCC(O)C(=O)C1C=CCCC1 1458a_100011196387_100000751183 [0,1,0,0,0,0|1,0,2]=4 1338 B12R1.34 CCC(O)C(=O)C1CCCCC1 1458a_100011196387_100000210327 [0,1,0,0,0,0|1,0,0]=2 1339 B12R1.34 CCC(O)C(=O)C1CCCOC1 1458a_100011196387_100000693364 [0,1,0,0,0,0|2,0,0]=3 1340 B12R1.34 CCC(O)C(=O)C1CCOCC1 1458a_100011196387_100011324220 [0,1,0,0,0,0|2,0,0]=3 1341 B12R1.34 CCC(O)C(=O)N1CCCOC1 240690a_100000131196_100011196387 [0,1,0,0,0,0|3,0,0]=4 1342 B12R1.34 CCC(O)C(=O)N1CCOCC1 240690a_100015191051_100011196387 [0,1,0,0,0,0|3,0,0]=4 1343 B12R1.34 CCC(O)C(=O)N1CCSCC1 240690a_100000737611_100011196387 [0,1,0,0,0,0|3,0,0]=4 1344 B12R1.34 CCN(C)C(=O)C1=CCCCC1 11a_100000225621_100000765259 [0,1,0,0,0,0|1,0,2]=4 1345 B12R1.34 CCN(C)C(=O)C1=CCCCC1 1626a_100000225621_100000765259 [0,1,0,0,0,0|1,0,2]=4 1346 B12R1.34 CCN(C)C(=O)C1=CCCCC1 240690a_100000225621_100000765259 [0,1,0,0,0,0|1,0,2]=4 1347 B12R1.34 CCN(C)C(=O)C1=CCCCC1 527a_100000225621_100000765259 [0,1,0,0,0,0|1,0,2]=4 1348 B12R1.34 CCN(C)C(=O)C1CCCCC1 11a_100000225621_100000210647 [0,1,0,0,0,0|1,0,0]=2 1349 B12R1.34 CCN(C)C(=O)C1CCCCC1 1626a_100000225621_100000210647 [0,1,0,0,0,0|1,0,0]=2 1350 B12R1.34 CCN(C)C(=O)C1CCCCC1 240690a_100000225621_100000210647 [0,1,0,0,0,0|1,0,0]=2 1351 B12R1.34 CCN(C)C(=O)C1CCCCC1 527a_100000225621_100000210647 [0,1,0,0,0,0|1,0,0]=2 1352 B12R1.34 CCN(C)C(=O)C1CCCCO1 11a_100000225621_100000748299 [0,1,0,0,0,0|2,0,0]=3 1353 B12R1.34 CCN(C)C(=O)C1CCCCO1 1626a_100000225621_100000748299 [0,1,0,0,0,0|2,0,0]=3 1354 B12R1.34 CCN(C)C(=O)C1CCCCO1 240690a_100000225621_100000748299 [0,1,0,0,0,0|2,0,0]=3 1355 B12R1.34 CCN(C)C(=O)C1CCCCO1 527a_100000225621_100000748299 [0,1,0,0,0,0|2,0,0]=3 1356 B12R1.34 CCN(C)C(=O)C1CCCOC1 11a_100000225621_100000741522 [0,1,0,0,0,0|2,0,0]=3 1357 B12R1.34 CCN(C)C(=O)C1CCCOC1 1626a_100000225621_100000741522 [0,1,0,0,0,0|2,0,0]=3 1358 B12R1.34 CCN(C)C(=O)C1CCCOC1 240690a_100000225621_100000741522 [0,1,0,0,0,0|2,0,0]=3 1359 B12R1.34 CCN(C)C(=O)C1CCCOC1 527a_100000225621_100000741522 [0,1,0,0,0,0|2,0,0]=3 1360 B12R1.34 CCN(C)C(=O)C1CCOCC1 11a_100000225621_100000195482 [0,1,0,0,0,0|2,0,0]=3 1361 B12R1.34 CCN(C)C(=O)C1CCOCC1 1626a_100000225621_100000195482 [0,1,0,0,0,0|2,0,0]=3 1362 B12R1.34 CCN(C)C(=O)C1CCOCC1 240690a_100000225621_100000195482 [0,1,0,0,0,0|2,0,0]=3 1363 B12R1.34 CCN(C)C(=O)C1CCOCC1 527a_100000225621_100000195482 [0,1,0,0,0,0|2,0,0]=3 1364 B12R1.34 CCN(C)C(=O)C1CCSCC1 11a_100000225621_100000755232 [0,1,0,0,0,0|2,0,0]=3 1365 B12R1.34 CCN(C)C(=O)C1CCSCC1 1626a_100000225621_100000755232 [0,1,0,0,0,0|2,0,0]=3 1366 B12R1.34 CCN(C)C(=O)C1CCSCC1 240690a_100000225621_100000755232 [0,1,0,0,0,0|2,0,0]=3 1367 B12R1.34 CCN(C)C(=O)C1CCSCC1 527a_100000225621_100000755232 [0,1,0,0,0,0|2,0,0]=3 1368 B12R1.34 CCN(C)C(=O)C1COCCO1 11a_100000225621_100000045528 [0,1,0,0,0,0|3,0,0]=4 1369 B12R1.34 CCN(C)C(=O)C1COCCO1 1626a_100000225621_100000045528 [0,1,0,0,0,0|3,0,0]=4 1370 B12R1.34 CCN(C)C(=O)C1COCCO1 240690a_100000225621_100000045528 [0,1,0,0,0,0|3,0,0]=4 1371 B12R1.34 CCN(C)C(=O)C1COCCO1 527a_100000225621_100000045528 [0,1,0,0,0,0|3,0,0]=4 1372 B12R1.34 CCN(C)C(=O)C1SCCCS1 11a_100000225621_100000028545 [0,1,0,0,0,0|3,0,0]=4 1373 B12R1.34 CCN(C)C(=O)C1SCCCS1 1626a_100000225621_100000028545 [0,1,0,0,0,0|3,0,0]=4 1374 B12R1.34 CCN(C)C(=O)C1SCCCS1 240690a_100000225621_100000028545 [0,1,0,0,0,0|3,0,0]=4 1375 B12R1.34 CCN(C)C(=O)C1SCCCS1 527a_100000225621_100000028545 [0,1,0,0,0,0|3,0,0]=4 1376 B12R1.34 CCN(C)C(=O)[C@H]1CC=CCC1 11a_100000225621_100009820709 [0,1,0,0,0,0|1,0,2]=4 1377 B12R1.34 CCN(C)C(=O)[C@H]1CC=CCC1 1626a_100000225621_100009820709 [0,1,0,0,0,0|1,0,2]=4 1378 B12R1.34 CCN(C)C(=O)[C@H]1CC=CCC1 240690a_100000225621_100009820709 [0,1,0,0,0,0|1,0,2]=4 1379 B12R1.34 CCN(C)C(=O)[C@H]1CC=CCC1 527a_100000225621_100009820709 [0,1,0,0,0,0|1,0,2]=4 1380 B12R1.34 CNC(=O)C(=O)C1CCCCC1 1458a_100011218921_100000210327 [0,1,0,0,0,0|2,0,0]=3 1381 B12R1.34 CNC(=O)C(=O)C1CCCOC1 1458a_100011218921_100000693364 [0,1,0,0,0,0|3,0,0]=4 1382 B12R1.34 CNC(=O)C(=O)C1CCOCC1 1458a_100011218921_100011324220 [0,1,0,0,0,0|3,0,0]=4 1383 B12R1.34 CNC(=O)C(=O)N1CCCCC1 1626a_100102657272_200011297168 [0,1,0,0,0,0|3,0,0]=4 1384 B12R1.34 CNC(=O)C(=O)N1CCCCC1 240690a_100102657272_200011297168 [0,1,0,0,0,0|3,0,0]=4 1385 B12R1.34 CNC(=O)C(=O)N1CCCCC1 527a_100102657272_200011297168 [0,1,0,0,0,0|3,0,0]=4 1386 B12R1.34 CNC(C)C(=O)N1CCCCC1 2230a_106832991635_100000183932 [0,1,0,0,0,0|3,0,0]=4 1387 B12R1.34 CNC(C)C(=O)N1CCCCC1 7a_106832991635_100000183932 [0,1,0,0,0,0|3,0,0]=4 1388 B12R1.34 CN[C@H](C)C(=O)N1CCCCC1 2230a_100138413195_200000210301 [0,1,0,0,0,0|3,0,0]=4 1389 B12R1.34 CN[C@H](C)C(=O)N1CCCCC1 34a_100138413195_200000210301 [0,1,0,0,0,0|3,0,0]=4 1390 B12R1.34 COC(C)C(=O)C1CCCCC1 1458a_100000743197_100000210327 [0,1,0,0,0,0|2,0,0]=3 1391 B12R1.34 COC(C)C(=O)C1CCCOC1 1458a_100000743197_100000693364 [0,1,0,0,0,0|3,0,0]=4 1392 B12R1.34 COC(C)C(=O)C1CCOCC1 1458a_100000743197_100011324220 [0,1,0,0,0,0|3,0,0]=4 1393 B12R1.34 CSC(C)C(=O)C1CCCCC1 1458a_100000149566_100000210327 [0,1,0,0,0,0|2,0,0]=3 1394 B12R1.34 CSC(C)C(=O)C1CCCOC1 1458a_100000149566_100000693364 [0,1,0,0,0,0|3,0,0]=4 1395 B12R1.34 CSC(C)C(=O)C1CCOCC1 1458a_100000149566_100011324220 [0,1,0,0,0,0|3,0,0]=4 1396 B12R1.34 CSC(C)C(=O)N1CCCCC1 62a_100000183932_200000210301 [0,1,0,0,0,0|3,0,0]=4 1397 B12R1.34 CSC(C)C(=O)N1CCCCC1 62a_200000210301_100000183932 [0,1,0,0,0,0|3,0,0]=4 1398 B12R1.34 C[C@@H](N[13CH3])C(=O)N1CCCCC1 2230a_100138413195_200025704644 [0,1,0,0,0,0|3,0,0]=4 1399 B12R1.34 C[C@@H](N[13CH3])C(=O)N1CCCCC1 34a_100138413195_200025704644 [0,1,0,0,0,0|3,0,0]=4 1400 B12R1.34 O=C(C(O)CO)C1CCCCC1 1458a_100011215603_100000210327 [0,1,0,0,0,0|2,0,0]=3 1401 B12R1.34 O=C(C(O)CO)C1CCCOC1 1458a_100011215603_100000693364 [0,1,0,0,0,0|3,0,0]=4 1402 B12R1.34 O=C(C(O)CO)C1CCOCC1 1458a_100011215603_100011324220 [0,1,0,0,0,0|3,0,0]=4 1403 B12R1.34 O=C(CF)C(=O)N1CCCCC1 1458a_200011297168_100015361967 [0,1,0,0,0,0|3,0,0]=4 1404 B12R1.39 CCNS(=O)(=O)C1CCCCC1 270084a_100015525214_100011219266 [0,1,0,0,0,0|2,0,0]=3 1405 B12R1.39 CCNS(=O)(=O)C1CCCCC1 274078a_100015525214_100011219266 [0,1,0,0,0,0|2,0,0]=3 1406 B12R1.39 CCNS(=O)(=O)C1CCOCC1 270084a_100015525214_100000747050 [0,1,0,0,0,0|3,0,0]=4 1407 B12R1.39 CCNS(=O)(=O)C1CCOCC1 274078a_100015525214_100000747050 [0,1,0,0,0,0|3,0,0]=4 1408 B12R1.39 CCOC(C)(C)C1CCNCC1 34a_100025784243_100000210202 [0,1,0,0,0,0|2,0,1]=4 1409 B12R1.107 C=C(C)CC(=O)C1CCCCC1 1458a_100000210647_100000748629 [0,1,0,0,0,0|1,0,1]=3 1410 B12R1.107 C=C(C)CC(=O)C1CCCCO1 1458a_100000748299_100000748629 [0,1,0,0,0,0|2,0,1]=4 1411 B12R1.107 C=C(C)CC(=O)C1CCCOC1 1458a_100000741522_100000748629 [0,1,0,0,0,0|2,0,1]=4 1412 B12R1.107 C=C(C)CC(=O)C1CCOCC1 1458a_100000195482_100000748629 [0,1,0,0,0,0|2,0,1]=4 1413 B12R1.107 C=C(C)CC(=O)C1CCSCC1 1458a_100000755232_100000748629 [0,1,0,0,0,0|2,0,1]=4 1414 B12R1.107 C=C(F)CC(=O)C1CCCCC1 1458a_100000210647_100009893438 [0,1,0,0,0,0|1,0,2]=4 1415 B12R1.107 CC(=CC(=O)C1CCCCC1)C 1458a_100000211388_100000210327 [0,1,0,0,0,0|1,0,1]=3 1416 B12R1.107 CC(=CC(=O)C1CCCCC1)Cl 1458a_200042562850_100000210327 [0,1,0,0,0,0|1,0,1]=3 1417 B12R1.107 CC(=CC(=O)C1CCCCC1)I 1458a_100025716642_100000210327 [0,1,0,0,0,0|1,0,1]=3 1418 B12R1.107 CC(=CC(=O)C1CCCOC1)C 1458a_100000211388_100000693364 [0,1,0,0,0,0|2,0,1]=4 1419 B12R1.107 CC(=CC(=O)C1CCCOC1)Cl 1458a_200042562850_100000693364 [0,1,0,0,0,0|2,0,1]=4 1420 B12R1.107 CC(=CC(=O)C1CCCOC1)I 1458a_100025716642_100000693364 [0,1,0,0,0,0|2,0,1]=4 1421 B12R1.107 CC(=CC(=O)C1CCOCC1)C 1458a_100000211388_100011324220 [0,1,0,0,0,0|2,0,1]=4 1422 B12R1.107 CC(=CC(=O)C1CCOCC1)Cl 1458a_200042562850_100011324220 [0,1,0,0,0,0|2,0,1]=4 1423 B12R1.107 CC(=CC(=O)C1CCOCC1)I 1458a_100025716642_100011324220 [0,1,0,0,0,0|2,0,1]=4 1424 B12R1.107 CC(=O)CC(=O)C1CCCCC1 1458a_100000070787_100000241979 [0,1,0,0,0,0|1,0,1]=3 1425 B12R1.107 CC(=O)CC(=O)C1CCOCC1 1458a_100000070787_100000689883 [0,1,0,0,0,0|2,0,1]=4 1426 B12R1.107 CC(=O)CC(=O)N1CCCCC1 1458a_100000070787_100000183409 [0,1,0,0,0,0|2,0,1]=4 1427 B12R1.107 CC(C)CC(=O)C1=CCCCC1 1458a_100000765259_100000210624 [0,1,0,0,0,0|1,0,2]=4 1428 B12R1.107 CC(C)CC(=O)C1C=CCCC1 1458a_100000210554_100000751183 [0,1,0,0,0,0|1,0,2]=4 1429 B12R1.107 CC(C)CC(=O)C1CCCCC1 1458a_100000210554_100000210327 [0,1,0,0,0,0|1,0,0]=2 1430 B12R1.107 CC(C)CC(=O)C1CCCCC1 1458a_100000210647_100000210624 [0,1,0,0,0,0|1,0,0]=2 1431 B12R1.107 CC(C)CC(=O)C1CCCCO1 1458a_100000748299_100000210624 [0,1,0,0,0,0|2,0,0]=3 1432 B12R1.107 CC(C)CC(=O)C1CCCOC1 1458a_100000210554_100000693364 [0,1,0,0,0,0|2,0,0]=3 1433 B12R1.107 CC(C)CC(=O)C1CCCOC1 1458a_100000741522_100000210624 [0,1,0,0,0,0|2,0,0]=3 1434 B12R1.107 CC(C)CC(=O)C1CCOCC1 1458a_100000195482_100000210624 [0,1,0,0,0,0|2,0,0]=3 1435 B12R1.107 CC(C)CC(=O)C1CCOCC1 1458a_100000210554_100011324220 [0,1,0,0,0,0|2,0,0]=3 1436 B12R1.107 CC(C)CC(=O)C1CCSCC1 1458a_100000755232_100000210624 [0,1,0,0,0,0|2,0,0]=3 1437 B12R1.107 CC(C)CC(=O)C1COCCO1 1458a_100000045528_100000210624 [0,1,0,0,0,0|3,0,0]=4 1438 B12R1.107 CC(C)CC(=O)C1SCCCS1 1458a_100000028545_100000210624 [0,1,0,0,0,0|3,0,0]=4 1439 B12R1.107 CC(C)CC(=O)N1CCCOC1 11a_100000131196_100000210554 [0,1,0,0,0,0|3,0,0]=4 1440 B12R1.107 CC(C)CC(=O)N1CCCOC1 240690a_100000131196_100000210554 [0,1,0,0,0,0|3,0,0]=4 1441 B12R1.107 CC(C)CC(=O)N1CCOCC1 11a_100015191051_100000210554 [0,1,0,0,0,0|3,0,0]=4 1442 B12R1.107 CC(C)CC(=O)N1CCOCC1 1626a_100015191051_100000210554 [0,1,0,0,0,0|3,0,0]=4 1443 B12R1.107 CC(C)CC(=O)N1CCOCC1 240690a_100015191051_100000210554 [0,1,0,0,0,0|3,0,0]=4 1444 B12R1.107 CC(C)CC(=O)N1CCOCC1 527a_100015191051_100000210554 [0,1,0,0,0,0|3,0,0]=4 1445 B12R1.107 CC(C)CC(=O)N1CCSCC1 11a_100000737611_100000210554 [0,1,0,0,0,0|3,0,0]=4 1446 B12R1.107 CC(C)CC(=O)N1CCSCC1 240690a_100000737611_100000210554 [0,1,0,0,0,0|3,0,0]=4 1447 B12R1.107 CC(C)CC(=O)N1CCSCC1 527a_100000737611_100000210554 [0,1,0,0,0,0|3,0,0]=4 1448 B12R1.107 CC(C)CC(=O)[C@H]1CC=CCC1 1458a_100009820709_100000210624 [0,1,0,0,0,0|1,0,2]=4 1449 B12R1.107 CC(C)CN(C)C1CCCCC1 2230a_100000207522_100000210760 [0,1,0,0,0,0|3,0,0]=4 1450 B12R1.107 CC(C)CN(C)C1CCCCC1 2230a_100015207052_200000210301 [0,1,0,0,0,0|3,0,0]=4 1451 B12R1.107 CC(C)CN(C)C1CCCCC1 269982a_100000207522_100000210624 [0,1,0,0,0,0|3,0,0]=4 1452 B12R1.107 CC(C)CN(C)C1CCCCC1 269982a_100000747067_100000210327 [0,1,0,0,0,0|3,0,0]=4 1453 B12R1.107 CC(C)CN(C)C1CCCCC1 269982a_100015207052_200000210301 [0,1,0,0,0,0|3,0,0]=4 1454 B12R1.107 CC(C)CN(C)C1CCCCC1 270004a_100000207522_100000210432 [0,1,0,0,0,0|3,0,0]=4 1455 B12R1.107 CC(C)CN(C)C1CCCCC1 270004a_100000747067_100000210434 [0,1,0,0,0,0|3,0,0]=4 1456 B12R1.107 CC(C)CN(C)C1CCCCC1 34a_100000207522_100000210624 [0,1,0,0,0,0|3,0,0]=4 1457 B12R1.107 CC(C)CN(C)C1CCCCC1 34a_100015207052_200000210301 [0,1,0,0,0,0|3,0,0]=4 1458 B12R1.107 CC(C)CN([13CH3])C1CCCCC1 2230a_100015207052_200025704644 [0,1,0,0,0,0|3,0,0]=4 1459 B12R1.107 CC(C)CN([13CH3])C1CCCCC1 269982a_100015207052_200025704644 [0,1,0,0,0,0|3,0,0]=4 1460 B12R1.107 CC(C)CN([13CH3])C1CCCCC1 34a_100015207052_200025704644 [0,1,0,0,0,0|3,0,0]=4 1461 B12R1.107 CC(C)NC(=O)C1=CCCCC1 11a_100138425928_100000765259 [0,1,0,0,0,0|1,0,2]=4 1462 B12R1.107 CC(C)NC(=O)C1=CCCCC1 1626a_100138425928_100000765259 [0,1,0,0,0,0|1,0,2]=4 1463 B12R1.107 CC(C)NC(=O)C1=CCCCC1 240690a_100138425928_100000765259 [0,1,0,0,0,0|1,0,2]=4 1464 B12R1.107 CC(C)NC(=O)C1=CCCCC1 527a_100138425928_100000765259 [0,1,0,0,0,0|1,0,2]=4 1465 B12R1.107 CC(C)NC(=O)C1CCCCC1 11a_100138425928_100000210647 [0,1,0,0,0,0|1,0,0]=2 1466 B12R1.107 CC(C)NC(=O)C1CCCCC1 1626a_100138425928_100000210647 [0,1,0,0,0,0|1,0,0]=2 1467 B12R1.107 CC(C)NC(=O)C1CCCCC1 240690a_100138425928_100000210647 [0,1,0,0,0,0|1,0,0]=2 1468 B12R1.107 CC(C)NC(=O)C1CCCCC1 527a_100138425928_100000210647 [0,1,0,0,0,0|1,0,0]=2 1469 B12R1.107 CC(C)NC(=O)C1CCCCO1 11a_100138425928_100000748299 [0,1,0,0,0,0|2,0,0]=3 1470 B12R1.107 CC(C)NC(=O)C1CCCCO1 1626a_100138425928_100000748299 [0,1,0,0,0,0|2,0,0]=3 1471 B12R1.107 CC(C)NC(=O)C1CCCCO1 240690a_100138425928_100000748299 [0,1,0,0,0,0|2,0,0]=3 1472 B12R1.107 CC(C)NC(=O)C1CCCCO1 527a_100138425928_100000748299 [0,1,0,0,0,0|2,0,0]=3 1473 B12R1.107 CC(C)NC(=O)C1CCCOC1 11a_100138425928_100000741522 [0,1,0,0,0,0|2,0,0]=3 1474 B12R1.107 CC(C)NC(=O)C1CCCOC1 1626a_100138425928_100000741522 [0,1,0,0,0,0|2,0,0]=3 1475 B12R1.107 CC(C)NC(=O)C1CCCOC1 240690a_100138425928_100000741522 [0,1,0,0,0,0|2,0,0]=3 1476 B12R1.107 CC(C)NC(=O)C1CCCOC1 527a_100138425928_100000741522 [0,1,0,0,0,0|2,0,0]=3 1477 B12R1.107 CC(C)NC(=O)C1CCOCC1 11a_100138425928_100000195482 [0,1,0,0,0,0|2,0,0]=3 1478 B12R1.107 CC(C)NC(=O)C1CCOCC1 1626a_100138425928_100000195482 [0,1,0,0,0,0|2,0,0]=3 1479 B12R1.107 CC(C)NC(=O)C1CCOCC1 240690a_100138425928_100000195482 [0,1,0,0,0,0|2,0,0]=3 1480 B12R1.107 CC(C)NC(=O)C1CCOCC1 527a_100138425928_100000195482 [0,1,0,0,0,0|2,0,0]=3 1481 B12R1.107 CC(C)NC(=O)C1CCSCC1 11a_100138425928_100000755232 [0,1,0,0,0,0|2,0,0]=3 1482 B12R1.107 CC(C)NC(=O)C1CCSCC1 1626a_100138425928_100000755232 [0,1,0,0,0,0|2,0,0]=3 1483 B12R1.107 CC(C)NC(=O)C1CCSCC1 240690a_100138425928_100000755232 [0,1,0,0,0,0|2,0,0]=3 1484 B12R1.107 CC(C)NC(=O)C1CCSCC1 527a_100138425928_100000755232 [0,1,0,0,0,0|2,0,0]=3 1485 B12R1.107 CC(C)NC(=O)C1COCCO1 11a_100138425928_100000045528 [0,1,0,0,0,0|3,0,0]=4 1486 B12R1.107 CC(C)NC(=O)C1COCCO1 1626a_100138425928_100000045528 [0,1,0,0,0,0|3,0,0]=4 1487 B12R1.107 CC(C)NC(=O)C1COCCO1 240690a_100138425928_100000045528 [0,1,0,0,0,0|3,0,0]=4 1488 B12R1.107 CC(C)NC(=O)C1COCCO1 527a_100138425928_100000045528 [0,1,0,0,0,0|3,0,0]=4 1489 B12R1.107 CC(C)NC(=O)C1SCCCS1 11a_100138425928_100000028545 [0,1,0,0,0,0|3,0,0]=4 1490 B12R1.107 CC(C)NC(=O)C1SCCCS1 1626a_100138425928_100000028545 [0,1,0,0,0,0|3,0,0]=4 1491 B12R1.107 CC(C)NC(=O)C1SCCCS1 240690a_100138425928_100000028545 [0,1,0,0,0,0|3,0,0]=4 1492 B12R1.107 CC(C)NC(=O)C1SCCCS1 527a_100138425928_100000028545 [0,1,0,0,0,0|3,0,0]=4 1493 B12R1.107 CC(C)NC(=O)N1CCCOC1 2708a_100138425928_100000131196 [0,1,0,0,0,0|3,0,0]=4 1494 B12R1.107 CC(C)NC(=O)N1CCCOC1 273464a_100138425928_100000131196 [0,1,0,0,0,0|3,0,0]=4 1495 B12R1.107 CC(C)NC(=O)N1CCOCC1 2708a_100138425928_100015191051 [0,1,0,0,0,0|3,0,0]=4 1496 B12R1.107 CC(C)NC(=O)N1CCOCC1 273464a_100138425928_100015191051 [0,1,0,0,0,0|3,0,0]=4 1497 B12R1.107 CC(C)NC(=O)N1CCSCC1 2708a_100138425928_100000737611 [0,1,0,0,0,0|3,0,0]=4 1498 B12R1.107 CC(C)NC(=O)N1CCSCC1 273464a_100138425928_100000737611 [0,1,0,0,0,0|3,0,0]=4 1499 B12R1.107 CC(C)NC(=O)[C@H]1CC=CCC1 11a_100138425928_100009820709 [0,1,0,0,0,0|1,0,2]=4 1500 B12R1.107 CC(C)NC(=O)[C@H]1CC=CCC1 1626a_100138425928_100009820709 [0,1,0,0,0,0|1,0,2]=4 1501 B12R1.107 CC(C)NC(=O)[C@H]1CC=CCC1 240690a_100138425928_100009820709 [0,1,0,0,0,0|1,0,2]=4 1502 B12R1.107 CC(C)NC(=O)[C@H]1CC=CCC1 527a_100138425928_100009820709 [0,1,0,0,0,0|1,0,2]=4 1503 B12R1.107 CC(C)N[C@H](C)C1CCCCC1 2230a_100025707633_100000210206 [0,1,0,0,0,0|2,0,1]=4 1504 B12R1.107 CC(C)N[C@H](C)C1CCCCC1 34a_100025707633_100000210206 [0,1,0,0,0,0|2,0,1]=4 1505 B12R1.107 CC(C)OC(C)C1CCCCC1 34a_100011216961_100000210206 [0,1,0,0,0,0|1,0,1]=3 1506 B12R1.107 CC(C)OC(C)C1CCCCC1 7a_100011216961_100000210206 [0,1,0,0,0,0|1,0,1]=3 1507 B12R1.107 CC(C)OC(C)C1CCCNC1 34a_100000740858_100000210206 [0,1,0,0,0,0|2,0,1]=4 1508 B12R1.107 CC(C)OC(C)C1CCNCC1 34a_100011728446_100000210206 [0,1,0,0,0,0|2,0,1]=4 1509 B12R1.107 CC(C)O[C@H](C)C1CCOCC1 34a_100000703848_100000210206 [0,1,0,0,0,0|2,0,1]=4 1510 B12R1.107 CC(C)O[C@H](C)C1CCOCC1 7a_100000703848_100000210206 [0,1,0,0,0,0|2,0,1]=4 1511 B12R1.107 CC(O)CC(=O)C1=CCCCC1 1458a_100000765259_100011218427 [0,1,0,0,0,0|1,0,2]=4 1512 B12R1.107 CC(O)CC(=O)C1CCCCC1 1458a_100000210647_100011218427 [0,1,0,0,0,0|1,0,0]=2 1513 B12R1.107 CC(O)CC(=O)C1CCCCO1 1458a_100000748299_100011218427 [0,1,0,0,0,0|2,0,0]=3 1514 B12R1.107 CC(O)CC(=O)C1CCCOC1 1458a_100000741522_100011218427 [0,1,0,0,0,0|2,0,0]=3 1515 B12R1.107 CC(O)CC(=O)C1CCOCC1 1458a_100000195482_100011218427 [0,1,0,0,0,0|2,0,0]=3 1516 B12R1.107 CC(O)CC(=O)C1CCSCC1 1458a_100000755232_100011218427 [0,1,0,0,0,0|2,0,0]=3 1517 B12R1.107 CC(O)CC(=O)C1COCCO1 1458a_100000045528_100011218427 [0,1,0,0,0,0|3,0,0]=4 1518 B12R1.107 CC(O)CC(=O)C1SCCCS1 1458a_100000028545_100011218427 [0,1,0,0,0,0|3,0,0]=4 1519 B12R1.107 CC(O)CC(=O)[C@H]1CC=CCC1 1458a_100009820709_100011218427 [0,1,0,0,0,0|1,0,2]=4 1520 B12R1.107 CC(O)CN(C)C1CCCCC1 2230a_100000202029_200000210301 [0,1,0,0,0,0|3,0,0]=4 1521 B12R1.107 CC(O)CN(C)C1CCCCC1 2230a_100000207522_100011218427 [0,1,0,0,0,0|3,0,0]=4 1522 B12R1.107 CC(O)CN(C)C1CCCCC1 269982a_100000202029_200000210301 [0,1,0,0,0,0|3,0,0]=4 1523 B12R1.107 CC(O)CN(C)C1CCCCC1 269982a_100000207522_100011218427 [0,1,0,0,0,0|3,0,0]=4 1524 B12R1.107 CC(O)CN(C)C1CCCCC1 269982a_100000227577_100000210327 [0,1,0,0,0,0|3,0,0]=4 1525 B12R1.107 CC(O)CN(C)C1CCCCC1 270004a_100000227577_100000210434 [0,1,0,0,0,0|3,0,0]=4 1526 B12R1.107 CC(O)CN(C)C1CCCCC1 34a_100000202029_200000210301 [0,1,0,0,0,0|3,0,0]=4 1527 B12R1.107 CC(O)CN(C)C1CCCCC1 34a_100000207522_100011218427 [0,1,0,0,0,0|3,0,0]=4 1528 B12R1.107 CC(O)CN([13CH3])C1CCCCC1 2230a_100000202029_200025704644 [0,1,0,0,0,0|3,0,0]=4 1529 B12R1.107 CC(O)CN([13CH3])C1CCCCC1 269982a_100000202029_200025704644 [0,1,0,0,0,0|3,0,0]=4 1530 B12R1.107 CC(O)CN([13CH3])C1CCCCC1 34a_100000202029_200025704644 [0,1,0,0,0,0|3,0,0]=4 1531 B12R1.107 CN(C)CC(=O)C1CCCCC1 1458a_100000750896_100000210327 [0,1,0,0,0,0|2,0,0]=3 1532 B12R1.107 CN(C)CC(=O)C1CCCCC1 2230a_100102631434_100000241979 [0,1,0,0,0,0|2,0,0]=3 1533 B12R1.107 CN(C)CC(=O)C1CCCCC1 269982a_100102631434_100000241979 [0,1,0,0,0,0|2,0,0]=3 1534 B12R1.107 CN(C)CC(=O)C1CCCOC1 1458a_100000750896_100000693364 [0,1,0,0,0,0|3,0,0]=4 1535 B12R1.107 CN(C)CC(=O)C1CCOCC1 1458a_100000750896_100011324220 [0,1,0,0,0,0|3,0,0]=4 1536 B12R1.107 CN(C)CC(=O)C1CCOCC1 2230a_100102631434_100000689883 [0,1,0,0,0,0|3,0,0]=4 1537 B12R1.107 CN(C)CC(=O)C1CCOCC1 269982a_100102631434_100000689883 [0,1,0,0,0,0|3,0,0]=4 1538 B12R1.107 CN(C)CC(=O)N1CCCCC1 2230a_100102631434_100000183409 [0,1,0,0,0,0|3,0,0]=4 1539 B12R1.107 CN(C)CC(=O)N1CCCCC1 2230a_200025747655_200000210301 [0,1,0,0,0,0|3,0,0]=4 1540 B12R1.107 CN(C)CC(=O)N1CCCCC1 269982a_100102631434_100000183409 [0,1,0,0,0,0|3,0,0]=4 1541 B12R1.107 CN(C)CC(=O)N1CCCCC1 269982a_200025747655_200000210301 [0,1,0,0,0,0|3,0,0]=4 1542 B12R1.107 CN([13CH3])CC(=O)N1CCCCC1 2230a_200025747655_200025704644 [0,1,0,0,0,0|3,0,0]=4 1543 B12R1.107 CN([13CH3])CC(=O)N1CCCCC1 269982a_200025747655_200025704644 [0,1,0,0,0,0|3,0,0]=4 1544 B12R1.107 C[C@@H](O)CC(=O)C1C=CCCC1 1458a_100011933948_100000751183 [0,1,0,0,0,0|1,0,2]=4 1545 B12R1.107 C[C@@H](O)CC(=O)C1CCCCC1 1458a_100011933948_100000210327 [0,1,0,0,0,0|1,0,0]=2 1546 B12R1.107 C[C@@H](O)CC(=O)C1CCCOC1 1458a_100011933948_100000693364 [0,1,0,0,0,0|2,0,0]=3 1547 B12R1.107 C[C@@H](O)CC(=O)C1CCOCC1 1458a_100011933948_100011324220 [0,1,0,0,0,0|2,0,0]=3 1548 B12R1.107 C[C@@H](O)CC(=O)N1CCCOC1 240690a_100000131196_100011933948 [0,1,0,0,0,0|3,0,0]=4 1549 B12R1.107 C[C@@H](O)CC(=O)N1CCOCC1 240690a_100015191051_100011933948 [0,1,0,0,0,0|3,0,0]=4 1550 B12R1.107 C[C@@H](O)CC(=O)N1CCSCC1 240690a_100000737611_100011933948 [0,1,0,0,0,0|3,0,0]=4 1551 B12R1.107 C[C@@H](O)CN(C)C1CCCCC1 2230a_100000207522_100009817552 [0,1,0,0,0,0|3,0,0]=4 1552 B12R1.107 C[C@@H](O)CN(C)C1CCCCC1 269982a_100000207522_100009817552 [0,1,0,0,0,0|3,0,0]=4 1553 B12R1.107 C[C@@H](O)CN(C)C1CCCCC1 34a_100000207522_100009817552 [0,1,0,0,0,0|3,0,0]=4 1554 B12R1.107 C[S+](C)CC(=O)C1CCCCC1 1458a_200159257847_100000210327 [0,1,0,0,0,0|2,0,0]=3 1555 B12R1.107 C[S+](C)CC(=O)C1CCCOC1 1458a_200159257847_100000693364 [0,1,0,0,0,0|3,0,0]=4 1556 B12R1.107 C[S+](C)CC(=O)C1CCOCC1 1458a_200159257847_100011324220 [0,1,0,0,0,0|3,0,0]=4 1557 B12R1.107 NC(=O)CC(=O)C1CCCCC1 1458a_100000210647_100000187820 [0,1,0,0,0,0|2,0,1]=4 1558 B12R1.107 NC(=O)CC(=O)C1CCCCC1 1458a_100134613110_100000210327 [0,1,0,0,0,0|2,0,1]=4 1559 B12R1.107 O=C(C=C(Cl)Cl)C1CCCCC1 1458a_100000137448_100000210327 [0,1,0,0,0,0|2,0,1]=4 1560 B12R1.107 O=C(CC(F)F)C1CCCCC1 1458a_100000210647_100011934356 [0,1,0,0,0,0|2,0,0]=3 1561 B12R1.107 O=C(CC(F)F)C1CCCCO1 1458a_100000748299_100011934356 [0,1,0,0,0,0|3,0,0]=4 1562 B12R1.107 O=C(CC(F)F)C1CCCOC1 1458a_100000741522_100011934356 [0,1,0,0,0,0|3,0,0]=4 1563 B12R1.107 O=C(CC(F)F)C1CCOCC1 1458a_100000195482_100011934356 [0,1,0,0,0,0|3,0,0]=4 1564 B12R1.107 O=C(CC(F)F)C1CCSCC1 1458a_100000755232_100011934356 [0,1,0,0,0,0|3,0,0]=4 1565 B12R1.107 O=C(C[N+](=O)[O-])C1CCCCC1 1458a_100000210647_100000761209 [0,1,0,0,0,0|3,0,0]=4 1566 B12R1.107 O=C([O-])CC(=O)C1CCCCC1 1458a_100000210647_100020667443 [0,1,0,0,0,0|2,0,1]=4 1567 B12R1.308 C#CCC(=O)C1CCCCC1C 1458a_100011215568_100000184674 [0,1,0,0,0,0|1,0,2]=4 1568 B12R1.308 C#CCC(=O)C1CCCCC1O 1458a_100011803323_100000184674 [0,1,0,0,0,0|1,0,2]=4 1569 B12R1.308 C=CCC(=O)C1CCCCC1C 1458a_100011215568_100000210623 [0,1,0,0,0,0|1,0,2]=4 1570 B12R1.308 C=CCC(=O)C1CCCCC1O 1458a_100011803323_100000210623 [0,1,0,0,0,0|1,0,2]=4 1571 B12R1.308 CC#CC(=O)C1CCCCC1=O 1458a_100000763181_100000204591 [0,1,0,0,0,0|1,0,2]=4 1572 B12R1.308 CC1CCCCC1C(=O)CC#N 1458a_100011215568_100011214920 [0,1,0,0,0,0|2,0,1]=4 1573 B12R1.308 CC1CCCCC1C(=O)CCF 1458a_100011215568_100011217306 [0,1,0,0,0,0|2,0,0]=3 1574 B12R1.308 CC1CCCCC1C(=O)CCO 1458a_100011215568_100000211926 [0,1,0,0,0,0|2,0,0]=3 1575 B12R1.308 CC1CCCCN1C(=O)CCO 240690a_100000211376_100011216618 [0,1,0,0,0,0|3,0,0]=4 1576 B12R1.308 CC1CCCCN1C(=O)CS[13CH3] 62a_100000182743_200025704644 [0,1,0,0,0,0|3,0,0]=4 1577 B12R1.308 CC1CCCCN1C(=O)CS[13CH3] 62a_200025704644_100000182743 [0,1,0,0,0,0|3,0,0]=4 1578 B12R1.308 CC=CC(=O)C1CCCCC1=O 1458a_100000210699_100000204591 [0,1,0,0,0,0|1,0,2]=4 1579 B12R1.308 CC=CC(=O)N1CCCCC1C 11a_100000211376_100000210699 [0,1,0,0,0,0|2,0,1]=4 1580 B12R1.308 CC=CC(=O)N1CCCCC1C 1626a_100000211376_100000210699 [0,1,0,0,0,0|2,0,1]=4 1581 B12R1.308 CC=CC(=O)N1CCCCC1C 240690a_100000211376_100000210699 [0,1,0,0,0,0|2,0,1]=4 1582 B12R1.308 CCCC(=O)C1CCCCC1=O 1458a_100000211992_100000204591 [0,1,0,0,0,0|1,0,1]=3 1583 B12R1.308 CCCC(=O)C1CCCCC1C 1458a_100011215568_100000210303 [0,1,0,0,0,0|1,0,0]=2 1584 B12R1.308 CCCC(=O)C1CCCCC1O 1458a_100011803323_100000210303 [0,1,0,0,0,0|1,0,0]=2 1585 B12R1.308 CCCC(=O)C1CCCNC1=O 1458a_100000087122_100000210303 [0,1,0,0,0,0|2,0,1]=4 1586 B12R1.308 CCCC(=O)C1CCCNC1=O 1458a_100000211992_100000687798 [0,1,0,0,0,0|2,0,1]=4 1587 B12R1.308 CCCC(=O)C1COCCC1=O 1458a_100000211992_100012180262 [0,1,0,0,0,0|2,0,1]=4 1588 B12R1.308 CCCC(=O)N1CCCCC1C 11a_100000211376_100000211992 [0,1,0,0,0,0|2,0,0]=3 1589 B12R1.308 CCCC(=O)N1CCCCC1C 1626a_100000211376_100000211992 [0,1,0,0,0,0|2,0,0]=3 1590 B12R1.308 CCCC(=O)N1CCCCC1C 240690a_100000211376_100000211992 [0,1,0,0,0,0|2,0,0]=3 1591 B12R1.308 CCCC(=O)N1CCCCC1C 527a_100000211376_100000211992 [0,1,0,0,0,0|2,0,0]=3 1592 B12R1.308 CCCC(=O)N1CCOC[C@@H]1C 11a_100009815349_100000211992 [0,1,0,0,0,0|3,0,0]=4 1593 B12R1.308 CCCC(=O)N1CCOC[C@@H]1C 240690a_100009815349_100000211992 [0,1,0,0,0,0|3,0,0]=4 1594 B12R1.308 CCCC(=O)N1CCOC[C@@H]1C 527a_100009815349_100000211992 [0,1,0,0,0,0|3,0,0]=4 1595 B12R1.308 CCCC(=O)[C@H]1CCCCN1C 1458a_100000767060_100000210303 [0,1,0,0,0,0|2,0,0]=3 1596 B12R1.308 CCCN(C)C1CCCCC1C 270004a_100000747261_100000210921 [0,1,0,0,0,0|3,0,0]=4 1597 B12R1.308 CCCN(C)C1CCCCC1F 269982a_100000747261_100015423560 [0,1,0,0,0,0|3,0,0]=4 1598 B12R1.308 CCCN(C)C1CCCCC1O 269982a_100000747261_100000038908 [0,1,0,0,0,0|3,0,0]=4 1599 B12R1.308 CCCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000210303 [0,1,0,0,0,0|3,0,0]=4 1600 B12R1.308 CCNC(=O)C1CCCCC1C 11a_100015525214_100011215568 [0,1,0,0,0,0|1,0,0]=2 1601 B12R1.308 CCNC(=O)C1CCCCC1C 240690a_100015525214_100011215568 [0,1,0,0,0,0|1,0,0]=2 1602 B12R1.308 CCNC(=O)C1CCCCC1C 527a_100015525214_100011215568 [0,1,0,0,0,0|1,0,0]=2 1603 B12R1.308 CCNC(=O)C1CCCNC1=O 11a_100015525214_100000087122 [0,1,0,0,0,0|2,0,1]=4 1604 B12R1.308 CCNC(=O)C1CCCNC1=O 240690a_100015525214_100000087122 [0,1,0,0,0,0|2,0,1]=4 1605 B12R1.308 CCNC(=O)C1CCCNC1=O 527a_100015525214_100000087122 [0,1,0,0,0,0|2,0,1]=4 1606 B12R1.308 CCNC(=O)N1CCCCC1C 2708a_100015525214_100000211376 [0,1,0,0,0,0|2,0,0]=3 1607 B12R1.308 CCNC(=O)N1CCCCC1C 273464a_100015525214_100000211376 [0,1,0,0,0,0|2,0,0]=3 1608 B12R1.308 CCNC(=O)N1CCOC[C@@H]1C 2708a_100015525214_100009815349 [0,1,0,0,0,0|3,0,0]=4 1609 B12R1.308 CCNC(=O)N1CCOC[C@@H]1C 273464a_100015525214_100009815349 [0,1,0,0,0,0|3,0,0]=4 1610 B12R1.308 CCNC(=O)[C@H]1CCCCN1C 11a_100015525214_100000767060 [0,1,0,0,0,0|2,0,0]=3 1611 B12R1.308 CCNC(=O)[C@H]1CCCCN1C 240690a_100015525214_100000767060 [0,1,0,0,0,0|2,0,0]=3 1612 B12R1.308 CCNC(=O)[C@H]1CCCCN1C 527a_100015525214_100000767060 [0,1,0,0,0,0|2,0,0]=3 1613 B12R1.308 CCOC(=O)C1CCCCN1C 2230a_100016990872_200000210301 [0,1,0,0,0,0|1,0,0]=2 1614 B12R1.308 CCOC(=O)C1CCCCN1C 269982a_100016990872_200000210301 [0,1,0,0,0,0|1,0,0]=2 1615 B12R1.308 CCOC(=O)C1CCCCN1[13CH3] 2230a_100016990872_200025704644 [0,1,0,0,0,0|1,0,0]=2 1616 B12R1.308 CCOC(=O)C1CCCCN1[13CH3] 269982a_100016990872_200025704644 [0,1,0,0,0,0|1,0,0]=2 1617 B12R1.308 CCOC(=O)C1CSCCN1C 2230a_100000735462_200000210301 [0,1,0,0,0,0|2,0,0]=3 1618 B12R1.308 CCOC(=O)C1CSCCN1C 269982a_100000735462_200000210301 [0,1,0,0,0,0|2,0,0]=3 1619 B12R1.308 CCOC(=O)C1CSCCN1[13CH3] 2230a_100000735462_200025704644 [0,1,0,0,0,0|2,0,0]=3 1620 B12R1.308 CCOC(=O)C1CSCCN1[13CH3] 269982a_100000735462_200025704644 [0,1,0,0,0,0|2,0,0]=3 1621 B12R1.308 CCOC(=O)[C@@H]1COCCN1C 2230a_100015229691_200000210301 [0,1,0,0,0,0|2,0,0]=3 1622 B12R1.308 CCOC(=O)[C@@H]1COCCN1C 269982a_100015229691_200000210301 [0,1,0,0,0,0|2,0,0]=3 1623 B12R1.308 CCOC(=O)[C@@H]1COCCN1[13CH3] 2230a_100015229691_200025704644 [0,1,0,0,0,0|2,0,0]=3 1624 B12R1.308 CCOC(=O)[C@@H]1COCCN1[13CH3] 269982a_100015229691_200025704644 [0,1,0,0,0,0|2,0,0]=3 1625 B12R1.308 CN1CCCC[C@@H]1C(=O)CCF 1458a_100000767060_100011217306 [0,1,0,0,0,0|3,0,0]=4 1626 B12R1.308 CN1CCCC[C@@H]1C(=O)CCO 1458a_100000767060_100000211926 [0,1,0,0,0,0|3,0,0]=4 1627 B12R1.308 CNCC(=O)N1CCCCC1C 2230a_106832991635_100000182743 [0,1,0,0,0,0|3,0,0]=4 1628 B12R1.308 CNCC(=O)N1CCCCC1C 34a_100102657272_100000182743 [0,1,0,0,0,0|3,0,0]=4 1629 B12R1.308 CNCC(=O)N1CCCCC1C 7a_106832991635_100000182743 [0,1,0,0,0,0|3,0,0]=4 1630 B12R1.308 CNNC(=O)C1CCCCC1C 22a_100016993582_100011215568 [0,1,0,0,0,0|2,0,0]=3 1631 B12R1.308 CNNC(=O)C1CCCCC1O 22a_100016993582_100011803323 [0,1,0,0,0,0|2,0,0]=3 1632 B12R1.308 CNNC(=O)[C@H]1CCCCN1C 22a_100016993582_100000767060 [0,1,0,0,0,0|3,0,0]=4 1633 B12R1.308 COCC(=O)C1CCCCC1=O 1458a_100000210968_100000204591 [0,1,0,0,0,0|2,0,1]=4 1634 B12R1.308 COCC(=O)N1CCCCC1C 11a_100000211376_100000210968 [0,1,0,0,0,0|3,0,0]=4 1635 B12R1.308 COCC(=O)N1CCCCC1C 1626a_100000211376_100000210968 [0,1,0,0,0,0|3,0,0]=4 1636 B12R1.308 COCC(=O)N1CCCCC1C 240690a_100000211376_100000210968 [0,1,0,0,0,0|3,0,0]=4 1637 B12R1.308 COCC(=O)N1CCCCC1C 34a_100138415774_100000182743 [0,1,0,0,0,0|3,0,0]=4 1638 B12R1.308 COCC(=O)N1CCCCC1C 527a_100000211376_100000210968 [0,1,0,0,0,0|3,0,0]=4 1639 B12R1.308 CSCC(=O)C1CCCCC1=O 1458a_100000184570_100000204591 [0,1,0,0,0,0|2,0,1]=4 1640 B12R1.308 CSCC(=O)N1CCCCC1C 11a_100000211376_100000184570 [0,1,0,0,0,0|3,0,0]=4 1641 B12R1.308 CSCC(=O)N1CCCCC1C 1626a_100000211376_100000184570 [0,1,0,0,0,0|3,0,0]=4 1642 B12R1.308 CSCC(=O)N1CCCCC1C 240690a_100000211376_100000184570 [0,1,0,0,0,0|3,0,0]=4 1643 B12R1.308 CSCC(=O)N1CCCCC1C 527a_100000211376_100000184570 [0,1,0,0,0,0|3,0,0]=4 1644 B12R1.308 CSCC(=O)N1CCCCC1C 62a_100000182743_200000210301 [0,1,0,0,0,0|3,0,0]=4 1645 B12R1.308 CSCC(=O)N1CCCCC1C 62a_200000210301_100000182743 [0,1,0,0,0,0|3,0,0]=4 1646 B12R1.308 N#CCC(=O)C1CCCCC1O 1458a_100011803323_100011214920 [0,1,0,0,0,0|2,0,1]=4 1647 B12R1.308 O=C(CCF)C1CCCCC1O 1458a_100011803323_100011217306 [0,1,0,0,0,0|2,0,0]=3 1648 B12R1.308 O=C(CCO)C1CCCCC1=O 1458a_100011216618_100000204591 [0,1,0,0,0,0|2,0,1]=4 1649 B12R1.308 O=C(CCO)C1CCCCC1O 1458a_100011803323_100000211926 [0,1,0,0,0,0|2,0,0]=3 1650 B12R1.1595 C#CCC(=O)C1(CCCCC1)C 1458a_100000762840_100000184674 [0,1,0,0,0,0|1,0,2]=4 1651 B12R1.1595 C#CCC(=O)C1(CCCCC1)F 1458a_100000069003_100000184674 [0,1,0,0,0,0|1,0,2]=4 1652 B12R1.1595 C#CCC(=O)C1(CCCCC1)O 1458a_100000242742_100000184674 [0,1,0,0,0,0|1,0,2]=4 1653 B12R1.1595 C=CCC(=O)C1(CCCCC1)C 1458a_100000762840_100000210623 [0,1,0,0,0,0|1,0,2]=4 1654 B12R1.1595 C=CCC(=O)C1(CCCCC1)F 1458a_100000069003_100000210623 [0,1,0,0,0,0|1,0,2]=4 1655 B12R1.1595 C=CCC(=O)C1(CCCCC1)O 1458a_100000242742_100000210623 [0,1,0,0,0,0|1,0,2]=4 1656 B12R1.1595 CC1(CCCCC1)C(=O)CC#N 1458a_100000762840_100011214920 [0,1,0,0,0,0|2,0,1]=4 1657 B12R1.1595 CC1(CCCCC1)C(=O)CCF 1458a_100000762840_100011217306 [0,1,0,0,0,0|2,0,0]=3 1658 B12R1.1595 CC1(CCCCC1)C(=O)CCO 1458a_100000762840_100000211926 [0,1,0,0,0,0|2,0,0]=3 1659 B12R1.1595 CC1(CCOCC1)C(=O)CCF 1458a_100000749465_100011217306 [0,1,0,0,0,0|3,0,0]=4 1660 B12R1.1595 CC1(CCOCC1)C(=O)CCO 1458a_100000749465_100000211926 [0,1,0,0,0,0|3,0,0]=4 1661 B12R1.1595 CCCC(=O)C1(CCCCC1)C 1458a_100000762840_100000210303 [0,1,0,0,0,0|1,0,0]=2 1662 B12R1.1595 CCCC(=O)C1(CCCCC1)F 1458a_100000069003_100000210303 [0,1,0,0,0,0|1,0,0]=2 1663 B12R1.1595 CCCC(=O)C1(CCCCC1)O 1458a_100000242742_100000210303 [0,1,0,0,0,0|1,0,0]=2 1664 B12R1.1595 CCCC(=O)C1(CCOCC1)C 1458a_100000749465_100000210303 [0,1,0,0,0,0|2,0,0]=3 1665 B12R1.1595 CCCC(=O)C1(CCOCC1)F 1458a_100009845733_100000210303 [0,1,0,0,0,0|2,0,0]=3 1666 B12R1.1595 CCCC(=O)C1(CCOCC1)O 1458a_100000751969_100000210303 [0,1,0,0,0,0|2,0,0]=3 1667 B12R1.1595 CCNC(=O)C1(CCCCC1)C 11a_100015525214_100000762840 [0,1,0,0,0,0|1,0,0]=2 1668 B12R1.1595 CCNC(=O)C1(CCCCC1)C 240690a_100015525214_100000762840 [0,1,0,0,0,0|1,0,0]=2 1669 B12R1.1595 CCNC(=O)C1(CCCCC1)C 527a_100015525214_100000762840 [0,1,0,0,0,0|1,0,0]=2 1670 B12R1.1595 CCNC(=O)C1(CCCCC1)F 11a_100015525214_100000069003 [0,1,0,0,0,0|1,0,0]=2 1671 B12R1.1595 CCNC(=O)C1(CCCCC1)F 240690a_100015525214_100000069003 [0,1,0,0,0,0|1,0,0]=2 1672 B12R1.1595 CCNC(=O)C1(CCCCC1)F 527a_100015525214_100000069003 [0,1,0,0,0,0|1,0,0]=2 1673 B12R1.1595 CCNC(=O)C1(CCCCC1)O 240690a_100015525214_100000242742 [0,1,0,0,0,0|1,0,0]=2 1674 B12R1.1595 CCNC(=O)C1(CCOCC1)C 11a_100015525214_100000749465 [0,1,0,0,0,0|2,0,0]=3 1675 B12R1.1595 CCNC(=O)C1(CCOCC1)C 240690a_100015525214_100000749465 [0,1,0,0,0,0|2,0,0]=3 1676 B12R1.1595 CCNC(=O)C1(CCOCC1)C 527a_100015525214_100000749465 [0,1,0,0,0,0|2,0,0]=3 1677 B12R1.1595 CCNC(=O)C1(CCOCC1)F 11a_100015525214_100009845733 [0,1,0,0,0,0|2,0,0]=3 1678 B12R1.1595 CCNC(=O)C1(CCOCC1)F 240690a_100015525214_100009845733 [0,1,0,0,0,0|2,0,0]=3 1679 B12R1.1595 CCNC(=O)C1(CCOCC1)F 527a_100015525214_100009845733 [0,1,0,0,0,0|2,0,0]=3 1680 B12R1.1595 CCNC(=O)C1(CCOCC1)O 240690a_100015525214_100000751969 [0,1,0,0,0,0|2,0,0]=3 1681 B12R1.1595 CNNC(=O)C1(CCCCC1)C 22a_100016993582_100000762840 [0,1,0,0,0,0|2,0,0]=3 1682 B12R1.1595 CNNC(=O)C1(CCCCC1)F 22a_100016993582_100000069003 [0,1,0,0,0,0|2,0,0]=3 1683 B12R1.1595 CNNC(=O)C1(CCCCC1)O 22a_100016993582_100000242742 [0,1,0,0,0,0|2,0,0]=3 1684 B12R1.1595 CNNC(=O)C1(CCOCC1)C 22a_100016993582_100000749465 [0,1,0,0,0,0|3,0,0]=4 1685 B12R1.1595 CNNC(=O)C1(CCOCC1)F 22a_100016993582_100009845733 [0,1,0,0,0,0|3,0,0]=4 1686 B12R1.1595 CNNC(=O)C1(CCOCC1)O 22a_100016993582_100000751969 [0,1,0,0,0,0|3,0,0]=4 1687 B12R1.1595 N#CCC(=O)C1(CCCCC1)F 1458a_100000069003_100011214920 [0,1,0,0,0,0|2,0,1]=4 1688 B12R1.1595 N#CCC(=O)C1(CCCCC1)O 1458a_100000242742_100011214920 [0,1,0,0,0,0|2,0,1]=4 1689 B12R1.1595 O=C(CCF)C1(CCCCC1)F 1458a_100000069003_100011217306 [0,1,0,0,0,0|2,0,0]=3 1690 B12R1.1595 O=C(CCF)C1(CCCCC1)O 1458a_100000242742_100011217306 [0,1,0,0,0,0|2,0,0]=3 1691 B12R1.1595 O=C(CCF)C1(CCOCC1)F 1458a_100009845733_100011217306 [0,1,0,0,0,0|3,0,0]=4 1692 B12R1.1595 O=C(CCF)C1(CCOCC1)O 1458a_100000751969_100011217306 [0,1,0,0,0,0|3,0,0]=4 1693 B12R1.1595 O=C(CCO)C1(CCCCC1)F 1458a_100000069003_100000211926 [0,1,0,0,0,0|2,0,0]=3 1694 B12R1.1595 O=C(CCO)C1(CCCCC1)O 1458a_100000242742_100000211926 [0,1,0,0,0,0|2,0,0]=3 1695 B12R1.1595 O=C(CCO)C1(CCOCC1)F 1458a_100009845733_100000211926 [0,1,0,0,0,0|3,0,0]=4 1696 B12R1.1595 O=C(CCO)C1(CCOCC1)O 1458a_100000751969_100000211926 [0,1,0,0,0,0|3,0,0]=4 1697 B10R0.1 C#CCC(=O)CCCCCC 1458a_100011220946_100000210757 [0,0,1,0,0,0|1,0,2]=4 1698 B10R0.1 C#CCC(=O)CCCCCC 1458a_100102632555_100000184674 [0,0,1,0,0,0|1,0,2]=4 1699 B10R0.1 C#CCCCCC(=O)CCC 1458a_100000211992_100010269958 [0,0,1,0,0,0|1,0,2]=4 1700 B10R0.1 C#CCCCCC(=O)CCC 1458a_100000696528_100000210303 [0,0,1,0,0,0|1,0,2]=4 1701 B10R0.1 C#CCCCCC(=O)NCC 11a_100015525214_100000696528 [0,0,1,0,0,0|1,0,2]=4 1702 B10R0.1 C#CCCCCC(=O)NCC 240690a_100015525214_100000696528 [0,0,1,0,0,0|1,0,2]=4 1703 B10R0.1 C#CCCCCC(=O)NCC 527a_100015525214_100000696528 [0,0,1,0,0,0|1,0,2]=4 1704 B10R0.1 C#CCCNCC(=O)OCC 34a_100000755551_100000188475 [0,0,1,0,0,0|1,0,2]=4 1705 B10R0.1 C#CCCOCC(=O)OCC 34a_100011215631_100000188475 [0,0,1,0,0,0|1,0,2]=4 1706 B10R0.1 C#CCCSCC(=O)OCC 62a_100000188475_100000688953 [0,0,1,0,0,0|1,0,2]=4 1707 B10R0.1 C#CCCSCC(=O)OCC 62a_100000688953_100000188475 [0,0,1,0,0,0|1,0,2]=4 1708 B10R0.1 C#CCNCCC(=O)OCC 34a_100000212058_100000765890 [0,0,1,0,0,0|1,0,2]=4 1709 B10R0.1 C#CCOCCC(=O)OCC 34a_100000210247_100000765890 [0,0,1,0,0,0|1,0,2]=4 1710 B10R0.1 C#CCSCCC(=O)OCC 62a_100000038162_100000765890 [0,0,1,0,0,0|1,0,2]=4 1711 B10R0.1 C/C=C/COCC(=O)OCC 34a_100016270725_100000188475 [0,0,1,0,0,0|1,0,2]=4 1712 B10R0.1 C/C=C/CSCC(=O)OCC 62a_100000188475_100102629194 [0,0,1,0,0,0|1,0,2]=4 1713 B10R0.1 C/C=C/CSCC(=O)OCC 62a_100102629194_100000188475 [0,0,1,0,0,0|1,0,2]=4 1714 B10R0.1 C=CCC(=O)CCCCCC 1458a_100000210193_100000210757 [0,0,1,0,0,0|1,0,2]=4 1715 B10R0.1 C=CCC(=O)CCCCCC 1458a_100102632555_100000210623 [0,0,1,0,0,0|1,0,2]=4 1716 B10R0.1 C=CCCCCC(=O)CCC 1458a_100000211992_100011215482 [0,0,1,0,0,0|1,0,2]=4 1717 B10R0.1 C=CCCCCC(=O)CCC 1458a_100011215552_100000210303 [0,0,1,0,0,0|1,0,2]=4 1718 B10R0.1 C=CCCCCC(=O)NCC 11a_100015525214_100011215552 [0,0,1,0,0,0|1,0,2]=4 1719 B10R0.1 C=CCCCCC(=O)NCC 240690a_100015525214_100011215552 [0,0,1,0,0,0|1,0,2]=4 1720 B10R0.1 C=CCCCCC(=O)NCC 527a_100015525214_100011215552 [0,0,1,0,0,0|1,0,2]=4 1721 B10R0.1 C=CCCNCC(=O)OCC 2230a_100015191253_100000188475 [0,0,1,0,0,0|1,0,2]=4 1722 B10R0.1 C=CCCOCC(=O)OCC 34a_100011205117_100000188475 [0,0,1,0,0,0|1,0,2]=4 1723 B10R0.1 C=CCCSCC(=O)OCC 62a_100000188475_100000754431 [0,0,1,0,0,0|1,0,2]=4 1724 B10R0.1 C=CCCSCC(=O)OCC 62a_100000754431_100000188475 [0,0,1,0,0,0|1,0,2]=4 1725 B10R0.1 C=CCNCCC(=O)OCC 2230a_100020586998_100011206558 [0,0,1,0,0,0|1,0,2]=4 1726 B10R0.1 C=CCOCCC(=O)OCC 34a_200000210373_100000765890 [0,0,1,0,0,0|1,0,2]=4 1727 B10R0.1 C=CCSCCC(=O)OCC 62a_100000210623_100000765890 [0,0,1,0,0,0|1,0,2]=4 1728 B10R0.1 C=CCSCCC(=O)OCC 62a_100000765890_100000210623 [0,0,1,0,0,0|1,0,2]=4 1729 B10R0.1 C=COC(=O)CNCCCC 2230a_100000102301_100000036128 [0,0,1,0,0,0|1,0,2]=4 1730 B10R0.1 C=COC(=O)COCCCC 34a_100000210227_100000036128 [0,0,1,0,0,0|1,0,2]=4 1731 B10R0.1 C=COC(=O)CSCCCC 62a_100000036128_100000210210 [0,0,1,0,0,0|1,0,2]=4 1732 B10R0.1 C=COC(=O)CSCCCC 62a_100000210211_100000036128 [0,0,1,0,0,0|1,0,2]=4 1733 B10R0.1 CC#CC(=O)CCCCCC 1458a_100000763181_100000210757 [0,0,1,0,0,0|1,0,1]=3 1734 B10R0.1 CC#CC(=O)CCCCCF 1458a_100000763181_100000729378 [0,0,1,0,0,0|2,0,1]=4 1735 B10R0.1 CC#CC(=O)CCCCCO 1458a_100000763181_100000746330 [0,0,1,0,0,0|2,0,1]=4 1736 B10R0.1 CC#CC(=O)CCCCOC 1458a_100000763181_100000755781 [0,0,1,0,0,0|2,0,1]=4 1737 B10R0.1 CC#CC(=O)CCCOCC 1458a_100000763181_100012232248 [0,0,1,0,0,0|2,0,1]=4 1738 B10R0.1 CC#CC(=O)CCOCCC 1458a_100000763181_100011215938 [0,0,1,0,0,0|2,0,1]=4 1739 B10R0.1 CC#CC(=O)COCCCC 1458a_100000763181_100011995733 [0,0,1,0,0,0|2,0,1]=4 1740 B10R0.1 CC#CCNCC(=O)OCC 2230a_100000685387_100000188475 [0,0,1,0,0,0|1,0,2]=4 1741 B10R0.1 CC#CCNCC(=O)OCC 34a_100000685387_100000188475 [0,0,1,0,0,0|1,0,2]=4 1742 B10R0.1 CC#CCOCC(=O)OCC 34a_100000761923_100000188475 [0,0,1,0,0,0|1,0,2]=4 1743 B10R0.1 CC#CCSCC(=O)OCC 62a_100000188475_100000748600 [0,0,1,0,0,0|1,0,2]=4 1744 B10R0.1 CC#CCSCC(=O)OCC 62a_100000748600_100000188475 [0,0,1,0,0,0|1,0,2]=4 1745 B10R0.1 CC/C=C\CCC(=O)CCC 1458a_100000211992_100015370543 [0,0,1,0,0,0|1,0,2]=4 1746 B10R0.1 CC=CC(=O)CCCCCC 1458a_100000210699_100000210757 [0,0,1,0,0,0|1,0,1]=3 1747 B10R0.1 CC=CC(=O)CCCCCF 1458a_100000210699_100000729378 [0,0,1,0,0,0|2,0,1]=4 1748 B10R0.1 CC=CC(=O)CCCCCO 1458a_100000210699_100000746330 [0,0,1,0,0,0|2,0,1]=4 1749 B10R0.1 CC=CC(=O)CCCCOC 1458a_100000210699_100000755781 [0,0,1,0,0,0|2,0,1]=4 1750 B10R0.1 CC=CC(=O)CCCOCC 1458a_100000210699_100012232248 [0,0,1,0,0,0|2,0,1]=4 1751 B10R0.1 CC=CC(=O)CCOCCC 1458a_100000210699_100011215938 [0,0,1,0,0,0|2,0,1]=4 1752 B10R0.1 CC=CC(=O)COCCCC 1458a_100000210699_100011995733 [0,0,1,0,0,0|2,0,1]=4 1753 B10R0.1 CC=CC(=O)NCCCCC 11a_100000209983_100000210699 [0,0,1,0,0,0|2,0,1]=4 1754 B10R0.1 CC=CC(=O)NCCCCC 1626a_100000209983_100000210699 [0,0,1,0,0,0|2,0,1]=4 1755 B10R0.1 CC=CC(=O)NCCCCC 240690a_100000209983_100000210699 [0,0,1,0,0,0|2,0,1]=4 1756 B10R0.1 CC=CCSCC(=O)OCC 62a_100000070051_100000188475 [0,0,1,0,0,0|1,0,2]=4 1757 B10R0.1 CC=CCSCC(=O)OCC 62a_100000188475_100000070051 [0,0,1,0,0,0|1,0,2]=4 1758 B10R0.1 CCC/C=C/CC(=O)CCC 1458a_200016266809_100000210303 [0,0,1,0,0,0|1,0,2]=4 1759 B10R0.1 CCC/C=C/CC(=O)NCC 11a_100015525214_200016266809 [0,0,1,0,0,0|1,0,2]=4 1760 B10R0.1 CCC/C=C/CC(=O)NCC 240690a_100015525214_200016266809 [0,0,1,0,0,0|1,0,2]=4 1761 B10R0.1 CCC/C=C/CC(=O)NCC 527a_100015525214_200016266809 [0,0,1,0,0,0|1,0,2]=4 1762 B10R0.1 CCCC(=O)CCCCC#N 1458a_100000211992_100000211819 [0,0,1,0,0,0|2,0,1]=4 1763 B10R0.1 CCCC(=O)CCCCCF 1458a_100000211992_100000729378 [0,0,1,0,0,0|2,0,0]=3 1764 B10R0.1 CCCC(=O)CCCCCO 1458a_100000211992_100000746330 [0,0,1,0,0,0|2,0,0]=3 1765 B10R0.1 CCCC(=O)CCCCCO 1458a_100102619762_100000210303 [0,0,1,0,0,0|2,0,0]=3 1766 B10R0.1 CCCC(=O)CCCCOC 1458a_100000211992_100000755781 [0,0,1,0,0,0|2,0,0]=3 1767 B10R0.1 CCCC(=O)CCCOCC 1458a_100000211992_100012232248 [0,0,1,0,0,0|2,0,0]=3 1768 B10R0.1 CCCC(=O)CCOCCO 1458a_100000211992_100011215305 [0,0,1,0,0,0|3,0,0]=4 1769 B10R0.1 CCCC(=O)CCOCCO 1458a_100011229844_100000210303 [0,0,1,0,0,0|3,0,0]=4 1770 B10R0.1 CCCC(=O)CNCCCF 2230a_100015189416_100000747444 [0,0,1,0,0,0|3,0,0]=4 1771 B10R0.1 CCCC(=O)CNCCOC 2230a_100000209980_100000747444 [0,0,1,0,0,0|3,0,0]=4 1772 B10R0.1 CCCC(=O)CNCCSC 2230a_100020590264_100000747444 [0,0,1,0,0,0|3,0,0]=4 1773 B10R0.1 CCCC(=O)COCCOC 1458a_100000211095_100000210303 [0,0,1,0,0,0|3,0,0]=4 1774 B10R0.1 CCCC(=O)COCCSC 7a_100000230434_100000747444 [0,0,1,0,0,0|3,0,0]=4 1775 B10R0.1 CCCC(=O)CSCCCF 62a_100000747444_100011934791 [0,0,1,0,0,0|3,0,0]=4 1776 B10R0.1 CCCC(=O)CSCCCF 62a_100011934791_100000747444 [0,0,1,0,0,0|3,0,0]=4 1777 B10R0.1 CCCC(=O)CSCCCO 62a_100000747444_100011215043 [0,0,1,0,0,0|3,0,0]=4 1778 B10R0.1 CCCC(=O)CSCCCO 62a_100011215043_100000747444 [0,0,1,0,0,0|3,0,0]=4 1779 B10R0.1 CCCC(=O)CSCCOC 62a_100000233755_100000747444 [0,0,1,0,0,0|3,0,0]=4 1780 B10R0.1 CCCC(=O)CSCCOC 62a_100000747444_100000233755 [0,0,1,0,0,0|3,0,0]=4 1781 B10R0.1 CCCC(=O)CSCCSC 62a_100000212216_100000747444 [0,0,1,0,0,0|3,0,0]=4 1782 B10R0.1 CCCC(=O)CSCCSC 62a_100000747444_100000751147 [0,0,1,0,0,0|3,0,0]=4 1783 B10R0.1 CCCC(=O)CSCOCC 62a_100000739092_100000747444 [0,0,1,0,0,0|3,0,0]=4 1784 B10R0.1 CCCC(=O)CSCOCC 62a_100000747444_100000739092 [0,0,1,0,0,0|3,0,0]=4 1785 B10R0.1 CCCC(=O)NCCCCO 240690a_100000750430_100000211992 [0,0,1,0,0,0|3,0,0]=4 1786 B10R0.1 CCCC(=O)NCCCCO 527a_100000750430_100000211992 [0,0,1,0,0,0|3,0,0]=4 1787 B10R0.1 CCCC(=O)NCCCOC 1626a_100150723488_100000211992 [0,0,1,0,0,0|3,0,0]=4 1788 B10R0.1 CCCC(=O)NCCCOC 240690a_100150723488_100000211992 [0,0,1,0,0,0|3,0,0]=4 1789 B10R0.1 CCCC(=O)NCCCOC 527a_100150723488_100000211992 [0,0,1,0,0,0|3,0,0]=4 1790 B10R0.1 CCCC(=O)NCCCSC 11a_100000749238_100000211992 [0,0,1,0,0,0|3,0,0]=4 1791 B10R0.1 CCCC(=O)NCCCSC 1626a_100000749238_100000211992 [0,0,1,0,0,0|3,0,0]=4 1792 B10R0.1 CCCC(=O)NCCCSC 240690a_100000749238_100000211992 [0,0,1,0,0,0|3,0,0]=4 1793 B10R0.1 CCCC(=O)NCCCSC 527a_100000749238_100000211992 [0,0,1,0,0,0|3,0,0]=4 1794 B10R0.1 CCCC(=O)NCCOCC 11a_100011200944_100000211992 [0,0,1,0,0,0|3,0,0]=4 1795 B10R0.1 CCCC(=O)NCCOCC 1626a_102516460346_100000211992 [0,0,1,0,0,0|3,0,0]=4 1796 B10R0.1 CCCC(=O)NCCOCC 240690a_100011200944_100000211992 [0,0,1,0,0,0|3,0,0]=4 1797 B10R0.1 CCCC(=O)NCCOCC 527a_100011200944_100000211992 [0,0,1,0,0,0|3,0,0]=4 1798 B10R0.1 CCCC(=O)NCCSCC 11a_100000106463_100000211992 [0,0,1,0,0,0|3,0,0]=4 1799 B10R0.1 CCCC(=O)NCCSCC 1626a_100000106463_100000211992 [0,0,1,0,0,0|3,0,0]=4 1800 B10R0.1 CCCC(=O)NCCSCC 240690a_100000106463_100000211992 [0,0,1,0,0,0|3,0,0]=4 1801 B10R0.1 CCCC(=O)NCCSCC 527a_100000106463_100000211992 [0,0,1,0,0,0|3,0,0]=4 1802 B10R0.1 CCCCC=CC(=O)CCC 1458a_100016266645_100000210303 [0,0,1,0,0,0|1,0,2]=4 1803 B10R0.1 CCCCC=CC(=O)NCC 11a_100015525214_100016266645 [0,0,1,0,0,0|1,0,2]=4 1804 B10R0.1 CCCCC=CC(=O)NCC 240690a_100015525214_100016266645 [0,0,1,0,0,0|1,0,2]=4 1805 B10R0.1 CCCCCCC(=O)C=CBr 1458a_100016273825_100000210757 [0,0,1,0,0,0|2,0,1]=4 1806 B10R0.1 CCCCCCC(=O)C=CCl 1458a_200016279998_100000210757 [0,0,1,0,0,0|2,0,1]=4 1807 B10R0.1 CCCCCCC(=O)C=CI 1458a_100016256311_100000210757 [0,0,1,0,0,0|2,0,1]=4 1808 B10R0.1 CCCCCCC(=O)CC#N 1458a_100051588842_100000210757 [0,0,1,0,0,0|2,0,1]=4 1809 B10R0.1 CCCCCCC(=O)CC#N 1458a_100102632555_100011214920 [0,0,1,0,0,0|2,0,1]=4 1810 B10R0.1 CCCCCCC(=O)CCC 1458a_100000211992_100000210757 [0,0,1,0,0,0|1,0,0]=2 1811 B10R0.1 CCCCCCC(=O)CCC 1458a_100102632555_100000210303 [0,0,1,0,0,0|1,0,0]=2 1812 B10R0.1 CCCCCCC(=O)CCF 1458a_100102632555_100011217306 [0,0,1,0,0,0|2,0,0]=3 1813 B10R0.1 CCCCCCC(=O)CCO 1458a_100011216618_100000210757 [0,0,1,0,0,0|2,0,0]=3 1814 B10R0.1 CCCCCCC(=O)CCO 1458a_100102632555_100000211926 [0,0,1,0,0,0|2,0,0]=3 1815 B10R0.1 CCCCCCC(=O)COC 1458a_100000210968_100000210757 [0,0,1,0,0,0|2,0,0]=3 1816 B10R0.1 CCCCCCC(=O)CSC 1458a_100000184570_100000210757 [0,0,1,0,0,0|2,0,0]=3 1817 B10R0.1 CCCCCCC(=O)NCC 11a_100015525214_100102632555 [0,0,1,0,0,0|1,0,0]=2 1818 B10R0.1 CCCCCCC(=O)NCC 240690a_100015525214_100102632555 [0,0,1,0,0,0|1,0,0]=2 1819 B10R0.1 CCCCCCC(=O)NCC 527a_100015525214_100102632555 [0,0,1,0,0,0|1,0,0]=2 1820 B10R0.1 CCCCCCC(=O)NNC 22a_100016993582_100102632555 [0,0,1,0,0,0|2,0,0]=3 1821 B10R0.1 CCCCCCC(C)NCC 2230a_100000210919_100000210202 [0,0,1,0,0,0|2,0,1]=4 1822 B10R0.1 CCCCCCC(C)NCC 2230a_100015525214_100011215978 [0,0,1,0,0,0|2,0,1]=4 1823 B10R0.1 CCCCCCC(C)NCC 270004a_100015525214_100000210826 [0,0,1,0,0,0|2,0,1]=4 1824 B10R0.1 CCCCCCC(C)NCC 34a_100000210919_100000210202 [0,0,1,0,0,0|2,0,1]=4 1825 B10R0.1 CCCCCCC(C)OCC 34a_100000210265_100000210202 [0,0,1,0,0,0|1,0,1]=3 1826 B10R0.1 CCCCCCC(C)OCC 34a_100121572206_100011215978 [0,0,1,0,0,0|1,0,1]=3 1827 B10R0.1 CCCCCCC(C)OCC 7a_100000210265_100000210202 [0,0,1,0,0,0|1,0,1]=3 1828 B10R0.1 CCCCCCC(C)OCF 34a_100000210265_100015361967 [0,0,1,0,0,0|2,0,1]=4 1829 B10R0.1 CCCCCCC(C)OCF 7a_100000210265_100015361967 [0,0,1,0,0,0|2,0,1]=4 1830 B10R0.1 CCCCCCC(C)SCC 62a_100000210202_100011215978 [0,0,1,0,0,0|1,1,1]=4 1831 B10R0.1 CCCCCCC(C)SCC 62a_100011215978_100000210202 [0,0,1,0,0,0|1,1,1]=4 1832 B10R0.1 CCCCCCN(C)CCC 2230a_100000747261_100000210314 [0,0,1,0,0,0|3,0,0]=4 1833 B10R0.1 CCCCCCN(C)CCC 2230a_106256046315_100000210303 [0,0,1,0,0,0|3,0,0]=4 1834 B10R0.1 CCCCCCN(C)CCC 269982a_100000747261_100000210757 [0,0,1,0,0,0|3,0,0]=4 1835 B10R0.1 CCCCCCN(C)CCC 269982a_106256046315_100000210303 [0,0,1,0,0,0|3,0,0]=4 1836 B10R0.1 CCCCCNC(=O)CCC 11a_100000209983_100000211992 [0,0,1,0,0,0|2,0,0]=3 1837 B10R0.1 CCCCCNC(=O)CCC 1626a_100000209983_100000211992 [0,0,1,0,0,0|2,0,0]=3 1838 B10R0.1 CCCCCNC(=O)CCC 240690a_100000209983_100000211992 [0,0,1,0,0,0|2,0,0]=3 1839 B10R0.1 CCCCCNC(=O)CCC 527a_100000209983_100000211992 [0,0,1,0,0,0|2,0,0]=3 1840 B10R0.1 CCCCCNC(=O)CCO 240690a_100000209983_100011216618 [0,0,1,0,0,0|3,0,0]=4 1841 B10R0.1 CCCCCNC(=O)CNC 2230a_106832991635_100000230301 [0,0,1,0,0,0|3,0,0]=4 1842 B10R0.1 CCCCCNC(=O)CNC 34a_100102657272_100000230301 [0,0,1,0,0,0|3,0,0]=4 1843 B10R0.1 CCCCCNC(=O)CNC 7a_106832991635_100000230301 [0,0,1,0,0,0|3,0,0]=4 1844 B10R0.1 CCCCCNC(=O)COC 11a_100000209983_100000210968 [0,0,1,0,0,0|3,0,0]=4 1845 B10R0.1 CCCCCNC(=O)COC 1626a_100000209983_100000210968 [0,0,1,0,0,0|3,0,0]=4 1846 B10R0.1 CCCCCNC(=O)COC 240690a_100000209983_100000210968 [0,0,1,0,0,0|3,0,0]=4 1847 B10R0.1 CCCCCNC(=O)COC 34a_100138415774_100000230301 [0,0,1,0,0,0|3,0,0]=4 1848 B10R0.1 CCCCCNC(=O)COC 527a_100000209983_100000210968 [0,0,1,0,0,0|3,0,0]=4 1849 B10R0.1 CCCCCNC(=O)CSC 11a_100000209983_100000184570 [0,0,1,0,0,0|3,0,0]=4 1850 B10R0.1 CCCCCNC(=O)CSC 1626a_100000209983_100000184570 [0,0,1,0,0,0|3,0,0]=4 1851 B10R0.1 CCCCCNC(=O)CSC 240690a_100000209983_100000184570 [0,0,1,0,0,0|3,0,0]=4 1852 B10R0.1 CCCCCNC(=O)CSC 527a_100000209983_100000184570 [0,0,1,0,0,0|3,0,0]=4 1853 B10R0.1 CCCCCNC(=O)CSC 62a_100000230301_200000210301 [0,0,1,0,0,0|3,0,0]=4 1854 B10R0.1 CCCCCNC(=O)CSC 62a_200000210301_100000230301 [0,0,1,0,0,0|3,0,0]=4 1855 B10R0.1 CCCCCNC(=O)CS[13CH3] 62a_100000230301_200025704644 [0,0,1,0,0,0|3,0,0]=4 1856 B10R0.1 CCCCCNC(=O)CS[13CH3] 62a_200025704644_100000230301 [0,0,1,0,0,0|3,0,0]=4 1857 B10R0.1 CCCCCNC(=O)NCC 2708a_100000209983_100015525214 [0,0,1,0,0,0|2,0,0]=3 1858 B10R0.1 CCCCCNC(=O)NCC 2708a_100015525214_100000209983 [0,0,1,0,0,0|2,0,0]=3 1859 B10R0.1 CCCCCNC(=O)NCC 273464a_100000209983_100015525214 [0,0,1,0,0,0|2,0,0]=3 1860 B10R0.1 CCCCCNC(=O)NCC 273464a_100015525214_100000209983 [0,0,1,0,0,0|2,0,0]=3 1861 B10R0.1 CCCCCNC(=O)NCC 512a_100000209983_100015525214 [0,0,1,0,0,0|2,0,0]=3 1862 B10R0.1 CCCCCNC(=O)NCC 512a_100015525214_100000209983 [0,0,1,0,0,0|2,0,0]=3 1863 B10R0.1 CCCCCNC(=O)NNC 273464a_100000209983_100016993582 [0,0,1,0,0,0|3,0,0]=4 1864 B10R0.1 CCCCCNC(=O)NNC 512a_100000209983_100016993582 [0,0,1,0,0,0|3,0,0]=4 1865 B10R0.1 CCCCCNC(=O)NNC 512a_100016993582_100000209983 [0,0,1,0,0,0|3,0,0]=4 1866 B10R0.1 CCCCNCC(=O)CCC 2230a_100000102301_100000747444 [0,0,1,0,0,0|2,0,0]=3 1867 B10R0.1 CCCCNCC(=O)CCC 7a_106832991798_100000747444 [0,0,1,0,0,0|2,0,0]=3 1868 B10R0.1 CCCCNCC(=O)NCC 2230a_100000102301_100000183381 [0,0,1,0,0,0|2,0,0]=3 1869 B10R0.1 CCCCNCC(=O)NCC 2230a_100016988866_100000210211 [0,0,1,0,0,0|2,0,0]=3 1870 B10R0.1 CCCCNCC(=O)NCC 7a_106832991798_100000183381 [0,0,1,0,0,0|2,0,0]=3 1871 B10R0.1 CCCCNCC(=O)NCO 2230a_100000102301_100000185155 [0,0,1,0,0,0|3,0,0]=4 1872 B10R0.1 CCCCNCC(=O)NCO 7a_106832991798_100000185155 [0,0,1,0,0,0|3,0,0]=4 1873 B10R0.1 CCCCNCC(=O)OCC 2230a_100000102301_100000188475 [0,0,1,0,0,0|1,0,0]=2 1874 B10R0.1 CCCCNCC(=O)OCC 7a_106832991798_100000188475 [0,0,1,0,0,0|1,0,0]=2 1875 B10R0.1 CCCCNNC(=O)CCC 22a_100025702795_100000211992 [0,0,1,0,0,0|3,0,0]=4 1876 B10R0.1 CCCCNNC(=O)NCC 273464a_100015525214_100025702795 [0,0,1,0,0,0|3,0,0]=4 1877 B10R0.1 CCCCNNC(=O)NCC 512a_100015525214_100025702795 [0,0,1,0,0,0|3,0,0]=4 1878 B10R0.1 CCCCNNC(=O)NCC 512a_100025702795_100015525214 [0,0,1,0,0,0|3,0,0]=4 1879 B10R0.1 CCCCOCC(=O)CCC 1458a_100000211992_100011995733 [0,0,1,0,0,0|2,0,0]=3 1880 B10R0.1 CCCCOCC(=O)CCC 1458a_100000757543_100000210303 [0,0,1,0,0,0|2,0,0]=3 1881 B10R0.1 CCCCOCC(=O)CCC 7a_100000210227_100000747444 [0,0,1,0,0,0|2,0,0]=3 1882 B10R0.1 CCCCOCC(=O)CCF 1458a_100000757543_100011217306 [0,0,1,0,0,0|3,0,0]=4 1883 B10R0.1 CCCCOCC(=O)CCO 1458a_100000757543_100000211926 [0,0,1,0,0,0|3,0,0]=4 1884 B10R0.1 CCCCOCC(=O)CCO 1458a_100011216618_100011995733 [0,0,1,0,0,0|3,0,0]=4 1885 B10R0.1 CCCCOCC(=O)COC 1458a_100000210968_100011995733 [0,0,1,0,0,0|3,0,0]=4 1886 B10R0.1 CCCCOCC(=O)CSC 1458a_100000184570_100011995733 [0,0,1,0,0,0|3,0,0]=4 1887 B10R0.1 CCCCOCC(=O)NCC 11a_100015525214_100000757543 [0,0,1,0,0,0|2,0,0]=3 1888 B10R0.1 CCCCOCC(=O)NCC 240690a_100015525214_100000757543 [0,0,1,0,0,0|2,0,0]=3 1889 B10R0.1 CCCCOCC(=O)NCC 34a_100000210227_100000183381 [0,0,1,0,0,0|2,0,0]=3 1890 B10R0.1 CCCCOCC(=O)NCC 527a_100015525214_100000757543 [0,0,1,0,0,0|2,0,0]=3 1891 B10R0.1 CCCCOCC(=O)NCC 7a_100000210227_100000183381 [0,0,1,0,0,0|2,0,0]=3 1892 B10R0.1 CCCCOCC(=O)NCO 34a_100000210227_100000185155 [0,0,1,0,0,0|3,0,0]=4 1893 B10R0.1 CCCCOCC(=O)NCO 7a_100000210227_100000185155 [0,0,1,0,0,0|3,0,0]=4 1894 B10R0.1 CCCCOCC(=O)NNC 22a_100016993582_100000757543 [0,0,1,0,0,0|3,0,0]=4 1895 B10R0.1 CCCCOCC(=O)OCC 34a_100000210227_100000188475 [0,0,1,0,0,0|1,0,0]=2 1896 B10R0.1 CCCCOCC(=O)OCC 7a_100000210227_100000188475 [0,0,1,0,0,0|1,0,0]=2 1897 B10R0.1 CCCCOCC(C)OCC 34a_100011217071_100000210202 [0,0,1,0,0,0|2,0,1]=4 1898 B10R0.1 CCCCOCC(C)OCC 7a_100011217071_100000210202 [0,0,1,0,0,0|2,0,1]=4 1899 B10R0.1 CCCCSCC(=O)CCC 1458a_100000191162_100000210303 [0,0,1,0,0,0|2,0,0]=3 1900 B10R0.1 CCCCSCC(=O)CCC 62a_100000210211_100000747444 [0,0,1,0,0,0|2,0,0]=3 1901 B10R0.1 CCCCSCC(=O)CCC 62a_100000747444_100000210210 [0,0,1,0,0,0|2,0,0]=3 1902 B10R0.1 CCCCSCC(=O)CCF 1458a_100000191162_100011217306 [0,0,1,0,0,0|3,0,0]=4 1903 B10R0.1 CCCCSCC(=O)CCO 1458a_100000191162_100000211926 [0,0,1,0,0,0|3,0,0]=4 1904 B10R0.1 CCCCSCC(=O)NCC 11a_100015525214_100000191162 [0,0,1,0,0,0|2,0,0]=3 1905 B10R0.1 CCCCSCC(=O)NCC 240690a_100015525214_100000191162 [0,0,1,0,0,0|2,0,0]=3 1906 B10R0.1 CCCCSCC(=O)NCC 527a_100015525214_100000191162 [0,0,1,0,0,0|2,0,0]=3 1907 B10R0.1 CCCCSCC(=O)NCC 62a_100000183381_100000210210 [0,0,1,0,0,0|2,0,0]=3 1908 B10R0.1 CCCCSCC(=O)NCC 62a_100000210211_100000183381 [0,0,1,0,0,0|2,0,0]=3 1909 B10R0.1 CCCCSCC(=O)NCO 62a_100000185155_100000210210 [0,0,1,0,0,0|3,0,0]=4 1910 B10R0.1 CCCCSCC(=O)NCO 62a_100000210211_100000185155 [0,0,1,0,0,0|3,0,0]=4 1911 B10R0.1 CCCCSCC(=O)NNC 22a_100016993582_100000191162 [0,0,1,0,0,0|3,0,0]=4 1912 B10R0.1 CCCCSCC(=O)OCC 62a_100000188475_100000210210 [0,0,1,0,0,0|1,0,0]=2 1913 B10R0.1 CCCCSCC(=O)OCC 62a_100000210211_100000188475 [0,0,1,0,0,0|1,0,0]=2 1914 B10R0.1 CCCNCCC(=O)NCC 34a_100025743525_100000210303 [0,0,1,0,0,0|2,0,0]=3 1915 B10R0.1 CCCNN=CC(=O)OCC 4a_100000740057_100000742314 [0,0,1,0,0,0|2,0,1]=4 1916 B10R0.1 CCCOCCC(=O)CCC 1458a_100000211992_100011215938 [0,0,1,0,0,0|2,0,0]=3 1917 B10R0.1 CCCOCCC(=O)CCO 1458a_100011216618_100011215938 [0,0,1,0,0,0|3,0,0]=4 1918 B10R0.1 CCCOCCC(=O)COC 1458a_100000210968_100011215938 [0,0,1,0,0,0|3,0,0]=4 1919 B10R0.1 CCCOCCC(=O)CSC 1458a_100000184570_100011215938 [0,0,1,0,0,0|3,0,0]=4 1920 B10R0.1 CCCOCCC(=O)OCC 34a_100000210258_100000765890 [0,0,1,0,0,0|1,0,0]=2 1921 B10R0.1 CCCOCOC(=O)CCC 34a_100000210258_100000034017 [0,0,1,0,0,0|3,0,0]=4 1922 B10R0.1 CCCSCCC(=O)NCC 62a_100000210303_100000737597 [0,0,1,0,0,0|2,0,0]=3 1923 B10R0.1 CCCSCCC(=O)NCC 62a_100000737597_100000210303 [0,0,1,0,0,0|2,0,0]=3 1924 B10R0.1 CCCSCCC(=O)OCC 62a_100000210303_100000765890 [0,0,1,0,0,0|1,0,0]=2 1925 B10R0.1 CCCSCCC(=O)OCC 62a_100000765890_100000210303 [0,0,1,0,0,0|1,0,0]=2 1926 B10R0.1 CCCSCOC(=O)CCC 62a_100000210303_100000034017 [0,0,1,0,0,0|3,0,0]=4 1927 B10R0.1 CCCSCOC(=O)OCC 62a_100000210303_100000075025 [0,0,1,0,0,0|2,0,0]=3 1928 B10R0.1 CCNC(=O)CCCCCO 240690a_100015525214_100102619762 [0,0,1,0,0,0|2,0,0]=3 1929 B10R0.1 CCNC(=O)CCNCCF 34a_100025743525_100011217306 [0,0,1,0,0,0|3,0,0]=4 1930 B10R0.1 CCNC(=O)CCNCCO 2230a_100016997473_100000737597 [0,0,1,0,0,0|3,0,0]=4 1931 B10R0.1 CCNC(=O)CCNCCO 34a_100025743525_100000211926 [0,0,1,0,0,0|3,0,0]=4 1932 B10R0.1 CCNC(=O)CCNCSC 34a_100025743525_100011218213 [0,0,1,0,0,0|3,0,0]=4 1933 B10R0.1 CCNC(=O)CCOCCO 240690a_100015525214_100011229844 [0,0,1,0,0,0|3,0,0]=4 1934 B10R0.1 CCNC(=O)CCSCCF 62a_100000737597_100011217306 [0,0,1,0,0,0|3,0,0]=4 1935 B10R0.1 CCNC(=O)CCSCCF 62a_100011217306_100000737597 [0,0,1,0,0,0|3,0,0]=4 1936 B10R0.1 CCNC(=O)CCSCCO 62a_100000211926_100000737597 [0,0,1,0,0,0|3,0,0]=4 1937 B10R0.1 CCNC(=O)CCSCCO 62a_100000737597_100000211926 [0,0,1,0,0,0|3,0,0]=4 1938 B10R0.1 CCNC(=O)CCSCOC 62a_100000737597_100000766300 [0,0,1,0,0,0|3,0,0]=4 1939 B10R0.1 CCNC(=O)CCSCOC 62a_100000766300_100000737597 [0,0,1,0,0,0|3,0,0]=4 1940 B10R0.1 CCNC(=O)CCSCSC 62a_100000737597_100011218213 [0,0,1,0,0,0|3,0,0]=4 1941 B10R0.1 CCNC(=O)CCSCSC 62a_100011218213_100000737597 [0,0,1,0,0,0|3,0,0]=4 1942 B10R0.1 CCNC(=O)CNCCCF 2230a_100015189416_100000183381 [0,0,1,0,0,0|3,0,0]=4 1943 B10R0.1 CCNC(=O)CNCCCF 2230a_100016988866_100011934791 [0,0,1,0,0,0|3,0,0]=4 1944 B10R0.1 CCNC(=O)CNCCCF 34a_100015189416_100000183381 [0,0,1,0,0,0|3,0,0]=4 1945 B10R0.1 CCNC(=O)CNCCCO 2230a_100016988866_100000230001 [0,0,1,0,0,0|3,0,0]=4 1946 B10R0.1 CCNC(=O)CNCCOC 2230a_100000209980_100000183381 [0,0,1,0,0,0|3,0,0]=4 1947 B10R0.1 CCNC(=O)CNCCOC 2230a_100016988866_100011201679 [0,0,1,0,0,0|3,0,0]=4 1948 B10R0.1 CCNC(=O)CNCCSC 2230a_100016988866_100000751147 [0,0,1,0,0,0|3,0,0]=4 1949 B10R0.1 CCNC(=O)CNCCSC 2230a_100020590264_100000183381 [0,0,1,0,0,0|3,0,0]=4 1950 B10R0.1 CCNC(=O)COCCCBr 34a_100011217188_100000183381 [0,0,1,0,0,0|3,0,0]=4 1951 B10R0.1 CCNC(=O)COCCCCl 34a_100000230001_100000183381 [0,0,1,0,0,0|3,0,0]=4 1952 B10R0.1 CCNC(=O)COCCCF 34a_100000759539_100000183381 [0,0,1,0,0,0|3,0,0]=4 1953 B10R0.1 CCNC(=O)COCCCN 34a_100000182051_100000183381 [0,0,1,0,0,0|3,0,0]=4 1954 B10R0.1 CCNC(=O)COCCOC 11a_100015525214_100000211095 [0,0,1,0,0,0|3,0,0]=4 1955 B10R0.1 CCNC(=O)COCCOC 240690a_100015525214_100000211095 [0,0,1,0,0,0|3,0,0]=4 1956 B10R0.1 CCNC(=O)COCCOC 34a_100000210237_100000183381 [0,0,1,0,0,0|3,0,0]=4 1957 B10R0.1 CCNC(=O)COCCOC 527a_100015525214_100000211095 [0,0,1,0,0,0|3,0,0]=4 1958 B10R0.1 CCNC(=O)COCCSC 34a_100000230434_100000183381 [0,0,1,0,0,0|3,0,0]=4 1959 B10R0.1 CCNC(=O)COCCSC 7a_100000230434_100000183381 [0,0,1,0,0,0|3,0,0]=4 1960 B10R0.1 CCNC(=O)CSCCCF 62a_100000183381_100011934791 [0,0,1,0,0,0|3,0,0]=4 1961 B10R0.1 CCNC(=O)CSCCCF 62a_100011934791_100000183381 [0,0,1,0,0,0|3,0,0]=4 1962 B10R0.1 CCNC(=O)CSCCCO 62a_100000183381_100011215043 [0,0,1,0,0,0|3,0,0]=4 1963 B10R0.1 CCNC(=O)CSCCCO 62a_100011215043_100000183381 [0,0,1,0,0,0|3,0,0]=4 1964 B10R0.1 CCNC(=O)CSCCOC 62a_100000183381_100000233755 [0,0,1,0,0,0|3,0,0]=4 1965 B10R0.1 CCNC(=O)CSCCOC 62a_100000233755_100000183381 [0,0,1,0,0,0|3,0,0]=4 1966 B10R0.1 CCNC(=O)CSCCSC 62a_100000183381_100000751147 [0,0,1,0,0,0|3,0,0]=4 1967 B10R0.1 CCNC(=O)CSCCSC 62a_100000212216_100000183381 [0,0,1,0,0,0|3,0,0]=4 1968 B10R0.1 CCNC(=O)CSCOCC 62a_100000183381_100000739092 [0,0,1,0,0,0|3,0,0]=4 1969 B10R0.1 CCNC(=O)CSCOCC 62a_100000739092_100000183381 [0,0,1,0,0,0|3,0,0]=4 1970 B10R0.1 CCNC(=O)NCCCCO 2708a_100000750430_100015525214 [0,0,1,0,0,0|3,0,0]=4 1971 B10R0.1 CCNC(=O)NCCCCO 2708a_100015525214_100000750430 [0,0,1,0,0,0|3,0,0]=4 1972 B10R0.1 CCNC(=O)NCCCCO 273464a_100000750430_100015525214 [0,0,1,0,0,0|3,0,0]=4 1973 B10R0.1 CCNC(=O)NCCCCO 273464a_100015525214_100000750430 [0,0,1,0,0,0|3,0,0]=4 1974 B10R0.1 CCNC(=O)NCCCCO 512a_100000750430_100015525214 [0,0,1,0,0,0|3,0,0]=4 1975 B10R0.1 CCNC(=O)NCCCCO 512a_100015525214_100000750430 [0,0,1,0,0,0|3,0,0]=4 1976 B10R0.1 CCNC(=O)NCCCOC 2708a_100015525214_100150723488 [0,0,1,0,0,0|3,0,0]=4 1977 B10R0.1 CCNC(=O)NCCCOC 2708a_100150723488_100015525214 [0,0,1,0,0,0|3,0,0]=4 1978 B10R0.1 CCNC(=O)NCCCOC 273464a_100015525214_100150723488 [0,0,1,0,0,0|3,0,0]=4 1979 B10R0.1 CCNC(=O)NCCCOC 273464a_100150723488_100015525214 [0,0,1,0,0,0|3,0,0]=4 1980 B10R0.1 CCNC(=O)NCCCOC 512a_100015525214_100150723488 [0,0,1,0,0,0|3,0,0]=4 1981 B10R0.1 CCNC(=O)NCCCSC 2708a_100000749238_100015525214 [0,0,1,0,0,0|3,0,0]=4 1982 B10R0.1 CCNC(=O)NCCCSC 2708a_100015525214_100000749238 [0,0,1,0,0,0|3,0,0]=4 1983 B10R0.1 CCNC(=O)NCCCSC 273464a_100000749238_100015525214 [0,0,1,0,0,0|3,0,0]=4 1984 B10R0.1 CCNC(=O)NCCCSC 273464a_100015525214_100000749238 [0,0,1,0,0,0|3,0,0]=4 1985 B10R0.1 CCNC(=O)NCCCSC 512a_100000749238_100015525214 [0,0,1,0,0,0|3,0,0]=4 1986 B10R0.1 CCNC(=O)NCCCSC 512a_100015525214_100000749238 [0,0,1,0,0,0|3,0,0]=4 1987 B10R0.1 CCNC(=O)NCCOCC 2708a_100011200944_100015525214 [0,0,1,0,0,0|3,0,0]=4 1988 B10R0.1 CCNC(=O)NCCOCC 2708a_100015525214_100011200944 [0,0,1,0,0,0|3,0,0]=4 1989 B10R0.1 CCNC(=O)NCCOCC 273464a_100015525214_102516460346 [0,0,1,0,0,0|3,0,0]=4 1990 B10R0.1 CCNC(=O)NCCOCC 273464a_102516460346_100015525214 [0,0,1,0,0,0|3,0,0]=4 1991 B10R0.1 CCNC(=O)NCCOCC 512a_100011200944_100015525214 [0,0,1,0,0,0|3,0,0]=4 1992 B10R0.1 CCNC(=O)NCCOCC 512a_100015525214_100011200944 [0,0,1,0,0,0|3,0,0]=4 1993 B10R0.1 CCNC(=O)NCCSCC 2708a_100000106463_100015525214 [0,0,1,0,0,0|3,0,0]=4 1994 B10R0.1 CCNC(=O)NCCSCC 2708a_100015525214_100000106463 [0,0,1,0,0,0|3,0,0]=4 1995 B10R0.1 CCNC(=O)NCCSCC 273464a_100000106463_100015525214 [0,0,1,0,0,0|3,0,0]=4 1996 B10R0.1 CCNC(=O)NCCSCC 273464a_100015525214_100000106463 [0,0,1,0,0,0|3,0,0]=4 1997 B10R0.1 CCNC(=O)NCCSCC 512a_100000106463_100015525214 [0,0,1,0,0,0|3,0,0]=4 1998 B10R0.1 CCNC(=O)NCCSCC 512a_100015525214_100000106463 [0,0,1,0,0,0|3,0,0]=4 1999 B10R0.1 CCNC/C=C/C(=O)OCC 2230a_100015525214_100016267167 [0,0,1,0,0,0|1,0,2]=4 2000 B10R0.1 CCNCCCC(=O)OCC 2230a_100015525214_100009991533 [0,0,1,0,0,0|1,0,0]=2 2001 B10R0.1 CCOC(=O)/C=C/CSCC 62a_100000210202_100016267167 [0,0,1,0,0,0|1,0,2]=4 2002 B10R0.1 CCOC(=O)/C=C/CSCC 62a_100016267167_100000210202 [0,0,1,0,0,0|1,0,2]=4 2003 B10R0.1 CCOC(=O)CCCCNC 2230a_106832991635_100000750268 [0,0,1,0,0,0|1,0,0]=2 2004 B10R0.1 CCOC(=O)CCCCNC 34a_100102657272_100000750268 [0,0,1,0,0,0|1,0,0]=2 2005 B10R0.1 CCOC(=O)CCCCNC 7a_106832991635_100000750268 [0,0,1,0,0,0|1,0,0]=2 2006 B10R0.1 CCOC(=O)CCCCOC 34a_100138415774_100000750268 [0,0,1,0,0,0|1,0,0]=2 2007 B10R0.1 CCOC(=O)CCCCSC 62a_100000750268_200000210301 [0,0,1,0,0,0|1,0,0]=2 2008 B10R0.1 CCOC(=O)CCCCSC 62a_200000210301_100000750268 [0,0,1,0,0,0|1,0,0]=2 2009 B10R0.1 CCOC(=O)CCCCS[13CH3] 62a_100000750268_200025704644 [0,0,1,0,0,0|1,0,0]=2 2010 B10R0.1 CCOC(=O)CCCCS[13CH3] 62a_200025704644_100000750268 [0,0,1,0,0,0|1,0,0]=2 2011 B10R0.1 CCOC(=O)CCCOCF 7a_100012001163_100015361967 [0,0,1,0,0,0|2,0,0]=3 2012 B10R0.1 CCOC(=O)CCCSCC 62a_100000210202_100009991533 [0,0,1,0,0,0|1,0,0]=2 2013 B10R0.1 CCOC(=O)CCCSCC 62a_100009991533_100000210202 [0,0,1,0,0,0|1,0,0]=2 2014 B10R0.1 CCOC(=O)CCCSCF 62a_100009991533_100015361967 [0,0,1,0,0,0|2,0,0]=3 2015 B10R0.1 CCOC(=O)CCCSCF 62a_100015361967_100009991533 [0,0,1,0,0,0|2,0,0]=3 2016 B10R0.1 CCOC(=O)CCNCCF 34a_100000724931_100000765890 [0,0,1,0,0,0|2,0,0]=3 2017 B10R0.1 CCOC(=O)CCNCCO 2230a_100016997473_100011206558 [0,0,1,0,0,0|2,0,0]=3 2018 B10R0.1 CCOC(=O)CCNCCO 34a_100016990907_100000765890 [0,0,1,0,0,0|2,0,0]=3 2019 B10R0.1 CCOC(=O)CCOCCBr 34a_100000211926_100000765890 [0,0,1,0,0,0|2,0,0]=3 2020 B10R0.1 CCOC(=O)CCOCCN 34a_100000210304_100000765890 [0,0,1,0,0,0|2,0,0]=3 2021 B10R0.1 CCOC(=O)CCSCC#N 62a_100000765890_100011215382 [0,0,1,0,0,0|2,0,1]=4 2022 B10R0.1 CCOC(=O)CCSCC#N 62a_100011215382_100000765890 [0,0,1,0,0,0|2,0,1]=4 2023 B10R0.1 CCOC(=O)CCSCC=O 62a_100000765890_200015260668 [0,0,1,0,0,0|2,0,1]=4 2024 B10R0.1 CCOC(=O)CCSCC=O 62a_200015260668_100000765890 [0,0,1,0,0,0|2,0,1]=4 2025 B10R0.1 CCOC(=O)CCSCCF 62a_100000765890_100011217306 [0,0,1,0,0,0|2,0,0]=3 2026 B10R0.1 CCOC(=O)CCSCCF 62a_100011217306_100000765890 [0,0,1,0,0,0|2,0,0]=3 2027 B10R0.1 CCOC(=O)CCSCCO 62a_100000211926_100000765890 [0,0,1,0,0,0|2,0,0]=3 2028 B10R0.1 CCOC(=O)CCSCCO 62a_100000765890_100000211926 [0,0,1,0,0,0|2,0,0]=3 2029 B10R0.1 CCOC(=O)CCSCOC 62a_100000765890_100000766300 [0,0,1,0,0,0|2,0,0]=3 2030 B10R0.1 CCOC(=O)CCSCOC 62a_100000766300_100000765890 [0,0,1,0,0,0|2,0,0]=3 2031 B10R0.1 CCOC(=O)CCSCSC 62a_100000765890_100011218213 [0,0,1,0,0,0|2,0,0]=3 2032 B10R0.1 CCOC(=O)CCSCSC 62a_100011218213_100000765890 [0,0,1,0,0,0|2,0,0]=3 2033 B10R0.1 CCOC(=O)CNCCCF 2230a_100015189416_100000188475 [0,0,1,0,0,0|2,0,0]=3 2034 B10R0.1 CCOC(=O)CNCCCF 34a_100015189416_100000188475 [0,0,1,0,0,0|2,0,0]=3 2035 B10R0.1 CCOC(=O)CNCCOC 2230a_100000209980_100000188475 [0,0,1,0,0,0|2,0,0]=3 2036 B10R0.1 CCOC(=O)CNCCSC 2230a_100020590264_100000188475 [0,0,1,0,0,0|2,0,0]=3 2037 B10R0.1 CCOC(=O)COCCCBr 34a_100011217188_100000188475 [0,0,1,0,0,0|2,0,0]=3 2038 B10R0.1 CCOC(=O)COCCCCl 34a_100000230001_100000188475 [0,0,1,0,0,0|2,0,0]=3 2039 B10R0.1 CCOC(=O)COCCCF 34a_100000759539_100000188475 [0,0,1,0,0,0|2,0,0]=3 2040 B10R0.1 CCOC(=O)COCCCN 34a_100000182051_100000188475 [0,0,1,0,0,0|2,0,0]=3 2041 B10R0.1 CCOC(=O)COCCNC 2230a_106832991635_100000088970 [0,0,1,0,0,0|2,0,0]=3 2042 B10R0.1 CCOC(=O)COCCNC 34a_100102657272_100000088970 [0,0,1,0,0,0|2,0,0]=3 2043 B10R0.1 CCOC(=O)COCCNC 7a_106832991635_100000088970 [0,0,1,0,0,0|2,0,0]=3 2044 B10R0.1 CCOC(=O)COCCOC 34a_100000210237_100000188475 [0,0,1,0,0,0|2,0,0]=3 2045 B10R0.1 CCOC(=O)COCCOC 34a_100138415774_100000088970 [0,0,1,0,0,0|2,0,0]=3 2046 B10R0.1 CCOC(=O)COCCON 34a_100000700252_100000188475 [0,0,1,0,0,0|3,0,0]=4 2047 B10R0.1 CCOC(=O)COCCSC 34a_100000230434_100000188475 [0,0,1,0,0,0|2,0,0]=3 2048 B10R0.1 CCOC(=O)COCCSC 62a_100000088970_200000210301 [0,0,1,0,0,0|2,0,0]=3 2049 B10R0.1 CCOC(=O)COCCSC 62a_200000210301_100000088970 [0,0,1,0,0,0|2,0,0]=3 2050 B10R0.1 CCOC(=O)COCCSC 7a_100000230434_100000188475 [0,0,1,0,0,0|2,0,0]=3 2051 B10R0.1 CCOC(=O)COCCS[13CH3] 62a_100000088970_200025704644 [0,0,1,0,0,0|2,0,0]=3 2052 B10R0.1 CCOC(=O)COCCS[13CH3] 62a_200025704644_100000088970 [0,0,1,0,0,0|2,0,0]=3 2053 B10R0.1 CCOC(=O)CSCCC#N 62a_100000188475_100011215226 [0,0,1,0,0,0|2,0,1]=4 2054 B10R0.1 CCOC(=O)CSCCC#N 62a_100011215226_100000188475 [0,0,1,0,0,0|2,0,1]=4 2055 B10R0.1 CCOC(=O)CSCCCF 62a_100000188475_100011934791 [0,0,1,0,0,0|2,0,0]=3 2056 B10R0.1 CCOC(=O)CSCCCF 62a_100011934791_100000188475 [0,0,1,0,0,0|2,0,0]=3 2057 B10R0.1 CCOC(=O)CSCCCO 62a_100000188475_100011215043 [0,0,1,0,0,0|2,0,0]=3 2058 B10R0.1 CCOC(=O)CSCCCO 62a_100011215043_100000188475 [0,0,1,0,0,0|2,0,0]=3 2059 B10R0.1 CCOC(=O)CSCCOC 62a_100000188475_100000233755 [0,0,1,0,0,0|2,0,0]=3 2060 B10R0.1 CCOC(=O)CSCCOC 62a_100000233755_100000188475 [0,0,1,0,0,0|2,0,0]=3 2061 B10R0.1 CCOC(=O)CSCCOC 7a_200000230590_200000210301 [0,0,1,0,0,0|2,0,0]=3 2062 B10R0.1 CCOC(=O)CSCCO[13CH3] 7a_200000230590_200025704644 [0,0,1,0,0,0|2,0,0]=3 2063 B10R0.1 CCOC(=O)CSCCSC 62a_100000188475_100000751147 [0,0,1,0,0,0|2,0,0]=3 2064 B10R0.1 CCOC(=O)CSCCSC 62a_100000212216_100000188475 [0,0,1,0,0,0|2,0,0]=3 2065 B10R0.1 CCOC(=O)NCCOCF 34a_100000158857_100015361967 [0,0,1,0,0,0|3,0,0]=4 2066 B10R0.1 CCOC(=O)NCCSCC 62a_100000210202_200011445536 [0,0,1,0,0,0|2,0,0]=3 2067 B10R0.1 CCOC(=O)NCCSCF 62a_100015361967_200011445536 [0,0,1,0,0,0|3,0,0]=4 2068 B10R0.1 CCOC(=O)OCSCCF 62a_100011217306_100000075025 [0,0,1,0,0,0|3,0,0]=4 2069 B10R0.1 CCOC(=O)OCSCCO 62a_100000211926_100000075025 [0,0,1,0,0,0|3,0,0]=4 2070 B10R0.1 CCOC(=O)OCSCOC 62a_100000766300_100000075025 [0,0,1,0,0,0|3,0,0]=4 2071 B10R0.1 CCOC(=O)OCSCSC 62a_100011218213_100000075025 [0,0,1,0,0,0|3,0,0]=4 2072 B10R0.1 CCOC/C=C/C(=O)OCC 34a_100121572206_100016267167 [0,0,1,0,0,0|1,0,2]=4 2073 B10R0.1 CCOCCCC(=O)CCO 1458a_100011216618_100012232248 [0,0,1,0,0,0|3,0,0]=4 2074 B10R0.1 CCOCCCC(=O)COC 1458a_100000210968_100012232248 [0,0,1,0,0,0|3,0,0]=4 2075 B10R0.1 CCOCCCC(=O)CSC 1458a_100000184570_100012232248 [0,0,1,0,0,0|3,0,0]=4 2076 B10R0.1 CCOCCCC(=O)OCC 34a_100121572206_100009991533 [0,0,1,0,0,0|1,0,0]=2 2077 B10R0.1 CCOCCCC(=O)OCC 7a_100012001163_100000210202 [0,0,1,0,0,0|1,0,0]=2 2078 B10R0.1 CCOCCNC(=O)OCC 34a_100000158857_100000210202 [0,0,1,0,0,0|2,0,0]=3 2079 B10R0.1 CCOCSCC(=O)OCC 62a_100000188475_100000739092 [0,0,1,0,0,0|2,0,0]=3 2080 B10R0.1 CCOCSCC(=O)OCC 62a_100000739092_100000188475 [0,0,1,0,0,0|2,0,0]=3 2081 B10R0.1 CNNC(=O)CCCCCO 22a_100016993582_100102619762 [0,0,1,0,0,0|3,0,0]=4 2082 B10R0.1 COCC(=O)CCCCCF 1458a_100000210968_100000729378 [0,0,1,0,0,0|3,0,0]=4 2083 B10R0.1 COCC(=O)CCCCCO 1458a_100000210968_100000746330 [0,0,1,0,0,0|3,0,0]=4 2084 B10R0.1 COCCCCC(=O)CCO 1458a_100011216618_100000755781 [0,0,1,0,0,0|3,0,0]=4 2085 B10R0.1 COCCCCC(=O)COC 1458a_100000210968_100000755781 [0,0,1,0,0,0|3,0,0]=4 2086 B10R0.1 COCCCCC(=O)CSC 1458a_100000184570_100000755781 [0,0,1,0,0,0|3,0,0]=4 2087 B10R0.1 CSCC(=O)CCCCCF 1458a_100000184570_100000729378 [0,0,1,0,0,0|3,0,0]=4 2088 B10R0.1 CSCC(=O)CCCCCO 1458a_100000184570_100000746330 [0,0,1,0,0,0|3,0,0]=4 2089 B10R0.1 O=C(CCF)CCCCCO 1458a_100102619762_100011217306 [0,0,1,0,0,0|3,0,0]=4 2090 B10R0.1 O=C(CCO)CCCCCF 1458a_100011216618_100000729378 [0,0,1,0,0,0|3,0,0]=4 2091 B10R0.1 O=C(CCO)CCCCCO 1458a_100011216618_100000746330 [0,0,1,0,0,0|3,0,0]=4 2092 B10R0.1 O=C(CCO)CCCCCO 1458a_100102619762_100000211926 [0,0,1,0,0,0|3,0,0]=4 2093 B10R0.19 C#CCC(=O)C(C)CCCC 1458a_100000725509_100000184674 [0,0,1,0,0,0|1,0,2]=4 2094 B10R0.19 C#CCC(=O)C(C)CCCC 1458a_100011220946_200011215066 [0,0,1,0,0,0|1,0,2]=4 2095 B10R0.19 C#CCNC(C)C(=O)OCC 34a_100000212058_100011216346 [0,0,1,0,0,0|1,0,2]=4 2096 B10R0.19 C#CCOC(C)C(=O)OCC 34a_100000210247_100011216346 [0,0,1,0,0,0|1,0,2]=4 2097 B10R0.19 C#CCO[C@@H](C)C(=O)OCC 7a_100000751109_100000038162 [0,0,1,0,0,0|1,0,2]=4 2098 B10R0.19 C#CCSC(C)C(=O)OCC 62a_100000038162_100011216346 [0,0,1,0,0,0|1,0,2]=4 2099 B10R0.19 C=C(COCC)C(=O)OCC 34a_100121572206_100000755967 [0,0,1,0,0,0|1,0,2]=4 2100 B10R0.19 C=C(CSCC)C(=O)OCC 62a_100000210202_100000755967 [0,0,1,0,0,0|1,0,2]=4 2101 B10R0.19 C=C(CSCC)C(=O)OCC 62a_100000755967_100000210202 [0,0,1,0,0,0|1,0,2]=4 2102 B10R0.19 C=CCC(=O)C(C)CCCC 1458a_100000210193_200011215066 [0,0,1,0,0,0|1,0,2]=4 2103 B10R0.19 C=CCC(=O)C(C)CCCC 1458a_100000725509_100000210623 [0,0,1,0,0,0|1,0,2]=4 2104 B10R0.19 C=CCNC(C)C(=O)OCC 2230a_100020586998_100011215307 [0,0,1,0,0,0|1,0,2]=4 2105 B10R0.19 C=CCOC(C)C(=O)OCC 34a_200000210373_100011216346 [0,0,1,0,0,0|1,0,2]=4 2106 B10R0.19 C=CCO[C@@H](C)C(=O)OCC 7a_100000751109_100015514636 [0,0,1,0,0,0|1,0,2]=4 2107 B10R0.19 C=CCSC(C)C(=O)OCC 62a_100000210623_100011216346 [0,0,1,0,0,0|1,0,2]=4 2108 B10R0.19 C=CCSC(C)C(=O)OCC 62a_100011216346_100000210623 [0,0,1,0,0,0|1,0,2]=4 2109 B10R0.19 CC#CC(=O)C(C)CCCC 1458a_100000763181_200011215066 [0,0,1,0,0,0|1,0,1]=3 2110 B10R0.19 CC=CC(=O)C(C)CCCC 1458a_100000210699_200011215066 [0,0,1,0,0,0|1,0,1]=3 2111 B10R0.19 CC=CC(=O)N(C)CCCC 11a_100000207549_100000210699 [0,0,1,0,0,0|2,0,1]=4 2112 B10R0.19 CC=CC(=O)N(C)CCCC 1626a_100000207549_100000210699 [0,0,1,0,0,0|2,0,1]=4 2113 B10R0.19 CC=CC(=O)N(C)CCCC 240690a_100000207549_100000210699 [0,0,1,0,0,0|2,0,1]=4 2114 B10R0.19 CCC/C=C(\C)/C(=O)CCC 1458a_200020648666_100000210303 [0,0,1,0,0,0|1,0,2]=4 2115 B10R0.19 CCC/C=C(\C)/C(=O)NCC 11a_100015525214_200020648666 [0,0,1,0,0,0|1,0,2]=4 2116 B10R0.19 CCC/C=C(\C)/C(=O)NCC 240690a_100015525214_200020648666 [0,0,1,0,0,0|1,0,2]=4 2117 B10R0.19 CCCC(=O)C(O)CCSC 1458a_100000685904_100000210303 [0,0,1,0,0,0|3,0,0]=4 2118 B10R0.19 CCCC(=O)N(C)CCCO 240690a_100000213112_100000211992 [0,0,1,0,0,0|3,0,0]=4 2119 B10R0.19 CCCC(=O)N(C)CCCO 527a_100000213112_100000211992 [0,0,1,0,0,0|3,0,0]=4 2120 B10R0.19 CCCC(=O)N(C)CCOC 11a_100000743101_100000211992 [0,0,1,0,0,0|3,0,0]=4 2121 B10R0.19 CCCC(=O)N(C)CCOC 1626a_100000743101_100000211992 [0,0,1,0,0,0|3,0,0]=4 2122 B10R0.19 CCCC(=O)N(C)CCOC 240690a_100000743101_100000211992 [0,0,1,0,0,0|3,0,0]=4 2123 B10R0.19 CCCC(=O)N(C)CCOC 527a_100000743101_100000211992 [0,0,1,0,0,0|3,0,0]=4 2124 B10R0.19 CCCC(=O)N(C)CCSC 11a_100000686725_100000211992 [0,0,1,0,0,0|3,0,0]=4 2125 B10R0.19 CCCC(=O)N(C)CCSC 1626a_100000686725_100000211992 [0,0,1,0,0,0|3,0,0]=4 2126 B10R0.19 CCCC(=O)N(C)CCSC 240690a_100000686725_100000211992 [0,0,1,0,0,0|3,0,0]=4 2127 B10R0.19 CCCC(=O)N(C)CCSC 527a_100000686725_100000211992 [0,0,1,0,0,0|3,0,0]=4 2128 B10R0.19 CCCCC(=O)C(=O)NCC 1458a_200011297158_100000210211 [0,0,1,0,0,0|2,0,1]=4 2129 B10R0.19 CCCCC(C)C(=O)C=CBr 1458a_100016273825_200011215066 [0,0,1,0,0,0|2,0,1]=4 2130 B10R0.19 CCCCC(C)C(=O)C=CCl 1458a_200016279998_200011215066 [0,0,1,0,0,0|2,0,1]=4 2131 B10R0.19 CCCCC(C)C(=O)C=CI 1458a_100016256311_200011215066 [0,0,1,0,0,0|2,0,1]=4 2132 B10R0.19 CCCCC(C)C(=O)CC#N 1458a_100000725509_100011214920 [0,0,1,0,0,0|2,0,1]=4 2133 B10R0.19 CCCCC(C)C(=O)CC#N 1458a_100051588842_200011215066 [0,0,1,0,0,0|2,0,1]=4 2134 B10R0.19 CCCCC(C)C(=O)CCC 1458a_100000211992_200011215066 [0,0,1,0,0,0|1,0,0]=2 2135 B10R0.19 CCCCC(C)C(=O)CCC 1458a_100000725509_100000210303 [0,0,1,0,0,0|1,0,0]=2 2136 B10R0.19 CCCCC(C)C(=O)CCF 1458a_100000725509_100011217306 [0,0,1,0,0,0|2,0,0]=3 2137 B10R0.19 CCCCC(C)C(=O)CCO 1458a_100000725509_100000211926 [0,0,1,0,0,0|2,0,0]=3 2138 B10R0.19 CCCCC(C)C(=O)CCO 1458a_100011216618_200011215066 [0,0,1,0,0,0|2,0,0]=3 2139 B10R0.19 CCCCC(C)C(=O)COC 1458a_100000210968_200011215066 [0,0,1,0,0,0|2,0,0]=3 2140 B10R0.19 CCCCC(C)C(=O)CSC 1458a_100000184570_200011215066 [0,0,1,0,0,0|2,0,0]=3 2141 B10R0.19 CCCCC(C)C(=O)NCC 11a_100015525214_100000725509 [0,0,1,0,0,0|1,0,0]=2 2142 B10R0.19 CCCCC(C)C(=O)NCC 240690a_100015525214_100000725509 [0,0,1,0,0,0|1,0,0]=2 2143 B10R0.19 CCCCC(C)C(=O)NCC 527a_100015525214_100000725509 [0,0,1,0,0,0|1,0,0]=2 2144 B10R0.19 CCCCC(C)C(=O)NNC 22a_100016993582_100000725509 [0,0,1,0,0,0|2,0,0]=3 2145 B10R0.19 CCCCC(C)N(C)CCC 2230a_100000747261_200011215066 [0,0,1,0,0,0|3,0,0]=4 2146 B10R0.19 CCCCC(C)N(C)CCC 269982a_100000747261_200011215066 [0,0,1,0,0,0|3,0,0]=4 2147 B10R0.19 CCCCC(C)N(C)CCC 270004a_100000747261_100000210087 [0,0,1,0,0,0|3,0,0]=4 2148 B10R0.19 CCCCC(O)C(=O)CCC 1458a_100000720857_100000210303 [0,0,1,0,0,0|2,0,0]=3 2149 B10R0.19 CCCCC(O)C(=O)CCF 1458a_100000720857_100011217306 [0,0,1,0,0,0|3,0,0]=4 2150 B10R0.19 CCCCC(O)C(=O)CCO 1458a_100000720857_100000211926 [0,0,1,0,0,0|3,0,0]=4 2151 B10R0.19 CCCCC(O)C(=O)NCC 240690a_100015525214_100000720857 [0,0,1,0,0,0|2,0,0]=3 2152 B10R0.19 CCCCC(O)C(=O)NCC 527a_100015525214_100000720857 [0,0,1,0,0,0|2,0,0]=3 2153 B10R0.19 CCCCC(O)C(=O)NNC 22a_100016993582_100000720857 [0,0,1,0,0,0|3,0,0]=4 2154 B10R0.19 CCCCN(C)C(=O)CCC 11a_100000207549_100000211992 [0,0,1,0,0,0|2,0,0]=3 2155 B10R0.19 CCCCN(C)C(=O)CCC 1626a_100000207549_100000211992 [0,0,1,0,0,0|2,0,0]=3 2156 B10R0.19 CCCCN(C)C(=O)CCC 240690a_100000207549_100000211992 [0,0,1,0,0,0|2,0,0]=3 2157 B10R0.19 CCCCN(C)C(=O)CCC 527a_100000207549_100000211992 [0,0,1,0,0,0|2,0,0]=3 2158 B10R0.19 CCCCN(C)C(=O)CCO 240690a_100000207549_100011216618 [0,0,1,0,0,0|3,0,0]=4 2159 B10R0.19 CCCCN(C)C(=O)CNC 2230a_106832991635_100000230175 [0,0,1,0,0,0|3,0,0]=4 2160 B10R0.19 CCCCN(C)C(=O)CNC 34a_100102657272_100000230175 [0,0,1,0,0,0|3,0,0]=4 2161 B10R0.19 CCCCN(C)C(=O)CNC 7a_106832991635_100000230175 [0,0,1,0,0,0|3,0,0]=4 2162 B10R0.19 CCCCN(C)C(=O)COC 11a_100000207549_100000210968 [0,0,1,0,0,0|3,0,0]=4 2163 B10R0.19 CCCCN(C)C(=O)COC 1626a_100000207549_100000210968 [0,0,1,0,0,0|3,0,0]=4 2164 B10R0.19 CCCCN(C)C(=O)COC 240690a_100000207549_100000210968 [0,0,1,0,0,0|3,0,0]=4 2165 B10R0.19 CCCCN(C)C(=O)COC 34a_100138415774_100000230175 [0,0,1,0,0,0|3,0,0]=4 2166 B10R0.19 CCCCN(C)C(=O)COC 527a_100000207549_100000210968 [0,0,1,0,0,0|3,0,0]=4 2167 B10R0.19 CCCCN(C)C(=O)CSC 11a_100000207549_100000184570 [0,0,1,0,0,0|3,0,0]=4 2168 B10R0.19 CCCCN(C)C(=O)CSC 1626a_100000207549_100000184570 [0,0,1,0,0,0|3,0,0]=4 2169 B10R0.19 CCCCN(C)C(=O)CSC 240690a_100000207549_100000184570 [0,0,1,0,0,0|3,0,0]=4 2170 B10R0.19 CCCCN(C)C(=O)CSC 527a_100000207549_100000184570 [0,0,1,0,0,0|3,0,0]=4 2171 B10R0.19 CCCCN(C)C(=O)CSC 62a_100000230175_200000210301 [0,0,1,0,0,0|3,0,0]=4 2172 B10R0.19 CCCCN(C)C(=O)CSC 62a_200000210301_100000230175 [0,0,1,0,0,0|3,0,0]=4 2173 B10R0.19 CCCCN(C)C(=O)CS[13CH3] 62a_100000230175_200025704644 [0,0,1,0,0,0|3,0,0]=4 2174 B10R0.19 CCCCN(C)C(=O)CS[13CH3] 62a_200025704644_100000230175 [0,0,1,0,0,0|3,0,0]=4 2175 B10R0.19 CCCCN(C)C(=O)NCC 2708a_100015525214_100000207549 [0,0,1,0,0,0|2,0,0]=3 2176 B10R0.19 CCCCN(C)C(=O)NCC 273464a_100015525214_100000207549 [0,0,1,0,0,0|2,0,0]=3 2177 B10R0.19 CCCNC(=O)C(=O)OCC 11a_100020643023_100014798877 [0,0,1,0,0,0|2,0,1]=4 2178 B10R0.19 CCCNC(=O)C(=O)OCC 1626a_100020643023_100014798877 [0,0,1,0,0,0|2,0,1]=4 2179 B10R0.19 CCCNC(=O)C(=O)OCC 240690a_100020643023_100014798877 [0,0,1,0,0,0|2,0,1]=4 2180 B10R0.19 CCCNC(C)C(=O)NCC 2230a_100000736553_100000210303 [0,0,1,0,0,0|2,0,0]=3 2181 B10R0.19 CCCNC(C)C(=O)NCC 34a_100000736553_100000210303 [0,0,1,0,0,0|2,0,0]=3 2182 B10R0.19 CCCN[C@@H](C)C(=O)SCC 2230a_100103168634_100000210303 [0,0,1,0,0,0|1,1,0]=3 2183 B10R0.19 CCCOC(C)C(=O)NCC 34a_100000210258_100000230173 [0,0,1,0,0,0|2,0,0]=3 2184 B10R0.19 CCCOC(C)C(=O)OCC 34a_100000210258_100011216346 [0,0,1,0,0,0|1,0,0]=2 2185 B10R0.19 CCCOC(F)C(=O)OCC 34a_100000210258_100000760018 [0,0,1,0,0,0|2,0,0]=3 2186 B10R0.19 CCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000210303 [0,0,1,0,0,0|1,0,0]=2 2187 B10R0.19 CCCSC(C)C(=O)NCC 62a_100000210303_100000230173 [0,0,1,0,0,0|2,0,0]=3 2188 B10R0.19 CCCSC(C)C(=O)NCC 62a_100000230173_100000210303 [0,0,1,0,0,0|2,0,0]=3 2189 B10R0.19 CCCSC(C)C(=O)OCC 62a_100000210303_100011216346 [0,0,1,0,0,0|1,0,0]=2 2190 B10R0.19 CCCSC(C)C(=O)OCC 62a_100011216346_100000210303 [0,0,1,0,0,0|1,0,0]=2 2191 B10R0.19 CCCSC(F)C(=O)OCC 62a_100000210303_100000760018 [0,0,1,0,0,0|2,0,0]=3 2192 B10R0.19 CCCSC(F)C(=O)OCC 62a_100000760018_100000210303 [0,0,1,0,0,0|2,0,0]=3 2193 B10R0.19 CCNC(=O)C(C)NCCF 2230a_100000736553_100011217306 [0,0,1,0,0,0|3,0,0]=4 2194 B10R0.19 CCNC(=O)C(C)NCCF 34a_100000724931_100000230173 [0,0,1,0,0,0|3,0,0]=4 2195 B10R0.19 CCNC(=O)C(C)NCCF 34a_100000736553_100011217306 [0,0,1,0,0,0|3,0,0]=4 2196 B10R0.19 CCNC(=O)C(C)NCCO 2230a_100000736553_100000211926 [0,0,1,0,0,0|3,0,0]=4 2197 B10R0.19 CCNC(=O)C(C)NCCO 2230a_100016997473_100000230173 [0,0,1,0,0,0|3,0,0]=4 2198 B10R0.19 CCNC(=O)C(C)NCCO 34a_100000736553_100000211926 [0,0,1,0,0,0|3,0,0]=4 2199 B10R0.19 CCNC(=O)C(C)NCCO 34a_100016990907_100000230173 [0,0,1,0,0,0|3,0,0]=4 2200 B10R0.19 CCNC(=O)C(C)NCOC 2230a_100000736553_100000766300 [0,0,1,0,0,0|3,0,0]=4 2201 B10R0.19 CCNC(=O)C(C)NCSC 2230a_100000736553_100011218213 [0,0,1,0,0,0|3,0,0]=4 2202 B10R0.19 CCNC(=O)C(C)NCSC 34a_100000736553_100011218213 [0,0,1,0,0,0|3,0,0]=4 2203 B10R0.19 CCNC(=O)C(C)OCCBr 34a_100000211926_100000230173 [0,0,1,0,0,0|3,0,0]=4 2204 B10R0.19 CCNC(=O)C(C)OCCN 34a_100000210304_100000230173 [0,0,1,0,0,0|3,0,0]=4 2205 B10R0.19 CCNC(=O)C(C)SCCF 62a_100000230173_100011217306 [0,0,1,0,0,0|3,0,0]=4 2206 B10R0.19 CCNC(=O)C(C)SCCF 62a_100011217306_100000230173 [0,0,1,0,0,0|3,0,0]=4 2207 B10R0.19 CCNC(=O)C(C)SCCO 62a_100000211926_100000230173 [0,0,1,0,0,0|3,0,0]=4 2208 B10R0.19 CCNC(=O)C(C)SCCO 62a_100000230173_100000211926 [0,0,1,0,0,0|3,0,0]=4 2209 B10R0.19 CCNC(=O)C(C)SCOC 62a_100000230173_100000766300 [0,0,1,0,0,0|3,0,0]=4 2210 B10R0.19 CCNC(=O)C(C)SCOC 62a_100000766300_100000230173 [0,0,1,0,0,0|3,0,0]=4 2211 B10R0.19 CCNC(=O)C(C)SCSC 62a_100000230173_100011218213 [0,0,1,0,0,0|3,0,0]=4 2212 B10R0.19 CCNC(=O)C(C)SCSC 62a_100011218213_100000230173 [0,0,1,0,0,0|3,0,0]=4 2213 B10R0.19 CCNC(=O)C(O)CCSC 240690a_100015525214_100000685904 [0,0,1,0,0,0|3,0,0]=4 2214 B10R0.19 CCNC(=O)N(C)CCCO 2708a_100015525214_100000213112 [0,0,1,0,0,0|3,0,0]=4 2215 B10R0.19 CCNC(=O)N(C)CCCO 273464a_100015525214_100000213112 [0,0,1,0,0,0|3,0,0]=4 2216 B10R0.19 CCNC(=O)N(C)CCOC 2708a_100015525214_100000743101 [0,0,1,0,0,0|3,0,0]=4 2217 B10R0.19 CCNC(=O)N(C)CCOC 273464a_100015525214_100000743101 [0,0,1,0,0,0|3,0,0]=4 2218 B10R0.19 CCNC(=O)N(C)CCSC 2708a_100015525214_100000686725 [0,0,1,0,0,0|3,0,0]=4 2219 B10R0.19 CCNC(=O)N(C)CCSC 273464a_100015525214_100000686725 [0,0,1,0,0,0|3,0,0]=4 2220 B10R0.19 CCNN=C(C)C(=O)OCC 4a_100000756455_100000209952 [0,0,1,0,0,0|2,0,1]=4 2221 B10R0.19 CCOC(=O)C(=O)CSCC 62a_100000210202_100000211299 [0,0,1,0,0,0|2,0,1]=4 2222 B10R0.19 CCOC(=O)C(=O)CSCC 62a_100000211299_100000210202 [0,0,1,0,0,0|2,0,1]=4 2223 B10R0.19 CCOC(=O)C(C)NCCF 34a_100000724931_100011216346 [0,0,1,0,0,0|2,0,0]=3 2224 B10R0.19 CCOC(=O)C(C)NCCO 2230a_100016997473_100011215307 [0,0,1,0,0,0|2,0,0]=3 2225 B10R0.19 CCOC(=O)C(C)NCCO 34a_100016990907_100011216346 [0,0,1,0,0,0|2,0,0]=3 2226 B10R0.19 CCOC(=O)C(C)OCCBr 34a_100000211926_100011216346 [0,0,1,0,0,0|2,0,0]=3 2227 B10R0.19 CCOC(=O)C(C)OCCN 34a_100000210304_100011216346 [0,0,1,0,0,0|2,0,0]=3 2228 B10R0.19 CCOC(=O)C(C)SCC#N 62a_100011215382_100011216346 [0,0,1,0,0,0|2,0,1]=4 2229 B10R0.19 CCOC(=O)C(C)SCC#N 62a_100011216346_100011215382 [0,0,1,0,0,0|2,0,1]=4 2230 B10R0.19 CCOC(=O)C(C)SCC=O 62a_100011216346_200015260668 [0,0,1,0,0,0|2,0,1]=4 2231 B10R0.19 CCOC(=O)C(C)SCC=O 62a_200015260668_100011216346 [0,0,1,0,0,0|2,0,1]=4 2232 B10R0.19 CCOC(=O)C(C)SCCF 62a_100011216346_100011217306 [0,0,1,0,0,0|2,0,0]=3 2233 B10R0.19 CCOC(=O)C(C)SCCF 62a_100011217306_100011216346 [0,0,1,0,0,0|2,0,0]=3 2234 B10R0.19 CCOC(=O)C(C)SCCO 62a_100000211926_100011216346 [0,0,1,0,0,0|2,0,0]=3 2235 B10R0.19 CCOC(=O)C(C)SCCO 62a_100011216346_100000211926 [0,0,1,0,0,0|2,0,0]=3 2236 B10R0.19 CCOC(=O)C(C)SCOC 62a_100000766300_100011216346 [0,0,1,0,0,0|2,0,0]=3 2237 B10R0.19 CCOC(=O)C(C)SCOC 62a_100011216346_100000766300 [0,0,1,0,0,0|2,0,0]=3 2238 B10R0.19 CCOC(=O)C(C)SCSC 62a_100011216346_100011218213 [0,0,1,0,0,0|2,0,0]=3 2239 B10R0.19 CCOC(=O)C(C)SCSC 62a_100011218213_100011216346 [0,0,1,0,0,0|2,0,0]=3 2240 B10R0.19 CCOC(=O)C(F)NCCF 34a_100000724931_100000760018 [0,0,1,0,0,0|3,0,0]=4 2241 B10R0.19 CCOC(=O)C(F)NCCO 2230a_100016997473_100000760018 [0,0,1,0,0,0|3,0,0]=4 2242 B10R0.19 CCOC(=O)C(F)NCCO 34a_100016990907_100000760018 [0,0,1,0,0,0|3,0,0]=4 2243 B10R0.19 CCOC(=O)C(F)OCCBr 34a_100000211926_100000760018 [0,0,1,0,0,0|3,0,0]=4 2244 B10R0.19 CCOC(=O)C(F)OCCN 34a_100000210304_100000760018 [0,0,1,0,0,0|3,0,0]=4 2245 B10R0.19 CCOC(=O)C(F)SCCF 62a_100000760018_100011217306 [0,0,1,0,0,0|3,0,0]=4 2246 B10R0.19 CCOC(=O)C(F)SCCF 62a_100011217306_100000760018 [0,0,1,0,0,0|3,0,0]=4 2247 B10R0.19 CCOC(=O)C(F)SCCO 62a_100000211926_100000760018 [0,0,1,0,0,0|3,0,0]=4 2248 B10R0.19 CCOC(=O)C(F)SCCO 62a_100000760018_100000211926 [0,0,1,0,0,0|3,0,0]=4 2249 B10R0.19 CCOC(=O)C(F)SCOC 62a_100000760018_100000766300 [0,0,1,0,0,0|3,0,0]=4 2250 B10R0.19 CCOC(=O)C(F)SCOC 62a_100000766300_100000760018 [0,0,1,0,0,0|3,0,0]=4 2251 B10R0.19 CCOC(=O)C(F)SCSC 62a_100000760018_100011218213 [0,0,1,0,0,0|3,0,0]=4 2252 B10R0.19 CCOC(=O)C(F)SCSC 62a_100011218213_100000760018 [0,0,1,0,0,0|3,0,0]=4 2253 B10R0.19 CCOC(=O)[C@H](C)OCC#N 7a_100000751109_100011215382 [0,0,1,0,0,0|2,0,1]=4 2254 B10R0.19 CCOC(=O)[C@H](C)OCC=O 7a_100000751109_200015260668 [0,0,1,0,0,0|2,0,1]=4 2255 B10R0.19 CCOC(=O)[C@H](C)OCCF 7a_100000751109_100011217306 [0,0,1,0,0,0|2,0,0]=3 2256 B10R0.19 CCOC(=O)[C@H](C)OCCO 7a_100000751109_100000211926 [0,0,1,0,0,0|2,0,0]=3 2257 B10R0.19 CCSC(=O)[C@H](C)NCCF 2230a_100103168634_100011217306 [0,0,1,0,0,0|2,1,0]=4 2258 B10R0.19 CCSC(=O)[C@H](C)NCCO 2230a_100103168634_100000211926 [0,0,1,0,0,0|2,1,0]=4 2259 B10R0.19 CCSC(=O)[C@H](C)NCOC 2230a_100103168634_100000766300 [0,0,1,0,0,0|2,1,0]=4 2260 B10R0.19 CCSC(=O)[C@H](C)NCSC 2230a_100103168634_100011218213 [0,0,1,0,0,0|2,1,0]=4 2261 B10R0.33 C#CCC(=O)C(CC)CCC 1458a_100011220946_100011219200 [0,0,1,0,0,0|1,0,2]=4 2262 B10R0.33 C#CCC(=O)C(CC)CCC 1458a_100011416436_100000184674 [0,0,1,0,0,0|1,0,2]=4 2263 B10R0.33 C=CCC(=O)C(CC)CCC 1458a_100000210193_100011219200 [0,0,1,0,0,0|1,0,2]=4 2264 B10R0.33 C=CCC(=O)C(CC)CCC 1458a_100011416436_100000210623 [0,0,1,0,0,0|1,0,2]=4 2265 B10R0.33 CC#CC(=O)C(CC)CCC 1458a_100000763181_100011219200 [0,0,1,0,0,0|1,0,1]=3 2266 B10R0.33 CC=CC(=O)C(CC)CCC 1458a_100000210699_100011219200 [0,0,1,0,0,0|1,0,1]=3 2267 B10R0.33 CC=CC(=O)N(CC)CCC 11a_100000226822_100000210699 [0,0,1,0,0,0|2,0,1]=4 2268 B10R0.33 CC=CC(=O)N(CC)CCC 1626a_100000226822_100000210699 [0,0,1,0,0,0|2,0,1]=4 2269 B10R0.33 CC=CC(=O)N(CC)CCC 240690a_100000226822_100000210699 [0,0,1,0,0,0|2,0,1]=4 2270 B10R0.33 CCCC(=O)C(CC)CCC 1458a_100000211992_100011219200 [0,0,1,0,0,0|1,0,0]=2 2271 B10R0.33 CCCC(=O)C(CC)CCC 1458a_100011416436_100000210303 [0,0,1,0,0,0|1,0,0]=2 2272 B10R0.33 CCCC(=O)C(CCC)OC 34a_200011216804_200000210301 [0,0,1,0,0,0|2,0,0]=3 2273 B10R0.33 CCCC(=O)C(CCC)OC 7a_200011216804_200000210301 [0,0,1,0,0,0|2,0,0]=3 2274 B10R0.33 CCCC(=O)C(CCC)O[13CH3] 34a_200011216804_200025704644 [0,0,1,0,0,0|2,0,0]=3 2275 B10R0.33 CCCC(=O)C(CCC)O[13CH3] 7a_200011216804_200025704644 [0,0,1,0,0,0|2,0,0]=3 2276 B10R0.33 CCCC(=O)N(CC)CCC 11a_100000226822_100000211992 [0,0,1,0,0,0|2,0,0]=3 2277 B10R0.33 CCCC(=O)N(CC)CCC 1626a_100000226822_100000211992 [0,0,1,0,0,0|2,0,0]=3 2278 B10R0.33 CCCC(=O)N(CC)CCC 240690a_100000226822_100000211992 [0,0,1,0,0,0|2,0,0]=3 2279 B10R0.33 CCCC(=O)N(CC)CCC 527a_100000226822_100000211992 [0,0,1,0,0,0|2,0,0]=3 2280 B10R0.33 CCCC(=O)N(CC)CCO 240690a_100000210973_100000211992 [0,0,1,0,0,0|3,0,0]=4 2281 B10R0.33 CCCC(=O)N(CC)CCO 527a_100000210973_100000211992 [0,0,1,0,0,0|3,0,0]=4 2282 B10R0.33 CCCC(CC)C(=O)C=CBr 1458a_100016273825_100011219200 [0,0,1,0,0,0|2,0,1]=4 2283 B10R0.33 CCCC(CC)C(=O)C=CCl 1458a_200016279998_100011219200 [0,0,1,0,0,0|2,0,1]=4 2284 B10R0.33 CCCC(CC)C(=O)C=CI 1458a_100016256311_100011219200 [0,0,1,0,0,0|2,0,1]=4 2285 B10R0.33 CCCC(CC)C(=O)CC#N 1458a_100011416436_100011214920 [0,0,1,0,0,0|2,0,1]=4 2286 B10R0.33 CCCC(CC)C(=O)CC#N 1458a_100051588842_100011219200 [0,0,1,0,0,0|2,0,1]=4 2287 B10R0.33 CCCC(CC)C(=O)CCF 1458a_100011416436_100011217306 [0,0,1,0,0,0|2,0,0]=3 2288 B10R0.33 CCCC(CC)C(=O)CCO 1458a_100011216618_100011219200 [0,0,1,0,0,0|2,0,0]=3 2289 B10R0.33 CCCC(CC)C(=O)CCO 1458a_100011416436_100000211926 [0,0,1,0,0,0|2,0,0]=3 2290 B10R0.33 CCCC(CC)C(=O)COC 1458a_100000210968_100011219200 [0,0,1,0,0,0|2,0,0]=3 2291 B10R0.33 CCCC(CC)C(=O)CSC 1458a_100000184570_100011219200 [0,0,1,0,0,0|2,0,0]=3 2292 B10R0.33 CCCC(CC)C(=O)NCC 11a_100015525214_100011416436 [0,0,1,0,0,0|1,0,0]=2 2293 B10R0.33 CCCC(CC)C(=O)NCC 240690a_100015525214_100011416436 [0,0,1,0,0,0|1,0,0]=2 2294 B10R0.33 CCCC(CC)C(=O)NCC 527a_100015525214_100011416436 [0,0,1,0,0,0|1,0,0]=2 2295 B10R0.33 CCCC(CC)C(=O)NNC 22a_100016993582_100011416436 [0,0,1,0,0,0|2,0,0]=3 2296 B10R0.33 CCCC(CC)N(C)CCC 269982a_100000747261_100011219200 [0,0,1,0,0,0|3,0,0]=4 2297 B10R0.33 CCCC(CC)N(C)CCC 270004a_100000747261_100000687865 [0,0,1,0,0,0|3,0,0]=4 2298 B10R0.33 CCCC(NC)C(=O)OCC 2230a_106832991635_100000695697 [0,0,1,0,0,0|1,0,0]=2 2299 B10R0.33 CCCC(NC)C(=O)OCC 34a_100102657272_100000695697 [0,0,1,0,0,0|1,0,0]=2 2300 B10R0.33 CCCC(NC)C(=O)OCC 7a_106832991635_100000695697 [0,0,1,0,0,0|1,0,0]=2 2301 B10R0.33 CCCC(OC)C(=O)OCC 34a_100138415774_100000695697 [0,0,1,0,0,0|1,0,0]=2 2302 B10R0.33 CCCC(OC)C(=O)OCC 34a_200011218214_200000210301 [0,0,1,0,0,0|1,0,0]=2 2303 B10R0.33 CCCC(OC)C(=O)OCC 7a_200011218214_200000210301 [0,0,1,0,0,0|1,0,0]=2 2304 B10R0.33 CCCC(O[13CH3])C(=O)OCC 34a_200011218214_200025704644 [0,0,1,0,0,0|1,0,0]=2 2305 B10R0.33 CCCC(O[13CH3])C(=O)OCC 7a_200011218214_200025704644 [0,0,1,0,0,0|1,0,0]=2 2306 B10R0.33 CCCC(SC)C(=O)OCC 62a_100000695697_200000210301 [0,0,1,0,0,0|1,0,0]=2 2307 B10R0.33 CCCC(SC)C(=O)OCC 62a_200000210301_100000695697 [0,0,1,0,0,0|1,0,0]=2 2308 B10R0.33 CCCC(S[13CH3])C(=O)OCC 62a_100000695697_200025704644 [0,0,1,0,0,0|1,0,0]=2 2309 B10R0.33 CCCC(S[13CH3])C(=O)OCC 62a_200025704644_100000695697 [0,0,1,0,0,0|1,0,0]=2 2310 B10R0.33 CCCN(CC)C(=O)CCO 240690a_100000226822_100011216618 [0,0,1,0,0,0|3,0,0]=4 2311 B10R0.33 CCCN(CC)C(=O)COC 11a_100000226822_100000210968 [0,0,1,0,0,0|3,0,0]=4 2312 B10R0.33 CCCN(CC)C(=O)COC 1626a_100000226822_100000210968 [0,0,1,0,0,0|3,0,0]=4 2313 B10R0.33 CCCN(CC)C(=O)COC 240690a_100000226822_100000210968 [0,0,1,0,0,0|3,0,0]=4 2314 B10R0.33 CCCN(CC)C(=O)COC 527a_100000226822_100000210968 [0,0,1,0,0,0|3,0,0]=4 2315 B10R0.33 CCCN(CC)C(=O)CSC 11a_100000226822_100000184570 [0,0,1,0,0,0|3,0,0]=4 2316 B10R0.33 CCCN(CC)C(=O)CSC 1626a_100000226822_100000184570 [0,0,1,0,0,0|3,0,0]=4 2317 B10R0.33 CCCN(CC)C(=O)CSC 240690a_100000226822_100000184570 [0,0,1,0,0,0|3,0,0]=4 2318 B10R0.33 CCCN(CC)C(=O)CSC 527a_100000226822_100000184570 [0,0,1,0,0,0|3,0,0]=4 2319 B10R0.33 CCCN(CC)C(=O)NCC 2708a_100015525214_100000226822 [0,0,1,0,0,0|2,0,0]=3 2320 B10R0.33 CCCN(CC)C(=O)NCC 273464a_100015525214_100000226822 [0,0,1,0,0,0|2,0,0]=3 2321 B10R0.33 CCNC(=O)N(CC)CCO 2708a_100015525214_100000210973 [0,0,1,0,0,0|3,0,0]=4 2322 B10R0.33 CCNC(=O)N(CC)CCO 273464a_100015525214_100000210973 [0,0,1,0,0,0|3,0,0]=4 2323 B10R0.33 CCNC(CC)C(=O)OCC 2230a_100015525214_100000212269 [0,0,1,0,0,0|1,0,0]=2 2324 B10R0.33 CCOC(=O)C(C=O)SCC 62a_100000053139_100000210202 [0,0,1,0,0,0|2,0,1]=4 2325 B10R0.33 CCOC(=O)C(C=O)SCC 62a_100000210202_100000053139 [0,0,1,0,0,0|2,0,1]=4 2326 B10R0.33 CCOC(=O)C(CC)OCC 34a_100011216719_100000210202 [0,0,1,0,0,0|1,0,0]=2 2327 B10R0.33 CCOC(=O)C(CC)OCC 34a_100121572206_100000212269 [0,0,1,0,0,0|1,0,0]=2 2328 B10R0.33 CCOC(=O)C(CC)OCC 7a_100011216719_100000210202 [0,0,1,0,0,0|1,0,0]=2 2329 B10R0.33 CCOC(=O)C(CC)OCF 34a_100011216719_100015361967 [0,0,1,0,0,0|2,0,0]=3 2330 B10R0.33 CCOC(=O)C(CC)OCF 7a_100011216719_100015361967 [0,0,1,0,0,0|2,0,0]=3 2331 B10R0.33 CCOC(=O)C(CC)SCC 62a_100000210202_100000212269 [0,0,1,0,0,0|1,0,0]=2 2332 B10R0.33 CCOC(=O)C(CC)SCC 62a_100000212269_100000210202 [0,0,1,0,0,0|1,0,0]=2 2333 B10R0.33 CCOC(=O)C(CC)SCF 62a_100000212269_100015361967 [0,0,1,0,0,0|2,0,0]=3 2334 B10R0.33 CCOC(=O)C(CC)SCF 62a_100015361967_100000212269 [0,0,1,0,0,0|2,0,0]=3 2335 B10R0.33 CCOC(=O)C(NC)OCC 34a_100102657272_100000033883 [0,0,1,0,0,0|2,0,0]=3 2336 B10R0.33 CCOC(=O)C(OC)OCC 34a_100138415774_100000033883 [0,0,1,0,0,0|2,0,0]=3 2337 B10R0.33 CCOC(=O)C(OCC)SC 34a_100121572206_100009893047 [0,0,1,0,0,0|2,0,0]=3 2338 B10R0.33 CCOC(=O)C(OCC)SC 62a_100000033883_200000210301 [0,0,1,0,0,0|2,0,0]=3 2339 B10R0.33 CCOC(=O)C(OCC)SC 62a_200000210301_100000033883 [0,0,1,0,0,0|2,0,0]=3 2340 B10R0.33 CCOC(=O)C(OCC)S[13CH3] 62a_100000033883_200025704644 [0,0,1,0,0,0|2,0,0]=3 2341 B10R0.33 CCOC(=O)C(OCC)S[13CH3] 62a_200025704644_100000033883 [0,0,1,0,0,0|2,0,0]=3 2342 B10R0.33 CCOC(=O)C(SC)SCC 62a_100000210202_100009893047 [0,0,1,0,0,0|2,0,0]=3 2343 B10R0.33 CCOC(=O)C(SC)SCC 62a_100009893047_100000210202 [0,0,1,0,0,0|2,0,0]=3 2344 B10R0.33 CCOC(=O)C(SC)SCF 62a_100009893047_100015361967 [0,0,1,0,0,0|3,0,0]=4 2345 B10R0.33 CCOC(=O)C(SC)SCF 62a_100015361967_100009893047 [0,0,1,0,0,0|3,0,0]=4 2346 B12R2.2 C1CCC(CC1)N2CCCC2 269982a_100000188435_100000210327 [0,0,0,1,0,0|3,0,0]=4 2347 B12R2.2 C1CCC(CC1)N2CCCC2 270004a_100000188435_100000210434 [0,0,0,1,0,0|3,0,0]=4 2348 B12R2.22 CC1CN(C1)C2CCCCC2 269982a_100000702820_100000210327 [0,0,0,1,0,0|3,0,0]=4 2349 B12R2.22 CC1CN(C1)C2CCCCC2 270004a_100000702820_100000210434 [0,0,0,1,0,0|3,0,0]=4 2350 B12R2.22 CC1CN(C1)C2CCCCC2 34a_100000702820_100000210327 [0,0,0,1,0,0|3,0,0]=4 2351 B12R2.186 CCCN1CC2CCC1CC2 2230a_100000750499_100000210303 [0,0,0,1,0,0|3,0,0]=4 2352 B12R2.186 CCCN1CC2CCC1CC2 269982a_100000750499_100000210303 [0,0,0,1,0,0|3,0,0]=4 2353 B12R2.186 CCCN1CC2CCC1CC2 34a_100000750499_100000210303 [0,0,0,1,0,0|3,0,0]=4 2354 B12R2.1081 CN1CCCC2C1CCCC2 2230a_100000211887_200000210301 [0,0,0,1,0,0|3,0,0]=4 2355 B12R2.1081 CN1CCCC2C1CCCC2 269982a_100000211887_200000210301 [0,0,0,1,0,0|3,0,0]=4 2356 B12R2.1081 CN1CCCC2C1CCCC2 34a_100000211887_200000210301 [0,0,0,1,0,0|3,0,0]=4 2357 B12R2.1081 [13CH3]N1CCCC2C1CCCC2 2230a_100000211887_200025704644 [0,0,0,1,0,0|3,0,0]=4 2358 B12R2.1081 [13CH3]N1CCCC2C1CCCC2 269982a_100000211887_200025704644 [0,0,0,1,0,0|3,0,0]=4 2359 B12R2.1081 [13CH3]N1CCCC2C1CCCC2 34a_100000211887_200025704644 [0,0,0,1,0,0|3,0,0]=4 2360 B12R2.1479 CCCC(=O)C1C2C1COC2 1458a_100000138910_100000210303 [0,0,0,1,0,0|2,0,0]=3 2361 B12R2.1479 CCNC(=O)C1C2C1COC2 11a_100015525214_100000138910 [0,0,0,1,0,0|2,0,0]=3 2362 B12R2.1479 CCNC(=O)C1C2C1COC2 240690a_100015525214_100000138910 [0,0,0,1,0,0|2,0,0]=3 2363 B12R2.1479 CCNC(=O)C1C2C1COC2 527a_100015525214_100000138910 [0,0,0,1,0,0|2,0,0]=3 2364 B12R2.1479 CNNC(=O)C1C2C1COC2 22a_100016993582_100000138910 [0,0,0,1,0,0|3,0,0]=4 2365 B12R2.1479 O=C(CCF)C1C2C1COC2 1458a_100000138910_100011217306 [0,0,0,1,0,0|3,0,0]=4 2366 B12R2.1479 O=C(CCO)C1C2C1COC2 1458a_100000138910_100000211926 [0,0,0,1,0,0|3,0,0]=4 2367 B12R2.1485 CCCN(C)C1CCC2C1C2 270004a_100000747261_100000692480 [0,0,0,1,0,0|3,0,0]=4 2368 B12R2.1488 CC=CC(=O)N1CC2CC2C1 11a_100000741873_100000210699 [0,0,0,1,0,0|2,0,1]=4 2369 B12R2.1488 CC=CC(=O)N1CC2CC2C1 1626a_100000741873_100000210699 [0,0,0,1,0,0|2,0,1]=4 2370 B12R2.1488 CC=CC(=O)N1CC2CC2C1 240690a_100000741873_100000210699 [0,0,0,1,0,0|2,0,1]=4 2371 B12R2.1488 CCCC(=O)N1CC2CC2C1 11a_100000741873_100000211992 [0,0,0,1,0,0|2,0,0]=3 2372 B12R2.1488 CCCC(=O)N1CC2CC2C1 1626a_100000741873_100000211992 [0,0,0,1,0,0|2,0,0]=3 2373 B12R2.1488 CCCC(=O)N1CC2CC2C1 240690a_100000741873_100000211992 [0,0,0,1,0,0|2,0,0]=3 2374 B12R2.1488 CCCC(=O)N1CC2CC2C1 527a_100000741873_100000211992 [0,0,0,1,0,0|2,0,0]=3 2375 B12R2.1488 CCCN(C)C1CC2CC2C1 270004a_100000747261_100010340937 [0,0,0,1,0,0|3,0,0]=4 2376 B12R2.1488 CCNC(=O)N1CC2CC2C1 2708a_100015525214_100000741873 [0,0,0,1,0,0|2,0,0]=3 2377 B12R2.1488 CCNC(=O)N1CC2CC2C1 273464a_100015525214_100000741873 [0,0,0,1,0,0|2,0,0]=3 2378 B12R2.1488 COCC(=O)N1CC2CC2C1 11a_100000741873_100000210968 [0,0,0,1,0,0|3,0,0]=4 2379 B12R2.1488 COCC(=O)N1CC2CC2C1 1626a_100000741873_100000210968 [0,0,0,1,0,0|3,0,0]=4 2380 B12R2.1488 COCC(=O)N1CC2CC2C1 240690a_100000741873_100000210968 [0,0,0,1,0,0|3,0,0]=4 2381 B12R2.1488 COCC(=O)N1CC2CC2C1 527a_100000741873_100000210968 [0,0,0,1,0,0|3,0,0]=4 2382 B12R2.1488 CSCC(=O)N1CC2CC2C1 11a_100000741873_100000184570 [0,0,0,1,0,0|3,0,0]=4 2383 B12R2.1488 CSCC(=O)N1CC2CC2C1 1626a_100000741873_100000184570 [0,0,0,1,0,0|3,0,0]=4 2384 B12R2.1488 CSCC(=O)N1CC2CC2C1 240690a_100000741873_100000184570 [0,0,0,1,0,0|3,0,0]=4 2385 B12R2.1488 CSCC(=O)N1CC2CC2C1 527a_100000741873_100000184570 [0,0,0,1,0,0|3,0,0]=4 2386 B12R2.1488 O=C(CCO)N1CC2CC2C1 240690a_100000741873_100011216618 [0,0,0,1,0,0|3,0,0]=4 2387 B12R2.2075 CN(C1CCCCC1)C2CC2 2230a_100000744332_200000210301 [0,0,0,1,0,0|3,0,0]=4 2388 B12R2.2075 CN(C1CCCCC1)C2CC2 269982a_100000207522_100000211595 [0,0,0,1,0,0|3,0,0]=4 2389 B12R2.2075 CN(C1CCCCC1)C2CC2 269982a_100000226674_100000210327 [0,0,0,1,0,0|3,0,0]=4 2390 B12R2.2075 CN(C1CCCCC1)C2CC2 269982a_100000744332_200000210301 [0,0,0,1,0,0|3,0,0]=4 2391 B12R2.2075 CN(C1CCCCC1)C2CC2 270004a_100000226674_100000210434 [0,0,0,1,0,0|3,0,0]=4 2392 B12R2.2075 CN(C1CCCCC1)C2CC2 34a_100000207522_100000211595 [0,0,0,1,0,0|3,0,0]=4 2393 B12R2.2075 CN(C1CCCCC1)C2CC2 34a_100000744332_200000210301 [0,0,0,1,0,0|3,0,0]=4 2394 B12R2.2075 O=C(C1C=CCCC1)C2CC2 1458a_100000210395_100000751183 [0,0,0,1,0,0|1,0,2]=4 2395 B12R2.2075 O=C(C1CC1)C2CCCOC2 1458a_100000210395_100000693364 [0,0,0,1,0,0|2,0,0]=3 2396 B12R2.2075 O=C(C1CC1)N2CCCOC2 11a_100000131196_100000210395 [0,0,0,1,0,0|3,0,0]=4 2397 B12R2.2075 O=C(C1CC1)N2CCCOC2 240690a_100000131196_100000210395 [0,0,0,1,0,0|3,0,0]=4 2398 B12R2.2075 O=C(C1CC1)N2CCOCC2 11a_100015191051_100000210395 [0,0,0,1,0,0|3,0,0]=4 2399 B12R2.2075 O=C(C1CC1)N2CCOCC2 1626a_100015191051_100000210395 [0,0,0,1,0,0|3,0,0]=4 2400 B12R2.2075 O=C(C1CC1)N2CCOCC2 240690a_100015191051_100000210395 [0,0,0,1,0,0|3,0,0]=4 2401 B12R2.2075 O=C(C1CC1)N2CCOCC2 527a_100015191051_100000210395 [0,0,0,1,0,0|3,0,0]=4 2402 B12R2.2075 O=C(C1CC1)N2CCSCC2 11a_100000737611_100000210395 [0,0,0,1,0,0|3,0,0]=4 2403 B12R2.2075 O=C(C1CC1)N2CCSCC2 240690a_100000737611_100000210395 [0,0,0,1,0,0|3,0,0]=4 2404 B12R2.2075 O=C(C1CC1)N2CCSCC2 527a_100000737611_100000210395 [0,0,0,1,0,0|3,0,0]=4 2405 B12R2.2075 O=C(C1CCCCC1)C2CC2 1458a_100000210395_100000210327 [0,0,0,1,0,0|1,0,0]=2 2406 B12R2.2075 O=C(C1CCCCC1)C2CO2 1458a_100000701028_100000210327 [0,0,0,1,0,0|2,0,0]=3 2407 B12R2.2075 O=C(C1CCCOC1)C2CO2 1458a_100000701028_100000693364 [0,0,0,1,0,0|3,0,0]=4 2408 B12R2.2075 O=C(C1CCOCC1)C2CC2 1458a_100000210395_100011324220 [0,0,0,1,0,0|2,0,0]=3 2409 B12R2.2075 O=C(C1CCOCC1)C2CO2 1458a_100000701028_100011324220 [0,0,0,1,0,0|3,0,0]=4 2410 B12R2.2075 [13CH3]N(C1CCCCC1)C2CC2 2230a_100000744332_200025704644 [0,0,0,1,0,0|3,0,0]=4 2411 B12R2.2075 [13CH3]N(C1CCCCC1)C2CC2 269982a_100000744332_200025704644 [0,0,0,1,0,0|3,0,0]=4 2412 B12R2.2075 [13CH3]N(C1CCCCC1)C2CC2 34a_100000744332_200025704644 [0,0,0,1,0,0|3,0,0]=4 2413 B10R1.11 C#CCC(=O)C1CCCC1 1458a_100000210718_100000184674 [0,0,0,0,1,0|1,0,2]=4 2414 B10R1.11 C#CCC(=O)C1CCCC1 1458a_100011220946_100000179811 [0,0,0,0,1,0|1,0,2]=4 2415 B10R1.11 C=CCC(=O)C1CCCC1 1458a_100000210193_100000179811 [0,0,0,0,1,0|1,0,2]=4 2416 B10R1.11 C=CCC(=O)C1CCCC1 1458a_100000210718_100000210623 [0,0,0,0,1,0|1,0,2]=4 2417 B10R1.11 CC#CC(=O)C1CCCC1 1458a_100000763181_100000179811 [0,0,0,0,1,0|1,0,1]=3 2418 B10R1.11 CC#CC(=O)C1CCOC1 1458a_100000763181_100000690089 [0,0,0,0,1,0|2,0,1]=4 2419 B10R1.11 CC(OCF)C1CCCC1 34a_100011216366_100015361967 [0,0,0,0,1,0|2,0,1]=4 2420 B10R1.11 CC(OCF)C1CCCC1 7a_100011216366_100015361967 [0,0,0,0,1,0|2,0,1]=4 2421 B10R1.11 CC=CC(=O)C1CCCC1 1458a_100000210699_100000179811 [0,0,0,0,1,0|1,0,1]=3 2422 B10R1.11 CC=CC(=O)C1CCOC1 1458a_100000210699_100000690089 [0,0,0,0,1,0|2,0,1]=4 2423 B10R1.11 CC=CC(=O)N1CCCC1 240690a_100000188435_100000210699 [0,0,0,0,1,0|2,0,1]=4 2424 B10R1.11 CCCC(=O)C1=CCCC1 1458a_100000038896_100000210303 [0,0,0,0,1,0|1,0,2]=4 2425 B10R1.11 CCCC(=O)C1CC=CC1 1458a_100000759439_100000210303 [0,0,0,0,1,0|1,0,2]=4 2426 B10R1.11 CCCC(=O)C1CCCC1 1458a_100000210718_100000210303 [0,0,0,0,1,0|1,0,0]=2 2427 B10R1.11 CCCC(=O)C1CCCC1 1458a_100000211992_100000179811 [0,0,0,0,1,0|1,0,0]=2 2428 B10R1.11 CCCC(=O)C1CCCS1 1458a_100012002731_100000210303 [0,0,0,0,1,0|2,0,0]=3 2429 B10R1.11 CCCC(=O)C1CCOC1 1458a_100000211992_100000690089 [0,0,0,0,1,0|2,0,0]=3 2430 B10R1.11 CCCC(=O)C1CCOC1 1458a_100011219752_100000210303 [0,0,0,0,1,0|2,0,0]=3 2431 B10R1.11 CCCC(=O)N1CCCC1 240690a_100000188435_100000211992 [0,0,0,0,1,0|2,0,0]=3 2432 B10R1.11 CCCC(=O)N1CCCC1 527a_100000188435_100000211992 [0,0,0,0,1,0|2,0,0]=3 2433 B10R1.11 CCCC(=O)N1CCSC1 11a_100011215254_100000211992 [0,0,0,0,1,0|3,0,0]=4 2434 B10R1.11 CCCC(=O)N1CCSC1 240690a_100011215254_100000211992 [0,0,0,0,1,0|3,0,0]=4 2435 B10R1.11 CCCC(=O)N1CCSC1 527a_100011215254_100000211992 [0,0,0,0,1,0|3,0,0]=4 2436 B10R1.11 CCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210303 [0,0,0,0,1,0|2,0,0]=3 2437 B10R1.11 CCCN(C)C1CCCC1 2230a_100000201646_200000210301 [0,0,0,0,1,0|3,0,0]=4 2438 B10R1.11 CCCN(C)C1CCCC1 2230a_100000207505_100000210303 [0,0,0,0,1,0|3,0,0]=4 2439 B10R1.11 CCCN(C)C1CCCC1 2230a_100000747261_100000179811 [0,0,0,0,1,0|3,0,0]=4 2440 B10R1.11 CCCN(C)C1CCCC1 269982a_100000201646_200000210301 [0,0,0,0,1,0|3,0,0]=4 2441 B10R1.11 CCCN(C)C1CCCC1 269982a_100000207505_100000210303 [0,0,0,0,1,0|3,0,0]=4 2442 B10R1.11 CCCN(C)C1CCCC1 269982a_100000747261_100000179811 [0,0,0,0,1,0|3,0,0]=4 2443 B10R1.11 CCCN(C)C1CCCC1 270004a_100000747261_100000210133 [0,0,0,0,1,0|3,0,0]=4 2444 B10R1.11 CCCN(C)C1CCCC1 34a_100000201646_200000210301 [0,0,0,0,1,0|3,0,0]=4 2445 B10R1.11 CCCN(C)C1CCCC1 34a_100000207505_100000210303 [0,0,0,0,1,0|3,0,0]=4 2446 B10R1.11 CCCN([13CH3])C1CCCC1 2230a_100000201646_200025704644 [0,0,0,0,1,0|3,0,0]=4 2447 B10R1.11 CCCN([13CH3])C1CCCC1 269982a_100000201646_200025704644 [0,0,0,0,1,0|3,0,0]=4 2448 B10R1.11 CCCN([13CH3])C1CCCC1 34a_100000201646_200025704644 [0,0,0,0,1,0|3,0,0]=4 2449 B10R1.11 CCNC(=O)C1=CCCC1 11a_100015525214_100000038896 [0,0,0,0,1,0|1,0,2]=4 2450 B10R1.11 CCNC(=O)C1=CCCC1 240690a_100015525214_100000038896 [0,0,0,0,1,0|1,0,2]=4 2451 B10R1.11 CCNC(=O)C1CC=CC1 11a_100015525214_100000759439 [0,0,0,0,1,0|1,0,2]=4 2452 B10R1.11 CCNC(=O)C1CC=CC1 240690a_100015525214_100000759439 [0,0,0,0,1,0|1,0,2]=4 2453 B10R1.11 CCNC(=O)C1CC=CC1 527a_100015525214_100000759439 [0,0,0,0,1,0|1,0,2]=4 2454 B10R1.11 CCNC(=O)C1CCCC1 11a_100015525214_100000210718 [0,0,0,0,1,0|1,0,0]=2 2455 B10R1.11 CCNC(=O)C1CCCC1 240690a_100015525214_100000210718 [0,0,0,0,1,0|1,0,0]=2 2456 B10R1.11 CCNC(=O)C1CCCC1 527a_100015525214_100000210718 [0,0,0,0,1,0|1,0,0]=2 2457 B10R1.11 CCNC(=O)C1CCCS1 11a_100015525214_100012002731 [0,0,0,0,1,0|2,0,0]=3 2458 B10R1.11 CCNC(=O)C1CCCS1 240690a_100015525214_100012002731 [0,0,0,0,1,0|2,0,0]=3 2459 B10R1.11 CCNC(=O)C1CCCS1 527a_100015525214_100012002731 [0,0,0,0,1,0|2,0,0]=3 2460 B10R1.11 CCNC(=O)C1CCOC1 11a_100015525214_100011219752 [0,0,0,0,1,0|2,0,0]=3 2461 B10R1.11 CCNC(=O)C1CCOC1 240690a_100015525214_100011219752 [0,0,0,0,1,0|2,0,0]=3 2462 B10R1.11 CCNC(=O)C1CCOC1 527a_100015525214_100011219752 [0,0,0,0,1,0|2,0,0]=3 2463 B10R1.11 CCNC(=O)N1CCCC1 2708a_100015525214_100000188435 [0,0,0,0,1,0|2,0,0]=3 2464 B10R1.11 CCNC(=O)N1CCCC1 273464a_100015525214_100000188435 [0,0,0,0,1,0|2,0,0]=3 2465 B10R1.11 CCNC(=O)N1CCSC1 2708a_100015525214_100011215254 [0,0,0,0,1,0|3,0,0]=4 2466 B10R1.11 CCNC(=O)N1CCSC1 273464a_100015525214_100011215254 [0,0,0,0,1,0|3,0,0]=4 2467 B10R1.11 CCNC(=O)[C@@H]1CCCO1 11a_100015525214_100000686382 [0,0,0,0,1,0|2,0,0]=3 2468 B10R1.11 CCNC(=O)[C@@H]1CCCO1 240690a_100015525214_100000686382 [0,0,0,0,1,0|2,0,0]=3 2469 B10R1.11 CCNC(=O)[C@@H]1CCCO1 527a_100015525214_100000686382 [0,0,0,0,1,0|2,0,0]=3 2470 B10R1.11 CCNC(C)C1CCCC1 2230a_100015185923_100000210202 [0,0,0,0,1,0|2,0,1]=4 2471 B10R1.11 CCNC(C)C1CCCC1 269862a_100015525214_100000749594 [0,0,0,0,1,0|2,0,1]=4 2472 B10R1.11 CCNC(C)C1CCCC1 270004a_100015525214_100000749594 [0,0,0,0,1,0|2,0,1]=4 2473 B10R1.11 CCNC(C)C1CCCC1 34a_100015185923_100000210202 [0,0,0,0,1,0|2,0,1]=4 2474 B10R1.11 CCOC(C)C1CCCC1 34a_100011216366_100000210202 [0,0,0,0,1,0|1,0,1]=3 2475 B10R1.11 CCOC(C)C1CCCC1 7a_100011216366_100000210202 [0,0,0,0,1,0|1,0,1]=3 2476 B10R1.11 CNCC(=O)N1CCCC1 2230a_100000751844_200000210301 [0,0,0,0,1,0|3,0,0]=4 2477 B10R1.11 CNCC(=O)N1CCCC1 2230a_106832991635_100000183516 [0,0,0,0,1,0|3,0,0]=4 2478 B10R1.11 CNCC(=O)N1CCCC1 34a_100102657272_100000183516 [0,0,0,0,1,0|3,0,0]=4 2479 B10R1.11 CNCC(=O)N1CCCC1 7a_106832991635_100000183516 [0,0,0,0,1,0|3,0,0]=4 2480 B10R1.11 CNNC(=O)C1CCCC1 22a_100016993582_100000210718 [0,0,0,0,1,0|2,0,0]=3 2481 B10R1.11 CNNC(=O)C1CCCS1 22a_100016993582_100012002731 [0,0,0,0,1,0|3,0,0]=4 2482 B10R1.11 CNNC(=O)C1CCOC1 22a_100016993582_100011219752 [0,0,0,0,1,0|3,0,0]=4 2483 B10R1.11 CNNC(=O)[C@@H]1CCCO1 22a_100016993582_100000686382 [0,0,0,0,1,0|3,0,0]=4 2484 B10R1.11 COCC(=O)C1CCCC1 1458a_100000210968_100000179811 [0,0,0,0,1,0|2,0,0]=3 2485 B10R1.11 COCC(=O)C1CCOC1 1458a_100000210968_100000690089 [0,0,0,0,1,0|3,0,0]=4 2486 B10R1.11 COCC(=O)N1CCCC1 240690a_100000188435_100000210968 [0,0,0,0,1,0|3,0,0]=4 2487 B10R1.11 COCC(=O)N1CCCC1 34a_100138415774_100000183516 [0,0,0,0,1,0|3,0,0]=4 2488 B10R1.11 COCC(=O)N1CCCC1 527a_100000188435_100000210968 [0,0,0,0,1,0|3,0,0]=4 2489 B10R1.11 COCC(=O)N1CCCC1 7a_200000752455_200000210301 [0,0,0,0,1,0|3,0,0]=4 2490 B10R1.11 CSCC(=O)C1CCCC1 1458a_100000184570_100000179811 [0,0,0,0,1,0|2,0,0]=3 2491 B10R1.11 CSCC(=O)C1CCOC1 1458a_100000184570_100000690089 [0,0,0,0,1,0|3,0,0]=4 2492 B10R1.11 CSCC(=O)N1CCCC1 240690a_100000188435_100000184570 [0,0,0,0,1,0|3,0,0]=4 2493 B10R1.11 CSCC(=O)N1CCCC1 527a_100000188435_100000184570 [0,0,0,0,1,0|3,0,0]=4 2494 B10R1.11 CSCC(=O)N1CCCC1 62a_100000183516_200000210301 [0,0,0,0,1,0|3,0,0]=4 2495 B10R1.11 CSCC(=O)N1CCCC1 62a_200000210301_100000183516 [0,0,0,0,1,0|3,0,0]=4 2496 B10R1.11 N#CCC(=O)C1CCCC1 1458a_100000210718_100011214920 [0,0,0,0,1,0|2,0,1]=4 2497 B10R1.11 N#CCC(=O)C1CCCC1 1458a_100051588842_100000179811 [0,0,0,0,1,0|2,0,1]=4 2498 B10R1.11 O=C(C=CBr)C1CCCC1 1458a_100016273825_100000179811 [0,0,0,0,1,0|2,0,1]=4 2499 B10R1.11 O=C(C=CCl)C1CCCC1 1458a_200016279998_100000179811 [0,0,0,0,1,0|2,0,1]=4 2500 B10R1.11 O=C(C=CI)C1CCCC1 1458a_100016256311_100000179811 [0,0,0,0,1,0|2,0,1]=4 2501 B10R1.11 O=C(CCF)C1CCCC1 1458a_100000210718_100011217306 [0,0,0,0,1,0|2,0,0]=3 2502 B10R1.11 O=C(CCF)C1CCCS1 1458a_100012002731_100011217306 [0,0,0,0,1,0|3,0,0]=4 2503 B10R1.11 O=C(CCF)C1CCOC1 1458a_100011219752_100011217306 [0,0,0,0,1,0|3,0,0]=4 2504 B10R1.11 O=C(CCF)[C@@H]1CCCO1 1458a_100000686382_100011217306 [0,0,0,0,1,0|3,0,0]=4 2505 B10R1.11 O=C(CCO)C1CCCC1 1458a_100000210718_100000211926 [0,0,0,0,1,0|2,0,0]=3 2506 B10R1.11 O=C(CCO)C1CCCC1 1458a_100011216618_100000179811 [0,0,0,0,1,0|2,0,0]=3 2507 B10R1.11 O=C(CCO)C1CCCS1 1458a_100012002731_100000211926 [0,0,0,0,1,0|3,0,0]=4 2508 B10R1.11 O=C(CCO)C1CCOC1 1458a_100011216618_100000690089 [0,0,0,0,1,0|3,0,0]=4 2509 B10R1.11 O=C(CCO)C1CCOC1 1458a_100011219752_100000211926 [0,0,0,0,1,0|3,0,0]=4 2510 B10R1.11 O=C(CCO)N1CCCC1 240690a_100000188435_100011216618 [0,0,0,0,1,0|3,0,0]=4 2511 B10R1.11 O=C(CCO)[C@@H]1CCCO1 1458a_100000686382_100000211926 [0,0,0,0,1,0|3,0,0]=4 2512 B10R1.11 [13CH3]NCC(=O)N1CCCC1 2230a_100000751844_200025704644 [0,0,0,0,1,0|3,0,0]=4 2513 B10R1.11 [13CH3]OCC(=O)N1CCCC1 7a_200000752455_200025704644 [0,0,0,0,1,0|3,0,0]=4 2514 B10R1.11 [13CH3]SCC(=O)N1CCCC1 62a_100000183516_200025704644 [0,0,0,0,1,0|3,0,0]=4 2515 B10R1.11 [13CH3]SCC(=O)N1CCCC1 62a_200025704644_100000183516 [0,0,0,0,1,0|3,0,0]=4 2516 B12R1.32 C#CCC(=O)CC1CCCCC1 1458a_100000211666_100000184674 [0,0,0,0,0,1|1,0,2]=4 2517 B12R1.32 C#CCC(=O)CC1CCCCC1 1458a_100011220946_100000211423 [0,0,0,0,0,1|1,0,2]=4 2518 B12R1.32 C#CCC(=O)NC1CCCCC1 1626a_100000182618_100011220946 [0,0,0,0,0,1|1,0,2]=4 2519 B12R1.32 C#CCC(=O)NC1CCCCC1 527a_100000182618_100011220946 [0,0,0,0,0,1|1,0,2]=4 2520 B12R1.32 C=CCC(=O)CC1CCCCC1 1458a_100000210193_100000211423 [0,0,0,0,0,1|1,0,2]=4 2521 B12R1.32 C=CCC(=O)CC1CCCCC1 1458a_100000211666_100000210623 [0,0,0,0,0,1|1,0,2]=4 2522 B12R1.32 C=CCC(=O)NC1CCCCC1 11a_100000182618_100000210193 [0,0,0,0,0,1|1,0,2]=4 2523 B12R1.32 C=CCC(=O)NC1CCCCC1 1626a_100000182618_100000210193 [0,0,0,0,0,1|1,0,2]=4 2524 B12R1.32 C=CCC(=O)NC1CCCCC1 240690a_100000182618_100000210193 [0,0,0,0,0,1|1,0,2]=4 2525 B12R1.32 C=CCC(=O)NC1CCCCC1 527a_100000182618_100000210193 [0,0,0,0,0,1|1,0,2]=4 2526 B12R1.32 CC#CC(=O)CC1CCCCC1 1458a_100000763181_100000211423 [0,0,0,0,0,1|1,0,1]=3 2527 B12R1.32 CC#CC(=O)CC1CCCCO1 1458a_100000763181_100000211543 [0,0,0,0,0,1|2,0,1]=4 2528 B12R1.32 CC#CC(=O)CC1CCCOC1 1458a_100000763181_100000741521 [0,0,0,0,0,1|2,0,1]=4 2529 B12R1.32 CC#CC(=O)CC1CCOCC1 1458a_100000763181_100000754603 [0,0,0,0,0,1|2,0,1]=4 2530 B12R1.32 CC=CC(=O)CC1CCCCC1 1458a_100000210699_100000211423 [0,0,0,0,0,1|1,0,1]=3 2531 B12R1.32 CC=CC(=O)CC1CCCCO1 1458a_100000210699_100000211543 [0,0,0,0,0,1|2,0,1]=4 2532 B12R1.32 CC=CC(=O)CC1CCCOC1 1458a_100000210699_100000741521 [0,0,0,0,0,1|2,0,1]=4 2533 B12R1.32 CC=CC(=O)CC1CCOCC1 1458a_100000210699_100000754603 [0,0,0,0,0,1|2,0,1]=4 2534 B12R1.32 CC=CC(=O)NC1CCCCC1 11a_100000182618_100000210699 [0,0,0,0,0,1|1,0,1]=3 2535 B12R1.32 CC=CC(=O)NC1CCCCC1 1626a_100000182618_100000210699 [0,0,0,0,0,1|1,0,1]=3 2536 B12R1.32 CC=CC(=O)NC1CCCCC1 240690a_100000182618_100000210699 [0,0,0,0,0,1|1,0,1]=3 2537 B12R1.32 CC=CC(=O)NC1CCCOC1 11a_100000719290_100000210699 [0,0,0,0,0,1|2,0,1]=4 2538 B12R1.32 CC=CC(=O)NC1CCCOC1 1626a_100000719290_100000210699 [0,0,0,0,0,1|2,0,1]=4 2539 B12R1.32 CC=CC(=O)NC1CCCOC1 240690a_100000719290_100000210699 [0,0,0,0,0,1|2,0,1]=4 2540 B12R1.32 CC=CC(=O)NC1CCOCC1 11a_100000741149_100000210699 [0,0,0,0,0,1|2,0,1]=4 2541 B12R1.32 CC=CC(=O)NC1CCOCC1 1626a_100000741149_100000210699 [0,0,0,0,0,1|2,0,1]=4 2542 B12R1.32 CC=CC(=O)NC1CCOCC1 240690a_100000741149_100000210699 [0,0,0,0,0,1|2,0,1]=4 2543 B12R1.32 CC=CC(=O)NC1CCSCC1 11a_100000748639_100000210699 [0,0,0,0,0,1|2,0,1]=4 2544 B12R1.32 CC=CC(=O)NC1CCSCC1 1626a_100000748639_100000210699 [0,0,0,0,0,1|2,0,1]=4 2545 B12R1.32 CC=CC(=O)NC1CCSCC1 240690a_100000748639_100000210699 [0,0,0,0,0,1|2,0,1]=4 2546 B12R1.32 CCCC(=O)C=C1CCCCC1 1458a_100000743792_100000210303 [0,0,0,0,0,1|1,0,1]=3 2547 B12R1.32 CCCC(=O)C=C1CCOCC1 1458a_100000761426_100000210303 [0,0,0,0,0,1|2,0,1]=4 2548 B12R1.32 CCCC(=O)CC1=CCCCC1 1458a_100000039269_100000210303 [0,0,0,0,0,1|1,0,2]=4 2549 B12R1.32 CCCC(=O)CC1CCCCC1 1458a_100000211666_100000210303 [0,0,0,0,0,1|1,0,0]=2 2550 B12R1.32 CCCC(=O)CC1CCCCC1 1458a_100000211992_100000211423 [0,0,0,0,0,1|1,0,0]=2 2551 B12R1.32 CCCC(=O)CC1CCCCO1 1458a_100000211992_100000211543 [0,0,0,0,0,1|2,0,0]=3 2552 B12R1.32 CCCC(=O)CC1CCCCO1 1458a_100000238585_100000210303 [0,0,0,0,0,1|2,0,0]=3 2553 B12R1.32 CCCC(=O)CC1CCCOC1 1458a_100000211992_100000741521 [0,0,0,0,0,1|2,0,0]=3 2554 B12R1.32 CCCC(=O)CC1CCCOC1 1458a_100000741523_100000210303 [0,0,0,0,0,1|2,0,0]=3 2555 B12R1.32 CCCC(=O)CC1CCOCC1 1458a_100000211992_100000754603 [0,0,0,0,0,1|2,0,0]=3 2556 B12R1.32 CCCC(=O)CC1CCOCC1 1458a_100000757261_100000210303 [0,0,0,0,0,1|2,0,0]=3 2557 B12R1.32 CCCC(=O)CN1CCCCC1 1458a_100000740322_100000210303 [0,0,0,0,0,1|2,0,0]=3 2558 B12R1.32 CCCC(=O)CN1CCCOC1 2230a_100000131196_100000747444 [0,0,0,0,0,1|3,0,0]=4 2559 B12R1.32 CCCC(=O)CN1CCCOC1 269982a_100000131196_100000747444 [0,0,0,0,0,1|3,0,0]=4 2560 B12R1.32 CCCC(=O)CN1CCOCC1 1458a_100000740321_100000210303 [0,0,0,0,0,1|3,0,0]=4 2561 B12R1.32 CCCC(=O)CN1CCOCC1 2230a_100015191051_100000747444 [0,0,0,0,0,1|3,0,0]=4 2562 B12R1.32 CCCC(=O)CN1CCOCC1 269982a_100015191051_100000747444 [0,0,0,0,0,1|3,0,0]=4 2563 B12R1.32 CCCC(=O)CN1CCSCC1 2230a_100000737611_100000747444 [0,0,0,0,0,1|3,0,0]=4 2564 B12R1.32 CCCC(=O)CN1CCSCC1 269982a_100000737611_100000747444 [0,0,0,0,0,1|3,0,0]=4 2565 B12R1.32 CCCC(=O)NC1CCCCC1 11a_100000182618_100000211992 [0,0,0,0,0,1|1,0,0]=2 2566 B12R1.32 CCCC(=O)NC1CCCCC1 1626a_100000182618_100000211992 [0,0,0,0,0,1|1,0,0]=2 2567 B12R1.32 CCCC(=O)NC1CCCCC1 240690a_100000182618_100000211992 [0,0,0,0,0,1|1,0,0]=2 2568 B12R1.32 CCCC(=O)NC1CCCCC1 527a_100000182618_100000211992 [0,0,0,0,0,1|1,0,0]=2 2569 B12R1.32 CCCC(=O)NC1CCCOC1 11a_100000719290_100000211992 [0,0,0,0,0,1|2,0,0]=3 2570 B12R1.32 CCCC(=O)NC1CCCOC1 1626a_100000719290_100000211992 [0,0,0,0,0,1|2,0,0]=3 2571 B12R1.32 CCCC(=O)NC1CCCOC1 240690a_100000719290_100000211992 [0,0,0,0,0,1|2,0,0]=3 2572 B12R1.32 CCCC(=O)NC1CCCOC1 527a_100000719290_100000211992 [0,0,0,0,0,1|2,0,0]=3 2573 B12R1.32 CCCC(=O)NC1CCOCC1 11a_100000741149_100000211992 [0,0,0,0,0,1|2,0,0]=3 2574 B12R1.32 CCCC(=O)NC1CCOCC1 1626a_100000741149_100000211992 [0,0,0,0,0,1|2,0,0]=3 2575 B12R1.32 CCCC(=O)NC1CCOCC1 240690a_100000741149_100000211992 [0,0,0,0,0,1|2,0,0]=3 2576 B12R1.32 CCCC(=O)NC1CCOCC1 527a_100000741149_100000211992 [0,0,0,0,0,1|2,0,0]=3 2577 B12R1.32 CCCC(=O)NC1CCSCC1 11a_100000748639_100000211992 [0,0,0,0,0,1|2,0,0]=3 2578 B12R1.32 CCCC(=O)NC1CCSCC1 1626a_100000748639_100000211992 [0,0,0,0,0,1|2,0,0]=3 2579 B12R1.32 CCCC(=O)NC1CCSCC1 240690a_100000748639_100000211992 [0,0,0,0,0,1|2,0,0]=3 2580 B12R1.32 CCCC(=O)NC1CCSCC1 527a_100000748639_100000211992 [0,0,0,0,0,1|2,0,0]=3 2581 B12R1.32 CCCC(C)NC1CCCCC1 2230a_100000182618_100000766640 [0,0,0,0,0,1|2,0,1]=4 2582 B12R1.32 CCCC(C)NC1CCCCC1 270004a_100000182618_100000211909 [0,0,0,0,0,1|2,0,1]=4 2583 B12R1.32 CCCC(C)NC1CCCCC1 270004a_100000741246_100000210434 [0,0,0,0,0,1|2,0,1]=4 2584 B12R1.32 CCCC(C)NC1CCCCC1 34a_100000182618_100000766640 [0,0,0,0,0,1|2,0,1]=4 2585 B12R1.32 CCCC(C)OC1CCCCC1 34a_100000210231_100000766640 [0,0,0,0,0,1|2,0,1]=4 2586 B12R1.32 CCCC(C)OC1CCCCC1 34a_100000764384_100000210327 [0,0,0,0,0,1|2,0,1]=4 2587 B12R1.32 CCCC(C)OC1CCCCC1 7a_100000210231_100000766640 [0,0,0,0,0,1|2,0,1]=4 2588 B12R1.32 CCCC(C)OC1CCCCC1 7a_100000764384_100000210327 [0,0,0,0,0,1|2,0,1]=4 2589 B12R1.32 CCCC(C)SC1CCCCC1 62a_100000210327_100000766640 [0,0,0,0,0,1|2,0,1]=4 2590 B12R1.32 CCCC(C)SC1CCCCC1 62a_100000766640_100000210327 [0,0,0,0,0,1|2,0,1]=4 2591 B12R1.32 CCCN(C)CC1CCCCC1 2230a_100000736448_100000210303 [0,0,0,0,0,1|3,0,0]=4 2592 B12R1.32 CCCN(C)CC1CCCCC1 2230a_100000743638_200000210301 [0,0,0,0,0,1|3,0,0]=4 2593 B12R1.32 CCCN(C)CC1CCCCC1 2230a_100000747261_100000211423 [0,0,0,0,0,1|3,0,0]=4 2594 B12R1.32 CCCN(C)CC1CCCCC1 269982a_100000736448_100000210303 [0,0,0,0,0,1|3,0,0]=4 2595 B12R1.32 CCCN(C)CC1CCCCC1 269982a_100000743638_200000210301 [0,0,0,0,0,1|3,0,0]=4 2596 B12R1.32 CCCN(C)CC1CCCCC1 269982a_100000747261_100000211423 [0,0,0,0,0,1|3,0,0]=4 2597 B12R1.32 CCCN(C)CC1CCCCC1 34a_100000736448_100000210303 [0,0,0,0,0,1|3,0,0]=4 2598 B12R1.32 CCCN(C)CC1CCCCC1 34a_100000743638_200000210301 [0,0,0,0,0,1|3,0,0]=4 2599 B12R1.32 CCCN([13CH3])CC1CCCCC1 2230a_100000743638_200025704644 [0,0,0,0,0,1|3,0,0]=4 2600 B12R1.32 CCCN([13CH3])CC1CCCCC1 269982a_100000743638_200025704644 [0,0,0,0,0,1|3,0,0]=4 2601 B12R1.32 CCCN([13CH3])CC1CCCCC1 34a_100000743638_200025704644 [0,0,0,0,0,1|3,0,0]=4 2602 B12R1.32 CCNC(=O)C=C1CCCCC1 11a_100015525214_100000743792 [0,0,0,0,0,1|1,0,1]=3 2603 B12R1.32 CCNC(=O)C=C1CCCCC1 240690a_100015525214_100000743792 [0,0,0,0,0,1|1,0,1]=3 2604 B12R1.32 CCNC(=O)C=C1CCOCC1 11a_100015525214_100000761426 [0,0,0,0,0,1|2,0,1]=4 2605 B12R1.32 CCNC(=O)C=C1CCOCC1 240690a_100015525214_100000761426 [0,0,0,0,0,1|2,0,1]=4 2606 B12R1.32 CCNC(=O)CC1=CCCCC1 11a_100015525214_100000039269 [0,0,0,0,0,1|1,0,2]=4 2607 B12R1.32 CCNC(=O)CC1=CCCCC1 240690a_100015525214_100000039269 [0,0,0,0,0,1|1,0,2]=4 2608 B12R1.32 CCNC(=O)CC1=CCCCC1 527a_100015525214_100000039269 [0,0,0,0,0,1|1,0,2]=4 2609 B12R1.32 CCNC(=O)CC1CCCCC1 11a_100015525214_100000211666 [0,0,0,0,0,1|1,0,0]=2 2610 B12R1.32 CCNC(=O)CC1CCCCC1 240690a_100015525214_100000211666 [0,0,0,0,0,1|1,0,0]=2 2611 B12R1.32 CCNC(=O)CC1CCCCC1 527a_100015525214_100000211666 [0,0,0,0,0,1|1,0,0]=2 2612 B12R1.32 CCNC(=O)CC1CCCCO1 11a_100015525214_100000238585 [0,0,0,0,0,1|2,0,0]=3 2613 B12R1.32 CCNC(=O)CC1CCCCO1 240690a_100015525214_100000238585 [0,0,0,0,0,1|2,0,0]=3 2614 B12R1.32 CCNC(=O)CC1CCCCO1 527a_100015525214_100000238585 [0,0,0,0,0,1|2,0,0]=3 2615 B12R1.32 CCNC(=O)CC1CCCOC1 11a_100015525214_100000741523 [0,0,0,0,0,1|2,0,0]=3 2616 B12R1.32 CCNC(=O)CC1CCCOC1 240690a_100015525214_100000741523 [0,0,0,0,0,1|2,0,0]=3 2617 B12R1.32 CCNC(=O)CC1CCCOC1 527a_100015525214_100000741523 [0,0,0,0,0,1|2,0,0]=3 2618 B12R1.32 CCNC(=O)CC1CCOCC1 11a_100015525214_100000757261 [0,0,0,0,0,1|2,0,0]=3 2619 B12R1.32 CCNC(=O)CC1CCOCC1 240690a_100015525214_100000757261 [0,0,0,0,0,1|2,0,0]=3 2620 B12R1.32 CCNC(=O)CC1CCOCC1 527a_100015525214_100000757261 [0,0,0,0,0,1|2,0,0]=3 2621 B12R1.32 CCNC(=O)CN1CCCCC1 11a_100015525214_100000740322 [0,0,0,0,0,1|2,0,0]=3 2622 B12R1.32 CCNC(=O)CN1CCCCC1 240690a_100015525214_100000740322 [0,0,0,0,0,1|2,0,0]=3 2623 B12R1.32 CCNC(=O)CN1CCCCC1 527a_100015525214_100000740322 [0,0,0,0,0,1|2,0,0]=3 2624 B12R1.32 CCNC(=O)CN1CCCOC1 2230a_100000131196_100000183381 [0,0,0,0,0,1|3,0,0]=4 2625 B12R1.32 CCNC(=O)CN1CCCOC1 269982a_100000131196_100000183381 [0,0,0,0,0,1|3,0,0]=4 2626 B12R1.32 CCNC(=O)CN1CCCOC1 34a_100000131196_100000183381 [0,0,0,0,0,1|3,0,0]=4 2627 B12R1.32 CCNC(=O)CN1CCOCC1 11a_100015525214_100000740321 [0,0,0,0,0,1|3,0,0]=4 2628 B12R1.32 CCNC(=O)CN1CCOCC1 2230a_100015191051_100000183381 [0,0,0,0,0,1|3,0,0]=4 2629 B12R1.32 CCNC(=O)CN1CCOCC1 240690a_100015525214_100000740321 [0,0,0,0,0,1|3,0,0]=4 2630 B12R1.32 CCNC(=O)CN1CCOCC1 269982a_100015191051_100000183381 [0,0,0,0,0,1|3,0,0]=4 2631 B12R1.32 CCNC(=O)CN1CCOCC1 34a_100015191051_100000183381 [0,0,0,0,0,1|3,0,0]=4 2632 B12R1.32 CCNC(=O)CN1CCOCC1 527a_100015525214_100000740321 [0,0,0,0,0,1|3,0,0]=4 2633 B12R1.32 CCNC(=O)CN1CCSCC1 2230a_100000737611_100000183381 [0,0,0,0,0,1|3,0,0]=4 2634 B12R1.32 CCNC(=O)CN1CCSCC1 269982a_100000737611_100000183381 [0,0,0,0,0,1|3,0,0]=4 2635 B12R1.32 CCNC(=O)NC1CCCCC1 2708a_100000182618_100015525214 [0,0,0,0,0,1|1,0,0]=2 2636 B12R1.32 CCNC(=O)NC1CCCCC1 2708a_100015525214_100000182618 [0,0,0,0,0,1|1,0,0]=2 2637 B12R1.32 CCNC(=O)NC1CCCCC1 273464a_100000182618_100015525214 [0,0,0,0,0,1|1,0,0]=2 2638 B12R1.32 CCNC(=O)NC1CCCCC1 273464a_100015525214_100000182618 [0,0,0,0,0,1|1,0,0]=2 2639 B12R1.32 CCNC(=O)NC1CCCOC1 2708a_100000719290_100015525214 [0,0,0,0,0,1|2,0,0]=3 2640 B12R1.32 CCNC(=O)NC1CCCOC1 2708a_100015525214_100000719290 [0,0,0,0,0,1|2,0,0]=3 2641 B12R1.32 CCNC(=O)NC1CCCOC1 273464a_100000719290_100015525214 [0,0,0,0,0,1|2,0,0]=3 2642 B12R1.32 CCNC(=O)NC1CCCOC1 273464a_100015525214_100000719290 [0,0,0,0,0,1|2,0,0]=3 2643 B12R1.32 CCNC(=O)NC1CCCOC1 512a_100000719290_100015525214 [0,0,0,0,0,1|2,0,0]=3 2644 B12R1.32 CCNC(=O)NC1CCCOC1 512a_100015525214_100000719290 [0,0,0,0,0,1|2,0,0]=3 2645 B12R1.32 CCNC(=O)NC1CCOCC1 2708a_100000741149_100015525214 [0,0,0,0,0,1|2,0,0]=3 2646 B12R1.32 CCNC(=O)NC1CCOCC1 2708a_100015525214_100000741149 [0,0,0,0,0,1|2,0,0]=3 2647 B12R1.32 CCNC(=O)NC1CCOCC1 273464a_100000741149_100015525214 [0,0,0,0,0,1|2,0,0]=3 2648 B12R1.32 CCNC(=O)NC1CCOCC1 273464a_100015525214_100000741149 [0,0,0,0,0,1|2,0,0]=3 2649 B12R1.32 CCNC(=O)NC1CCOCC1 512a_100000741149_100015525214 [0,0,0,0,0,1|2,0,0]=3 2650 B12R1.32 CCNC(=O)NC1CCOCC1 512a_100015525214_100000741149 [0,0,0,0,0,1|2,0,0]=3 2651 B12R1.32 CCNC(=O)NC1CCSCC1 2708a_100000748639_100015525214 [0,0,0,0,0,1|2,0,0]=3 2652 B12R1.32 CCNC(=O)NC1CCSCC1 2708a_100015525214_100000748639 [0,0,0,0,0,1|2,0,0]=3 2653 B12R1.32 CCNC(=O)NC1CCSCC1 273464a_100000748639_100015525214 [0,0,0,0,0,1|2,0,0]=3 2654 B12R1.32 CCNC(=O)NC1CCSCC1 273464a_100015525214_100000748639 [0,0,0,0,0,1|2,0,0]=3 2655 B12R1.32 CCNC(=O)NC1CCSCC1 512a_100000748639_100015525214 [0,0,0,0,0,1|2,0,0]=3 2656 B12R1.32 CCNC(=O)NC1CCSCC1 512a_100015525214_100000748639 [0,0,0,0,0,1|2,0,0]=3 2657 B12R1.32 CCNC(C)CC1CCCCC1 270004a_100015525214_100011215996 [0,0,0,0,0,1|2,0,1]=4 2658 B12R1.32 CCOC(=O)CN1CC=CCC1 2230a_100000698166_100000188475 [0,0,0,0,0,1|1,0,2]=4 2659 B12R1.32 CCOC(=O)CN1CC=CCC1 269982a_100000698166_100000188475 [0,0,0,0,0,1|1,0,2]=4 2660 B12R1.32 CCOC(=O)CN1CC=CCC1 34a_100000698166_100000188475 [0,0,0,0,0,1|1,0,2]=4 2661 B12R1.32 CCOC(=O)CN1CCCOC1 2230a_100000131196_100000188475 [0,0,0,0,0,1|2,0,0]=3 2662 B12R1.32 CCOC(=O)CN1CCCOC1 269982a_100000131196_100000188475 [0,0,0,0,0,1|2,0,0]=3 2663 B12R1.32 CCOC(=O)CN1CCCOC1 34a_100000131196_100000188475 [0,0,0,0,0,1|2,0,0]=3 2664 B12R1.32 CCOC(=O)CN1CCOCC1 2230a_100015191051_100000188475 [0,0,0,0,0,1|2,0,0]=3 2665 B12R1.32 CCOC(=O)CN1CCOCC1 269982a_100015191051_100000188475 [0,0,0,0,0,1|2,0,0]=3 2666 B12R1.32 CCOC(=O)CN1CCOCC1 34a_100015191051_100000188475 [0,0,0,0,0,1|2,0,0]=3 2667 B12R1.32 CCOC(=O)CN1CCSCC1 2230a_100000737611_100000188475 [0,0,0,0,0,1|2,0,0]=3 2668 B12R1.32 CCOC(=O)CN1CCSCC1 269982a_100000737611_100000188475 [0,0,0,0,0,1|2,0,0]=3 2669 B12R1.32 CNCC(=O)NC1CCCCC1 2230a_100015207117_200000210301 [0,0,0,0,0,1|2,0,0]=3 2670 B12R1.32 CNCC(=O)NC1CCCCC1 2230a_106832991635_100000183541 [0,0,0,0,0,1|2,0,0]=3 2671 B12R1.32 CNCC(=O)NC1CCCCC1 34a_100102657272_100000183541 [0,0,0,0,0,1|2,0,0]=3 2672 B12R1.32 CNCC(=O)NC1CCCCC1 7a_106832991635_100000183541 [0,0,0,0,0,1|2,0,0]=3 2673 B12R1.32 CNCC(=O)OC1CCCCC1 2230a_106832991635_100000041653 [0,0,0,0,0,1|2,0,0]=3 2674 B12R1.32 CNCC(=O)OC1CCCCC1 34a_100102657272_100000041653 [0,0,0,0,0,1|2,0,0]=3 2675 B12R1.32 CNCC(=O)OC1CCCCC1 7a_106832991635_100000041653 [0,0,0,0,0,1|2,0,0]=3 2676 B12R1.32 CNNC(=O)C=C1CCCCC1 22a_100016993582_100000743792 [0,0,0,0,0,1|2,0,1]=4 2677 B12R1.32 CNNC(=O)CC1CCCCC1 22a_100016993582_100000211666 [0,0,0,0,0,1|2,0,0]=3 2678 B12R1.32 CNNC(=O)CC1CCCCO1 22a_100016993582_100000238585 [0,0,0,0,0,1|3,0,0]=4 2679 B12R1.32 CNNC(=O)CC1CCCOC1 22a_100016993582_100000741523 [0,0,0,0,0,1|3,0,0]=4 2680 B12R1.32 CNNC(=O)CC1CCOCC1 22a_100016993582_100000757261 [0,0,0,0,0,1|3,0,0]=4 2681 B12R1.32 CNNC(=O)CN1CCCCC1 22a_100016993582_100000740322 [0,0,0,0,0,1|3,0,0]=4 2682 B12R1.32 CNNC(=O)NC1CCCCC1 273464a_100000182618_100016993582 [0,0,0,0,0,1|2,0,0]=3 2683 B12R1.32 CNNC(=O)NC1CCCOC1 273464a_100000719290_100016993582 [0,0,0,0,0,1|3,0,0]=4 2684 B12R1.32 CNNC(=O)NC1CCCOC1 512a_100000719290_100016993582 [0,0,0,0,0,1|3,0,0]=4 2685 B12R1.32 CNNC(=O)NC1CCCOC1 512a_100016993582_100000719290 [0,0,0,0,0,1|3,0,0]=4 2686 B12R1.32 CNNC(=O)NC1CCOCC1 273464a_100000741149_100016993582 [0,0,0,0,0,1|3,0,0]=4 2687 B12R1.32 CNNC(=O)NC1CCOCC1 512a_100000741149_100016993582 [0,0,0,0,0,1|3,0,0]=4 2688 B12R1.32 CNNC(=O)NC1CCOCC1 512a_100016993582_100000741149 [0,0,0,0,0,1|3,0,0]=4 2689 B12R1.32 CNNC(=O)NC1CCSCC1 273464a_100000748639_100016993582 [0,0,0,0,0,1|3,0,0]=4 2690 B12R1.32 CNNC(=O)NC1CCSCC1 512a_100000748639_100016993582 [0,0,0,0,0,1|3,0,0]=4 2691 B12R1.32 CNNC(=O)NC1CCSCC1 512a_100016993582_100000748639 [0,0,0,0,0,1|3,0,0]=4 2692 B12R1.32 COCC(=O)CC1CCCCC1 1458a_100000210968_100000211423 [0,0,0,0,0,1|2,0,0]=3 2693 B12R1.32 COCC(=O)CC1CCCCO1 1458a_100000210968_100000211543 [0,0,0,0,0,1|3,0,0]=4 2694 B12R1.32 COCC(=O)CC1CCCOC1 1458a_100000210968_100000741521 [0,0,0,0,0,1|3,0,0]=4 2695 B12R1.32 COCC(=O)CC1CCOCC1 1458a_100000210968_100000754603 [0,0,0,0,0,1|3,0,0]=4 2696 B12R1.32 COCC(=O)NC1CCCCC1 11a_100000182618_100000210968 [0,0,0,0,0,1|2,0,0]=3 2697 B12R1.32 COCC(=O)NC1CCCCC1 1626a_100000182618_100000210968 [0,0,0,0,0,1|2,0,0]=3 2698 B12R1.32 COCC(=O)NC1CCCCC1 240690a_100000182618_100000210968 [0,0,0,0,0,1|2,0,0]=3 2699 B12R1.32 COCC(=O)NC1CCCCC1 34a_100138415774_100000183541 [0,0,0,0,0,1|2,0,0]=3 2700 B12R1.32 COCC(=O)NC1CCCCC1 527a_100000182618_100000210968 [0,0,0,0,0,1|2,0,0]=3 2701 B12R1.32 COCC(=O)NC1CCCOC1 11a_100000719290_100000210968 [0,0,0,0,0,1|3,0,0]=4 2702 B12R1.32 COCC(=O)NC1CCCOC1 1626a_100000719290_100000210968 [0,0,0,0,0,1|3,0,0]=4 2703 B12R1.32 COCC(=O)NC1CCCOC1 240690a_100000719290_100000210968 [0,0,0,0,0,1|3,0,0]=4 2704 B12R1.32 COCC(=O)NC1CCCOC1 527a_100000719290_100000210968 [0,0,0,0,0,1|3,0,0]=4 2705 B12R1.32 COCC(=O)NC1CCOCC1 11a_100000741149_100000210968 [0,0,0,0,0,1|3,0,0]=4 2706 B12R1.32 COCC(=O)NC1CCOCC1 1626a_100000741149_100000210968 [0,0,0,0,0,1|3,0,0]=4 2707 B12R1.32 COCC(=O)NC1CCOCC1 240690a_100000741149_100000210968 [0,0,0,0,0,1|3,0,0]=4 2708 B12R1.32 COCC(=O)NC1CCOCC1 527a_100000741149_100000210968 [0,0,0,0,0,1|3,0,0]=4 2709 B12R1.32 COCC(=O)NC1CCSCC1 11a_100000748639_100000210968 [0,0,0,0,0,1|3,0,0]=4 2710 B12R1.32 COCC(=O)NC1CCSCC1 1626a_100000748639_100000210968 [0,0,0,0,0,1|3,0,0]=4 2711 B12R1.32 COCC(=O)NC1CCSCC1 240690a_100000748639_100000210968 [0,0,0,0,0,1|3,0,0]=4 2712 B12R1.32 COCC(=O)NC1CCSCC1 527a_100000748639_100000210968 [0,0,0,0,0,1|3,0,0]=4 2713 B12R1.32 COCC(=O)OC1CCCCC1 34a_100138415774_100000041653 [0,0,0,0,0,1|2,0,0]=3 2714 B12R1.32 CSCC(=O)CC1CCCCC1 1458a_100000184570_100000211423 [0,0,0,0,0,1|2,0,0]=3 2715 B12R1.32 CSCC(=O)CC1CCCCO1 1458a_100000184570_100000211543 [0,0,0,0,0,1|3,0,0]=4 2716 B12R1.32 CSCC(=O)CC1CCCOC1 1458a_100000184570_100000741521 [0,0,0,0,0,1|3,0,0]=4 2717 B12R1.32 CSCC(=O)CC1CCOCC1 1458a_100000184570_100000754603 [0,0,0,0,0,1|3,0,0]=4 2718 B12R1.32 CSCC(=O)NC1CCCCC1 11a_100000182618_100000184570 [0,0,0,0,0,1|2,0,0]=3 2719 B12R1.32 CSCC(=O)NC1CCCCC1 1626a_100000182618_100000184570 [0,0,0,0,0,1|2,0,0]=3 2720 B12R1.32 CSCC(=O)NC1CCCCC1 240690a_100000182618_100000184570 [0,0,0,0,0,1|2,0,0]=3 2721 B12R1.32 CSCC(=O)NC1CCCCC1 527a_100000182618_100000184570 [0,0,0,0,0,1|2,0,0]=3 2722 B12R1.32 CSCC(=O)NC1CCCCC1 62a_100000183541_200000210301 [0,0,0,0,0,1|2,0,0]=3 2723 B12R1.32 CSCC(=O)NC1CCCCC1 62a_200000210301_100000183541 [0,0,0,0,0,1|2,0,0]=3 2724 B12R1.32 CSCC(=O)NC1CCCOC1 11a_100000719290_100000184570 [0,0,0,0,0,1|3,0,0]=4 2725 B12R1.32 CSCC(=O)NC1CCCOC1 1626a_100000719290_100000184570 [0,0,0,0,0,1|3,0,0]=4 2726 B12R1.32 CSCC(=O)NC1CCCOC1 240690a_100000719290_100000184570 [0,0,0,0,0,1|3,0,0]=4 2727 B12R1.32 CSCC(=O)NC1CCCOC1 527a_100000719290_100000184570 [0,0,0,0,0,1|3,0,0]=4 2728 B12R1.32 CSCC(=O)NC1CCOCC1 11a_100000741149_100000184570 [0,0,0,0,0,1|3,0,0]=4 2729 B12R1.32 CSCC(=O)NC1CCOCC1 1626a_100000741149_100000184570 [0,0,0,0,0,1|3,0,0]=4 2730 B12R1.32 CSCC(=O)NC1CCOCC1 240690a_100000741149_100000184570 [0,0,0,0,0,1|3,0,0]=4 2731 B12R1.32 CSCC(=O)NC1CCOCC1 527a_100000741149_100000184570 [0,0,0,0,0,1|3,0,0]=4 2732 B12R1.32 CSCC(=O)NC1CCSCC1 11a_100000748639_100000184570 [0,0,0,0,0,1|3,0,0]=4 2733 B12R1.32 CSCC(=O)NC1CCSCC1 1626a_100000748639_100000184570 [0,0,0,0,0,1|3,0,0]=4 2734 B12R1.32 CSCC(=O)NC1CCSCC1 240690a_100000748639_100000184570 [0,0,0,0,0,1|3,0,0]=4 2735 B12R1.32 CSCC(=O)NC1CCSCC1 527a_100000748639_100000184570 [0,0,0,0,0,1|3,0,0]=4 2736 B12R1.32 CSCC(=O)OC1CCCCC1 62a_100000041653_200000210301 [0,0,0,0,0,1|2,0,0]=3 2737 B12R1.32 CSCC(=O)OC1CCCCC1 62a_200000210301_100000041653 [0,0,0,0,0,1|2,0,0]=3 2738 B12R1.32 N#CCC(=O)CC1CCCCC1 1458a_100000211666_100011214920 [0,0,0,0,0,1|2,0,1]=4 2739 B12R1.32 N#CCC(=O)CC1CCCCC1 1458a_100051588842_100000211423 [0,0,0,0,0,1|2,0,1]=4 2740 B12R1.32 N#CCC(=O)NC1CCCCC1 1626a_100000182618_100051588842 [0,0,0,0,0,1|2,0,1]=4 2741 B12R1.32 N#CCC(=O)NC1CCCCC1 240690a_100000182618_100051588842 [0,0,0,0,0,1|2,0,1]=4 2742 B12R1.32 O=C(C=C1CCCCC1)CCF 1458a_100000743792_100011217306 [0,0,0,0,0,1|2,0,1]=4 2743 B12R1.32 O=C(C=C1CCCCC1)CCO 1458a_100000743792_100000211926 [0,0,0,0,0,1|2,0,1]=4 2744 B12R1.32 O=C(C=CBr)CC1CCCCC1 1458a_100016273825_100000211423 [0,0,0,0,0,1|2,0,1]=4 2745 B12R1.32 O=C(C=CBr)NC1CCCCC1 1626a_100000182618_100016273825 [0,0,0,0,0,1|2,0,1]=4 2746 B12R1.32 O=C(C=CBr)NC1CCCCC1 240690a_100000182618_100016273825 [0,0,0,0,0,1|2,0,1]=4 2747 B12R1.32 O=C(C=CCl)CC1CCCCC1 1458a_200016279998_100000211423 [0,0,0,0,0,1|2,0,1]=4 2748 B12R1.32 O=C(C=CCl)NC1CCCCC1 11a_100000182618_200016279998 [0,0,0,0,0,1|2,0,1]=4 2749 B12R1.32 O=C(C=CCl)NC1CCCCC1 1626a_100000182618_200016279998 [0,0,0,0,0,1|2,0,1]=4 2750 B12R1.32 O=C(C=CCl)NC1CCCCC1 240690a_100000182618_200016279998 [0,0,0,0,0,1|2,0,1]=4 2751 B12R1.32 O=C(C=CI)CC1CCCCC1 1458a_100016256311_100000211423 [0,0,0,0,0,1|2,0,1]=4 2752 B12R1.32 O=C(C=CI)NC1CCCCC1 1626a_100000182618_100016256311 [0,0,0,0,0,1|2,0,1]=4 2753 B12R1.32 O=C(CCF)CC1CCCCC1 1458a_100000211666_100011217306 [0,0,0,0,0,1|2,0,0]=3 2754 B12R1.32 O=C(CCF)CC1CCCCO1 1458a_100000238585_100011217306 [0,0,0,0,0,1|3,0,0]=4 2755 B12R1.32 O=C(CCF)CC1CCCOC1 1458a_100000741523_100011217306 [0,0,0,0,0,1|3,0,0]=4 2756 B12R1.32 O=C(CCF)CC1CCOCC1 1458a_100000757261_100011217306 [0,0,0,0,0,1|3,0,0]=4 2757 B12R1.32 O=C(CCF)CN1CCCCC1 1458a_100000740322_100011217306 [0,0,0,0,0,1|3,0,0]=4 2758 B12R1.32 O=C(CCO)CC1CCCCC1 1458a_100000211666_100000211926 [0,0,0,0,0,1|2,0,0]=3 2759 B12R1.32 O=C(CCO)CC1CCCCC1 1458a_100011216618_100000211423 [0,0,0,0,0,1|2,0,0]=3 2760 B12R1.32 O=C(CCO)CC1CCCCO1 1458a_100000238585_100000211926 [0,0,0,0,0,1|3,0,0]=4 2761 B12R1.32 O=C(CCO)CC1CCCCO1 1458a_100011216618_100000211543 [0,0,0,0,0,1|3,0,0]=4 2762 B12R1.32 O=C(CCO)CC1CCCOC1 1458a_100000741523_100000211926 [0,0,0,0,0,1|3,0,0]=4 2763 B12R1.32 O=C(CCO)CC1CCCOC1 1458a_100011216618_100000741521 [0,0,0,0,0,1|3,0,0]=4 2764 B12R1.32 O=C(CCO)CC1CCOCC1 1458a_100000757261_100000211926 [0,0,0,0,0,1|3,0,0]=4 2765 B12R1.32 O=C(CCO)CC1CCOCC1 1458a_100011216618_100000754603 [0,0,0,0,0,1|3,0,0]=4 2766 B12R1.32 O=C(CCO)CN1CCCCC1 1458a_100000740322_100000211926 [0,0,0,0,0,1|3,0,0]=4 2767 B12R1.32 O=C(CCO)NC1CCCCC1 240690a_100000182618_100011216618 [0,0,0,0,0,1|2,0,0]=3 2768 B12R1.32 O=C(CCO)NC1CCCOC1 240690a_100000719290_100011216618 [0,0,0,0,0,1|3,0,0]=4 2769 B12R1.32 O=C(CCO)NC1CCOCC1 240690a_100000741149_100011216618 [0,0,0,0,0,1|3,0,0]=4 2770 B12R1.32 O=C(CCO)NC1CCSCC1 240690a_100000748639_100011216618 [0,0,0,0,0,1|3,0,0]=4 2771 B12R1.32 [13CH3]NCC(=O)NC1CCCCC1 2230a_100015207117_200025704644 [0,0,0,0,0,1|2,0,0]=3 2772 B12R1.32 [13CH3]SCC(=O)NC1CCCCC1 62a_100000183541_200025704644 [0,0,0,0,0,1|2,0,0]=3 2773 B12R1.32 [13CH3]SCC(=O)NC1CCCCC1 62a_200025704644_100000183541 [0,0,0,0,0,1|2,0,0]=3 2774 B12R1.32 [13CH3]SCC(=O)OC1CCCCC1 62a_100000041653_200025704644 [0,0,0,0,0,1|2,0,0]=3 2775 B12R1.32 [13CH3]SCC(=O)OC1CCCCC1 62a_200025704644_100000041653 [0,0,0,0,0,1|2,0,0]=3 2776 B12R1.1564 C#CCC(=O)C1CCCCCC1 1458a_100000749507_100000184674 [0,0,0,0,0,1|1,0,2]=4 2777 B12R1.1564 C#CCC(=O)C1CCCCCC1 1458a_100011220946_100011217769 [0,0,0,0,0,1|1,0,2]=4 2778 B12R1.1564 C=CCC(=O)C1CCCCCC1 1458a_100000210193_100011217769 [0,0,0,0,0,1|1,0,2]=4 2779 B12R1.1564 C=CCC(=O)C1CCCCCC1 1458a_100000749507_100000210623 [0,0,0,0,0,1|1,0,2]=4 2780 B12R1.1564 CC#CC(=O)C1CCCCCC1 1458a_100000763181_100011217769 [0,0,0,0,0,1|1,0,1]=3 2781 B12R1.1564 CC=CC(=O)C1CCCCCC1 1458a_100000210699_100011217769 [0,0,0,0,0,1|1,0,1]=3 2782 B12R1.1564 CC=CC(=O)N1CCCCCC1 11a_100000185865_100000210699 [0,0,0,0,0,1|2,0,1]=4 2783 B12R1.1564 CC=CC(=O)N1CCCCCC1 1626a_100000185865_100000210699 [0,0,0,0,0,1|2,0,1]=4 2784 B12R1.1564 CC=CC(=O)N1CCCCCC1 240690a_100000185865_100000210699 [0,0,0,0,0,1|2,0,1]=4 2785 B12R1.1564 CC=CC(=O)N1CCCOCC1 11a_100000685342_100000210699 [0,0,0,0,0,1|2,0,1]=4 2786 B12R1.1564 CC=CC(=O)N1CCCOCC1 1626a_100000685342_100000210699 [0,0,0,0,0,1|2,0,1]=4 2787 B12R1.1564 CC=CC(=O)N1CCCOCC1 240690a_100000685342_100000210699 [0,0,0,0,0,1|2,0,1]=4 2788 B12R1.1564 CCCC(=O)C1CCC=CCC1 1458a_100000048548_100000210303 [0,0,0,0,0,1|1,0,1]=3 2789 B12R1.1564 CCCC(=O)C1CCCCCC1 1458a_100000211992_100011217769 [0,0,0,0,0,1|1,0,0]=2 2790 B12R1.1564 CCCC(=O)C1CCCCCC1 1458a_100000749507_100000210303 [0,0,0,0,0,1|1,0,0]=2 2791 B12R1.1564 CCCC(=O)N1CCCCCC1 11a_100000185865_100000211992 [0,0,0,0,0,1|2,0,0]=3 2792 B12R1.1564 CCCC(=O)N1CCCCCC1 1626a_100000185865_100000211992 [0,0,0,0,0,1|2,0,0]=3 2793 B12R1.1564 CCCC(=O)N1CCCCCC1 240690a_100000185865_100000211992 [0,0,0,0,0,1|2,0,0]=3 2794 B12R1.1564 CCCC(=O)N1CCCCCC1 527a_100000185865_100000211992 [0,0,0,0,0,1|2,0,0]=3 2795 B12R1.1564 CCCC(=O)N1CCCOCC1 11a_100000685342_100000211992 [0,0,0,0,0,1|2,0,0]=3 2796 B12R1.1564 CCCC(=O)N1CCCOCC1 1626a_100000685342_100000211992 [0,0,0,0,0,1|2,0,0]=3 2797 B12R1.1564 CCCC(=O)N1CCCOCC1 240690a_100000685342_100000211992 [0,0,0,0,0,1|2,0,0]=3 2798 B12R1.1564 CCCC(=O)N1CCCOCC1 527a_100000685342_100000211992 [0,0,0,0,0,1|2,0,0]=3 2799 B12R1.1564 CCCN(C)C1CCCCCC1 2230a_100015185097_100000210303 [0,0,0,0,0,1|3,0,0]=4 2800 B12R1.1564 CCCN(C)C1CCCCCC1 2230a_100015187045_200000210301 [0,0,0,0,0,1|3,0,0]=4 2801 B12R1.1564 CCCN(C)C1CCCCCC1 269982a_100000747261_100011217769 [0,0,0,0,0,1|3,0,0]=4 2802 B12R1.1564 CCCN(C)C1CCCCCC1 269982a_100015185097_100000210303 [0,0,0,0,0,1|3,0,0]=4 2803 B12R1.1564 CCCN(C)C1CCCCCC1 269982a_100015187045_200000210301 [0,0,0,0,0,1|3,0,0]=4 2804 B12R1.1564 CCCN(C)C1CCCCCC1 270004a_100000747261_100000210131 [0,0,0,0,0,1|3,0,0]=4 2805 B12R1.1564 CCCN(C)C1CCCCCC1 34a_100015185097_100000210303 [0,0,0,0,0,1|3,0,0]=4 2806 B12R1.1564 CCCN(C)C1CCCCCC1 34a_100015187045_200000210301 [0,0,0,0,0,1|3,0,0]=4 2807 B12R1.1564 CCCN(C)C1CCCNCC1 270004a_100000747261_100015187895 [0,0,0,0,0,1|3,0,0]=4 2808 B12R1.1564 CCCN([13CH3])C1CCCCCC1 2230a_100015187045_200025704644 [0,0,0,0,0,1|3,0,0]=4 2809 B12R1.1564 CCCN([13CH3])C1CCCCCC1 269982a_100015187045_200025704644 [0,0,0,0,0,1|3,0,0]=4 2810 B12R1.1564 CCCN([13CH3])C1CCCCCC1 34a_100015187045_200025704644 [0,0,0,0,0,1|3,0,0]=4 2811 B12R1.1564 CCNC(=O)C1CCC=CCC1 11a_100015525214_100000048548 [0,0,0,0,0,1|1,0,1]=3 2812 B12R1.1564 CCNC(=O)C1CCC=CCC1 240690a_100015525214_100000048548 [0,0,0,0,0,1|1,0,1]=3 2813 B12R1.1564 CCNC(=O)C1CCC=CCC1 527a_100015525214_100000048548 [0,0,0,0,0,1|1,0,1]=3 2814 B12R1.1564 CCNC(=O)C1CCCCCC1 11a_100015525214_100000749507 [0,0,0,0,0,1|1,0,0]=2 2815 B12R1.1564 CCNC(=O)C1CCCCCC1 240690a_100015525214_100000749507 [0,0,0,0,0,1|1,0,0]=2 2816 B12R1.1564 CCNC(=O)C1CCCCCC1 527a_100015525214_100000749507 [0,0,0,0,0,1|1,0,0]=2 2817 B12R1.1564 CCNC(=O)N1CCCCCC1 2708a_100015525214_100000185865 [0,0,0,0,0,1|2,0,0]=3 2818 B12R1.1564 CCNC(=O)N1CCCCCC1 273464a_100015525214_100000185865 [0,0,0,0,0,1|2,0,0]=3 2819 B12R1.1564 CCNC(=O)N1CCCOCC1 2708a_100015525214_100000685342 [0,0,0,0,0,1|2,0,0]=3 2820 B12R1.1564 CCNC(=O)N1CCCOCC1 273464a_100015525214_100000685342 [0,0,0,0,0,1|2,0,0]=3 2821 B12R1.1564 CNCC(=O)N1CCCCCC1 2230a_106832991635_100000182869 [0,0,0,0,0,1|3,0,0]=4 2822 B12R1.1564 CNCC(=O)N1CCCCCC1 34a_100102657272_100000182869 [0,0,0,0,0,1|3,0,0]=4 2823 B12R1.1564 CNCC(=O)N1CCCCCC1 7a_106832991635_100000182869 [0,0,0,0,0,1|3,0,0]=4 2824 B12R1.1564 CNNC(=O)C1CCC=CCC1 22a_100016993582_100000048548 [0,0,0,0,0,1|2,0,1]=4 2825 B12R1.1564 CNNC(=O)C1CCCCCC1 22a_100016993582_100000749507 [0,0,0,0,0,1|2,0,0]=3 2826 B12R1.1564 COCC(=O)C1CCCCCC1 1458a_100000210968_100011217769 [0,0,0,0,0,1|2,0,0]=3 2827 B12R1.1564 COCC(=O)N1CCCCCC1 11a_100000185865_100000210968 [0,0,0,0,0,1|3,0,0]=4 2828 B12R1.1564 COCC(=O)N1CCCCCC1 1626a_100000185865_100000210968 [0,0,0,0,0,1|3,0,0]=4 2829 B12R1.1564 COCC(=O)N1CCCCCC1 240690a_100000185865_100000210968 [0,0,0,0,0,1|3,0,0]=4 2830 B12R1.1564 COCC(=O)N1CCCCCC1 34a_100138415774_100000182869 [0,0,0,0,0,1|3,0,0]=4 2831 B12R1.1564 COCC(=O)N1CCCCCC1 527a_100000185865_100000210968 [0,0,0,0,0,1|3,0,0]=4 2832 B12R1.1564 COCC(=O)N1CCCOCC1 11a_100000685342_100000210968 [0,0,0,0,0,1|3,0,0]=4 2833 B12R1.1564 COCC(=O)N1CCCOCC1 1626a_100000685342_100000210968 [0,0,0,0,0,1|3,0,0]=4 2834 B12R1.1564 COCC(=O)N1CCCOCC1 240690a_100000685342_100000210968 [0,0,0,0,0,1|3,0,0]=4 2835 B12R1.1564 COCC(=O)N1CCCOCC1 527a_100000685342_100000210968 [0,0,0,0,0,1|3,0,0]=4 2836 B12R1.1564 CSCC(=O)C1CCCCCC1 1458a_100000184570_100011217769 [0,0,0,0,0,1|2,0,0]=3 2837 B12R1.1564 CSCC(=O)N1CCCCCC1 11a_100000185865_100000184570 [0,0,0,0,0,1|3,0,0]=4 2838 B12R1.1564 CSCC(=O)N1CCCCCC1 1626a_100000185865_100000184570 [0,0,0,0,0,1|3,0,0]=4 2839 B12R1.1564 CSCC(=O)N1CCCCCC1 240690a_100000185865_100000184570 [0,0,0,0,0,1|3,0,0]=4 2840 B12R1.1564 CSCC(=O)N1CCCCCC1 527a_100000185865_100000184570 [0,0,0,0,0,1|3,0,0]=4 2841 B12R1.1564 CSCC(=O)N1CCCCCC1 62a_100000182869_200000210301 [0,0,0,0,0,1|3,0,0]=4 2842 B12R1.1564 CSCC(=O)N1CCCCCC1 62a_200000210301_100000182869 [0,0,0,0,0,1|3,0,0]=4 2843 B12R1.1564 CSCC(=O)N1CCCOCC1 11a_100000685342_100000184570 [0,0,0,0,0,1|3,0,0]=4 2844 B12R1.1564 CSCC(=O)N1CCCOCC1 1626a_100000685342_100000184570 [0,0,0,0,0,1|3,0,0]=4 2845 B12R1.1564 CSCC(=O)N1CCCOCC1 240690a_100000685342_100000184570 [0,0,0,0,0,1|3,0,0]=4 2846 B12R1.1564 CSCC(=O)N1CCCOCC1 527a_100000685342_100000184570 [0,0,0,0,0,1|3,0,0]=4 2847 B12R1.1564 N#CCC(=O)C1CCCCCC1 1458a_100000749507_100011214920 [0,0,0,0,0,1|2,0,1]=4 2848 B12R1.1564 N#CCC(=O)C1CCCCCC1 1458a_100051588842_100011217769 [0,0,0,0,0,1|2,0,1]=4 2849 B12R1.1564 O=C(C=CBr)C1CCCCCC1 1458a_100016273825_100011217769 [0,0,0,0,0,1|2,0,1]=4 2850 B12R1.1564 O=C(C=CCl)C1CCCCCC1 1458a_200016279998_100011217769 [0,0,0,0,0,1|2,0,1]=4 2851 B12R1.1564 O=C(C=CI)C1CCCCCC1 1458a_100016256311_100011217769 [0,0,0,0,0,1|2,0,1]=4 2852 B12R1.1564 O=C(CCF)C1CCC=CCC1 1458a_100000048548_100011217306 [0,0,0,0,0,1|2,0,1]=4 2853 B12R1.1564 O=C(CCF)C1CCCCCC1 1458a_100000749507_100011217306 [0,0,0,0,0,1|2,0,0]=3 2854 B12R1.1564 O=C(CCO)C1CCC=CCC1 1458a_100000048548_100000211926 [0,0,0,0,0,1|2,0,1]=4 2855 B12R1.1564 O=C(CCO)C1CCCCCC1 1458a_100000749507_100000211926 [0,0,0,0,0,1|2,0,0]=3 2856 B12R1.1564 O=C(CCO)C1CCCCCC1 1458a_100011216618_100011217769 [0,0,0,0,0,1|2,0,0]=3 2857 B12R1.1564 O=C(CCO)N1CCCCCC1 240690a_100000185865_100011216618 [0,0,0,0,0,1|3,0,0]=4 2858 B12R1.1564 O=C(CCO)N1CCCOCC1 240690a_100000685342_100011216618 [0,0,0,0,0,1|3,0,0]=4 2859 B12R1.1564 [13CH3]SCC(=O)N1CCCCCC1 62a_100000182869_200025704644 [0,0,0,0,0,1|3,0,0]=4 2860 B12R1.1564 [13CH3]SCC(=O)N1CCCCCC1 62a_200025704644_100000182869 [0,0,0,0,0,1|3,0,0]=4 2861 B9R0.5 CC#CC(=O)CCCCC 1458a_100000763181_100000210326 [1,0,1,0,0,0|1,0,1]=4 2862 B9R0.5 CC=CC(=O)CCCCC 1458a_100000210699_100000210326 [1,0,1,0,0,0|1,0,1]=4 2863 B9R0.5 CCCC(=O)CCCCF 1458a_100000211992_100000729493 [1,0,1,0,0,0|2,0,0]=4 2864 B9R0.5 CCCC(=O)CCCCO 1458a_100000211992_100000210776 [1,0,1,0,0,0|2,0,0]=4 2865 B9R0.5 CCCC(=O)CCCCO 1458a_100000695505_100000210303 [1,0,1,0,0,0|2,0,0]=4 2866 B9R0.5 CCCC(=O)CCCOC 1458a_100000211992_100000740836 [1,0,1,0,0,0|2,0,0]=4 2867 B9R0.5 CCCC(=O)CCCOC 1458a_100000741012_100000210303 [1,0,1,0,0,0|2,0,0]=4 2868 B9R0.5 CCCC(=O)CCCSC 1458a_100000173376_100000210303 [1,0,1,0,0,0|2,0,0]=4 2869 B9R0.5 CCCC(=O)CCOCC 1458a_100000211992_100011215890 [1,0,1,0,0,0|2,0,0]=4 2870 B9R0.5 CCCC(=O)CCOCC 1458a_100000749530_100000210303 [1,0,1,0,0,0|2,0,0]=4 2871 B9R0.5 CCCC(=O)CCSCC 1458a_100000211992_100000757381 [1,0,1,0,0,0|2,0,0]=4 2872 B9R0.5 CCCC(=O)CCSCC 1458a_100000230768_100000210303 [1,0,1,0,0,0|2,0,0]=4 2873 B9R0.5 CCCCCC(=O)CCC 1458a_100000211992_100000210326 [1,0,1,0,0,0|1,0,0]=3 2874 B9R0.5 CCCCCC(=O)CCC 1458a_100000212188_100000210303 [1,0,1,0,0,0|1,0,0]=3 2875 B9R0.5 CCCCCC(=O)CCF 1458a_100000212188_100011217306 [1,0,1,0,0,0|2,0,0]=4 2876 B9R0.5 CCCCCC(=O)CCO 1458a_100000212188_100000211926 [1,0,1,0,0,0|2,0,0]=4 2877 B9R0.5 CCCCCC(=O)CCO 1458a_100011216618_100000210326 [1,0,1,0,0,0|2,0,0]=4 2878 B9R0.5 CCCCCC(=O)CNC 2230a_106832991635_200012276598 [1,0,1,0,0,0|2,0,0]=4 2879 B9R0.5 CCCCCC(=O)CNC 34a_100102657272_200012276598 [1,0,1,0,0,0|2,0,0]=4 2880 B9R0.5 CCCCCC(=O)CNC 7a_106832991635_200012276598 [1,0,1,0,0,0|2,0,0]=4 2881 B9R0.5 CCCCCC(=O)COC 1458a_100000210968_100000210326 [1,0,1,0,0,0|2,0,0]=4 2882 B9R0.5 CCCCCC(=O)COC 34a_100138415774_200012276598 [1,0,1,0,0,0|2,0,0]=4 2883 B9R0.5 CCCCCC(=O)CSC 1458a_100000184570_100000210326 [1,0,1,0,0,0|2,0,0]=4 2884 B9R0.5 CCCCCC(=O)CSC 62a_200000210301_200012276598 [1,0,1,0,0,0|2,0,0]=4 2885 B9R0.5 CCCCCC(=O)CSC 62a_200012276598_200000210301 [1,0,1,0,0,0|2,0,0]=4 2886 B9R0.5 CCCCCC(=O)CS[13CH3] 62a_200012276598_200025704644 [1,0,1,0,0,0|2,0,0]=4 2887 B9R0.5 CCCCCC(=O)CS[13CH3] 62a_200025704644_200012276598 [1,0,1,0,0,0|2,0,0]=4 2888 B9R0.5 CCCCCC(=O)NCC 11a_100015525214_100000212188 [1,0,1,0,0,0|1,0,0]=3 2889 B9R0.5 CCCCCC(=O)NCC 240690a_100015525214_100000212188 [1,0,1,0,0,0|1,0,0]=3 2890 B9R0.5 CCCCCC(=O)NCC 527a_100015525214_100000212188 [1,0,1,0,0,0|1,0,0]=3 2891 B9R0.5 CCCCCC(=O)NNC 22a_100016993582_100000212188 [1,0,1,0,0,0|2,0,0]=4 2892 B9R0.5 CCCCCC(C)OCC 34a_100011215632_100000210202 [1,0,1,0,0,0|1,0,1]=4 2893 B9R0.5 CCCCCC(C)OCC 34a_100121572206_200011218191 [1,0,1,0,0,0|1,0,1]=4 2894 B9R0.5 CCCCCC(C)OCC 7a_100011215632_100000210202 [1,0,1,0,0,0|1,0,1]=4 2895 B9R0.5 CCCCNC(=O)CCC 11a_100000102301_100000211992 [1,0,1,0,0,0|2,0,0]=4 2896 B9R0.5 CCCCNC(=O)CCC 1626a_100000102301_100000211992 [1,0,1,0,0,0|2,0,0]=4 2897 B9R0.5 CCCCNC(=O)CCC 240690a_100000102301_100000211992 [1,0,1,0,0,0|2,0,0]=4 2898 B9R0.5 CCCCNC(=O)CCC 527a_100000102301_100000211992 [1,0,1,0,0,0|2,0,0]=4 2899 B9R0.5 CCCCNC(=O)NCC 2708a_100000102301_100015525214 [1,0,1,0,0,0|2,0,0]=4 2900 B9R0.5 CCCCNC(=O)NCC 2708a_100015525214_100000102301 [1,0,1,0,0,0|2,0,0]=4 2901 B9R0.5 CCCCNC(=O)NCC 273464a_100000102301_100015525214 [1,0,1,0,0,0|2,0,0]=4 2902 B9R0.5 CCCCNC(=O)NCC 273464a_100015525214_100000102301 [1,0,1,0,0,0|2,0,0]=4 2903 B9R0.5 CCCCNC(=O)NCC 512a_100000102301_100015525214 [1,0,1,0,0,0|2,0,0]=4 2904 B9R0.5 CCCCNC(=O)NCC 512a_100015525214_100000102301 [1,0,1,0,0,0|2,0,0]=4 2905 B9R0.5 CCCNCC(=O)NCC 2230a_100016988866_100000210303 [1,0,1,0,0,0|2,0,0]=4 2906 B9R0.5 CCCOCC(=O)CCC 1458a_100000745993_100000210303 [1,0,1,0,0,0|2,0,0]=4 2907 B9R0.5 CCCOCC(=O)NCC 11a_100015525214_100000745993 [1,0,1,0,0,0|2,0,0]=4 2908 B9R0.5 CCCOCC(=O)NCC 240690a_100015525214_100000745993 [1,0,1,0,0,0|2,0,0]=4 2909 B9R0.5 CCCOCC(=O)NCC 34a_100000210258_100000183381 [1,0,1,0,0,0|2,0,0]=4 2910 B9R0.5 CCCOCC(=O)NCC 527a_100015525214_100000745993 [1,0,1,0,0,0|2,0,0]=4 2911 B9R0.5 CCCOCC(=O)OCC 34a_100000210258_100000188475 [1,0,1,0,0,0|1,0,0]=3 2912 B9R0.5 CCCSCC(=O)CCC 1458a_100000217233_100000210303 [1,0,1,0,0,0|2,0,0]=4 2913 B9R0.5 CCCSCC(=O)CCC 62a_100000210303_100000747444 [1,0,1,0,0,0|2,0,0]=4 2914 B9R0.5 CCCSCC(=O)CCC 62a_100000747444_100000210303 [1,0,1,0,0,0|2,0,0]=4 2915 B9R0.5 CCCSCC(=O)NCC 11a_100015525214_100000217233 [1,0,1,0,0,0|2,0,0]=4 2916 B9R0.5 CCCSCC(=O)NCC 240690a_100015525214_100000217233 [1,0,1,0,0,0|2,0,0]=4 2917 B9R0.5 CCCSCC(=O)NCC 527a_100015525214_100000217233 [1,0,1,0,0,0|2,0,0]=4 2918 B9R0.5 CCCSCC(=O)NCC 62a_100000183381_100000210303 [1,0,1,0,0,0|2,0,0]=4 2919 B9R0.5 CCCSCC(=O)NCC 62a_100000210303_100000183381 [1,0,1,0,0,0|2,0,0]=4 2920 B9R0.5 CCCSCC(=O)OCC 62a_100000188475_100000210303 [1,0,1,0,0,0|1,0,0]=3 2921 B9R0.5 CCCSCC(=O)OCC 62a_100000210303_100000188475 [1,0,1,0,0,0|1,0,0]=3 2922 B9R0.5 CCNC(=O)CCCOC 11a_100015525214_100000741012 [1,0,1,0,0,0|2,0,0]=4 2923 B9R0.5 CCNC(=O)CCCOC 240690a_100015525214_100000741012 [1,0,1,0,0,0|2,0,0]=4 2924 B9R0.5 CCNC(=O)CCCOC 527a_100015525214_100000741012 [1,0,1,0,0,0|2,0,0]=4 2925 B9R0.5 CCNC(=O)CCCSC 11a_100015525214_100000173376 [1,0,1,0,0,0|2,0,0]=4 2926 B9R0.5 CCNC(=O)CCCSC 240690a_100015525214_100000173376 [1,0,1,0,0,0|2,0,0]=4 2927 B9R0.5 CCNC(=O)CCCSC 527a_100015525214_100000173376 [1,0,1,0,0,0|2,0,0]=4 2928 B9R0.5 CCNC(=O)CCOCC 11a_100015525214_100000749530 [1,0,1,0,0,0|2,0,0]=4 2929 B9R0.5 CCNC(=O)CCOCC 240690a_100015525214_100000749530 [1,0,1,0,0,0|2,0,0]=4 2930 B9R0.5 CCNC(=O)CCOCC 527a_100015525214_100000749530 [1,0,1,0,0,0|2,0,0]=4 2931 B9R0.5 CCNC(=O)CCSCC 11a_100015525214_100000230768 [1,0,1,0,0,0|2,0,0]=4 2932 B9R0.5 CCNC(=O)CCSCC 240690a_100015525214_100000230768 [1,0,1,0,0,0|2,0,0]=4 2933 B9R0.5 CCNC(=O)CCSCC 527a_100015525214_100000230768 [1,0,1,0,0,0|2,0,0]=4 2934 B9R0.5 CCNC(=O)CCSCC 62a_100000210202_100000737597 [1,0,1,0,0,0|2,0,0]=4 2935 B9R0.5 CCNC(=O)CCSCC 62a_100000737597_100000210202 [1,0,1,0,0,0|2,0,0]=4 2936 B9R0.5 CCNCCC(=O)NCC 2230a_100015525214_100000737597 [1,0,1,0,0,0|2,0,0]=4 2937 B9R0.5 CCNCCC(=O)NCC 34a_100025743525_100000210202 [1,0,1,0,0,0|2,0,0]=4 2938 B9R0.5 CCNCCC(=O)OCC 2230a_100015525214_100011206558 [1,0,1,0,0,0|1,0,0]=3 2939 B9R0.5 CCOC(=O)CCCNC 2230a_106832991635_100009991533 [1,0,1,0,0,0|1,0,0]=3 2940 B9R0.5 CCOC(=O)CCCNC 34a_100102657272_100009991533 [1,0,1,0,0,0|1,0,0]=3 2941 B9R0.5 CCOC(=O)CCCNC 7a_106832991635_100011215271 [1,0,1,0,0,0|1,0,0]=3 2942 B9R0.5 CCOC(=O)CCCOC 34a_100138415774_100009991533 [1,0,1,0,0,0|1,0,0]=3 2943 B9R0.5 CCOC(=O)CCCOC 7a_100012001163_200000210301 [1,0,1,0,0,0|1,0,0]=3 2944 B9R0.5 CCOC(=O)CCCO[13CH3] 7a_100012001163_200025704644 [1,0,1,0,0,0|1,0,0]=3 2945 B9R0.5 CCOC(=O)CCCSC 62a_100009991533_200000210301 [1,0,1,0,0,0|1,0,0]=3 2946 B9R0.5 CCOC(=O)CCCSC 62a_200000210301_100009991533 [1,0,1,0,0,0|1,0,0]=3 2947 B9R0.5 CCOC(=O)CCCS[13CH3] 62a_100009991533_200025704644 [1,0,1,0,0,0|1,0,0]=3 2948 B9R0.5 CCOC(=O)CCCS[13CH3] 62a_200025704644_100009991533 [1,0,1,0,0,0|1,0,0]=3 2949 B9R0.5 CCOC(=O)CCSCC 62a_100000210202_100000765890 [1,0,1,0,0,0|1,0,0]=3 2950 B9R0.5 CCOC(=O)CCSCC 62a_100000765890_100000210202 [1,0,1,0,0,0|1,0,0]=3 2951 B9R0.5 CCOC(=O)CCSCF 62a_100000765890_100015361967 [1,0,1,0,0,0|2,0,0]=4 2952 B9R0.5 CCOC(=O)CCSCF 62a_100015361967_100000765890 [1,0,1,0,0,0|2,0,0]=4 2953 B9R0.5 CCOC(=O)CNCCF 34a_100000724931_100000188475 [1,0,1,0,0,0|2,0,0]=4 2954 B9R0.5 CCOC(=O)CNCCO 2230a_100016997473_100000188475 [1,0,1,0,0,0|2,0,0]=4 2955 B9R0.5 CCOC(=O)CNCCO 34a_100016990907_100000188475 [1,0,1,0,0,0|2,0,0]=4 2956 B9R0.5 CCOC(=O)COCCBr 34a_100000211926_100000188475 [1,0,1,0,0,0|2,0,0]=4 2957 B9R0.5 CCOC(=O)COCCN 34a_100000210304_100000188475 [1,0,1,0,0,0|2,0,0]=4 2958 B9R0.5 CCOC(=O)CSCCF 62a_100000188475_100011217306 [1,0,1,0,0,0|2,0,0]=4 2959 B9R0.5 CCOC(=O)CSCCF 62a_100011217306_100000188475 [1,0,1,0,0,0|2,0,0]=4 2960 B9R0.5 CCOC(=O)CSCCO 62a_100000188475_100000211926 [1,0,1,0,0,0|2,0,0]=4 2961 B9R0.5 CCOC(=O)CSCCO 62a_100000211926_100000188475 [1,0,1,0,0,0|2,0,0]=4 2962 B9R0.5 CCOC(=O)CSCOC 62a_100000188475_100000766300 [1,0,1,0,0,0|2,0,0]=4 2963 B9R0.5 CCOC(=O)CSCOC 62a_100000766300_100000188475 [1,0,1,0,0,0|2,0,0]=4 2964 B9R0.5 CCOC(=O)CSCSC 62a_100000188475_100011218213 [1,0,1,0,0,0|2,0,0]=4 2965 B9R0.5 CCOC(=O)CSCSC 62a_100011218213_100000188475 [1,0,1,0,0,0|2,0,0]=4 2966 B9R0.5 CCOC(=O)NCCNC 7a_106832991635_200011445536 [1,0,1,0,0,0|2,0,0]=4 2967 B9R0.5 CCOC(=O)NCCOC 34a_100000158857_200000210301 [1,0,1,0,0,0|2,0,0]=4 2968 B9R0.5 CCOC(=O)NCCO[13CH3] 34a_100000158857_200025704644 [1,0,1,0,0,0|2,0,0]=4 2969 B9R0.5 CCOC(=O)NCCSC 62a_200000210301_200011445536 [1,0,1,0,0,0|2,0,0]=4 2970 B9R0.5 CCOC(=O)NCCS[13CH3] 62a_200025704644_200011445536 [1,0,1,0,0,0|2,0,0]=4 2971 B9R0.5 CCOC(=O)OCSCC 62a_100000210202_100000075025 [1,0,1,0,0,0|2,0,0]=4 2972 B9R0.5 CCOCCC(=O)OCC 34a_100121572206_100000765890 [1,0,1,0,0,0|1,0,0]=3 2973 B9R0.45 CC/C=C/CCCOCC 34a_100016287902_100000210202 [1,0,1,0,0,0|2,0,0]=4 2974 B9R0.45 CC/C=C/CCCOCC 7a_100016287902_100000210202 [1,0,1,0,0,0|2,0,0]=4 2975 B9R0.45 CC/C=C\CCCCOC 34a_100016287862_200000210301 [1,0,1,0,0,0|2,0,0]=4 2976 B9R0.45 CC/C=C\CCCCOC 7a_100016287862_200000210301 [1,0,1,0,0,0|2,0,0]=4 2977 B9R0.45 CC/C=C\CCCCO[13CH3] 34a_100016287862_200025704644 [1,0,1,0,0,0|2,0,0]=4 2978 B9R0.45 CC/C=C\CCCCO[13CH3] 7a_100016287862_200025704644 [1,0,1,0,0,0|2,0,0]=4 2979 B9R0.45 CC/C=C\CCOCCC 34a_100000210258_100015370543 [1,0,1,0,0,0|2,0,0]=4 2980 B9R0.45 CC/C=C\CCOCCC 34a_100016288707_100000210303 [1,0,1,0,0,0|2,0,0]=4 2981 B9R0.45 CC/C=C\CCOCCC 7a_100016288707_100000210303 [1,0,1,0,0,0|2,0,0]=4 2982 B9R0.45 CC/C=C\CCSCCC 62a_100000210303_100015370543 [1,0,1,0,0,0|2,0,0]=4 2983 B9R0.45 CC/C=C\CCSCCC 62a_100015370543_100000210303 [1,0,1,0,0,0|2,0,0]=4 2984 B9R0.45 CC/C=C\CNCCCC 2230a_100000102301_100103147603 [1,0,1,0,0,0|2,0,0]=4 2985 B9R0.45 CC/C=C\CNCCCC 7a_106832991798_100103147603 [1,0,1,0,0,0|2,0,0]=4 2986 B9R0.45 CC/C=C\COCCCC 34a_100000210227_100103147603 [1,0,1,0,0,0|2,0,0]=4 2987 B9R0.45 CC/C=C\COCCCC 34a_100016268518_100000210210 [1,0,1,0,0,0|2,0,0]=4 2988 B9R0.45 CC/C=C\COCCCC 7a_100000210227_100103147603 [1,0,1,0,0,0|2,0,0]=4 2989 B9R0.45 CC/C=C\CSCCCC 62a_100000210211_100103147603 [1,0,1,0,0,0|2,0,0]=4 2990 B9R0.45 CC/C=C\CSCCCC 62a_100103147603_100000210210 [1,0,1,0,0,0|2,0,0]=4 2991 B9R0.45 CCCCCCCNCC 2230a_100000229938_100000210202 [1,0,1,0,0,0|1,0,1]=4 2992 B9R0.45 CCCCCCCNCC 2230a_100015525214_100000210681 [1,0,1,0,0,0|1,0,1]=4 2993 B9R0.45 CCCCCCCOCC 34a_100000210272_100000210202 [1,0,1,0,0,0|0,0,1]=3 2994 B9R0.45 CCCCCCCOCC 34a_100121572206_100000210614 [1,0,1,0,0,0|0,0,1]=3 2995 B9R0.45 CCCCCCCOCC 7a_100000210272_100000210202 [1,0,1,0,0,0|0,0,1]=3 2996 B9R0.45 CCCCCCCOCF 34a_100000210272_100015361967 [1,0,1,0,0,0|1,0,1]=4 2997 B9R0.45 CCCCCCCOCF 7a_100000210272_100015361967 [1,0,1,0,0,0|1,0,1]=4 2998 B9R0.45 CCCCCCCSCC 62a_100000210202_100000210316 [1,0,1,0,0,0|0,1,1]=4 2999 B9R0.45 CCCCCCCSCC 62a_100000210614_100000210202 [1,0,1,0,0,0|0,1,1]=4 3000 B9R0.45 CCCCCCNCCC 2230a_100000210581_100000210303 [1,0,1,0,0,0|2,0,0]=4 3001 B9R0.45 CCCCCCOCCC 34a_100000210258_100000210314 [1,0,1,0,0,0|2,0,0]=4 3002 B9R0.45 CCCCCCOCCC 34a_100000210259_100000210303 [1,0,1,0,0,0|2,0,0]=4 3003 B9R0.45 CCCCCCOCCC 7a_100000210259_100000210303 [1,0,1,0,0,0|2,0,0]=4 3004 B9R0.45 CCCCCCSCCC 62a_100000210303_100000210757 [1,0,1,0,0,0|2,0,0]=4 3005 B9R0.45 CCCCCCSCCC 62a_100000210314_100000210303 [1,0,1,0,0,0|2,0,0]=4 3006 B9R0.45 CCCCCSCOCC 62a_100000210326_100000739092 [1,0,1,0,0,0|1,0,1]=4 3007 B9R0.45 CCCCCSCOCC 62a_100000739092_100000210326 [1,0,1,0,0,0|1,0,1]=4 3008 B9R0.45 CCCCNCCOCC 2230a_100000102301_100011215890 [1,0,1,0,0,0|1,0,1]=4 3009 B9R0.45 CCCCNCCOCC 2230a_102516460346_100000210211 [1,0,1,0,0,0|1,0,1]=4 3010 B9R0.45 CCCCNCCOCC 34a_102516460346_100000210210 [1,0,1,0,0,0|1,0,1]=4 3011 B9R0.45 CCCCNCCOCC 7a_106832991798_100011215890 [1,0,1,0,0,0|1,0,1]=4 3012 B9R0.45 CCCCOCCOCC 34a_100000210136_100000210210 [1,0,1,0,0,0|1,0,1]=4 3013 B9R0.45 CCCCOCCOCC 34a_100000210227_100000210147 [1,0,1,0,0,0|1,0,1]=4 3014 B9R0.45 CCCCOCCOCC 34a_100000210238_100000210202 [1,0,1,0,0,0|1,0,1]=4 3015 B9R0.45 CCCCOCCOCC 34a_100121572206_100000743108 [1,0,1,0,0,0|1,0,1]=4 3016 B9R0.45 CCCCOCCOCC 7a_100000210136_100000210211 [1,0,1,0,0,0|1,0,1]=4 3017 B9R0.45 CCCCOCCOCC 7a_100000210227_100011215890 [1,0,1,0,0,0|1,0,1]=4 3018 B9R0.45 CCCCOCCOCC 7a_100000210238_100000210202 [1,0,1,0,0,0|1,0,1]=4 3019 B9R0.45 CCCCSCCOCC 34a_200000230436_100000210202 [1,0,1,0,0,0|1,0,1]=4 3020 B9R0.45 CCCCSCCOCC 62a_100000210147_100000210210 [1,0,1,0,0,0|1,0,1]=4 3021 B9R0.45 CCCCSCCOCC 62a_100000210211_100011215890 [1,0,1,0,0,0|1,0,1]=4 3022 B9R0.45 CCCCSCCOCC 7a_200000230436_100000210202 [1,0,1,0,0,0|1,0,1]=4 3023 B9R0.45 CCCNCCCOCC 2230a_100000210961_100000210303 [1,0,1,0,0,0|1,0,1]=4 3024 B9R0.45 CCCNCCCOCC 34a_100000210961_100000210303 [1,0,1,0,0,0|1,0,1]=4 3025 B9R0.45 CCCOCCCOCC 34a_100000210258_100012232248 [1,0,1,0,0,0|1,0,1]=4 3026 B9R0.45 CCCOCCCOCC 34a_100000757476_100000210303 [1,0,1,0,0,0|1,0,1]=4 3027 B9R0.45 CCCOCCCOCC 7a_100000757476_100000210303 [1,0,1,0,0,0|1,0,1]=4 3028 B9R0.45 CCCSCCCOCC 62a_100000210303_100012232248 [1,0,1,0,0,0|1,0,1]=4 3029 B9R0.45 CCCSCCCOCC 62a_100012232248_100000210303 [1,0,1,0,0,0|1,0,1]=4 3030 B9R0.45 CCOCCCCCCBr 34a_100011215345_100000210202 [1,0,1,0,0,0|1,0,1]=4 3031 B9R0.45 CCOCCCCCCBr 7a_100011215345_100000210202 [1,0,1,0,0,0|1,0,1]=4 3032 B9R0.45 CCOCCCCCCCl 34a_100000766143_100000210202 [1,0,1,0,0,0|1,0,1]=4 3033 B9R0.45 CCOCCCCCCCl 7a_100000766143_100000210202 [1,0,1,0,0,0|1,0,1]=4 3034 B9R0.45 CCOCCCCCCF 34a_100000732779_100000210202 [1,0,1,0,0,0|1,0,1]=4 3035 B9R0.45 CCOCCCCCCF 34a_100121572206_100015922095 [1,0,1,0,0,0|1,0,1]=4 3036 B9R0.45 CCOCCCCCCF 7a_100000732779_100000210202 [1,0,1,0,0,0|1,0,1]=4 3037 B9R0.45 CCOCCCCCCN 34a_100000686447_100000210202 [1,0,1,0,0,0|1,0,1]=4 3038 B9R0.45 CCOCCCCCCO 34a_100121572206_100000766143 [1,0,1,0,0,0|1,0,1]=4 3039 B9R0.45 CCOCCCCCNC 34a_100000722520_100000210202 [1,0,1,0,0,0|1,0,1]=4 3040 B9R0.46 C#CC(=O)CCCCCC 1458a_100000211873_100000210757 [1,0,1,0,0,0|0,0,2]=4 3041 B9R0.46 C#CCCCCC(=O)CC 1458a_100000210414_100010269958 [1,0,1,0,0,0|0,0,2]=4 3042 B9R0.46 C#CCCCCC(=O)CC 1458a_100000696528_100000210202 [1,0,1,0,0,0|0,0,2]=4 3043 B9R0.46 C=CC(=O)CCCCCC 1458a_100000185746_100000210757 [1,0,1,0,0,0|0,0,2]=4 3044 B9R0.46 C=CCCCCC(=O)CC 1458a_100000210414_100011215482 [1,0,1,0,0,0|0,0,2]=4 3045 B9R0.46 C=CCCCCC(=O)CC 1458a_100011215552_100000210202 [1,0,1,0,0,0|0,0,2]=4 3046 B9R0.46 CC/C=C\CCC(=O)CC 1458a_100000210414_100015370543 [1,0,1,0,0,0|0,0,2]=4 3047 B9R0.46 CCC(=O)CCCCC#N 1458a_100000210414_100000211819 [1,0,1,0,0,0|1,0,1]=4 3048 B9R0.46 CCC(=O)CCCCCF 1458a_100000210414_100000729378 [1,0,1,0,0,0|1,0,0]=3 3049 B9R0.46 CCC(=O)CCCCCO 1458a_100000210414_100000746330 [1,0,1,0,0,0|1,0,0]=3 3050 B9R0.46 CCC(=O)CCCCCO 1458a_100102619762_100000210202 [1,0,1,0,0,0|1,0,0]=3 3051 B9R0.46 CCC(=O)CCCCOC 1458a_100000210414_100000755781 [1,0,1,0,0,0|1,0,0]=3 3052 B9R0.46 CCC(=O)CCOCCO 1458a_100000210414_100011215305 [1,0,1,0,0,0|2,0,0]=4 3053 B9R0.46 CCC(=O)CCOCCO 1458a_100011229844_100000210202 [1,0,1,0,0,0|2,0,0]=4 3054 B9R0.46 CCC(=O)COCCCF 34a_100000725409_100011934791 [1,0,1,0,0,0|2,0,0]=4 3055 B9R0.46 CCC(=O)COCCCO 34a_100000725409_100000230001 [1,0,1,0,0,0|2,0,0]=4 3056 B9R0.46 CCC(=O)COCCOC 1458a_100000211095_100000210202 [1,0,1,0,0,0|2,0,0]=4 3057 B9R0.46 CCC(=O)COCCOC 34a_100000725409_100011201679 [1,0,1,0,0,0|2,0,0]=4 3058 B9R0.46 CCC(=O)COCCSC 34a_100000725409_100000212216 [1,0,1,0,0,0|2,0,0]=4 3059 B9R0.46 CCC(=O)COCCSC 7a_100000230434_100000747405 [1,0,1,0,0,0|2,0,0]=4 3060 B9R0.46 CCC(=O)CSCCCF 62a_100000747405_100011934791 [1,0,1,0,0,0|2,0,0]=4 3061 B9R0.46 CCC(=O)CSCCCF 62a_100011934791_100000747405 [1,0,1,0,0,0|2,0,0]=4 3062 B9R0.46 CCC(=O)CSCCCO 62a_100000747405_100011215043 [1,0,1,0,0,0|2,0,0]=4 3063 B9R0.46 CCC(=O)CSCCCO 62a_100011215043_100000747405 [1,0,1,0,0,0|2,0,0]=4 3064 B9R0.46 CCC(=O)CSCCOC 62a_100000233755_100000747405 [1,0,1,0,0,0|2,0,0]=4 3065 B9R0.46 CCC(=O)CSCCOC 62a_100000747405_100000233755 [1,0,1,0,0,0|2,0,0]=4 3066 B9R0.46 CCC(=O)CSCCSC 62a_100000212216_100000747405 [1,0,1,0,0,0|2,0,0]=4 3067 B9R0.46 CCC(=O)CSCCSC 62a_100000747405_100000751147 [1,0,1,0,0,0|2,0,0]=4 3068 B9R0.46 CCC(=O)NCCCCO 240690a_100000750430_100000210414 [1,0,1,0,0,0|2,0,0]=4 3069 B9R0.46 CCC(=O)NCCCCO 527a_100000750430_100000210414 [1,0,1,0,0,0|2,0,0]=4 3070 B9R0.46 CCC(=O)NCCCOC 1626a_100150723488_100000210414 [1,0,1,0,0,0|2,0,0]=4 3071 B9R0.46 CCC(=O)NCCCOC 240690a_100150723488_100000210414 [1,0,1,0,0,0|2,0,0]=4 3072 B9R0.46 CCC(=O)NCCCOC 527a_100150723488_100000210414 [1,0,1,0,0,0|2,0,0]=4 3073 B9R0.46 CCC(=O)NCCCSC 11a_100000749238_100000210414 [1,0,1,0,0,0|2,0,0]=4 3074 B9R0.46 CCC(=O)NCCCSC 1626a_100000749238_100000210414 [1,0,1,0,0,0|2,0,0]=4 3075 B9R0.46 CCC(=O)NCCCSC 240690a_100000749238_100000210414 [1,0,1,0,0,0|2,0,0]=4 3076 B9R0.46 CCC(=O)NCCCSC 527a_100000749238_100000210414 [1,0,1,0,0,0|2,0,0]=4 3077 B9R0.46 CCC/C=C/CC(=O)CC 1458a_200016266809_100000210202 [1,0,1,0,0,0|0,0,2]=4 3078 B9R0.46 CCCCC=CC(=O)CC 1458a_100016266645_100000210202 [1,0,1,0,0,0|0,0,2]=4 3079 B9R0.46 CCCCCCC(=O)CC 1458a_100000210414_100000210757 [1,0,1,0,0,0|0,0,0]=2 3080 B9R0.46 CCCCCCC(=O)CC 1458a_100102632555_100000210202 [1,0,1,0,0,0|0,0,0]=2 3081 B9R0.46 CCCCCCC(=O)CF 1458a_100102632555_100015361967 [1,0,1,0,0,0|1,0,0]=3 3082 B9R0.46 CCCCCCC(=O)CO 1458a_100000210174_100000210757 [1,0,1,0,0,0|1,0,0]=3 3083 B9R0.46 CCCCCCC(=O)NC 11a_106832991635_100102632555 [1,0,1,0,0,0|1,0,0]=3 3084 B9R0.46 CCCCCCC(=O)NC 1626a_100102657272_100102632555 [1,0,1,0,0,0|1,0,0]=3 3085 B9R0.46 CCCCCCC(=O)NC 240690a_100102657272_100102632555 [1,0,1,0,0,0|1,0,0]=3 3086 B9R0.46 CCCCCCC(=O)NC 527a_100102657272_100102632555 [1,0,1,0,0,0|1,0,0]=3 3087 B9R0.46 CCCCCCC(C)OC 34a_100000210265_200000210301 [1,0,1,0,0,0|1,0,1]=4 3088 B9R0.46 CCCCCCC(C)OC 34a_100138415774_100011215978 [1,0,1,0,0,0|1,0,1]=4 3089 B9R0.46 CCCCCCC(C)OC 7a_100000210265_200000210301 [1,0,1,0,0,0|1,0,1]=4 3090 B9R0.46 CCCCCCC(C)O[13CH3] 34a_100000210265_200025704644 [1,0,1,0,0,0|1,0,1]=4 3091 B9R0.46 CCCCCCC(C)O[13CH3] 7a_100000210265_200025704644 [1,0,1,0,0,0|1,0,1]=4 3092 B9R0.46 CCCCCCN(C)CC 2230a_100000225621_100000210314 [1,0,1,0,0,0|2,0,0]=4 3093 B9R0.46 CCCCCCN(C)CC 2230a_106256046315_100000210202 [1,0,1,0,0,0|2,0,0]=4 3094 B9R0.46 CCCCCCN(C)CC 269982a_100000225621_100000210757 [1,0,1,0,0,0|2,0,0]=4 3095 B9R0.46 CCCCCCN(C)CC 269982a_106256046315_100000204670 [1,0,1,0,0,0|2,0,0]=4 3096 B9R0.46 CCCCCNC(=O)CC 11a_100000209983_100000210414 [1,0,1,0,0,0|1,0,0]=3 3097 B9R0.46 CCCCCNC(=O)CC 1626a_100000209983_100000210414 [1,0,1,0,0,0|1,0,0]=3 3098 B9R0.46 CCCCCNC(=O)CC 240690a_100000209983_100000210414 [1,0,1,0,0,0|1,0,0]=3 3099 B9R0.46 CCCCCNC(=O)CC 527a_100000209983_100000210414 [1,0,1,0,0,0|1,0,0]=3 3100 B9R0.46 CCCCCNC(=O)CO 240690a_100000209983_100000210174 [1,0,1,0,0,0|2,0,0]=4 3101 B9R0.46 CCCCCNC(=O)CO 527a_100000209983_100000210174 [1,0,1,0,0,0|2,0,0]=4 3102 B9R0.46 CCCCCNC(=O)NC 2708a_100000209983_106832991635 [1,0,1,0,0,0|2,0,0]=4 3103 B9R0.46 CCCCCNC(=O)NC 2708a_100102657272_100000209983 [1,0,1,0,0,0|2,0,0]=4 3104 B9R0.46 CCCCCNC(=O)NC 273464a_100000209983_100102657272 [1,0,1,0,0,0|2,0,0]=4 3105 B9R0.46 CCCCCNC(=O)NC 273464a_100102657272_100000209983 [1,0,1,0,0,0|2,0,0]=4 3106 B9R0.46 CCCCCNC(=O)NC 512a_100000209983_100102657272 [1,0,1,0,0,0|2,0,0]=4 3107 B9R0.46 CCCCCNC(=O)NC 512a_106832991638_100000209983 [1,0,1,0,0,0|2,0,0]=4 3108 B9R0.46 CCCCNCC(=O)CC 7a_106832991798_100000747405 [1,0,1,0,0,0|1,0,0]=3 3109 B9R0.46 CCCCNCC(=O)NC 2230a_100000102301_100000183359 [1,0,1,0,0,0|2,0,0]=4 3110 B9R0.46 CCCCNCC(=O)NC 2230a_100000693194_100000210211 [1,0,1,0,0,0|2,0,0]=4 3111 B9R0.46 CCCCNCC(=O)NC 7a_106832991798_100000183359 [1,0,1,0,0,0|2,0,0]=4 3112 B9R0.46 CCCCNCC(=O)OC 2230a_100000102301_100000747449 [1,0,1,0,0,0|1,0,0]=3 3113 B9R0.46 CCCCNCC(=O)OC 7a_106832991798_100000747449 [1,0,1,0,0,0|1,0,0]=3 3114 B9R0.46 CCCCNNC(=O)CC 22a_100025702795_100000210414 [1,0,1,0,0,0|2,0,0]=4 3115 B9R0.46 CCCCOCC(=O)CC 1458a_100000210414_100011995733 [1,0,1,0,0,0|1,0,0]=3 3116 B9R0.46 CCCCOCC(=O)CC 1458a_100000757543_100000210202 [1,0,1,0,0,0|1,0,0]=3 3117 B9R0.46 CCCCOCC(=O)CC 34a_100000725409_100000210210 [1,0,1,0,0,0|1,0,0]=3 3118 B9R0.46 CCCCOCC(=O)CC 7a_100000210227_100000747405 [1,0,1,0,0,0|1,0,0]=3 3119 B9R0.46 CCCCOCC(=O)CF 1458a_100000757543_100015361967 [1,0,1,0,0,0|2,0,0]=4 3120 B9R0.46 CCCCOCC(=O)CO 1458a_100000210174_100011995733 [1,0,1,0,0,0|2,0,0]=4 3121 B9R0.46 CCCCOCC(=O)NC 11a_106832991635_100000757543 [1,0,1,0,0,0|2,0,0]=4 3122 B9R0.46 CCCCOCC(=O)NC 1626a_100102657272_100000757543 [1,0,1,0,0,0|2,0,0]=4 3123 B9R0.46 CCCCOCC(=O)NC 240690a_100102657272_100000757543 [1,0,1,0,0,0|2,0,0]=4 3124 B9R0.46 CCCCOCC(=O)NC 34a_100000210227_100000183359 [1,0,1,0,0,0|2,0,0]=4 3125 B9R0.46 CCCCOCC(=O)NC 34a_100000750040_100000210210 [1,0,1,0,0,0|2,0,0]=4 3126 B9R0.46 CCCCOCC(=O)NC 527a_100102657272_100000757543 [1,0,1,0,0,0|2,0,0]=4 3127 B9R0.46 CCCCOCC(=O)NC 7a_100000210227_100000183359 [1,0,1,0,0,0|2,0,0]=4 3128 B9R0.46 CCCCOCC(=O)OC 34a_100000210227_100000747449 [1,0,1,0,0,0|1,0,0]=3 3129 B9R0.46 CCCCOCC(=O)OC 7a_100000210227_100000747449 [1,0,1,0,0,0|1,0,0]=3 3130 B9R0.46 CCCCSCC(=O)CC 1458a_100000191162_100000210202 [1,0,1,0,0,0|1,0,0]=3 3131 B9R0.46 CCCCSCC(=O)CC 62a_100000210211_100000747405 [1,0,1,0,0,0|1,0,0]=3 3132 B9R0.46 CCCCSCC(=O)CC 62a_100000747405_100000210210 [1,0,1,0,0,0|1,0,0]=3 3133 B9R0.46 CCCCSCC(=O)CF 1458a_100000191162_100015361967 [1,0,1,0,0,0|2,0,0]=4 3134 B9R0.46 CCCCSCC(=O)NC 11a_106832991635_100000191162 [1,0,1,0,0,0|2,0,0]=4 3135 B9R0.46 CCCCSCC(=O)NC 1626a_100102657272_100000191162 [1,0,1,0,0,0|2,0,0]=4 3136 B9R0.46 CCCCSCC(=O)NC 240690a_100102657272_100000191162 [1,0,1,0,0,0|2,0,0]=4 3137 B9R0.46 CCCCSCC(=O)NC 527a_100102657272_100000191162 [1,0,1,0,0,0|2,0,0]=4 3138 B9R0.46 CCCCSCC(=O)NC 62a_100000183359_100000210210 [1,0,1,0,0,0|2,0,0]=4 3139 B9R0.46 CCCCSCC(=O)NC 62a_100000210211_100000183359 [1,0,1,0,0,0|2,0,0]=4 3140 B9R0.46 CCCCSCC(=O)OC 62a_100000210211_100000747449 [1,0,1,0,0,0|1,0,0]=3 3141 B9R0.46 CCCCSCC(=O)OC 62a_100000747449_100000210210 [1,0,1,0,0,0|1,0,0]=3 3142 B9R0.46 CCCNCCC(=O)NC 2230a_100000738227_100000210303 [1,0,1,0,0,0|2,0,0]=4 3143 B9R0.46 CCCNCCC(=O)NC 34a_100000738227_100000210303 [1,0,1,0,0,0|2,0,0]=4 3144 B9R0.46 CCCOCCC(=O)CC 1458a_100000210414_100011215938 [1,0,1,0,0,0|1,0,0]=3 3145 B9R0.46 CCCOCCC(=O)CO 1458a_100000210174_100011215938 [1,0,1,0,0,0|2,0,0]=4 3146 B9R0.46 CCCOCCC(=O)NC 34a_100000210258_100012179268 [1,0,1,0,0,0|2,0,0]=4 3147 B9R0.46 CCCOCCC(=O)NC 34a_100000754576_100000210303 [1,0,1,0,0,0|2,0,0]=4 3148 B9R0.46 CCCOCCC(=O)OC 34a_100000210258_100000742370 [1,0,1,0,0,0|1,0,0]=3 3149 B9R0.46 CCCSCCC(=O)NC 62a_100000210303_100000737683 [1,0,1,0,0,0|2,0,0]=4 3150 B9R0.46 CCCSCCC(=O)NC 62a_100000737683_100000210303 [1,0,1,0,0,0|2,0,0]=4 3151 B9R0.46 CCCSCCC(=O)OC 62a_100000204255_100000210303 [1,0,1,0,0,0|1,0,0]=3 3152 B9R0.46 CCCSCCC(=O)OC 62a_100000210303_100000204255 [1,0,1,0,0,0|1,0,0]=3 3153 B9R0.46 CCCSCOC(=O)OC 62a_100000210303_100000139417 [1,0,1,0,0,0|2,0,0]=4 3154 B9R0.46 CCNCCCC(=O)NC 2230a_100000740002_100000210202 [1,0,1,0,0,0|2,0,0]=4 3155 B9R0.46 CCNCCCC(=O)NC 2230a_100015525214_100000741757 [1,0,1,0,0,0|2,0,0]=4 3156 B9R0.46 CCNCCCC(=O)NC 34a_100000740002_100000210202 [1,0,1,0,0,0|2,0,0]=4 3157 B9R0.46 CCNCCCC(=O)OC 2230a_100015525214_100011218270 [1,0,1,0,0,0|1,0,0]=3 3158 B9R0.46 CCNCCNC(=O)CC 34a_100132302217_100000210202 [1,0,1,0,0,0|2,0,0]=4 3159 B9R0.46 CCOCCCC(=O)CC 1458a_100000210414_100012232248 [1,0,1,0,0,0|1,0,0]=3 3160 B9R0.46 CCOCCCC(=O)CO 1458a_100000210174_100012232248 [1,0,1,0,0,0|2,0,0]=4 3161 B9R0.46 CCOCCCC(=O)NC 34a_100121572206_100000741757 [1,0,1,0,0,0|2,0,0]=4 3162 B9R0.46 CCOCCCC(=O)OC 34a_100121572206_100000742333 [1,0,1,0,0,0|1,0,0]=3 3163 B9R0.46 CCOCCNC(=O)CC 11a_100011200944_100000210414 [1,0,1,0,0,0|2,0,0]=4 3164 B9R0.46 CCOCCNC(=O)CC 1626a_102516460346_100000210414 [1,0,1,0,0,0|2,0,0]=4 3165 B9R0.46 CCOCCNC(=O)CC 240690a_100011200944_100000210414 [1,0,1,0,0,0|2,0,0]=4 3166 B9R0.46 CCOCCNC(=O)CC 34a_200000158885_100000210202 [1,0,1,0,0,0|2,0,0]=4 3167 B9R0.46 CCOCCNC(=O)CC 527a_100011200944_100000210414 [1,0,1,0,0,0|2,0,0]=4 3168 B9R0.46 CCOCCNC(=O)CC 7a_200000158885_100000210202 [1,0,1,0,0,0|2,0,0]=4 3169 B9R0.46 CCOCCNC(=O)OC 34a_100000757965_100000210202 [1,0,1,0,0,0|2,0,0]=4 3170 B9R0.46 CCOCCOC(=O)CC 7a_200000031056_100000210202 [1,0,1,0,0,0|2,0,0]=4 3171 B9R0.46 CCOCCOC(=O)OC 34a_100010262106_100000210202 [1,0,1,0,0,0|2,0,0]=4 3172 B9R0.46 CCOCSCC(=O)CC 62a_100000739092_100000747405 [1,0,1,0,0,0|2,0,0]=4 3173 B9R0.46 CCOCSCC(=O)CC 62a_100000747405_100000739092 [1,0,1,0,0,0|2,0,0]=4 3174 B9R0.46 CCOCSCC(=O)OC 62a_100000739092_100000747449 [1,0,1,0,0,0|2,0,0]=4 3175 B9R0.46 CCOCSCC(=O)OC 62a_100000747449_100000739092 [1,0,1,0,0,0|2,0,0]=4 3176 B9R0.46 CCSCCCC(=O)NC 62a_100000210202_100000741757 [1,0,1,0,0,0|2,0,0]=4 3177 B9R0.46 CCSCCCC(=O)NC 62a_100000741757_100000210202 [1,0,1,0,0,0|2,0,0]=4 3178 B9R0.46 CCSCCCC(=O)OC 62a_100000210202_100011218270 [1,0,1,0,0,0|1,0,0]=3 3179 B9R0.46 CCSCCCC(=O)OC 62a_100011218270_100000210202 [1,0,1,0,0,0|1,0,0]=3 3180 B9R0.46 CCSCCNC(=O)CC 11a_100000106463_100000210414 [1,0,1,0,0,0|2,0,0]=4 3181 B9R0.46 CCSCCNC(=O)CC 1626a_100000106463_100000210414 [1,0,1,0,0,0|2,0,0]=4 3182 B9R0.46 CCSCCNC(=O)CC 240690a_100000106463_100000210414 [1,0,1,0,0,0|2,0,0]=4 3183 B9R0.46 CCSCCNC(=O)CC 527a_100000106463_100000210414 [1,0,1,0,0,0|2,0,0]=4 3184 B9R0.46 CNC(=O)CCCCCO 240690a_100102657272_100102619762 [1,0,1,0,0,0|2,0,0]=4 3185 B9R0.46 CNCCCCC(=O)OC 2230a_106832991635_100000204269 [1,0,1,0,0,0|1,0,0]=3 3186 B9R0.46 CNCCCCC(=O)OC 34a_100102657272_100000204269 [1,0,1,0,0,0|1,0,0]=3 3187 B9R0.46 CNCCCCC(=O)OC 7a_106832991635_100000204269 [1,0,1,0,0,0|1,0,0]=3 3188 B9R0.46 CNCCOCC(=O)OC 2230a_106832991635_100000090808 [1,0,1,0,0,0|2,0,0]=4 3189 B9R0.46 CNCCOCC(=O)OC 34a_100102657272_100000090808 [1,0,1,0,0,0|2,0,0]=4 3190 B9R0.46 CNCCOCC(=O)OC 7a_106832991635_100000090808 [1,0,1,0,0,0|2,0,0]=4 3191 B9R0.46 COC(=O)CCCCO[13CH3] 34a_100000059025_200025704644 [1,0,1,0,0,0|1,0,0]=3 3192 B9R0.46 COC(=O)CCCCO[13CH3] 7a_100000059025_200025704644 [1,0,1,0,0,0|1,0,0]=3 3193 B9R0.46 COC(=O)CCCCSC 62a_100000204269_200000210301 [1,0,1,0,0,0|1,0,0]=3 3194 B9R0.46 COC(=O)CCCCSC 62a_200000210301_100000204269 [1,0,1,0,0,0|1,0,0]=3 3195 B9R0.46 COC(=O)CCCCS[13CH3] 62a_100000204269_200025704644 [1,0,1,0,0,0|1,0,0]=3 3196 B9R0.46 COC(=O)CCCCS[13CH3] 62a_200025704644_100000204269 [1,0,1,0,0,0|1,0,0]=3 3197 B9R0.46 COC(=O)CCCSCF 62a_100011218270_100015361967 [1,0,1,0,0,0|2,0,0]=4 3198 B9R0.46 COC(=O)CCCSCF 62a_100015361967_100011218270 [1,0,1,0,0,0|2,0,0]=4 3199 B9R0.46 COC(=O)CCNCCF 34a_100000724931_100000742370 [1,0,1,0,0,0|2,0,0]=4 3200 B9R0.46 COC(=O)CCNCCO 2230a_100016997473_100000204255 [1,0,1,0,0,0|2,0,0]=4 3201 B9R0.46 COC(=O)CCNCCO 34a_100016990907_100000742370 [1,0,1,0,0,0|2,0,0]=4 3202 B9R0.46 COC(=O)CCOCCBr 34a_100000211926_100000742370 [1,0,1,0,0,0|2,0,0]=4 3203 B9R0.46 COC(=O)CCOCCN 34a_100000210304_100000742370 [1,0,1,0,0,0|2,0,0]=4 3204 B9R0.46 COC(=O)CCSCCF 62a_100000204255_100011217306 [1,0,1,0,0,0|2,0,0]=4 3205 B9R0.46 COC(=O)CCSCCF 62a_100011217306_100000204255 [1,0,1,0,0,0|2,0,0]=4 3206 B9R0.46 COC(=O)CCSCCO 62a_100000204255_100000211926 [1,0,1,0,0,0|2,0,0]=4 3207 B9R0.46 COC(=O)CCSCCO 62a_100000211926_100000204255 [1,0,1,0,0,0|2,0,0]=4 3208 B9R0.46 COC(=O)CCSCSC 62a_100000204255_100011218213 [1,0,1,0,0,0|2,0,0]=4 3209 B9R0.46 COC(=O)CCSCSC 62a_100011218213_100000204255 [1,0,1,0,0,0|2,0,0]=4 3210 B9R0.46 COC(=O)CNCCCF 2230a_100015189416_100000747449 [1,0,1,0,0,0|2,0,0]=4 3211 B9R0.46 COC(=O)CNCCCF 34a_100015189416_100000747449 [1,0,1,0,0,0|2,0,0]=4 3212 B9R0.46 COC(=O)CNCCSC 2230a_100020590264_100000747449 [1,0,1,0,0,0|2,0,0]=4 3213 B9R0.46 COC(=O)COCCCBr 34a_100011217188_100000747449 [1,0,1,0,0,0|2,0,0]=4 3214 B9R0.46 COC(=O)COCCCCl 34a_100000230001_100000747449 [1,0,1,0,0,0|2,0,0]=4 3215 B9R0.46 COC(=O)COCCCF 34a_100000759539_100000747449 [1,0,1,0,0,0|2,0,0]=4 3216 B9R0.46 COC(=O)COCCCN 34a_100000182051_100000747449 [1,0,1,0,0,0|2,0,0]=4 3217 B9R0.46 COC(=O)COCCSC 34a_100000230434_100000747449 [1,0,1,0,0,0|2,0,0]=4 3218 B9R0.46 COC(=O)COCCSC 62a_100000090808_200000210301 [1,0,1,0,0,0|2,0,0]=4 3219 B9R0.46 COC(=O)COCCSC 62a_200000210301_100000090808 [1,0,1,0,0,0|2,0,0]=4 3220 B9R0.46 COC(=O)COCCSC 7a_100000230434_100000747449 [1,0,1,0,0,0|2,0,0]=4 3221 B9R0.46 COC(=O)COCCS[13CH3] 62a_100000090808_200025704644 [1,0,1,0,0,0|2,0,0]=4 3222 B9R0.46 COC(=O)COCCS[13CH3] 62a_200025704644_100000090808 [1,0,1,0,0,0|2,0,0]=4 3223 B9R0.46 COC(=O)CSCCCF 62a_100000747449_100011934791 [1,0,1,0,0,0|2,0,0]=4 3224 B9R0.46 COC(=O)CSCCCF 62a_100011934791_100000747449 [1,0,1,0,0,0|2,0,0]=4 3225 B9R0.46 COC(=O)CSCCCO 62a_100000747449_100011215043 [1,0,1,0,0,0|2,0,0]=4 3226 B9R0.46 COC(=O)CSCCCO 62a_100011215043_100000747449 [1,0,1,0,0,0|2,0,0]=4 3227 B9R0.46 COC(=O)CSCCSC 62a_100000212216_100000747449 [1,0,1,0,0,0|2,0,0]=4 3228 B9R0.46 COC(=O)CSCCSC 62a_100000747449_100000751147 [1,0,1,0,0,0|2,0,0]=4 3229 B9R0.46 COCCCCC(=O)CO 1458a_100000210174_100000755781 [1,0,1,0,0,0|2,0,0]=4 3230 B9R0.46 COCCCCC(=O)OC 34a_100000059025_200000210301 [1,0,1,0,0,0|1,0,0]=3 3231 B9R0.46 COCCCCC(=O)OC 34a_100138415774_100000204269 [1,0,1,0,0,0|1,0,0]=3 3232 B9R0.46 COCCCCC(=O)OC 7a_100000059025_200000210301 [1,0,1,0,0,0|1,0,0]=3 3233 B9R0.46 COCCNCC(=O)OC 2230a_100000209980_100000747449 [1,0,1,0,0,0|2,0,0]=4 3234 B9R0.46 COCCOCC(=O)OC 34a_100000210237_100000747449 [1,0,1,0,0,0|2,0,0]=4 3235 B9R0.46 COCCOCC(=O)OC 34a_100138415774_100000090808 [1,0,1,0,0,0|2,0,0]=4 3236 B9R0.46 COCCSCC(=O)OC 62a_100000233755_100000747449 [1,0,1,0,0,0|2,0,0]=4 3237 B9R0.46 COCCSCC(=O)OC 62a_100000747449_100000233755 [1,0,1,0,0,0|2,0,0]=4 3238 B9R0.46 COCSCCC(=O)OC 62a_100000204255_100000766300 [1,0,1,0,0,0|2,0,0]=4 3239 B9R0.46 COCSCCC(=O)OC 62a_100000766300_100000204255 [1,0,1,0,0,0|2,0,0]=4 3240 B9R0.46 O=C(CF)CCCCCO 1458a_100102619762_100015361967 [1,0,1,0,0,0|2,0,0]=4 3241 B9R0.46 O=C(CO)CCCCCF 1458a_100000210174_100000729378 [1,0,1,0,0,0|2,0,0]=4 3242 B9R0.46 O=C(CO)CCCCCO 1458a_100000210174_100000746330 [1,0,1,0,0,0|2,0,0]=4 3243 B9R0.8 C#CC(=O)C(C)CCCC 1458a_100000211873_200011215066 [1,0,1,0,0,0|0,0,2]=4 3244 B9R0.8 C=CC(=O)C(C)CCCC 1458a_100000185746_200011215066 [1,0,1,0,0,0|0,0,2]=4 3245 B9R0.8 CCC(=O)C(C)NCCO 2230a_100016997473_100000742827 [1,0,1,0,0,0|2,0,0]=4 3246 B9R0.8 CCC(=O)C(C)SCCF 62a_100000742827_100011217306 [1,0,1,0,0,0|2,0,0]=4 3247 B9R0.8 CCC(=O)C(C)SCCF 62a_100011217306_100000742827 [1,0,1,0,0,0|2,0,0]=4 3248 B9R0.8 CCC(=O)C(C)SCCO 62a_100000211926_100000742827 [1,0,1,0,0,0|2,0,0]=4 3249 B9R0.8 CCC(=O)C(C)SCCO 62a_100000742827_100000211926 [1,0,1,0,0,0|2,0,0]=4 3250 B9R0.8 CCC(=O)C(C)SCOC 62a_100000742827_100000766300 [1,0,1,0,0,0|2,0,0]=4 3251 B9R0.8 CCC(=O)C(C)SCOC 62a_100000766300_100000742827 [1,0,1,0,0,0|2,0,0]=4 3252 B9R0.8 CCC(=O)C(C)SCSC 62a_100000742827_100011218213 [1,0,1,0,0,0|2,0,0]=4 3253 B9R0.8 CCC(=O)C(C)SCSC 62a_100011218213_100000742827 [1,0,1,0,0,0|2,0,0]=4 3254 B9R0.8 CCC(=O)C(O)CCSC 1458a_100000685904_100000210202 [1,0,1,0,0,0|2,0,0]=4 3255 B9R0.8 CCC(=O)N(C)CCCO 240690a_100000213112_100000210414 [1,0,1,0,0,0|2,0,0]=4 3256 B9R0.8 CCC(=O)N(C)CCCO 527a_100000213112_100000210414 [1,0,1,0,0,0|2,0,0]=4 3257 B9R0.8 CCC(=O)N(C)CCOC 11a_100000743101_100000210414 [1,0,1,0,0,0|2,0,0]=4 3258 B9R0.8 CCC(=O)N(C)CCOC 1626a_100000743101_100000210414 [1,0,1,0,0,0|2,0,0]=4 3259 B9R0.8 CCC(=O)N(C)CCOC 240690a_100000743101_100000210414 [1,0,1,0,0,0|2,0,0]=4 3260 B9R0.8 CCC(=O)N(C)CCOC 527a_100000743101_100000210414 [1,0,1,0,0,0|2,0,0]=4 3261 B9R0.8 CCC(=O)N(C)CCSC 11a_100000686725_100000210414 [1,0,1,0,0,0|2,0,0]=4 3262 B9R0.8 CCC(=O)N(C)CCSC 1626a_100000686725_100000210414 [1,0,1,0,0,0|2,0,0]=4 3263 B9R0.8 CCC(=O)N(C)CCSC 240690a_100000686725_100000210414 [1,0,1,0,0,0|2,0,0]=4 3264 B9R0.8 CCC(=O)N(C)CCSC 527a_100000686725_100000210414 [1,0,1,0,0,0|2,0,0]=4 3265 B9R0.8 CCC/C=C(\C)/C(=O)CC 1458a_200020648666_100000210202 [1,0,1,0,0,0|0,0,2]=4 3266 B9R0.8 CCCCC(C)C(=O)CC 1458a_100000210414_200011215066 [1,0,1,0,0,0|0,0,0]=2 3267 B9R0.8 CCCCC(C)C(=O)CC 1458a_100000725509_100000210202 [1,0,1,0,0,0|0,0,0]=2 3268 B9R0.8 CCCCC(C)C(=O)CF 1458a_100000725509_100015361967 [1,0,1,0,0,0|1,0,0]=3 3269 B9R0.8 CCCCC(C)C(=O)CO 1458a_100000210174_200011215066 [1,0,1,0,0,0|1,0,0]=3 3270 B9R0.8 CCCCC(C)C(=O)NC 11a_106832991635_100000725509 [1,0,1,0,0,0|1,0,0]=3 3271 B9R0.8 CCCCC(C)C(=O)NC 1626a_100102657272_100000725509 [1,0,1,0,0,0|1,0,0]=3 3272 B9R0.8 CCCCC(C)C(=O)NC 240690a_100102657272_100000725509 [1,0,1,0,0,0|1,0,0]=3 3273 B9R0.8 CCCCC(C)C(=O)NC 527a_100102657272_100000725509 [1,0,1,0,0,0|1,0,0]=3 3274 B9R0.8 CCCCC(C)N(C)CC 2230a_100000225621_200011215066 [1,0,1,0,0,0|2,0,0]=4 3275 B9R0.8 CCCCC(C)N(C)CC 269982a_100000225621_200011215066 [1,0,1,0,0,0|2,0,0]=4 3276 B9R0.8 CCCCC(O)C(=O)CC 1458a_100000720857_100000210202 [1,0,1,0,0,0|1,0,0]=3 3277 B9R0.8 CCCCC(O)C(=O)CF 1458a_100000720857_100015361967 [1,0,1,0,0,0|2,0,0]=4 3278 B9R0.8 CCCCC(O)C(=O)NC 240690a_100102657272_100000720857 [1,0,1,0,0,0|2,0,0]=4 3279 B9R0.8 CCCCC(O)C(=O)NC 527a_100102657272_100000720857 [1,0,1,0,0,0|2,0,0]=4 3280 B9R0.8 CCCCN(C)C(=O)CC 11a_100000207549_100000210414 [1,0,1,0,0,0|1,0,0]=3 3281 B9R0.8 CCCCN(C)C(=O)CC 1626a_100000207549_100000210414 [1,0,1,0,0,0|1,0,0]=3 3282 B9R0.8 CCCCN(C)C(=O)CC 240690a_100000207549_100000210414 [1,0,1,0,0,0|1,0,0]=3 3283 B9R0.8 CCCCN(C)C(=O)CC 527a_100000207549_100000210414 [1,0,1,0,0,0|1,0,0]=3 3284 B9R0.8 CCCCN(C)C(=O)CO 240690a_100000207549_100000210174 [1,0,1,0,0,0|2,0,0]=4 3285 B9R0.8 CCCCN(C)C(=O)CO 527a_100000207549_100000210174 [1,0,1,0,0,0|2,0,0]=4 3286 B9R0.8 CCCCN(C)C(=O)NC 2708a_100102657272_100000207549 [1,0,1,0,0,0|2,0,0]=4 3287 B9R0.8 CCCCN(C)C(=O)NC 273464a_100102657272_100000207549 [1,0,1,0,0,0|2,0,0]=4 3288 B9R0.8 CCCN[C@H](C)C(=O)NC 2230a_100000684985_100000210303 [1,0,1,0,0,0|2,0,0]=4 3289 B9R0.8 CCCN[C@H](C)C(=O)NC 34a_100000684985_100000210303 [1,0,1,0,0,0|2,0,0]=4 3290 B9R0.8 CCCOC(C)C(=O)NC 34a_100000210258_100000731044 [1,0,1,0,0,0|2,0,0]=4 3291 B9R0.8 CCCOC(C)C(=O)OC 34a_100000210258_100000211248 [1,0,1,0,0,0|1,0,0]=3 3292 B9R0.8 CCCOC(C)C(=O)OC 34a_100011215400_100000210303 [1,0,1,0,0,0|1,0,0]=3 3293 B9R0.8 CCCSC(C)C(=O)CC 62a_100000210303_100000742827 [1,0,1,0,0,0|1,0,0]=3 3294 B9R0.8 CCCSC(C)C(=O)CC 62a_100000742827_100000210303 [1,0,1,0,0,0|1,0,0]=3 3295 B9R0.8 CCCSC(C)C(=O)NC 62a_100000209862_100000210303 [1,0,1,0,0,0|2,0,0]=4 3296 B9R0.8 CCCSC(C)C(=O)NC 62a_100000210303_100000731044 [1,0,1,0,0,0|2,0,0]=4 3297 B9R0.8 CCCSC(C)C(=O)OC 62a_100000210303_100000211248 [1,0,1,0,0,0|1,0,0]=3 3298 B9R0.8 CCCSC(C)C(=O)OC 62a_100000211248_100000210303 [1,0,1,0,0,0|1,0,0]=3 3299 B9R0.8 CCNCC(C)C(=O)NC 2230a_100015187722_100000210202 [1,0,1,0,0,0|2,0,0]=4 3300 B9R0.8 CCNCC(C)C(=O)NC 34a_100015187722_100000210202 [1,0,1,0,0,0|2,0,0]=4 3301 B9R0.8 CCOCC(C)C(=O)OC 34a_100000749362_100000210202 [1,0,1,0,0,0|1,0,0]=3 3302 B9R0.8 CCOCC(C)C(=O)OC 34a_100121572206_100000698445 [1,0,1,0,0,0|1,0,0]=3 3303 B9R0.8 CCOCC(C)C(=O)OC 7a_100000749362_100000210202 [1,0,1,0,0,0|1,0,0]=3 3304 B9R0.8 CCOCC(F)C(=O)OC 34a_200009849844_100000210202 [1,0,1,0,0,0|2,0,0]=4 3305 B9R0.8 CCOC[C@@H](N)C(=O)OC 34a_100000003586_100000210202 [1,0,1,0,0,0|2,0,0]=4 3306 B9R0.8 CCSCC(C)C(=O)OC 62a_100000210202_100000698445 [1,0,1,0,0,0|1,0,0]=3 3307 B9R0.8 CCSCC(C)C(=O)OC 62a_100000698445_100000210202 [1,0,1,0,0,0|1,0,0]=3 3308 B9R0.8 CNCCC(C)C(=O)OC 2230a_106832991635_100000034942 [1,0,1,0,0,0|1,0,0]=3 3309 B9R0.8 CNCCC(C)C(=O)OC 34a_100102657272_100000034942 [1,0,1,0,0,0|1,0,0]=3 3310 B9R0.8 CNCCC(C)C(=O)OC 7a_106832991635_100000034942 [1,0,1,0,0,0|1,0,0]=3 3311 B9R0.8 COC(=O)C(C)CCSC 62a_100000034942_200000210301 [1,0,1,0,0,0|1,0,0]=3 3312 B9R0.8 COC(=O)C(C)CCSC 62a_200000210301_100000034942 [1,0,1,0,0,0|1,0,0]=3 3313 B9R0.8 COC(=O)C(C)CCS[13CH3] 62a_100000034942_200025704644 [1,0,1,0,0,0|1,0,0]=3 3314 B9R0.8 COC(=O)C(C)CCS[13CH3] 62a_200025704644_100000034942 [1,0,1,0,0,0|1,0,0]=3 3315 B9R0.8 COC(=O)C(C)COCF 34a_100000749362_100015361967 [1,0,1,0,0,0|2,0,0]=4 3316 B9R0.8 COC(=O)C(C)COCF 7a_100000749362_100015361967 [1,0,1,0,0,0|2,0,0]=4 3317 B9R0.8 COC(=O)C(C)CSCF 62a_100000698445_100015361967 [1,0,1,0,0,0|2,0,0]=4 3318 B9R0.8 COC(=O)C(C)CSCF 62a_100015361967_100000698445 [1,0,1,0,0,0|2,0,0]=4 3319 B9R0.8 COC(=O)C(C)NCCF 34a_100000724931_100000211248 [1,0,1,0,0,0|2,0,0]=4 3320 B9R0.8 COC(=O)C(C)NCCO 2230a_100016997473_100000211248 [1,0,1,0,0,0|2,0,0]=4 3321 B9R0.8 COC(=O)C(C)NCCO 34a_100016990907_100000211248 [1,0,1,0,0,0|2,0,0]=4 3322 B9R0.8 COC(=O)C(C)OCCBr 34a_100000211926_100000211248 [1,0,1,0,0,0|2,0,0]=4 3323 B9R0.8 COC(=O)C(C)OCCF 34a_100011215400_100011217306 [1,0,1,0,0,0|2,0,0]=4 3324 B9R0.8 COC(=O)C(C)OCCN 34a_100000210304_100000211248 [1,0,1,0,0,0|2,0,0]=4 3325 B9R0.8 COC(=O)C(C)OCCO 34a_100011215400_100000211926 [1,0,1,0,0,0|2,0,0]=4 3326 B9R0.8 COC(=O)C(C)OCSC 34a_100011215400_100011218213 [1,0,1,0,0,0|2,0,0]=4 3327 B9R0.8 COC(=O)C(C)SCCF 62a_100000211248_100011217306 [1,0,1,0,0,0|2,0,0]=4 3328 B9R0.8 COC(=O)C(C)SCCF 62a_100011217306_100000211248 [1,0,1,0,0,0|2,0,0]=4 3329 B9R0.8 COC(=O)C(C)SCCO 62a_100000211248_100000211926 [1,0,1,0,0,0|2,0,0]=4 3330 B9R0.8 COC(=O)C(C)SCCO 62a_100000211926_100000211248 [1,0,1,0,0,0|2,0,0]=4 3331 B9R0.8 COC(=O)C(C)SCSC 62a_100000211248_100011218213 [1,0,1,0,0,0|2,0,0]=4 3332 B9R0.8 COC(=O)C(C)SCSC 62a_100011218213_100000211248 [1,0,1,0,0,0|2,0,0]=4 3333 B9R0.8 COCCC(C)C(=O)OC 34a_100138415774_100000034942 [1,0,1,0,0,0|1,0,0]=3 3334 B9R0.8 COCSC(C)C(=O)OC 62a_100000211248_100000766300 [1,0,1,0,0,0|2,0,0]=4 3335 B9R0.8 COCSC(C)C(=O)OC 62a_100000766300_100000211248 [1,0,1,0,0,0|2,0,0]=4 3336 B9R0.18 CCCCC(C)COCC 34a_100011995851_100000210202 [1,0,1,0,0,0|0,0,1]=3 3337 B9R0.18 CCCCC(C)COCC 7a_100011995851_100000210202 [1,0,1,0,0,0|0,0,1]=3 3338 B9R0.18 CCCCC(C)COCF 34a_100011995851_100015361967 [1,0,1,0,0,0|1,0,1]=4 3339 B9R0.18 CCCCC(C)COCF 7a_100011995851_100015361967 [1,0,1,0,0,0|1,0,1]=4 3340 B9R0.18 CCCCC(C)NCCC 2230a_100000126638_100000210303 [1,0,1,0,0,0|2,0,0]=4 3341 B9R0.18 CCCCC(C)NCCC 270004a_100020643023_100000210087 [1,0,1,0,0,0|2,0,0]=4 3342 B9R0.18 CCCCC(C)OCCC 34a_100000210258_200011215066 [1,0,1,0,0,0|2,0,0]=4 3343 B9R0.18 CCCCC(C)OCCC 34a_100000687866_100000210303 [1,0,1,0,0,0|2,0,0]=4 3344 B9R0.18 CCCCC(C)OCCC 7a_100000687866_100000210303 [1,0,1,0,0,0|2,0,0]=4 3345 B9R0.18 CCCCC(C)SCCC 62a_100000210303_200011215066 [1,0,1,0,0,0|2,0,0]=4 3346 B9R0.18 CCCCC(C)SCCC 62a_200011215066_100000210303 [1,0,1,0,0,0|2,0,0]=4 3347 B9R0.18 CCCCN(C)COCC 269982a_100000207549_100000739092 [1,0,1,0,0,0|1,0,1]=4 3348 B9R0.18 CCCC[C@H](N)COCC 34a_100011934283_100000210202 [1,0,1,0,0,0|1,0,1]=4 3349 B9R0.18 CCCOC(C)COCC 34a_100000718985_100000210303 [1,0,1,0,0,0|1,0,1]=4 3350 B9R0.18 CCCOC(C)COCC 7a_100000718985_100000210303 [1,0,1,0,0,0|1,0,1]=4 3351 B9R0.35 CC#CC(=O)C(C)CCC 1458a_100000763181_100000766640 [1,0,1,0,0,0|1,0,1]=4 3352 B9R0.35 CC=CC(=O)C(C)CCC 1458a_100000210699_100000766640 [1,0,1,0,0,0|1,0,1]=4 3353 B9R0.35 CCCC(=O)C(C)CCC 1458a_100000210906_100000210303 [1,0,1,0,0,0|1,0,0]=3 3354 B9R0.35 CCCC(=O)C(C)CCC 1458a_100000211992_100000766640 [1,0,1,0,0,0|1,0,0]=3 3355 B9R0.35 CCCC(=O)C(C)CCO 1458a_100000211992_100009893172 [1,0,1,0,0,0|2,0,0]=4 3356 B9R0.35 CCCC(=O)C(C)COC 1458a_100000211992_100000765312 [1,0,1,0,0,0|2,0,0]=4 3357 B9R0.35 CCCC(=O)C(C)COC 1458a_100000751857_100000210303 [1,0,1,0,0,0|2,0,0]=4 3358 B9R0.35 CCCC(=O)C(C)CSC 1458a_100000753918_100000210303 [1,0,1,0,0,0|2,0,0]=4 3359 B9R0.35 CCCC(=O)C(C)OCC 1458a_100000739345_100000210303 [1,0,1,0,0,0|2,0,0]=4 3360 B9R0.35 CCCC(=O)C(C)SCC 1458a_100000230601_100000210303 [1,0,1,0,0,0|2,0,0]=4 3361 B9R0.35 CCCC(=O)N(C)CCC 11a_100000747261_100000211992 [1,0,1,0,0,0|2,0,0]=4 3362 B9R0.35 CCCC(=O)N(C)CCC 1626a_100000747261_100000211992 [1,0,1,0,0,0|2,0,0]=4 3363 B9R0.35 CCCC(=O)N(C)CCC 240690a_100000747261_100000211992 [1,0,1,0,0,0|2,0,0]=4 3364 B9R0.35 CCCC(=O)N(C)CCC 527a_100000747261_100000211992 [1,0,1,0,0,0|2,0,0]=4 3365 B9R0.35 CCCC(=O)[C@@H](O)CCC 1458a_100009822183_100000210303 [1,0,1,0,0,0|2,0,0]=4 3366 B9R0.35 CCCC(C)C(=O)CCF 1458a_100000210906_100011217306 [1,0,1,0,0,0|2,0,0]=4 3367 B9R0.35 CCCC(C)C(=O)CCO 1458a_100000210906_100000211926 [1,0,1,0,0,0|2,0,0]=4 3368 B9R0.35 CCCC(C)C(=O)CCO 1458a_100011216618_100000766640 [1,0,1,0,0,0|2,0,0]=4 3369 B9R0.35 CCCC(C)C(=O)COC 1458a_100000210968_100000766640 [1,0,1,0,0,0|2,0,0]=4 3370 B9R0.35 CCCC(C)C(=O)CSC 1458a_100000184570_100000766640 [1,0,1,0,0,0|2,0,0]=4 3371 B9R0.35 CCCC(C)C(=O)NCC 11a_100015525214_100000210906 [1,0,1,0,0,0|1,0,0]=3 3372 B9R0.35 CCCC(C)C(=O)NCC 240690a_100015525214_100000210906 [1,0,1,0,0,0|1,0,0]=3 3373 B9R0.35 CCCC(C)C(=O)NCC 527a_100015525214_100000210906 [1,0,1,0,0,0|1,0,0]=3 3374 B9R0.35 CCCC(C)C(=O)NNC 22a_100016993582_100000210906 [1,0,1,0,0,0|2,0,0]=4 3375 B9R0.35 CCCC(C)C(C)OCC 34a_100000708338_100000210202 [1,0,1,0,0,0|1,0,1]=4 3376 B9R0.35 CCCC(C)C(C)OCC 7a_100000708338_100000210202 [1,0,1,0,0,0|1,0,1]=4 3377 B9R0.35 CCCN(C)C(=O)NCC 2708a_100015525214_100000747261 [1,0,1,0,0,0|2,0,0]=4 3378 B9R0.35 CCCN(C)C(=O)NCC 273464a_100015525214_100000747261 [1,0,1,0,0,0|2,0,0]=4 3379 B9R0.35 CCC[C@H](O)C(=O)NCC 240690a_100015525214_100009822183 [1,0,1,0,0,0|2,0,0]=4 3380 B9R0.35 CCNC(=O)C(C)COC 11a_100015525214_100000751857 [1,0,1,0,0,0|2,0,0]=4 3381 B9R0.35 CCNC(=O)C(C)COC 240690a_100015525214_100000751857 [1,0,1,0,0,0|2,0,0]=4 3382 B9R0.35 CCNC(=O)C(C)COC 527a_100015525214_100000751857 [1,0,1,0,0,0|2,0,0]=4 3383 B9R0.35 CCNC(=O)C(C)CSC 11a_100015525214_100000753918 [1,0,1,0,0,0|2,0,0]=4 3384 B9R0.35 CCNC(=O)C(C)CSC 240690a_100015525214_100000753918 [1,0,1,0,0,0|2,0,0]=4 3385 B9R0.35 CCNC(=O)C(C)CSC 527a_100015525214_100000753918 [1,0,1,0,0,0|2,0,0]=4 3386 B9R0.35 CCNC(=O)C(C)NCC 2230a_100000736553_100000210202 [1,0,1,0,0,0|2,0,0]=4 3387 B9R0.35 CCNC(=O)C(C)NCC 2230a_100015525214_100000230173 [1,0,1,0,0,0|2,0,0]=4 3388 B9R0.35 CCNC(=O)C(C)NCC 34a_100000736553_100000210202 [1,0,1,0,0,0|2,0,0]=4 3389 B9R0.35 CCNC(=O)C(C)OCC 11a_100015525214_100000739345 [1,0,1,0,0,0|2,0,0]=4 3390 B9R0.35 CCNC(=O)C(C)OCC 240690a_100015525214_100000739345 [1,0,1,0,0,0|2,0,0]=4 3391 B9R0.35 CCNC(=O)C(C)OCC 34a_100121572206_100000230173 [1,0,1,0,0,0|2,0,0]=4 3392 B9R0.35 CCNC(=O)C(C)OCC 527a_100015525214_100000739345 [1,0,1,0,0,0|2,0,0]=4 3393 B9R0.35 CCNC(=O)C(C)SCC 11a_100015525214_100000230601 [1,0,1,0,0,0|2,0,0]=4 3394 B9R0.35 CCNC(=O)C(C)SCC 240690a_100015525214_100000230601 [1,0,1,0,0,0|2,0,0]=4 3395 B9R0.35 CCNC(=O)C(C)SCC 527a_100015525214_100000230601 [1,0,1,0,0,0|2,0,0]=4 3396 B9R0.35 CCNC(=O)C(C)SCC 62a_100000210202_100000230173 [1,0,1,0,0,0|2,0,0]=4 3397 B9R0.35 CCNC(=O)C(C)SCC 62a_100000230173_100000210202 [1,0,1,0,0,0|2,0,0]=4 3398 B9R0.35 CCNC(C)C(=O)OCC 2230a_100015525214_100011215307 [1,0,1,0,0,0|1,0,0]=3 3399 B9R0.35 CCNC(F)C(=O)OCC 2230a_100015525214_100000760018 [1,0,1,0,0,0|2,0,0]=4 3400 B9R0.35 CCN[C@@H](C)C(=O)SCC 2230a_100103168634_100000210202 [1,0,1,0,0,0|1,1,0]=4 3401 B9R0.35 CCOC(=O)C(C)OCC 34a_100121572206_100011216346 [1,0,1,0,0,0|1,0,0]=3 3402 B9R0.35 CCOC(=O)C(C)SCC 62a_100000210202_100011216346 [1,0,1,0,0,0|1,0,0]=3 3403 B9R0.35 CCOC(=O)C(C)SCC 62a_100011216346_100000210202 [1,0,1,0,0,0|1,0,0]=3 3404 B9R0.35 CCOC(=O)C(C)SCF 62a_100011216346_100015361967 [1,0,1,0,0,0|2,0,0]=4 3405 B9R0.35 CCOC(=O)C(C)SCF 62a_100015361967_100011216346 [1,0,1,0,0,0|2,0,0]=4 3406 B9R0.35 CCOC(=O)C(F)OCC 34a_100121572206_100000760018 [1,0,1,0,0,0|2,0,0]=4 3407 B9R0.35 CCOC(=O)C(F)SCC 62a_100000210202_100000760018 [1,0,1,0,0,0|2,0,0]=4 3408 B9R0.35 CCOC(=O)C(F)SCC 62a_100000760018_100000210202 [1,0,1,0,0,0|2,0,0]=4 3409 B9R0.35 CCOC(=O)[C@H](C)OCC 7a_100000751109_100000210202 [1,0,1,0,0,0|1,0,0]=3 3410 B9R0.35 CCOC(=O)[C@H](C)OCF 7a_100000751109_100015361967 [1,0,1,0,0,0|2,0,0]=4 3411 B9R0.12 C#CC(=O)C(CC)CCC 1458a_100000211873_100011219200 [1,0,1,0,0,0|0,0,2]=4 3412 B9R0.12 C=CC(=O)C(CC)CCC 1458a_100000185746_100011219200 [1,0,1,0,0,0|0,0,2]=4 3413 B9R0.12 CCC(=O)C(CC)OCF 34a_200011218131_100015361967 [1,0,1,0,0,0|2,0,0]=4 3414 B9R0.12 CCC(=O)C(CC)OCF 7a_200011218131_100015361967 [1,0,1,0,0,0|2,0,0]=4 3415 B9R0.12 CCC(=O)N(CC)CCO 240690a_100000210973_100000210414 [1,0,1,0,0,0|2,0,0]=4 3416 B9R0.12 CCC(=O)N(CC)CCO 527a_100000210973_100000210414 [1,0,1,0,0,0|2,0,0]=4 3417 B9R0.12 CCC(OCF)C(=O)OC 34a_100000695916_100015361967 [1,0,1,0,0,0|2,0,0]=4 3418 B9R0.12 CCC(OCF)C(=O)OC 7a_100000695916_100015361967 [1,0,1,0,0,0|2,0,0]=4 3419 B9R0.12 CCC(SCF)C(=O)OC 62a_100000235869_100015361967 [1,0,1,0,0,0|2,0,0]=4 3420 B9R0.12 CCC(SCF)C(=O)OC 62a_100015361967_100000235869 [1,0,1,0,0,0|2,0,0]=4 3421 B9R0.12 CCCC(CC)C(=O)CC 1458a_100000210414_100011219200 [1,0,1,0,0,0|0,0,0]=2 3422 B9R0.12 CCCC(CC)C(=O)CC 1458a_100011416436_100000210202 [1,0,1,0,0,0|0,0,0]=2 3423 B9R0.12 CCCC(CC)C(=O)CF 1458a_100011416436_100015361967 [1,0,1,0,0,0|1,0,0]=3 3424 B9R0.12 CCCC(CC)C(=O)CO 1458a_100000210174_100011219200 [1,0,1,0,0,0|1,0,0]=3 3425 B9R0.12 CCCC(CC)C(=O)NC 11a_106832991635_100011416436 [1,0,1,0,0,0|1,0,0]=3 3426 B9R0.12 CCCC(CC)C(=O)NC 1626a_100102657272_100011416436 [1,0,1,0,0,0|1,0,0]=3 3427 B9R0.12 CCCC(CC)C(=O)NC 240690a_100102657272_100011416436 [1,0,1,0,0,0|1,0,0]=3 3428 B9R0.12 CCCC(CC)C(=O)NC 527a_100102657272_100011416436 [1,0,1,0,0,0|1,0,0]=3 3429 B9R0.12 CCCC(CC)N(C)CC 269982a_100000225621_100011219200 [1,0,1,0,0,0|2,0,0]=4 3430 B9R0.12 CCCC(NC)C(=O)NC 2230a_106256046333_200000210301 [1,0,1,0,0,0|2,0,0]=4 3431 B9R0.12 CCCC(NC)C(=O)NC 34a_106256046333_200000210301 [1,0,1,0,0,0|2,0,0]=4 3432 B9R0.12 CCCC(NC)C(=O)OC 2230a_106832991635_200009843822 [1,0,1,0,0,0|1,0,0]=3 3433 B9R0.12 CCCC(NC)C(=O)OC 34a_100102657272_200009843822 [1,0,1,0,0,0|1,0,0]=3 3434 B9R0.12 CCCC(NC)C(=O)OC 7a_106832991635_200009843822 [1,0,1,0,0,0|1,0,0]=3 3435 B9R0.12 CCCC(N[13CH3])C(=O)NC 2230a_106256046333_200025704644 [1,0,1,0,0,0|2,0,0]=4 3436 B9R0.12 CCCC(N[13CH3])C(=O)NC 34a_106256046333_200025704644 [1,0,1,0,0,0|2,0,0]=4 3437 B9R0.12 CCCC(OC)C(=O)OC 34a_100138415774_200009843822 [1,0,1,0,0,0|1,0,0]=3 3438 B9R0.12 CCCC(SC)C(=O)OC 62a_200000210301_200009843822 [1,0,1,0,0,0|1,0,0]=3 3439 B9R0.12 CCCC(SC)C(=O)OC 62a_200009843822_200000210301 [1,0,1,0,0,0|1,0,0]=3 3440 B9R0.12 CCCC(S[13CH3])C(=O)OC 62a_200009843822_200025704644 [1,0,1,0,0,0|1,0,0]=3 3441 B9R0.12 CCCC(S[13CH3])C(=O)OC 62a_200025704644_200009843822 [1,0,1,0,0,0|1,0,0]=3 3442 B9R0.12 CCCN(CC)C(=O)CC 11a_100000226822_100000210414 [1,0,1,0,0,0|1,0,0]=3 3443 B9R0.12 CCCN(CC)C(=O)CC 1626a_100000226822_100000210414 [1,0,1,0,0,0|1,0,0]=3 3444 B9R0.12 CCCN(CC)C(=O)CC 240690a_100000226822_100000210414 [1,0,1,0,0,0|1,0,0]=3 3445 B9R0.12 CCCN(CC)C(=O)CC 527a_100000226822_100000210414 [1,0,1,0,0,0|1,0,0]=3 3446 B9R0.12 CCCN(CC)C(=O)CO 240690a_100000226822_100000210174 [1,0,1,0,0,0|2,0,0]=4 3447 B9R0.12 CCCN(CC)C(=O)CO 527a_100000226822_100000210174 [1,0,1,0,0,0|2,0,0]=4 3448 B9R0.12 CCCN(CC)C(=O)NC 2708a_100102657272_100000226822 [1,0,1,0,0,0|2,0,0]=4 3449 B9R0.12 CCCN(CC)C(=O)NC 273464a_100102657272_100000226822 [1,0,1,0,0,0|2,0,0]=4 3450 B9R0.12 CCNC(CC)C(=O)OC 2230a_100015525214_100000235869 [1,0,1,0,0,0|1,0,0]=3 3451 B9R0.12 CCN[C@@H](CC)C(=O)NC 2230a_106657271573_100000210202 [1,0,1,0,0,0|2,0,0]=4 3452 B9R0.12 CCN[C@@H](CC)C(=O)NC 34a_106657271573_100000210202 [1,0,1,0,0,0|2,0,0]=4 3453 B9R0.12 CCOC(CC)C(=O)CC 34a_200011218131_100000210202 [1,0,1,0,0,0|1,0,0]=3 3454 B9R0.12 CCOC(CC)C(=O)CC 7a_200011218131_100000210202 [1,0,1,0,0,0|1,0,0]=3 3455 B9R0.12 CCOC(CC)C(=O)OC 34a_100000695916_100000210202 [1,0,1,0,0,0|1,0,0]=3 3456 B9R0.12 CCOC(CC)C(=O)OC 34a_100121572206_100000235869 [1,0,1,0,0,0|1,0,0]=3 3457 B9R0.12 CCOC(CC)C(=O)OC 7a_100000695916_100000210202 [1,0,1,0,0,0|1,0,0]=3 3458 B9R0.12 CCOC(CN)C(=O)OC 34a_100000695228_100000210202 [1,0,1,0,0,0|2,0,0]=4 3459 B9R0.12 CCOC(CO)C(=O)OC 34a_100121572206_100012276630 [1,0,1,0,0,0|2,0,0]=4 3460 B9R0.12 CCOC(OC)C(=O)OC 34a_100000036821_100000210202 [1,0,1,0,0,0|2,0,0]=4 3461 B9R0.12 CCOC(OC)C(=O)OC 34a_100121572206_100000101307 [1,0,1,0,0,0|2,0,0]=4 3462 B9R0.12 CCSC(CC)C(=O)OC 62a_100000210202_100000235869 [1,0,1,0,0,0|1,0,0]=3 3463 B9R0.12 CCSC(CC)C(=O)OC 62a_100000235869_100000210202 [1,0,1,0,0,0|1,0,0]=3 3464 B9R0.12 CCSC(CO)C(=O)OC 62a_100000210202_100012276630 [1,0,1,0,0,0|2,0,0]=4 3465 B9R0.12 CCSC(CO)C(=O)OC 62a_100012276630_100000210202 [1,0,1,0,0,0|2,0,0]=4 3466 B9R0.12 CCSC(OC)C(=O)OC 62a_100000101307_100000210202 [1,0,1,0,0,0|2,0,0]=4 3467 B9R0.12 CCSC(OC)C(=O)OC 62a_100000210202_100000101307 [1,0,1,0,0,0|2,0,0]=4 3468 B9R0.12 CNC(COC)C(=O)OC 34a_100102657272_100000717350 [1,0,1,0,0,0|2,0,0]=4 3469 B9R0.12 COCC(OC)C(=O)OC 34a_100138415774_100000717350 [1,0,1,0,0,0|2,0,0]=4 3470 B9R0.12 COCC(SC)C(=O)OC 62a_100000717350_200000210301 [1,0,1,0,0,0|2,0,0]=4 3471 B9R0.12 COCC(SC)C(=O)OC 62a_200000210301_100000717350 [1,0,1,0,0,0|2,0,0]=4 3472 B9R0.12 COCC(S[13CH3])C(=O)OC 62a_100000717350_200025704644 [1,0,1,0,0,0|2,0,0]=4 3473 B9R0.12 COCC(S[13CH3])C(=O)OC 62a_200025704644_100000717350 [1,0,1,0,0,0|2,0,0]=4 3474 B9R0.37 CC#CC(=O)C(CC)CC 1458a_100000763181_100000210505 [1,0,1,0,0,0|1,0,1]=4 3475 B9R0.37 CC=CC(=O)C(CC)CC 1458a_100000210699_100000210505 [1,0,1,0,0,0|1,0,1]=4 3476 B9R0.37 CCC(CC)C(=O)CCF 1458a_100000211163_100011217306 [1,0,1,0,0,0|2,0,0]=4 3477 B9R0.37 CCC(CC)C(=O)CCO 1458a_100000211163_100000211926 [1,0,1,0,0,0|2,0,0]=4 3478 B9R0.37 CCC(CC)C(=O)CCO 1458a_100011216618_100000210505 [1,0,1,0,0,0|2,0,0]=4 3479 B9R0.37 CCC(CC)C(=O)COC 1458a_100000210968_100000210505 [1,0,1,0,0,0|2,0,0]=4 3480 B9R0.37 CCC(CC)C(=O)CSC 1458a_100000184570_100000210505 [1,0,1,0,0,0|2,0,0]=4 3481 B9R0.37 CCC(CC)C(=O)NNC 22a_100016993582_100000211163 [1,0,1,0,0,0|2,0,0]=4 3482 B9R0.37 CCCC(=O)C(CC)CC 1458a_100000211163_100000210303 [1,0,1,0,0,0|1,0,0]=3 3483 B9R0.37 CCCC(=O)C(CC)CC 1458a_100000211992_100000210505 [1,0,1,0,0,0|1,0,0]=3 3484 B9R0.37 CCCC(=O)C(CC)OC 1458a_100000747056_100000210303 [1,0,1,0,0,0|2,0,0]=4 3485 B9R0.37 CCCC(=O)N(CC)CC 11a_100000724800_100000211992 [1,0,1,0,0,0|2,0,0]=4 3486 B9R0.37 CCCC(=O)N(CC)CC 1626a_100000724800_100000211992 [1,0,1,0,0,0|2,0,0]=4 3487 B9R0.37 CCCC(=O)N(CC)CC 240690a_100000724800_100000211992 [1,0,1,0,0,0|2,0,0]=4 3488 B9R0.37 CCCC(=O)N(CC)CC 527a_100000724800_100000211992 [1,0,1,0,0,0|2,0,0]=4 3489 B9R0.37 CCNC(=O)C(CC)CC 11a_100015525214_100000211163 [1,0,1,0,0,0|1,0,0]=3 3490 B9R0.37 CCNC(=O)C(CC)CC 240690a_100015525214_100000211163 [1,0,1,0,0,0|1,0,0]=3 3491 B9R0.37 CCNC(=O)C(CC)CC 527a_100015525214_100000211163 [1,0,1,0,0,0|1,0,0]=3 3492 B9R0.37 CCNC(=O)C(CC)OC 11a_100015525214_100000747056 [1,0,1,0,0,0|2,0,0]=4 3493 B9R0.37 CCNC(=O)C(CC)OC 240690a_100015525214_100000747056 [1,0,1,0,0,0|2,0,0]=4 3494 B9R0.37 CCNC(=O)C(CC)OC 527a_100015525214_100000747056 [1,0,1,0,0,0|2,0,0]=4 3495 B9R0.37 CCNC(=O)N(CC)CC 2708a_100015525214_100000724800 [1,0,1,0,0,0|2,0,0]=4 3496 B9R0.37 CCNC(=O)N(CC)CC 273464a_100015525214_100000724800 [1,0,1,0,0,0|2,0,0]=4 3497 B9R0.37 CCOC(=O)C(CC)NC 2230a_106832991635_100000212269 [1,0,1,0,0,0|1,0,0]=3 3498 B9R0.37 CCOC(=O)C(CC)NC 34a_100102657272_100000212269 [1,0,1,0,0,0|1,0,0]=3 3499 B9R0.37 CCOC(=O)C(CC)NC 7a_106832991635_100000212269 [1,0,1,0,0,0|1,0,0]=3 3500 B9R0.37 CCOC(=O)C(CC)OC 34a_100011216719_200000210301 [1,0,1,0,0,0|1,0,0]=3 3501 B9R0.37 CCOC(=O)C(CC)OC 34a_100138415774_100000212269 [1,0,1,0,0,0|1,0,0]=3 3502 B9R0.37 CCOC(=O)C(CC)OC 7a_100011216719_200000210301 [1,0,1,0,0,0|1,0,0]=3 3503 B9R0.37 CCOC(=O)C(CC)O[13CH3] 34a_100011216719_200025704644 [1,0,1,0,0,0|1,0,0]=3 3504 B9R0.37 CCOC(=O)C(CC)O[13CH3] 7a_100011216719_200025704644 [1,0,1,0,0,0|1,0,0]=3 3505 B9R0.37 CCOC(=O)C(CC)SC 62a_100000212269_200000210301 [1,0,1,0,0,0|1,0,0]=3 3506 B9R0.37 CCOC(=O)C(CC)SC 62a_200000210301_100000212269 [1,0,1,0,0,0|1,0,0]=3 3507 B9R0.37 CCOC(=O)C(CC)S[13CH3] 62a_100000212269_200025704644 [1,0,1,0,0,0|1,0,0]=3 3508 B9R0.37 CCOC(=O)C(CC)S[13CH3] 62a_200025704644_100000212269 [1,0,1,0,0,0|1,0,0]=3 3509 B9R0.37 CCOC(=O)C(NC)SC 34a_100102657272_100009893047 [1,0,1,0,0,0|2,0,0]=4 3510 B9R0.37 CCOC(=O)C(OC)SC 34a_100138415774_100009893047 [1,0,1,0,0,0|2,0,0]=4 3511 B9R0.37 CCOC(=O)C(SC)SC 62a_100009893047_200000210301 [1,0,1,0,0,0|2,0,0]=4 3512 B9R0.37 CCOC(=O)C(SC)SC 62a_200000210301_100009893047 [1,0,1,0,0,0|2,0,0]=4 3513 B9R0.37 CCOC(=O)C(SC)S[13CH3] 62a_100009893047_200025704644 [1,0,1,0,0,0|2,0,0]=4 3514 B9R0.37 CCOC(=O)C(SC)S[13CH3] 62a_200025704644_100009893047 [1,0,1,0,0,0|2,0,0]=4 3515 B9R0.40 CCCN(CC)COCC 269982a_100000226822_100000739092 [1,0,1,0,0,0|1,0,1]=4 3516 B9R0.40 CCCNC(CC)CCC 2230a_100000747048_100000210303 [1,0,1,0,0,0|2,0,0]=4 3517 B9R0.40 CCCNC(CC)CCC 270004a_100020643023_100000687865 [1,0,1,0,0,0|2,0,0]=4 3518 B9R0.40 CCCOC(CC)CCC 34a_100000687864_100000210303 [1,0,1,0,0,0|2,0,0]=4 3519 B9R0.40 CCCOC(CC)CCC 7a_100000687864_100000210303 [1,0,1,0,0,0|2,0,0]=4 3520 B9R0.40 CCCSC(CC)CCC 62a_100000210303_100011219200 [1,0,1,0,0,0|2,0,0]=4 3521 B9R0.40 CCCSC(CC)CCC 62a_100011219200_100000210303 [1,0,1,0,0,0|2,0,0]=4 3522 B9R1.6 CC(=O)C1=CCCCC1 1458a_100000765259_200000210301 [2,0,0,0,0,0|0,0,2]=4 3523 B9R1.6 CC(=O)C1C=CCCC1 1458a_100000070787_100000751183 [2,0,0,0,0,0|0,0,2]=4 3524 B9R1.6 CC(=O)C1CCCCC1 1458a_100000070787_100000210327 [2,0,0,0,0,0|0,0,0]=2 3525 B9R1.6 CC(=O)C1CCCCC1 1458a_100000210647_200000210301 [2,0,0,0,0,0|0,0,0]=2 3526 B9R1.6 CC(=O)C1CCCCO1 1458a_100000748299_200000210301 [2,0,0,0,0,0|1,0,0]=3 3527 B9R1.6 CC(=O)C1CCCOC1 1458a_100000070787_100000693364 [2,0,0,0,0,0|1,0,0]=3 3528 B9R1.6 CC(=O)C1CCCOC1 1458a_100000741522_200000210301 [2,0,0,0,0,0|1,0,0]=3 3529 B9R1.6 CC(=O)C1CCOCC1 1458a_100000070787_100011324220 [2,0,0,0,0,0|1,0,0]=3 3530 B9R1.6 CC(=O)C1CCOCC1 1458a_100000195482_200000210301 [2,0,0,0,0,0|1,0,0]=3 3531 B9R1.6 CC(=O)C1CCSCC1 1458a_100000755232_200000210301 [2,0,0,0,0,0|1,0,0]=3 3532 B9R1.6 CC(=O)C1COCCO1 1458a_100000045528_200000210301 [2,0,0,0,0,0|2,0,0]=4 3533 B9R1.6 CC(=O)C1SCCCS1 1458a_100000028545_200000210301 [2,0,0,0,0,0|2,0,0]=4 3534 B9R1.6 CC(=O)N1CCCOC1 11a_100000131196_100015343762 [2,0,0,0,0,0|2,0,0]=4 3535 B9R1.6 CC(=O)N1CCCOC1 240690a_100000131196_100015343762 [2,0,0,0,0,0|2,0,0]=4 3536 B9R1.6 CC(=O)N1CCOCC1 11a_100015191051_100015343762 [2,0,0,0,0,0|2,0,0]=4 3537 B9R1.6 CC(=O)N1CCOCC1 1626a_100015191051_100015343762 [2,0,0,0,0,0|2,0,0]=4 3538 B9R1.6 CC(=O)N1CCOCC1 240690a_100015191051_100015343762 [2,0,0,0,0,0|2,0,0]=4 3539 B9R1.6 CC(=O)N1CCOCC1 527a_100015191051_100103153847 [2,0,0,0,0,0|2,0,0]=4 3540 B9R1.6 CC(=O)N1CCSCC1 11a_100000737611_100015343762 [2,0,0,0,0,0|2,0,0]=4 3541 B9R1.6 CC(=O)N1CCSCC1 240690a_100000737611_100015343762 [2,0,0,0,0,0|2,0,0]=4 3542 B9R1.6 CC(=O)N1CCSCC1 527a_100000737611_100103153847 [2,0,0,0,0,0|2,0,0]=4 3543 B9R1.6 CC(=O)[C@H]1CC=CCC1 1458a_100009820709_200000210301 [2,0,0,0,0,0|0,0,2]=4 3544 B9R1.6 CN(C)C1CCCCC1 2230a_100000207522_200000210301 [2,0,0,0,0,0|2,0,0]=4 3545 B9R1.6 CN(C)C1CCCCC1 269982a_100000207522_200000210301 [2,0,0,0,0,0|2,0,0]=4 3546 B9R1.6 CN(C)C1CCCCC1 269982a_100102631434_100000210327 [2,0,0,0,0,0|2,0,0]=4 3547 B9R1.6 CN(C)C1CCCCC1 270004a_100102631434_100000210434 [2,0,0,0,0,0|2,0,0]=4 3548 B9R1.6 CN(C)C1CCCCC1 34a_100000207522_200000210301 [2,0,0,0,0,0|2,0,0]=4 3549 B9R1.6 CN([13CH3])C1CCCCC1 2230a_100000207522_200025704644 [2,0,0,0,0,0|2,0,0]=4 3550 B9R1.6 CN([13CH3])C1CCCCC1 269982a_100000207522_200025704644 [2,0,0,0,0,0|2,0,0]=4 3551 B9R1.6 CN([13CH3])C1CCCCC1 34a_100000207522_200025704644 [2,0,0,0,0,0|2,0,0]=4 3552 B9R1.6 [13CH3]C(=O)C1=CCCCC1 1458a_100000765259_200025704644 [2,0,0,0,0,0|0,0,2]=4 3553 B9R1.6 [13CH3]C(=O)C1CCCCC1 1458a_100000210647_200025704644 [2,0,0,0,0,0|0,0,0]=2 3554 B9R1.6 [13CH3]C(=O)C1CCCCO1 1458a_100000748299_200025704644 [2,0,0,0,0,0|1,0,0]=3 3555 B9R1.6 [13CH3]C(=O)C1CCCOC1 1458a_100000741522_200025704644 [2,0,0,0,0,0|1,0,0]=3 3556 B9R1.6 [13CH3]C(=O)C1CCOCC1 1458a_100000195482_200025704644 [2,0,0,0,0,0|1,0,0]=3 3557 B9R1.6 [13CH3]C(=O)C1CCSCC1 1458a_100000755232_200025704644 [2,0,0,0,0,0|1,0,0]=3 3558 B9R1.6 [13CH3]C(=O)C1COCCO1 1458a_100000045528_200025704644 [2,0,0,0,0,0|2,0,0]=4 3559 B9R1.6 [13CH3]C(=O)C1SCCCS1 1458a_100000028545_200025704644 [2,0,0,0,0,0|2,0,0]=4 3560 B9R1.6 [13CH3]C(=O)[C@H]1CC=CCC1 1458a_100009820709_200025704644 [2,0,0,0,0,0|0,0,2]=4 3561 B9R1.8 CCNC1CCCCC1 2230a_100000182618_100000210202 [2,0,0,0,0,0|1,0,0]=3 3562 B9R1.8 CCNC1CCCCC1 270004a_100015525214_100000210434 [2,0,0,0,0,0|1,0,0]=3 3563 B9R1.8 CCNC1CCCCC1 34a_100000182618_100000210202 [2,0,0,0,0,0|1,0,0]=3 3564 B9R1.8 CCNC1CCCOC1 2230a_100000719290_100000210202 [2,0,0,0,0,0|2,0,0]=4 3565 B9R1.8 CCNC1CCCOC1 270004a_100015525214_100000753404 [2,0,0,0,0,0|2,0,0]=4 3566 B9R1.8 CCNC1CCCOC1 34a_100000719290_100000210202 [2,0,0,0,0,0|2,0,0]=4 3567 B9R1.8 CCNC1CCCSC1 270004a_100015525214_100000057913 [2,0,0,0,0,0|2,0,0]=4 3568 B9R1.8 CCNC1CCNCC1 270004a_100015525214_100015192401 [2,0,0,0,0,0|2,0,0]=4 3569 B9R1.8 CCNC1CCOCC1 2230a_100000741149_100000210202 [2,0,0,0,0,0|2,0,0]=4 3570 B9R1.8 CCNC1CCOCC1 270004a_100015525214_100011217826 [2,0,0,0,0,0|2,0,0]=4 3571 B9R1.8 CCNC1CCOCC1 34a_100000741149_100000210202 [2,0,0,0,0,0|2,0,0]=4 3572 B9R1.8 CCNC1CCSCC1 2230a_100000748639_100000210202 [2,0,0,0,0,0|2,0,0]=4 3573 B9R1.8 CCNC1CCSCC1 270004a_100015525214_100000203788 [2,0,0,0,0,0|2,0,0]=4 3574 B9R1.8 CCNC1CCSCC1 34a_100000748639_100000210202 [2,0,0,0,0,0|2,0,0]=4 3575 B9R1.8 CCOC1C=CCCC1 34a_100011215024_100000210202 [2,0,0,0,0,0|0,0,2]=4 3576 B9R1.8 CCOC1CC=CCC1 34a_100000073881_100000210202 [2,0,0,0,0,0|0,0,2]=4 3577 B9R1.8 CCOC1CCCCC1 34a_100000210231_100000210202 [2,0,0,0,0,0|0,0,0]=2 3578 B9R1.8 CCOC1CCCCC1 34a_100121572206_100000210327 [2,0,0,0,0,0|0,0,0]=2 3579 B9R1.8 CCOC1CCCCC1 7a_100000210231_100000210202 [2,0,0,0,0,0|0,0,0]=2 3580 B9R1.8 CCOC1CCCCO1 34a_100000033831_100000210202 [2,0,0,0,0,0|1,0,0]=3 3581 B9R1.8 CCOC1CCCOC1 34a_100000754041_100000210202 [2,0,0,0,0,0|1,0,0]=3 3582 B9R1.8 CCOC1CCCOC1 34a_100121572206_100000693364 [2,0,0,0,0,0|1,0,0]=3 3583 B9R1.8 CCOC1CCCSC1 7a_100015962668_100000210202 [2,0,0,0,0,0|1,0,0]=3 3584 B9R1.8 CCOC1CCOCC1 34a_100000744328_100000210202 [2,0,0,0,0,0|1,0,0]=3 3585 B9R1.8 CCOC1CCSCC1 34a_100000731022_100000210202 [2,0,0,0,0,0|1,0,0]=3 3586 B9R1.8 CCOC1CCSCC1 34a_100121572206_100000069128 [2,0,0,0,0,0|1,0,0]=3 3587 B9R1.8 CCOC1CCSCC1 7a_100000731022_100000210202 [2,0,0,0,0,0|1,0,0]=3 3588 B9R1.8 CCSC1CCCCC1 62a_100000210202_100000210327 [2,0,0,0,0,0|0,1,0]=3 3589 B9R1.8 CCSC1CCCCC1 62a_100000210327_100000210202 [2,0,0,0,0,0|0,1,0]=3 3590 B9R1.8 CCSC1CCCOC1 62a_100000210202_100000693364 [2,0,0,0,0,0|1,1,0]=4 3591 B9R1.8 CCSC1CCOCC1 62a_100000210202_100011324220 [2,0,0,0,0,0|1,1,0]=4 3592 B9R1.8 CCSC1CCSCC1 62a_100000210202_100000069128 [2,0,0,0,0,0|1,1,0]=4 3593 B9R1.8 CNCC1CCCCC1 2230a_100000210473_200000210301 [2,0,0,0,0,0|1,0,1]=4 3594 B9R1.8 CNCC1CCCCC1 2230a_106832991635_100000211423 [2,0,0,0,0,0|1,0,1]=4 3595 B9R1.8 CNCC1CCCCC1 269862a_106832991636_100000211278 [2,0,0,0,0,0|1,0,1]=4 3596 B9R1.8 CNCC1CCCCC1 34a_100000210473_200000210301 [2,0,0,0,0,0|1,0,1]=4 3597 B9R1.8 CNCC1CCCCC1 34a_100102657272_100000211423 [2,0,0,0,0,0|1,0,1]=4 3598 B9R1.8 CNCC1CCCCC1 7a_106832991635_100000211423 [2,0,0,0,0,0|1,0,1]=4 3599 B9R1.8 COCC1CCCCC1 34a_100000212181_200000210301 [2,0,0,0,0,0|0,0,1]=3 3600 B9R1.8 COCC1CCCCC1 34a_100138415774_100000211423 [2,0,0,0,0,0|0,0,1]=3 3601 B9R1.8 COCC1CCCCC1 7a_100000212181_200000210301 [2,0,0,0,0,0|0,0,1]=3 3602 B9R1.8 COCC1CCCCN1 34a_100000210821_200000210301 [2,0,0,0,0,0|1,0,1]=4 3603 B9R1.8 COCC1CCCCO1 34a_100000211370_200000210301 [2,0,0,0,0,0|1,0,1]=4 3604 B9R1.8 COCC1CCCCO1 34a_100138415774_100000211543 [2,0,0,0,0,0|1,0,1]=4 3605 B9R1.8 COCC1CCCCO1 7a_100000211370_200000210301 [2,0,0,0,0,0|1,0,1]=4 3606 B9R1.8 COCC1CCCNC1 34a_100000211344_200000210301 [2,0,0,0,0,0|1,0,1]=4 3607 B9R1.8 COCC1CCCOC1 34a_100000741520_200000210301 [2,0,0,0,0,0|1,0,1]=4 3608 B9R1.8 COCC1CCCOC1 34a_100138415774_100000741521 [2,0,0,0,0,0|1,0,1]=4 3609 B9R1.8 COCC1CCNCC1 34a_100000738675_200000210301 [2,0,0,0,0,0|1,0,1]=4 3610 B9R1.8 COCC1CCOCC1 34a_100000749013_200000210301 [2,0,0,0,0,0|1,0,1]=4 3611 B9R1.8 COCC1CCOCC1 34a_100138415774_100000754603 [2,0,0,0,0,0|1,0,1]=4 3612 B9R1.8 COCC1CCSCC1 34a_100000070558_200000210301 [2,0,0,0,0,0|1,0,1]=4 3613 B9R1.8 COCC1CCSCC1 7a_100000070558_200000210301 [2,0,0,0,0,0|1,0,1]=4 3614 B9R1.8 CSCC1CCCCC1 62a_100000211423_200000210301 [2,0,0,0,0,0|0,1,1]=4 3615 B9R1.8 CSCC1CCCCC1 62a_200000210301_100000211423 [2,0,0,0,0,0|0,1,1]=4 3616 B9R1.8 FCNC1CCCCC1 34a_100000182618_100015361967 [2,0,0,0,0,0|2,0,0]=4 3617 B9R1.8 FCOC1CCCCC1 34a_100000210231_100015361967 [2,0,0,0,0,0|1,0,0]=3 3618 B9R1.8 FCOC1CCCCC1 7a_100000210231_100015361967 [2,0,0,0,0,0|1,0,0]=3 3619 B9R1.8 FCOC1CCCCO1 34a_100000033831_100015361967 [2,0,0,0,0,0|2,0,0]=4 3620 B9R1.8 FCOC1CCCOC1 34a_100000754041_100015361967 [2,0,0,0,0,0|2,0,0]=4 3621 B9R1.8 FCOC1CCCSC1 7a_100015962668_100015361967 [2,0,0,0,0,0|2,0,0]=4 3622 B9R1.8 FCOC1CCOCC1 34a_100000744328_100015361967 [2,0,0,0,0,0|2,0,0]=4 3623 B9R1.8 FCOC1CCSCC1 34a_100000731022_100015361967 [2,0,0,0,0,0|2,0,0]=4 3624 B9R1.8 FCOC1CCSCC1 7a_100000731022_100015361967 [2,0,0,0,0,0|2,0,0]=4 3625 B9R1.8 FCSC1CCCCC1 62a_100000210327_100015361967 [2,0,0,0,0,0|1,1,0]=4 3626 B9R1.8 FCSC1CCCCC1 62a_100015361967_100000210327 [2,0,0,0,0,0|1,1,0]=4 3627 B9R1.8 [13CH3]NCC1CCCCC1 2230a_100000210473_200025704644 [2,0,0,0,0,0|1,0,1]=4 3628 B9R1.8 [13CH3]NCC1CCCCC1 34a_100000210473_200025704644 [2,0,0,0,0,0|1,0,1]=4 3629 B9R1.8 [13CH3]OCC1CCCCC1 34a_100000212181_200025704644 [2,0,0,0,0,0|0,0,1]=3 3630 B9R1.8 [13CH3]OCC1CCCCC1 7a_100000212181_200025704644 [2,0,0,0,0,0|0,0,1]=3 3631 B9R1.8 [13CH3]OCC1CCCCN1 34a_100000210821_200025704644 [2,0,0,0,0,0|1,0,1]=4 3632 B9R1.8 [13CH3]OCC1CCCCO1 34a_100000211370_200025704644 [2,0,0,0,0,0|1,0,1]=4 3633 B9R1.8 [13CH3]OCC1CCCCO1 7a_100000211370_200025704644 [2,0,0,0,0,0|1,0,1]=4 3634 B9R1.8 [13CH3]OCC1CCCNC1 34a_100000211344_200025704644 [2,0,0,0,0,0|1,0,1]=4 3635 B9R1.8 [13CH3]OCC1CCCOC1 34a_100000741520_200025704644 [2,0,0,0,0,0|1,0,1]=4 3636 B9R1.8 [13CH3]OCC1CCNCC1 34a_100000738675_200025704644 [2,0,0,0,0,0|1,0,1]=4 3637 B9R1.8 [13CH3]OCC1CCOCC1 34a_100000749013_200025704644 [2,0,0,0,0,0|1,0,1]=4 3638 B9R1.8 [13CH3]OCC1CCSCC1 34a_100000070558_200025704644 [2,0,0,0,0,0|1,0,1]=4 3639 B9R1.8 [13CH3]OCC1CCSCC1 7a_100000070558_200025704644 [2,0,0,0,0,0|1,0,1]=4 3640 B9R1.8 [13CH3]SCC1CCCCC1 62a_100000211423_200025704644 [2,0,0,0,0,0|0,1,1]=4 3641 B9R1.8 [13CH3]SCC1CCCCC1 62a_200025704644_100000211423 [2,0,0,0,0,0|0,1,1]=4 3642 B11R0.2 C=C(C)CC(=O)CCCCCC 1458a_100102632555_100000748629 [0,1,1,0,0,0|1,0,1]=4 3643 B11R0.2 CC(C)CC(=O)CCCCCF 1458a_100000210554_100000729378 [0,1,1,0,0,0|2,0,0]=4 3644 B11R0.2 CC(C)CC(=O)CCCCCO 1458a_100000210554_100000746330 [0,1,1,0,0,0|2,0,0]=4 3645 B11R0.2 CC(C)CC(=O)CCCCCO 1458a_100102619762_100000210624 [0,1,1,0,0,0|2,0,0]=4 3646 B11R0.2 CC(C)NC(=O)CCCCCO 240690a_100138425928_100102619762 [0,1,1,0,0,0|2,0,0]=4 3647 B11R0.2 CC(C)OC(=O)CCNCCO 2230a_100016997473_100000760027 [0,1,1,0,0,0|2,0,0]=4 3648 B11R0.2 CC(C)OC(=O)CCSCCF 62a_100000760027_100011217306 [0,1,1,0,0,0|2,0,0]=4 3649 B11R0.2 CC(C)OC(=O)CCSCCF 62a_100011217306_100000760027 [0,1,1,0,0,0|2,0,0]=4 3650 B11R0.2 CC(C)OC(=O)CCSCCO 62a_100000211926_100000760027 [0,1,1,0,0,0|2,0,0]=4 3651 B11R0.2 CC(C)OC(=O)CCSCCO 62a_100000760027_100000211926 [0,1,1,0,0,0|2,0,0]=4 3652 B11R0.2 CC(C)OC(=O)CNCCCF 2230a_100015189416_100011215430 [0,1,1,0,0,0|2,0,0]=4 3653 B11R0.2 CC(C)OC(=O)CNCCCF 34a_100015189416_100011215430 [0,1,1,0,0,0|2,0,0]=4 3654 B11R0.2 CC(C)OC(=O)COCCCBr 34a_100011217188_100011215430 [0,1,1,0,0,0|2,0,0]=4 3655 B11R0.2 CC(C)OC(=O)COCCCCl 34a_100000230001_100011215430 [0,1,1,0,0,0|2,0,0]=4 3656 B11R0.2 CC(C)OC(=O)COCCCF 34a_100000759539_100011215430 [0,1,1,0,0,0|2,0,0]=4 3657 B11R0.2 CC(C)OC(=O)COCCCN 34a_100000182051_100011215430 [0,1,1,0,0,0|2,0,0]=4 3658 B11R0.2 CC(C)OC(=O)CSCCCF 62a_100011215430_100011934791 [0,1,1,0,0,0|2,0,0]=4 3659 B11R0.2 CC(C)OC(=O)CSCCCF 62a_100011934791_100011215430 [0,1,1,0,0,0|2,0,0]=4 3660 B11R0.2 CC(C)OC(=O)CSCCCO 62a_100011215043_100011215430 [0,1,1,0,0,0|2,0,0]=4 3661 B11R0.2 CC(C)OC(=O)CSCCCO 62a_100011215430_100011215043 [0,1,1,0,0,0|2,0,0]=4 3662 B11R0.2 CC(O)CC(=O)CCCCCO 1458a_100102619762_100011218427 [0,1,1,0,0,0|2,0,0]=4 3663 B11R0.2 CCCCCCC(=O)C=C(C)C 1458a_100000211388_100000210757 [0,1,1,0,0,0|1,0,1]=4 3664 B11R0.2 CCCCCCC(=O)C=C(C)Cl 1458a_200042562850_100000210757 [0,1,1,0,0,0|1,0,1]=4 3665 B11R0.2 CCCCCCC(=O)C=C(C)I 1458a_100025716642_100000210757 [0,1,1,0,0,0|1,0,1]=4 3666 B11R0.2 CCCCCCC(=O)CC(C)C 1458a_100000210554_100000210757 [0,1,1,0,0,0|1,0,0]=3 3667 B11R0.2 CCCCCCC(=O)CC(C)C 1458a_100102632555_100000210624 [0,1,1,0,0,0|1,0,0]=3 3668 B11R0.2 CCCCCCC(=O)CC(C)O 1458a_100102632555_100011218427 [0,1,1,0,0,0|1,0,0]=3 3669 B11R0.2 CCCCCCC(=O)CC(F)F 1458a_100102632555_100011934356 [0,1,1,0,0,0|2,0,0]=4 3670 B11R0.2 CCCCCCC(=O)CN(C)C 1458a_100000750896_100000210757 [0,1,1,0,0,0|2,0,0]=4 3671 B11R0.2 CCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210757 [0,1,1,0,0,0|1,0,0]=3 3672 B11R0.2 CCCCCCC(=O)C[S+](C)C 1458a_200159257847_100000210757 [0,1,1,0,0,0|2,0,0]=4 3673 B11R0.2 CCCCCCC(=O)NC(C)C 11a_100138425928_100102632555 [0,1,1,0,0,0|1,0,0]=3 3674 B11R0.2 CCCCCCC(=O)NC(C)C 1626a_100138425928_100102632555 [0,1,1,0,0,0|1,0,0]=3 3675 B11R0.2 CCCCCCC(=O)NC(C)C 240690a_100138425928_100102632555 [0,1,1,0,0,0|1,0,0]=3 3676 B11R0.2 CCCCCCC(=O)NC(C)C 527a_100138425928_100102632555 [0,1,1,0,0,0|1,0,0]=3 3677 B11R0.2 CCCCCCC(C)OC(C)C 34a_100000210265_100000210206 [0,1,1,0,0,0|1,0,1]=4 3678 B11R0.2 CCCCCCC(C)OC(C)C 34a_100000212225_100011215978 [0,1,1,0,0,0|1,0,1]=4 3679 B11R0.2 CCCCCCC(C)OC(C)C 7a_100000210265_100000210206 [0,1,1,0,0,0|1,0,1]=4 3680 B11R0.2 CCCCCNC(=O)CC(C)C 11a_100000209983_100000210554 [0,1,1,0,0,0|2,0,0]=4 3681 B11R0.2 CCCCCNC(=O)CC(C)C 1626a_100000209983_100000210554 [0,1,1,0,0,0|2,0,0]=4 3682 B11R0.2 CCCCCNC(=O)CC(C)C 240690a_100000209983_100000210554 [0,1,1,0,0,0|2,0,0]=4 3683 B11R0.2 CCCCCNC(=O)CC(C)C 527a_100000209983_100000210554 [0,1,1,0,0,0|2,0,0]=4 3684 B11R0.2 CCCCCNC(=O)C[C@@H](C)O 240690a_100000209983_100011933948 [0,1,1,0,0,0|2,0,0]=4 3685 B11R0.2 CCCCCNC(=O)NC(C)C 2708a_100000209983_100138425928 [0,1,1,0,0,0|2,0,0]=4 3686 B11R0.2 CCCCCNC(=O)NC(C)C 2708a_100138425928_100000209983 [0,1,1,0,0,0|2,0,0]=4 3687 B11R0.2 CCCCCNC(=O)NC(C)C 273464a_100138425928_100000209983 [0,1,1,0,0,0|2,0,0]=4 3688 B11R0.2 CCCCCNC(=O)NC(C)C 512a_100000209983_100138425928 [0,1,1,0,0,0|2,0,0]=4 3689 B11R0.2 CCCCCNC(=O)NC(C)C 512a_100138425928_100000209983 [0,1,1,0,0,0|2,0,0]=4 3690 B11R0.2 CCCCNCC(=O)NC(C)C 2230a_100000102301_100000183996 [0,1,1,0,0,0|2,0,0]=4 3691 B11R0.2 CCCCNCC(=O)NC(C)C 2230a_100000168517_100000210211 [0,1,1,0,0,0|2,0,0]=4 3692 B11R0.2 CCCCNCC(=O)NC(C)C 7a_106832991798_100000183996 [0,1,1,0,0,0|2,0,0]=4 3693 B11R0.2 CCCCNCC(=O)OC(C)C 2230a_100000102301_100011215430 [0,1,1,0,0,0|1,0,0]=3 3694 B11R0.2 CCCCNCC(=O)OC(C)C 7a_106832991798_100011215430 [0,1,1,0,0,0|1,0,0]=3 3695 B11R0.2 CCCCOCC(=O)CC(C)C 1458a_100000210554_100011995733 [0,1,1,0,0,0|2,0,0]=4 3696 B11R0.2 CCCCOCC(=O)CC(C)C 1458a_100000757543_100000210624 [0,1,1,0,0,0|2,0,0]=4 3697 B11R0.2 CCCCOCC(=O)CC(C)O 1458a_100000757543_100011218427 [0,1,1,0,0,0|2,0,0]=4 3698 B11R0.2 CCCCOCC(=O)C[C@@H](C)O 1458a_100011933948_100011995733 [0,1,1,0,0,0|2,0,0]=4 3699 B11R0.2 CCCCOCC(=O)NC(C)C 11a_100138425928_100000757543 [0,1,1,0,0,0|2,0,0]=4 3700 B11R0.2 CCCCOCC(=O)NC(C)C 1626a_100138425928_100000757543 [0,1,1,0,0,0|2,0,0]=4 3701 B11R0.2 CCCCOCC(=O)NC(C)C 240690a_100138425928_100000757543 [0,1,1,0,0,0|2,0,0]=4 3702 B11R0.2 CCCCOCC(=O)NC(C)C 34a_100000210227_100000183996 [0,1,1,0,0,0|2,0,0]=4 3703 B11R0.2 CCCCOCC(=O)NC(C)C 527a_100138425928_100000757543 [0,1,1,0,0,0|2,0,0]=4 3704 B11R0.2 CCCCOCC(=O)NC(C)C 7a_100000210227_100000183996 [0,1,1,0,0,0|2,0,0]=4 3705 B11R0.2 CCCCOCC(=O)OC(C)C 34a_100000210227_100011215430 [0,1,1,0,0,0|1,0,0]=3 3706 B11R0.2 CCCCOCC(=O)OC(C)C 7a_100000210227_100011215430 [0,1,1,0,0,0|1,0,0]=3 3707 B11R0.2 CCCCSCC(=O)CC(C)C 1458a_100000191162_100000210624 [0,1,1,0,0,0|2,0,0]=4 3708 B11R0.2 CCCCSCC(=O)CC(C)O 1458a_100000191162_100011218427 [0,1,1,0,0,0|2,0,0]=4 3709 B11R0.2 CCCCSCC(=O)NC(C)C 11a_100138425928_100000191162 [0,1,1,0,0,0|2,0,0]=4 3710 B11R0.2 CCCCSCC(=O)NC(C)C 1626a_100138425928_100000191162 [0,1,1,0,0,0|2,0,0]=4 3711 B11R0.2 CCCCSCC(=O)NC(C)C 240690a_100138425928_100000191162 [0,1,1,0,0,0|2,0,0]=4 3712 B11R0.2 CCCCSCC(=O)NC(C)C 527a_100138425928_100000191162 [0,1,1,0,0,0|2,0,0]=4 3713 B11R0.2 CCCCSCC(=O)NC(C)C 62a_100000183996_100000210210 [0,1,1,0,0,0|2,0,0]=4 3714 B11R0.2 CCCCSCC(=O)NC(C)C 62a_100000210211_100000183996 [0,1,1,0,0,0|2,0,0]=4 3715 B11R0.2 CCCCSCC(=O)OC(C)C 62a_100000210211_100011215430 [0,1,1,0,0,0|1,0,0]=3 3716 B11R0.2 CCCCSCC(=O)OC(C)C 62a_100011215430_100000210210 [0,1,1,0,0,0|1,0,0]=3 3717 B11R0.2 CCCOCCC(=O)CC(C)C 1458a_100000210554_100011215938 [0,1,1,0,0,0|2,0,0]=4 3718 B11R0.2 CCCOCCC(=O)C[C@@H](C)O 1458a_100011933948_100011215938 [0,1,1,0,0,0|2,0,0]=4 3719 B11R0.2 CCCSCCC(=O)NC(C)C 62a_100000210303_100000737564 [0,1,1,0,0,0|2,0,0]=4 3720 B11R0.2 CCCSCCC(=O)NC(C)C 62a_100000737564_100000210303 [0,1,1,0,0,0|2,0,0]=4 3721 B11R0.2 CCCSCCC(=O)OC(C)C 62a_100000210303_100000760027 [0,1,1,0,0,0|1,0,0]=3 3722 B11R0.2 CCCSCCC(=O)OC(C)C 62a_100000760027_100000210303 [0,1,1,0,0,0|1,0,0]=3 3723 B11R0.2 CCCSCOC(=O)OC(C)C 62a_100000003507_100000210303 [0,1,1,0,0,0|2,0,0]=4 3724 B11R0.2 CCCSCOC(=O)OC(C)C 62a_100000210303_100000003507 [0,1,1,0,0,0|2,0,0]=4 3725 B11R0.2 CCOCCCC(=O)CC(C)C 1458a_100000210554_100012232248 [0,1,1,0,0,0|2,0,0]=4 3726 B11R0.2 CCOCCCC(=O)C[C@@H](C)O 1458a_100011933948_100012232248 [0,1,1,0,0,0|2,0,0]=4 3727 B11R0.2 CCOCSCC(=O)OC(C)C 62a_100000739092_100011215430 [0,1,1,0,0,0|2,0,0]=4 3728 B11R0.2 CCOCSCC(=O)OC(C)C 62a_100011215430_100000739092 [0,1,1,0,0,0|2,0,0]=4 3729 B11R0.2 COCCCCC(=O)CC(C)C 1458a_100000210554_100000755781 [0,1,1,0,0,0|2,0,0]=4 3730 B11R0.2 COCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000755781 [0,1,1,0,0,0|2,0,0]=4 3731 B11R0.2 COCCNCC(=O)OC(C)C 2230a_100000209980_100011215430 [0,1,1,0,0,0|2,0,0]=4 3732 B11R0.2 COCCOCC(=O)OC(C)C 34a_100000210237_100011215430 [0,1,1,0,0,0|2,0,0]=4 3733 B11R0.2 COCCSCC(=O)OC(C)C 62a_100000233755_100011215430 [0,1,1,0,0,0|2,0,0]=4 3734 B11R0.2 COCCSCC(=O)OC(C)C 62a_100011215430_100000233755 [0,1,1,0,0,0|2,0,0]=4 3735 B11R0.2 COCSCCC(=O)OC(C)C 62a_100000760027_100000766300 [0,1,1,0,0,0|2,0,0]=4 3736 B11R0.2 COCSCCC(=O)OC(C)C 62a_100000766300_100000760027 [0,1,1,0,0,0|2,0,0]=4 3737 B11R0.2 CSCCNCC(=O)OC(C)C 2230a_100020590264_100011215430 [0,1,1,0,0,0|2,0,0]=4 3738 B11R0.2 CSCCOCC(=O)OC(C)C 34a_100000230434_100011215430 [0,1,1,0,0,0|2,0,0]=4 3739 B11R0.2 CSCCOCC(=O)OC(C)C 7a_100000230434_100011215430 [0,1,1,0,0,0|2,0,0]=4 3740 B11R0.2 CSCCSCC(=O)OC(C)C 62a_100000212216_100011215430 [0,1,1,0,0,0|2,0,0]=4 3741 B11R0.2 CSCCSCC(=O)OC(C)C 62a_100011215430_100000751147 [0,1,1,0,0,0|2,0,0]=4 3742 B11R0.2 CSCSCCC(=O)OC(C)C 62a_100000760027_100011218213 [0,1,1,0,0,0|2,0,0]=4 3743 B11R0.2 CSCSCCC(=O)OC(C)C 62a_100011218213_100000760027 [0,1,1,0,0,0|2,0,0]=4 3744 B11R0.2 C[C@@H](O)CC(=O)CCCCCF 1458a_100011933948_100000729378 [0,1,1,0,0,0|2,0,0]=4 3745 B11R0.2 C[C@@H](O)CC(=O)CCCCCO 1458a_100011933948_100000746330 [0,1,1,0,0,0|2,0,0]=4 3746 B11R0.4 C#CCCCCCC(=O)CCC 1458a_100000211992_100012094781 [0,1,1,0,0,0|1,0,1]=4 3747 B11R0.4 C#CCCCCCC(=O)CCC 1458a_100000694772_100000210303 [0,1,1,0,0,0|1,0,1]=4 3748 B11R0.4 C#CCCCCCC(=O)NCC 11a_100015525214_100000694772 [0,1,1,0,0,0|1,0,1]=4 3749 B11R0.4 C#CCCCCCC(=O)NCC 240690a_100015525214_100000694772 [0,1,1,0,0,0|1,0,1]=4 3750 B11R0.4 C#CCCCCCC(=O)NCC 527a_100015525214_100000694772 [0,1,1,0,0,0|1,0,1]=4 3751 B11R0.4 C#CCCCNCC(=O)OCC 34a_100000718082_100000188475 [0,1,1,0,0,0|0,0,2]=4 3752 B11R0.4 C#CCCCOCC(=O)OCC 34a_100000215630_100000188475 [0,1,1,0,0,0|0,0,2]=4 3753 B11R0.4 C#CCCCOCC(=O)OCC 7a_100000215630_100000188475 [0,1,1,0,0,0|0,0,2]=4 3754 B11R0.4 C#CCCCSCC(=O)OCC 62a_100000188475_100011215417 [0,1,1,0,0,0|0,0,2]=4 3755 B11R0.4 C#CCCCSCC(=O)OCC 62a_100011215417_100000188475 [0,1,1,0,0,0|0,0,2]=4 3756 B11R0.4 C#CCCNCCC(=O)OCC 34a_100000755551_100000765890 [0,1,1,0,0,0|0,0,2]=4 3757 B11R0.4 C#CCCOCCC(=O)OCC 34a_100011215631_100000765890 [0,1,1,0,0,0|0,0,2]=4 3758 B11R0.4 C#CCCSCCC(=O)OCC 62a_100000688953_100000765890 [0,1,1,0,0,0|0,0,2]=4 3759 B11R0.4 C#CCCSCCC(=O)OCC 62a_100000765890_100000688953 [0,1,1,0,0,0|0,0,2]=4 3760 B11R0.4 C#CCNCCCC(=O)OCC 34a_100000212058_100009991533 [0,1,1,0,0,0|0,0,2]=4 3761 B11R0.4 C#CCOCCCC(=O)OCC 34a_100000210247_100009991533 [0,1,1,0,0,0|0,0,2]=4 3762 B11R0.4 C#CCOCCCC(=O)OCC 7a_100012001163_100000038162 [0,1,1,0,0,0|0,0,2]=4 3763 B11R0.4 C#CCSCCCC(=O)OCC 62a_100000038162_100009991533 [0,1,1,0,0,0|0,0,2]=4 3764 B11R0.4 C/C=C/CCOCC(=O)OCC 34a_100016278192_100000188475 [0,1,1,0,0,0|0,0,2]=4 3765 B11R0.4 C/C=C/COCCC(=O)OCC 34a_100016270725_100000765890 [0,1,1,0,0,0|0,0,2]=4 3766 B11R0.4 C/C=C/CSCCC(=O)OCC 62a_100000765890_100102629194 [0,1,1,0,0,0|0,0,2]=4 3767 B11R0.4 C/C=C/CSCCC(=O)OCC 62a_100102629194_100000765890 [0,1,1,0,0,0|0,0,2]=4 3768 B11R0.4 C=CCCCCCC(=O)CCC 1458a_100000211992_100000700193 [0,1,1,0,0,0|1,0,1]=4 3769 B11R0.4 C=CCCCCCC(=O)CCC 1458a_100011934241_100000210303 [0,1,1,0,0,0|1,0,1]=4 3770 B11R0.4 C=CCCCCCC(=O)NCC 11a_100015525214_100011934241 [0,1,1,0,0,0|1,0,1]=4 3771 B11R0.4 C=CCCCCCC(=O)NCC 240690a_100015525214_100011934241 [0,1,1,0,0,0|1,0,1]=4 3772 B11R0.4 C=CCCCCCC(=O)NCC 527a_100015525214_100011934241 [0,1,1,0,0,0|1,0,1]=4 3773 B11R0.4 C=CCCCNCC(=O)OCC 2230a_100000700776_100000188475 [0,1,1,0,0,0|0,0,2]=4 3774 B11R0.4 C=CCCCNCC(=O)OCC 34a_100000700776_100000188475 [0,1,1,0,0,0|0,0,2]=4 3775 B11R0.4 C=CCCCOCC(=O)OCC 34a_100000758997_100000188475 [0,1,1,0,0,0|0,0,2]=4 3776 B11R0.4 C=CCCCOCC(=O)OCC 7a_100000758997_100000188475 [0,1,1,0,0,0|0,0,2]=4 3777 B11R0.4 C=CCCCSCC(=O)OCC 62a_100000188475_100000757094 [0,1,1,0,0,0|0,0,2]=4 3778 B11R0.4 C=CCCCSCC(=O)OCC 62a_100011713584_100000188475 [0,1,1,0,0,0|0,0,2]=4 3779 B11R0.4 C=CCCNCCC(=O)OCC 2230a_100015191253_100011206558 [0,1,1,0,0,0|0,0,2]=4 3780 B11R0.4 C=CCCOCCC(=O)OCC 34a_100011205117_100000765890 [0,1,1,0,0,0|0,0,2]=4 3781 B11R0.4 C=CCCSCCC(=O)OCC 62a_100000754431_100000765890 [0,1,1,0,0,0|0,0,2]=4 3782 B11R0.4 C=CCCSCCC(=O)OCC 62a_100000765890_100000754431 [0,1,1,0,0,0|0,0,2]=4 3783 B11R0.4 C=CCNCCCC(=O)OCC 2230a_100020586998_100009991533 [0,1,1,0,0,0|0,0,2]=4 3784 B11R0.4 C=CCOCCCC(=O)OCC 34a_200000210373_100009991533 [0,1,1,0,0,0|0,0,2]=4 3785 B11R0.4 C=CCOCCCC(=O)OCC 7a_100012001163_100015514636 [0,1,1,0,0,0|0,0,2]=4 3786 B11R0.4 C=CCSCCCC(=O)OCC 62a_100000210623_100009991533 [0,1,1,0,0,0|0,0,2]=4 3787 B11R0.4 C=CCSCCCC(=O)OCC 62a_100009991533_100000210623 [0,1,1,0,0,0|0,0,2]=4 3788 B11R0.4 C=COC(=O)CNCCCCC 2230a_100000209983_100000036128 [0,1,1,0,0,0|0,0,2]=4 3789 B11R0.4 C=COC(=O)COCCCCC 34a_100000210253_100000036128 [0,1,1,0,0,0|0,0,2]=4 3790 B11R0.4 C=COC(=O)CSCCCCC 62a_100000036128_100000210326 [0,1,1,0,0,0|0,0,2]=4 3791 B11R0.4 C=COC(=O)CSCCCCC 62a_100000210326_100000036128 [0,1,1,0,0,0|0,0,2]=4 3792 B11R0.4 CC#CC(=O)CCCCCCC 1458a_100000763181_100000210614 [0,1,1,0,0,0|1,0,1]=4 3793 B11R0.4 CC#CC(=O)CCCCCCF 1458a_100000763181_100015922095 [0,1,1,0,0,0|1,0,1]=4 3794 B11R0.4 CC#CC(=O)CCCCCCO 1458a_100000763181_100000766143 [0,1,1,0,0,0|1,0,1]=4 3795 B11R0.4 CC#CC(=O)CCOCCCC 1458a_100000763181_100000743108 [0,1,1,0,0,0|1,0,1]=4 3796 B11R0.4 CC#CCCOCC(=O)OCC 34a_100000750427_100000188475 [0,1,1,0,0,0|0,0,2]=4 3797 B11R0.4 CC#CCNCCC(=O)OCC 2230a_100000685387_100011206558 [0,1,1,0,0,0|0,0,2]=4 3798 B11R0.4 CC#CCNCCC(=O)OCC 34a_100000685387_100000765890 [0,1,1,0,0,0|0,0,2]=4 3799 B11R0.4 CC#CCOCCC(=O)OCC 34a_100000761923_100000765890 [0,1,1,0,0,0|0,0,2]=4 3800 B11R0.4 CC#CCSCCC(=O)OCC 62a_100000748600_100000765890 [0,1,1,0,0,0|0,0,2]=4 3801 B11R0.4 CC#CCSCCC(=O)OCC 62a_100000765890_100000748600 [0,1,1,0,0,0|0,0,2]=4 3802 B11R0.4 CC/C=C\COCC(=O)OCC 34a_100016268518_100000188475 [0,1,1,0,0,0|0,0,2]=4 3803 B11R0.4 CC/C=C\CSCC(=O)OCC 62a_100000188475_100103147603 [0,1,1,0,0,0|0,0,2]=4 3804 B11R0.4 CC/C=C\CSCC(=O)OCC 62a_100103147603_100000188475 [0,1,1,0,0,0|0,0,2]=4 3805 B11R0.4 CC=CC(=O)CCCCCCC 1458a_100000210699_100000210614 [0,1,1,0,0,0|1,0,1]=4 3806 B11R0.4 CC=CC(=O)CCCCCCF 1458a_100000210699_100015922095 [0,1,1,0,0,0|1,0,1]=4 3807 B11R0.4 CC=CC(=O)CCCCCCO 1458a_100000210699_100000766143 [0,1,1,0,0,0|1,0,1]=4 3808 B11R0.4 CC=CC(=O)CCOCCCC 1458a_100000210699_100000743108 [0,1,1,0,0,0|1,0,1]=4 3809 B11R0.4 CC=CC(=O)NCCCCCC 11a_100000210581_100000210699 [0,1,1,0,0,0|1,0,1]=4 3810 B11R0.4 CC=CC(=O)NCCCCCC 1626a_100000210581_100000210699 [0,1,1,0,0,0|1,0,1]=4 3811 B11R0.4 CC=CC(=O)NCCCCCC 240690a_100000210581_100000210699 [0,1,1,0,0,0|1,0,1]=4 3812 B11R0.4 CC=CCSCCC(=O)OCC 62a_100000070051_100000765890 [0,1,1,0,0,0|0,0,2]=4 3813 B11R0.4 CC=CCSCCC(=O)OCC 62a_100000765890_100000070051 [0,1,1,0,0,0|0,0,2]=4 3814 B11R0.4 CCC#CCOCC(=O)OCC 34a_100000032950_100000188475 [0,1,1,0,0,0|0,0,2]=4 3815 B11R0.4 CCC#CCSCC(=O)OCC 62a_100000188475_100009813939 [0,1,1,0,0,0|0,0,2]=4 3816 B11R0.4 CCC#CCSCC(=O)OCC 62a_100009813939_100000188475 [0,1,1,0,0,0|0,0,2]=4 3817 B11R0.4 CCCC(=O)CCCCCC#N 1458a_100000211992_100009813376 [0,1,1,0,0,0|1,0,1]=4 3818 B11R0.4 CCCC(=O)CCCCCCF 1458a_100000211992_100015922095 [0,1,1,0,0,0|1,0,0]=3 3819 B11R0.4 CCCC(=O)CCCCCCO 1458a_100000211992_100000766143 [0,1,1,0,0,0|1,0,0]=3 3820 B11R0.4 CCCC(=O)CCCCCCO 1458a_100011996774_100000210303 [0,1,1,0,0,0|1,0,0]=3 3821 B11R0.4 CCCC(=O)CCCCCOC 1458a_100011935119_100000210303 [0,1,1,0,0,0|1,0,0]=3 3822 B11R0.4 CCCC(=O)CCOCCOC 1458a_100000211992_100000695917 [0,1,1,0,0,0|2,0,0]=4 3823 B11R0.4 CCCC(=O)CCOCCOC 1458a_100000745395_100000210303 [0,1,1,0,0,0|2,0,0]=4 3824 B11R0.4 CCCC(=O)CNCCCCO 2230a_100000750430_100000747444 [0,1,1,0,0,0|2,0,0]=4 3825 B11R0.4 CCCC(=O)CNCCCSC 2230a_100000749238_100000747444 [0,1,1,0,0,0|2,0,0]=4 3826 B11R0.4 CCCC(=O)CNCCOCC 2230a_102516460346_100000747444 [0,1,1,0,0,0|2,0,0]=4 3827 B11R0.4 CCCC(=O)CNCCSCC 2230a_100000106463_100000747444 [0,1,1,0,0,0|2,0,0]=4 3828 B11R0.4 CCCC(=O)COCCCCCl 7a_100000210776_100000747444 [0,1,1,0,0,0|2,0,0]=4 3829 B11R0.4 CCCC(=O)COCCCCF 7a_100011995726_100000747444 [0,1,1,0,0,0|2,0,0]=4 3830 B11R0.4 CCCC(=O)COCCCSC 7a_100000690336_100000747444 [0,1,1,0,0,0|2,0,0]=4 3831 B11R0.4 CCCC(=O)COCCOCC 7a_100000210136_100000747444 [0,1,1,0,0,0|2,0,0]=4 3832 B11R0.4 CCCC(=O)COCCSCC 7a_100000212035_100000747444 [0,1,1,0,0,0|2,0,0]=4 3833 B11R0.4 CCCC(=O)CSCCCCF 62a_100000729493_100000747444 [0,1,1,0,0,0|2,0,0]=4 3834 B11R0.4 CCCC(=O)CSCCCCF 62a_100000747444_100000729493 [0,1,1,0,0,0|2,0,0]=4 3835 B11R0.4 CCCC(=O)CSCCCCO 62a_100000210776_100000747444 [0,1,1,0,0,0|2,0,0]=4 3836 B11R0.4 CCCC(=O)CSCCCCO 62a_100000747444_100000210776 [0,1,1,0,0,0|2,0,0]=4 3837 B11R0.4 CCCC(=O)CSCCCOC 62a_100000709357_100000747444 [0,1,1,0,0,0|2,0,0]=4 3838 B11R0.4 CCCC(=O)CSCCCOC 62a_100000747444_100000709357 [0,1,1,0,0,0|2,0,0]=4 3839 B11R0.4 CCCC(=O)CSCCOCC 62a_100000210147_100000747444 [0,1,1,0,0,0|2,0,0]=4 3840 B11R0.4 CCCC(=O)CSCCOCC 62a_100000747444_100011215890 [0,1,1,0,0,0|2,0,0]=4 3841 B11R0.4 CCCC(=O)CSCCSCC 62a_100000747444_100000757381 [0,1,1,0,0,0|2,0,0]=4 3842 B11R0.4 CCCC(=O)CSCCSCC 62a_100000757381_100000747444 [0,1,1,0,0,0|2,0,0]=4 3843 B11R0.4 CCCC(=O)NCCCCCO 240690a_100000762737_100000211992 [0,1,1,0,0,0|2,0,0]=4 3844 B11R0.4 CCCC(=O)NCCCOCC 11a_100000210961_100000211992 [0,1,1,0,0,0|2,0,0]=4 3845 B11R0.4 CCCC(=O)NCCCOCC 1626a_100000210961_100000211992 [0,1,1,0,0,0|2,0,0]=4 3846 B11R0.4 CCCC(=O)NCCCOCC 240690a_100000210961_100000211992 [0,1,1,0,0,0|2,0,0]=4 3847 B11R0.4 CCCC(=O)NCCCOCC 527a_100000210961_100000211992 [0,1,1,0,0,0|2,0,0]=4 3848 B11R0.4 CCCC/C=C/CC(=O)CCC 1458a_200016282684_100000210303 [0,1,1,0,0,0|1,0,1]=4 3849 B11R0.4 CCCC/C=C/CC(=O)NCC 11a_100015525214_200016282684 [0,1,1,0,0,0|1,0,1]=4 3850 B11R0.4 CCCC/C=C/CC(=O)NCC 240690a_100015525214_200016282684 [0,1,1,0,0,0|1,0,1]=4 3851 B11R0.4 CCCC/C=C/CC(=O)NCC 527a_100015525214_200016282684 [0,1,1,0,0,0|1,0,1]=4 3852 B11R0.4 CCCCCC#CC(=O)CCC 1458a_100011215388_100000210303 [0,1,1,0,0,0|1,0,1]=4 3853 B11R0.4 CCCCCC#CC(=O)NCC 240690a_100015525214_100011215388 [0,1,1,0,0,0|1,0,1]=4 3854 B11R0.4 CCCCCC=CC(=O)CCC 1458a_100016263427_100000210303 [0,1,1,0,0,0|1,0,1]=4 3855 B11R0.4 CCCCCC=CC(=O)NCC 11a_100015525214_100016263427 [0,1,1,0,0,0|1,0,1]=4 3856 B11R0.4 CCCCCC=CC(=O)NCC 240690a_100015525214_100016263427 [0,1,1,0,0,0|1,0,1]=4 3857 B11R0.4 CCCCCCCC(=O)CCC 1458a_100000211969_100000210303 [0,1,1,0,0,0|1,0,0]=3 3858 B11R0.4 CCCCCCCC(=O)CCC 1458a_100000211992_100000210614 [0,1,1,0,0,0|1,0,0]=3 3859 B11R0.4 CCCCCCCC(=O)CCF 1458a_100000211969_100011217306 [0,1,1,0,0,0|2,0,0]=4 3860 B11R0.4 CCCCCCCC(=O)CCO 1458a_100000211969_100000211926 [0,1,1,0,0,0|2,0,0]=4 3861 B11R0.4 CCCCCCCC(=O)CCO 1458a_100011216618_100000210614 [0,1,1,0,0,0|2,0,0]=4 3862 B11R0.4 CCCCCCCC(=O)COC 1458a_100000210968_100000210614 [0,1,1,0,0,0|2,0,0]=4 3863 B11R0.4 CCCCCCCC(=O)CSC 1458a_100000184570_100000210614 [0,1,1,0,0,0|2,0,0]=4 3864 B11R0.4 CCCCCCCC(=O)NCC 11a_100015525214_100000211969 [0,1,1,0,0,0|1,0,0]=3 3865 B11R0.4 CCCCCCCC(=O)NCC 240690a_100015525214_100000211969 [0,1,1,0,0,0|1,0,0]=3 3866 B11R0.4 CCCCCCCC(=O)NCC 527a_100015525214_100000211969 [0,1,1,0,0,0|1,0,0]=3 3867 B11R0.4 CCCCCCCC(=O)NNC 22a_100016993582_100000211969 [0,1,1,0,0,0|2,0,0]=4 3868 B11R0.4 CCCCCCCC(C)OCC 34a_100121572206_200011218727 [0,1,1,0,0,0|1,0,1]=4 3869 B11R0.4 CCCCCCCC(C)OCC 34a_200011215852_100000210202 [0,1,1,0,0,0|1,0,1]=4 3870 B11R0.4 CCCCCCCC(C)OCC 7a_200011215852_100000210202 [0,1,1,0,0,0|1,0,1]=4 3871 B11R0.4 CCCCCCNC(=O)CCC 11a_100000210581_100000211992 [0,1,1,0,0,0|1,0,0]=3 3872 B11R0.4 CCCCCCNC(=O)CCC 1626a_100000210581_100000211992 [0,1,1,0,0,0|1,0,0]=3 3873 B11R0.4 CCCCCCNC(=O)CCC 240690a_100000210581_100000211992 [0,1,1,0,0,0|1,0,0]=3 3874 B11R0.4 CCCCCCNC(=O)CCC 527a_100000210581_100000211992 [0,1,1,0,0,0|1,0,0]=3 3875 B11R0.4 CCCCCCNC(=O)CCO 240690a_100000210581_100011216618 [0,1,1,0,0,0|2,0,0]=4 3876 B11R0.4 CCCCCCNC(=O)CNC 2230a_106832991635_100000230325 [0,1,1,0,0,0|2,0,0]=4 3877 B11R0.4 CCCCCCNC(=O)CNC 34a_100102657272_100000230325 [0,1,1,0,0,0|2,0,0]=4 3878 B11R0.4 CCCCCCNC(=O)CNC 7a_106832991635_100000230325 [0,1,1,0,0,0|2,0,0]=4 3879 B11R0.4 CCCCCCNC(=O)COC 11a_100000210581_100000210968 [0,1,1,0,0,0|2,0,0]=4 3880 B11R0.4 CCCCCCNC(=O)COC 1626a_100000210581_100000210968 [0,1,1,0,0,0|2,0,0]=4 3881 B11R0.4 CCCCCCNC(=O)COC 240690a_100000210581_100000210968 [0,1,1,0,0,0|2,0,0]=4 3882 B11R0.4 CCCCCCNC(=O)COC 34a_100138415774_100000230325 [0,1,1,0,0,0|2,0,0]=4 3883 B11R0.4 CCCCCCNC(=O)COC 527a_100000210581_100000210968 [0,1,1,0,0,0|2,0,0]=4 3884 B11R0.4 CCCCCCNC(=O)CSC 11a_100000210581_100000184570 [0,1,1,0,0,0|2,0,0]=4 3885 B11R0.4 CCCCCCNC(=O)CSC 1626a_100000210581_100000184570 [0,1,1,0,0,0|2,0,0]=4 3886 B11R0.4 CCCCCCNC(=O)CSC 240690a_100000210581_100000184570 [0,1,1,0,0,0|2,0,0]=4 3887 B11R0.4 CCCCCCNC(=O)CSC 527a_100000210581_100000184570 [0,1,1,0,0,0|2,0,0]=4 3888 B11R0.4 CCCCCCNC(=O)CSC 62a_100000230325_200000210301 [0,1,1,0,0,0|2,0,0]=4 3889 B11R0.4 CCCCCCNC(=O)CS[13CH3] 62a_100000230325_200025704644 [0,1,1,0,0,0|2,0,0]=4 3890 B11R0.4 CCCCCCNC(=O)NCC 2708a_100000210581_100015525214 [0,1,1,0,0,0|1,0,0]=3 3891 B11R0.4 CCCCCCNC(=O)NCC 2708a_100015525214_100000210581 [0,1,1,0,0,0|1,0,0]=3 3892 B11R0.4 CCCCCCNC(=O)NCC 273464a_100000210581_100015525214 [0,1,1,0,0,0|1,0,0]=3 3893 B11R0.4 CCCCCCNC(=O)NCC 273464a_100015525214_100000210581 [0,1,1,0,0,0|1,0,0]=3 3894 B11R0.4 CCCCCCNC(=O)NCC 512a_100000210581_100015525214 [0,1,1,0,0,0|1,0,0]=3 3895 B11R0.4 CCCCCCNC(=O)NCC 512a_100015525214_100000210581 [0,1,1,0,0,0|1,0,0]=3 3896 B11R0.4 CCCCCCNC(=O)NNC 273464a_100000210581_100016993582 [0,1,1,0,0,0|2,0,0]=4 3897 B11R0.4 CCCCCCNC(=O)NNC 512a_100000210581_100016993582 [0,1,1,0,0,0|2,0,0]=4 3898 B11R0.4 CCCCCCNC(=O)NNC 512a_100016993582_100000210581 [0,1,1,0,0,0|2,0,0]=4 3899 B11R0.4 CCCCCNCC(=O)CCC 2230a_100000209983_100000747444 [0,1,1,0,0,0|1,0,0]=3 3900 B11R0.4 CCCCCNCC(=O)NCC 2230a_100000209983_100000183381 [0,1,1,0,0,0|1,0,0]=3 3901 B11R0.4 CCCCCNCC(=O)NCC 2230a_100016988866_100000210326 [0,1,1,0,0,0|1,0,0]=3 3902 B11R0.4 CCCCCNCC(=O)NCO 2230a_100000209983_100000185155 [0,1,1,0,0,0|2,0,0]=4 3903 B11R0.4 CCCCCNCC(=O)OCC 2230a_100000209983_100000188475 [0,1,1,0,0,0|0,0,0]=2 3904 B11R0.4 CCCCCNNC(=O)CCC 22a_100000694160_100000211992 [0,1,1,0,0,0|2,0,0]=4 3905 B11R0.4 CCCCCNNC(=O)NCC 273464a_100015525214_100000694160 [0,1,1,0,0,0|2,0,0]=4 3906 B11R0.4 CCCCCNNC(=O)NCC 512a_100000694160_100015525214 [0,1,1,0,0,0|2,0,0]=4 3907 B11R0.4 CCCCCNNC(=O)NCC 512a_100015525214_100000694160 [0,1,1,0,0,0|2,0,0]=4 3908 B11R0.4 CCCCCOCC(=O)CCC 7a_100000210253_100000747444 [0,1,1,0,0,0|1,0,0]=3 3909 B11R0.4 CCCCCOCC(=O)NCC 34a_100000210253_100000183381 [0,1,1,0,0,0|1,0,0]=3 3910 B11R0.4 CCCCCOCC(=O)NCC 7a_100000210253_100000183381 [0,1,1,0,0,0|1,0,0]=3 3911 B11R0.4 CCCCCOCC(=O)NCO 34a_100000210253_100000185155 [0,1,1,0,0,0|2,0,0]=4 3912 B11R0.4 CCCCCOCC(=O)NCO 7a_100000210253_100000185155 [0,1,1,0,0,0|2,0,0]=4 3913 B11R0.4 CCCCCOCC(=O)OCC 34a_100000210253_100000188475 [0,1,1,0,0,0|0,0,0]=2 3914 B11R0.4 CCCCCOCC(=O)OCC 7a_100000210253_100000188475 [0,1,1,0,0,0|0,0,0]=2 3915 B11R0.4 CCCCCSCC(=O)CCC 62a_100000210326_100000747444 [0,1,1,0,0,0|1,0,0]=3 3916 B11R0.4 CCCCCSCC(=O)CCC 62a_100000747444_100000210326 [0,1,1,0,0,0|1,0,0]=3 3917 B11R0.4 CCCCCSCC(=O)NCC 62a_100000183381_100000210326 [0,1,1,0,0,0|1,0,0]=3 3918 B11R0.4 CCCCCSCC(=O)NCC 62a_100000210326_100000183381 [0,1,1,0,0,0|1,0,0]=3 3919 B11R0.4 CCCCCSCC(=O)NCO 62a_100000185155_100000210326 [0,1,1,0,0,0|2,0,0]=4 3920 B11R0.4 CCCCCSCC(=O)NCO 62a_100000210326_100000185155 [0,1,1,0,0,0|2,0,0]=4 3921 B11R0.4 CCCCCSCC(=O)OCC 62a_100000188475_100000210326 [0,1,1,0,0,0|0,0,0]=2 3922 B11R0.4 CCCCCSCC(=O)OCC 62a_100000210326_100000188475 [0,1,1,0,0,0|0,0,0]=2 3923 B11R0.4 CCCCNCCC(=O)NCC 2230a_100000102301_100000737597 [0,1,1,0,0,0|1,0,0]=3 3924 B11R0.4 CCCCNCCC(=O)NCC 34a_100025743525_100000210210 [0,1,1,0,0,0|1,0,0]=3 3925 B11R0.4 CCCCNCCC(=O)NCC 7a_106832991798_100000737597 [0,1,1,0,0,0|1,0,0]=3 3926 B11R0.4 CCCCNCCC(=O)OCC 2230a_100000102301_100011206558 [0,1,1,0,0,0|0,0,0]=2 3927 B11R0.4 CCCCNCCC(=O)OCC 7a_106832991798_100011206558 [0,1,1,0,0,0|0,0,0]=2 3928 B11R0.4 CCCCNCOC(=O)CCC 2230a_100000102301_100000034017 [0,1,1,0,0,0|2,0,0]=4 3929 B11R0.4 CCCCNN=CC(=O)OCC 4a_100025702795_100000742314 [0,1,1,0,0,0|1,0,1]=4 3930 B11R0.4 CCCCOCCC(=O)CCC 1458a_100000211992_100000743108 [0,1,1,0,0,0|1,0,0]=3 3931 B11R0.4 CCCCOCCC(=O)CCO 1458a_100011216618_100000743108 [0,1,1,0,0,0|2,0,0]=4 3932 B11R0.4 CCCCOCCC(=O)COC 1458a_100000210968_100000743108 [0,1,1,0,0,0|2,0,0]=4 3933 B11R0.4 CCCCOCCC(=O)CSC 1458a_100000184570_100000743108 [0,1,1,0,0,0|2,0,0]=4 3934 B11R0.4 CCCCOCCC(=O)NCC 7a_100000210227_100000737597 [0,1,1,0,0,0|1,0,0]=3 3935 B11R0.4 CCCCOCCC(=O)OCC 34a_100000210227_100000765890 [0,1,1,0,0,0|0,0,0]=2 3936 B11R0.4 CCCCOCCC(=O)OCC 7a_100000210227_100011206558 [0,1,1,0,0,0|0,0,0]=2 3937 B11R0.4 CCCCOCOC(=O)CCC 34a_100000210227_100000034017 [0,1,1,0,0,0|2,0,0]=4 3938 B11R0.4 CCCCSCCC(=O)NCC 62a_100000210211_100000737597 [0,1,1,0,0,0|1,0,0]=3 3939 B11R0.4 CCCCSCCC(=O)NCC 62a_100000737597_100000210210 [0,1,1,0,0,0|1,0,0]=3 3940 B11R0.4 CCCCSCCC(=O)OCC 62a_100000210211_100000765890 [0,1,1,0,0,0|0,0,0]=2 3941 B11R0.4 CCCCSCCC(=O)OCC 62a_100000765890_100000210210 [0,1,1,0,0,0|0,0,0]=2 3942 B11R0.4 CCCCSCOC(=O)CCC 62a_100000210211_100000034017 [0,1,1,0,0,0|2,0,0]=4 3943 B11R0.4 CCCCSCOC(=O)OCC 62a_100000210211_100000075025 [0,1,1,0,0,0|1,0,0]=3 3944 B11R0.4 CCCOC/C=C/C(=O)OCC 34a_100000210258_100016267167 [0,1,1,0,0,0|0,0,2]=4 3945 B11R0.4 CCCOCCCC(=O)OCC 34a_100000210258_100009991533 [0,1,1,0,0,0|0,0,0]=2 3946 B11R0.4 CCCOCCCC(=O)OCC 7a_100012001163_100000210303 [0,1,1,0,0,0|0,0,0]=2 3947 B11R0.4 CCCOCCNC(=O)CCC 1626a_100161115042_100000211992 [0,1,1,0,0,0|2,0,0]=4 3948 B11R0.4 CCCOCCNC(=O)CCC 240690a_100161115042_100000211992 [0,1,1,0,0,0|2,0,0]=4 3949 B11R0.4 CCCOCCNC(=O)CCC 527a_100161115042_100000211992 [0,1,1,0,0,0|2,0,0]=4 3950 B11R0.4 CCCOCCNC(=O)NCC 2708a_100015525214_100161115042 [0,1,1,0,0,0|2,0,0]=4 3951 B11R0.4 CCCOCCNC(=O)NCC 2708a_100161115042_100015525214 [0,1,1,0,0,0|2,0,0]=4 3952 B11R0.4 CCCOCCNC(=O)NCC 273464a_100015525214_100161115042 [0,1,1,0,0,0|2,0,0]=4 3953 B11R0.4 CCCOCCNC(=O)NCC 273464a_100161115042_100015525214 [0,1,1,0,0,0|2,0,0]=4 3954 B11R0.4 CCCOCCNC(=O)NCC 512a_100015525214_100161115042 [0,1,1,0,0,0|2,0,0]=4 3955 B11R0.4 CCCOCCNC(=O)NCC 512a_100161115042_100015525214 [0,1,1,0,0,0|2,0,0]=4 3956 B11R0.4 CCCOCCNC(=O)OCC 34a_100000158857_100000210303 [0,1,1,0,0,0|1,0,0]=3 3957 B11R0.4 CCCSC/C=C/C(=O)OCC 62a_100000210303_100016267167 [0,1,1,0,0,0|0,0,2]=4 3958 B11R0.4 CCCSC/C=C/C(=O)OCC 62a_100016267167_100000210303 [0,1,1,0,0,0|0,0,2]=4 3959 B11R0.4 CCCSCCCC(=O)OCC 62a_100000210303_100009991533 [0,1,1,0,0,0|0,0,0]=2 3960 B11R0.4 CCCSCCCC(=O)OCC 62a_100009991533_100000210303 [0,1,1,0,0,0|0,0,0]=2 3961 B11R0.4 CCCSCCNC(=O)CCC 11a_100020603323_100000211992 [0,1,1,0,0,0|2,0,0]=4 3962 B11R0.4 CCCSCCNC(=O)CCC 240690a_100020603323_100000211992 [0,1,1,0,0,0|2,0,0]=4 3963 B11R0.4 CCCSCCNC(=O)CCC 527a_100020603323_100000211992 [0,1,1,0,0,0|2,0,0]=4 3964 B11R0.4 CCCSCCNC(=O)NCC 2708a_100015525214_100020603323 [0,1,1,0,0,0|2,0,0]=4 3965 B11R0.4 CCCSCCNC(=O)NCC 2708a_100020603323_100015525214 [0,1,1,0,0,0|2,0,0]=4 3966 B11R0.4 CCCSCCNC(=O)NCC 273464a_100015525214_100020603323 [0,1,1,0,0,0|2,0,0]=4 3967 B11R0.4 CCCSCCNC(=O)NCC 273464a_100020603323_100015525214 [0,1,1,0,0,0|2,0,0]=4 3968 B11R0.4 CCCSCCNC(=O)NCC 512a_100015525214_100020603323 [0,1,1,0,0,0|2,0,0]=4 3969 B11R0.4 CCCSCCNC(=O)NCC 512a_100020603323_100015525214 [0,1,1,0,0,0|2,0,0]=4 3970 B11R0.4 CCCSCCNC(=O)OCC 62a_100000210303_200011445536 [0,1,1,0,0,0|1,0,0]=3 3971 B11R0.4 CCNC(=O)CCCCCCO 240690a_100015525214_100011996774 [0,1,1,0,0,0|1,0,0]=3 3972 B11R0.4 CCNC(=O)CCCCCOC 11a_100015525214_100011935119 [0,1,1,0,0,0|1,0,0]=3 3973 B11R0.4 CCNC(=O)CCCCCOC 240690a_100015525214_100011935119 [0,1,1,0,0,0|1,0,0]=3 3974 B11R0.4 CCNC(=O)CCCCCOC 527a_100015525214_100011935119 [0,1,1,0,0,0|1,0,0]=3 3975 B11R0.4 CCNC(=O)CCNCCCF 2230a_100015189416_100000737597 [0,1,1,0,0,0|2,0,0]=4 3976 B11R0.4 CCNC(=O)CCNCCCF 34a_100025743525_100011934791 [0,1,1,0,0,0|2,0,0]=4 3977 B11R0.4 CCNC(=O)CCNCCCO 34a_100025743525_100000230001 [0,1,1,0,0,0|2,0,0]=4 3978 B11R0.4 CCNC(=O)CCNCCOC 2230a_100000209980_100000737597 [0,1,1,0,0,0|2,0,0]=4 3979 B11R0.4 CCNC(=O)CCNCCOC 34a_100025743525_100011201679 [0,1,1,0,0,0|2,0,0]=4 3980 B11R0.4 CCNC(=O)CCNCCSC 2230a_100020590264_100000737597 [0,1,1,0,0,0|2,0,0]=4 3981 B11R0.4 CCNC(=O)CCNCCSC 34a_100025743525_100000212216 [0,1,1,0,0,0|2,0,0]=4 3982 B11R0.4 CCNC(=O)CCOCCOC 11a_100015525214_100000745395 [0,1,1,0,0,0|2,0,0]=4 3983 B11R0.4 CCNC(=O)CCOCCOC 240690a_100015525214_100000745395 [0,1,1,0,0,0|2,0,0]=4 3984 B11R0.4 CCNC(=O)CCOCCOC 527a_100015525214_100000745395 [0,1,1,0,0,0|2,0,0]=4 3985 B11R0.4 CCNC(=O)CCOCCSC 7a_100000230434_100000737597 [0,1,1,0,0,0|2,0,0]=4 3986 B11R0.4 CCNC(=O)CCSCCCF 62a_100000737597_100011934791 [0,1,1,0,0,0|2,0,0]=4 3987 B11R0.4 CCNC(=O)CCSCCCF 62a_100011934791_100000737597 [0,1,1,0,0,0|2,0,0]=4 3988 B11R0.4 CCNC(=O)CCSCCCO 62a_100000737597_100011215043 [0,1,1,0,0,0|2,0,0]=4 3989 B11R0.4 CCNC(=O)CCSCCCO 62a_100011215043_100000737597 [0,1,1,0,0,0|2,0,0]=4 3990 B11R0.4 CCNC(=O)CCSCCOC 62a_100000233755_100000737597 [0,1,1,0,0,0|2,0,0]=4 3991 B11R0.4 CCNC(=O)CCSCCOC 62a_100000737597_100000233755 [0,1,1,0,0,0|2,0,0]=4 3992 B11R0.4 CCNC(=O)CCSCCSC 62a_100000212216_100000737597 [0,1,1,0,0,0|2,0,0]=4 3993 B11R0.4 CCNC(=O)CCSCCSC 62a_100000737597_100000751147 [0,1,1,0,0,0|2,0,0]=4 3994 B11R0.4 CCNC(=O)CCSCOCC 62a_100000737597_100000739092 [0,1,1,0,0,0|2,0,0]=4 3995 B11R0.4 CCNC(=O)CCSCOCC 62a_100000739092_100000737597 [0,1,1,0,0,0|2,0,0]=4 3996 B11R0.4 CCNC(=O)CNCCCCF 2230a_100016988866_100000729493 [0,1,1,0,0,0|2,0,0]=4 3997 B11R0.4 CCNC(=O)CNCCCCO 2230a_100000750430_100000183381 [0,1,1,0,0,0|2,0,0]=4 3998 B11R0.4 CCNC(=O)CNCCCCO 2230a_100016988866_100000210776 [0,1,1,0,0,0|2,0,0]=4 3999 B11R0.4 CCNC(=O)CNCCCCO 34a_100000750430_100000183381 [0,1,1,0,0,0|2,0,0]=4 4000 B11R0.4 CCNC(=O)CNCCCOC 2230a_100016988866_100000740836 [0,1,1,0,0,0|2,0,0]=4 4001 B11R0.4 CCNC(=O)CNCCCOC 34a_100150723488_100000183381 [0,1,1,0,0,0|2,0,0]=4 4002 B11R0.4 CCNC(=O)CNCCCSC 2230a_100000749238_100000183381 [0,1,1,0,0,0|2,0,0]=4 4003 B11R0.4 CCNC(=O)CNCCOCC 2230a_100016988866_100011215890 [0,1,1,0,0,0|2,0,0]=4 4004 B11R0.4 CCNC(=O)CNCCOCC 2230a_102516460346_100000183381 [0,1,1,0,0,0|2,0,0]=4 4005 B11R0.4 CCNC(=O)CNCCOCC 34a_102516460346_100000183381 [0,1,1,0,0,0|2,0,0]=4 4006 B11R0.4 CCNC(=O)CNCCSCC 2230a_100000106463_100000183381 [0,1,1,0,0,0|2,0,0]=4 4007 B11R0.4 CCNC(=O)CNCCSCC 2230a_100016988866_100000757381 [0,1,1,0,0,0|2,0,0]=4 4008 B11R0.4 CCNC(=O)COCCCCBr 34a_100011216708_100000183381 [0,1,1,0,0,0|2,0,0]=4 4009 B11R0.4 CCNC(=O)COCCCCCl 34a_100000210776_100000183381 [0,1,1,0,0,0|2,0,0]=4 4010 B11R0.4 CCNC(=O)COCCCCCl 7a_100000210776_100000183381 [0,1,1,0,0,0|2,0,0]=4 4011 B11R0.4 CCNC(=O)COCCCCF 34a_100011995726_100000183381 [0,1,1,0,0,0|2,0,0]=4 4012 B11R0.4 CCNC(=O)COCCCCF 7a_100011995726_100000183381 [0,1,1,0,0,0|2,0,0]=4 4013 B11R0.4 CCNC(=O)COCCCCI 34a_200012148704_100000183381 [0,1,1,0,0,0|2,0,0]=4 4014 B11R0.4 CCNC(=O)COCCCCN 34a_100000750430_100000183381 [0,1,1,0,0,0|2,0,0]=4 4015 B11R0.4 CCNC(=O)COCCCNC 34a_100000213112_100000183381 [0,1,1,0,0,0|2,0,0]=4 4016 B11R0.4 CCNC(=O)COCCCOC 34a_100000740835_100000183381 [0,1,1,0,0,0|2,0,0]=4 4017 B11R0.4 CCNC(=O)COCCCSC 34a_100000690336_100000183381 [0,1,1,0,0,0|2,0,0]=4 4018 B11R0.4 CCNC(=O)COCCCSC 7a_100000690336_100000183381 [0,1,1,0,0,0|2,0,0]=4 4019 B11R0.4 CCNC(=O)COCCOCC 34a_100000210136_100000183381 [0,1,1,0,0,0|2,0,0]=4 4020 B11R0.4 CCNC(=O)COCCOCC 7a_100000210136_100000183381 [0,1,1,0,0,0|2,0,0]=4 4021 B11R0.4 CCNC(=O)COCCSCC 34a_100000212035_100000183381 [0,1,1,0,0,0|2,0,0]=4 4022 B11R0.4 CCNC(=O)COCCSCC 7a_100000212035_100000183381 [0,1,1,0,0,0|2,0,0]=4 4023 B11R0.4 CCNC(=O)CSCCCCF 62a_100000183381_100000729493 [0,1,1,0,0,0|2,0,0]=4 4024 B11R0.4 CCNC(=O)CSCCCCF 62a_100000729493_100000183381 [0,1,1,0,0,0|2,0,0]=4 4025 B11R0.4 CCNC(=O)CSCCCCO 62a_100000183381_100000210776 [0,1,1,0,0,0|2,0,0]=4 4026 B11R0.4 CCNC(=O)CSCCCCO 62a_100000210776_100000183381 [0,1,1,0,0,0|2,0,0]=4 4027 B11R0.4 CCNC(=O)CSCCCOC 62a_100000183381_100000709357 [0,1,1,0,0,0|2,0,0]=4 4028 B11R0.4 CCNC(=O)CSCCCOC 62a_100000709357_100000183381 [0,1,1,0,0,0|2,0,0]=4 4029 B11R0.4 CCNC(=O)CSCCOCC 62a_100000183381_100011215890 [0,1,1,0,0,0|2,0,0]=4 4030 B11R0.4 CCNC(=O)CSCCOCC 62a_100000210147_100000183381 [0,1,1,0,0,0|2,0,0]=4 4031 B11R0.4 CCNC(=O)CSCCSCC 62a_100000183381_100000757381 [0,1,1,0,0,0|2,0,0]=4 4032 B11R0.4 CCNC(=O)CSCCSCC 62a_100000757381_100000183381 [0,1,1,0,0,0|2,0,0]=4 4033 B11R0.4 CCNC(=O)NCCCCCO 2708a_100015525214_100000762737 [0,1,1,0,0,0|2,0,0]=4 4034 B11R0.4 CCNC(=O)NCCCCCO 273464a_100000762737_100015525214 [0,1,1,0,0,0|2,0,0]=4 4035 B11R0.4 CCNC(=O)NCCCCCO 273464a_100015525214_100000762737 [0,1,1,0,0,0|2,0,0]=4 4036 B11R0.4 CCNC(=O)NCCCCCO 512a_100000762737_100015525214 [0,1,1,0,0,0|2,0,0]=4 4037 B11R0.4 CCNC(=O)NCCCCCO 512a_100015525214_100000762737 [0,1,1,0,0,0|2,0,0]=4 4038 B11R0.4 CCNC(=O)NCCCOCC 2708a_100000210961_100015525214 [0,1,1,0,0,0|2,0,0]=4 4039 B11R0.4 CCNC(=O)NCCCOCC 2708a_100015525214_100000210961 [0,1,1,0,0,0|2,0,0]=4 4040 B11R0.4 CCNC(=O)NCCCOCC 273464a_100000210961_100015525214 [0,1,1,0,0,0|2,0,0]=4 4041 B11R0.4 CCNC(=O)NCCCOCC 273464a_100015525214_100000210961 [0,1,1,0,0,0|2,0,0]=4 4042 B11R0.4 CCNC(=O)NCCCOCC 512a_100000210961_100015525214 [0,1,1,0,0,0|2,0,0]=4 4043 B11R0.4 CCNC(=O)NCCCOCC 512a_100015525214_100000210961 [0,1,1,0,0,0|2,0,0]=4 4044 B11R0.4 CCNCCCCC(=O)OCC 2230a_100015525214_100000750268 [0,1,1,0,0,0|0,0,0]=2 4045 B11R0.4 CCNCCOCC(=O)OCC 2230a_100015525214_100000088970 [0,1,1,0,0,0|1,0,0]=3 4046 B11R0.4 CCOC(=O)CCCCCNC 2230a_106832991635_100000755133 [0,1,1,0,0,0|0,0,0]=2 4047 B11R0.4 CCOC(=O)CCCCCNC 34a_100102657272_100000755133 [0,1,1,0,0,0|0,0,0]=2 4048 B11R0.4 CCOC(=O)CCCCCNC 7a_106832991635_100000755133 [0,1,1,0,0,0|0,0,0]=2 4049 B11R0.4 CCOC(=O)CCCCCOC 34a_100138415774_100000755133 [0,1,1,0,0,0|0,0,0]=2 4050 B11R0.4 CCOC(=O)CCCCCOC 7a_100011214988_200000210301 [0,1,1,0,0,0|0,0,0]=2 4051 B11R0.4 CCOC(=O)CCCCCO[13CH3] 7a_100011214988_200025704644 [0,1,1,0,0,0|0,0,0]=2 4052 B11R0.4 CCOC(=O)CCCCCSC 62a_100000755133_200000210301 [0,1,1,0,0,0|0,0,0]=2 4053 B11R0.4 CCOC(=O)CCCCCSC 62a_200000210301_100000755133 [0,1,1,0,0,0|0,0,0]=2 4054 B11R0.4 CCOC(=O)CCCCCS[13CH3] 62a_100000755133_200025704644 [0,1,1,0,0,0|0,0,0]=2 4055 B11R0.4 CCOC(=O)CCCCCS[13CH3] 62a_200025704644_100000755133 [0,1,1,0,0,0|0,0,0]=2 4056 B11R0.4 CCOC(=O)CCCCSCC 62a_100000210202_100000750268 [0,1,1,0,0,0|0,0,0]=2 4057 B11R0.4 CCOC(=O)CCCCSCC 62a_100000750268_100000210202 [0,1,1,0,0,0|0,0,0]=2 4058 B11R0.4 CCOC(=O)CCCCSCF 62a_100000750268_100015361967 [0,1,1,0,0,0|1,0,0]=3 4059 B11R0.4 CCOC(=O)CCCCSCF 62a_100015361967_100000750268 [0,1,1,0,0,0|1,0,0]=3 4060 B11R0.4 CCOC(=O)CCCNCCF 34a_100000724931_100009991533 [0,1,1,0,0,0|1,0,0]=3 4061 B11R0.4 CCOC(=O)CCCNCCO 2230a_100016997473_100009991533 [0,1,1,0,0,0|1,0,0]=3 4062 B11R0.4 CCOC(=O)CCCNCCO 34a_100016990907_100009991533 [0,1,1,0,0,0|1,0,0]=3 4063 B11R0.4 CCOC(=O)CCCOCC#N 7a_100012001163_100011215382 [0,1,1,0,0,0|1,0,1]=4 4064 B11R0.4 CCOC(=O)CCCOCC=O 7a_100012001163_200015260668 [0,1,1,0,0,0|1,0,1]=4 4065 B11R0.4 CCOC(=O)CCCOCCBr 34a_100000211926_100009991533 [0,1,1,0,0,0|1,0,0]=3 4066 B11R0.4 CCOC(=O)CCCOCCF 7a_100012001163_100011217306 [0,1,1,0,0,0|1,0,0]=3 4067 B11R0.4 CCOC(=O)CCCOCCN 34a_100000210304_100009991533 [0,1,1,0,0,0|1,0,0]=3 4068 B11R0.4 CCOC(=O)CCCOCCO 7a_100012001163_100000211926 [0,1,1,0,0,0|1,0,0]=3 4069 B11R0.4 CCOC(=O)CCCSCC#N 62a_100009991533_100011215382 [0,1,1,0,0,0|1,0,1]=4 4070 B11R0.4 CCOC(=O)CCCSCC#N 62a_100011215382_100009991533 [0,1,1,0,0,0|1,0,1]=4 4071 B11R0.4 CCOC(=O)CCCSCC=O 62a_100009991533_200015260668 [0,1,1,0,0,0|1,0,1]=4 4072 B11R0.4 CCOC(=O)CCCSCC=O 62a_200015260668_100009991533 [0,1,1,0,0,0|1,0,1]=4 4073 B11R0.4 CCOC(=O)CCCSCCF 62a_100009991533_100011217306 [0,1,1,0,0,0|1,0,0]=3 4074 B11R0.4 CCOC(=O)CCCSCCF 62a_100011217306_100009991533 [0,1,1,0,0,0|1,0,0]=3 4075 B11R0.4 CCOC(=O)CCCSCCO 62a_100000211926_100009991533 [0,1,1,0,0,0|1,0,0]=3 4076 B11R0.4 CCOC(=O)CCCSCCO 62a_100009991533_100000211926 [0,1,1,0,0,0|1,0,0]=3 4077 B11R0.4 CCOC(=O)CCCSCOC 62a_100000766300_100009991533 [0,1,1,0,0,0|1,0,0]=3 4078 B11R0.4 CCOC(=O)CCCSCOC 62a_100009991533_100000766300 [0,1,1,0,0,0|1,0,0]=3 4079 B11R0.4 CCOC(=O)CCCSCSC 62a_100009991533_100011218213 [0,1,1,0,0,0|1,0,0]=3 4080 B11R0.4 CCOC(=O)CCCSCSC 62a_100011218213_100009991533 [0,1,1,0,0,0|1,0,0]=3 4081 B11R0.4 CCOC(=O)CCNCCCF 2230a_100015189416_100011206558 [0,1,1,0,0,0|1,0,0]=3 4082 B11R0.4 CCOC(=O)CCNCCCF 34a_100015189416_100000765890 [0,1,1,0,0,0|1,0,0]=3 4083 B11R0.4 CCOC(=O)CCNCCOC 2230a_100000209980_100011206558 [0,1,1,0,0,0|1,0,0]=3 4084 B11R0.4 CCOC(=O)CCNCCSC 2230a_100020590264_100011206558 [0,1,1,0,0,0|1,0,0]=3 4085 B11R0.4 CCOC(=O)CCOCCCBr 34a_100011217188_100000765890 [0,1,1,0,0,0|1,0,0]=3 4086 B11R0.4 CCOC(=O)CCOCCCCl 34a_100000230001_100000765890 [0,1,1,0,0,0|1,0,0]=3 4087 B11R0.4 CCOC(=O)CCOCCCF 34a_100000759539_100000765890 [0,1,1,0,0,0|1,0,0]=3 4088 B11R0.4 CCOC(=O)CCOCCCN 34a_100000182051_100000765890 [0,1,1,0,0,0|1,0,0]=3 4089 B11R0.4 CCOC(=O)CCOCCOC 34a_100000210237_100000765890 [0,1,1,0,0,0|1,0,0]=3 4090 B11R0.4 CCOC(=O)CCOCCON 34a_100000700252_100000765890 [0,1,1,0,0,0|2,0,0]=4 4091 B11R0.4 CCOC(=O)CCOCCSC 34a_100000230434_100000765890 [0,1,1,0,0,0|1,0,0]=3 4092 B11R0.4 CCOC(=O)CCOCCSC 7a_100000230434_100011206558 [0,1,1,0,0,0|1,0,0]=3 4093 B11R0.4 CCOC(=O)CCSCCC#N 62a_100000765890_100011215226 [0,1,1,0,0,0|1,0,1]=4 4094 B11R0.4 CCOC(=O)CCSCCC#N 62a_100011215226_100000765890 [0,1,1,0,0,0|1,0,1]=4 4095 B11R0.4 CCOC(=O)CCSCCCF 62a_100000765890_100011934791 [0,1,1,0,0,0|1,0,0]=3 4096 B11R0.4 CCOC(=O)CCSCCCF 62a_100011934791_100000765890 [0,1,1,0,0,0|1,0,0]=3 4097 B11R0.4 CCOC(=O)CCSCCCO 62a_100000765890_100011215043 [0,1,1,0,0,0|1,0,0]=3 4098 B11R0.4 CCOC(=O)CCSCCCO 62a_100011215043_100000765890 [0,1,1,0,0,0|1,0,0]=3 4099 B11R0.4 CCOC(=O)CCSCCOC 62a_100000233755_100000765890 [0,1,1,0,0,0|1,0,0]=3 4100 B11R0.4 CCOC(=O)CCSCCOC 62a_100000765890_100000233755 [0,1,1,0,0,0|1,0,0]=3 4101 B11R0.4 CCOC(=O)CCSCCSC 62a_100000212216_100000765890 [0,1,1,0,0,0|1,0,0]=3 4102 B11R0.4 CCOC(=O)CCSCCSC 62a_100000765890_100000751147 [0,1,1,0,0,0|1,0,0]=3 4103 B11R0.4 CCOC(=O)CNCCCCO 2230a_100000750430_100000188475 [0,1,1,0,0,0|1,0,0]=3 4104 B11R0.4 CCOC(=O)CNCCCCO 34a_100000750430_100000188475 [0,1,1,0,0,0|1,0,0]=3 4105 B11R0.4 CCOC(=O)CNCCCOC 34a_100150723488_100000188475 [0,1,1,0,0,0|1,0,0]=3 4106 B11R0.4 CCOC(=O)CNCCCSC 2230a_100000749238_100000188475 [0,1,1,0,0,0|1,0,0]=3 4107 B11R0.4 CCOC(=O)CNCCSCC 2230a_100000106463_100000188475 [0,1,1,0,0,0|1,0,0]=3 4108 B11R0.4 CCOC(=O)COCCCCBr 34a_100011216708_100000188475 [0,1,1,0,0,0|1,0,0]=3 4109 B11R0.4 CCOC(=O)COCCCCCl 34a_100000210776_100000188475 [0,1,1,0,0,0|1,0,0]=3 4110 B11R0.4 CCOC(=O)COCCCCCl 7a_100000210776_100000188475 [0,1,1,0,0,0|1,0,0]=3 4111 B11R0.4 CCOC(=O)COCCCCF 34a_100011995726_100000188475 [0,1,1,0,0,0|1,0,0]=3 4112 B11R0.4 CCOC(=O)COCCCCF 7a_100011995726_100000188475 [0,1,1,0,0,0|1,0,0]=3 4113 B11R0.4 CCOC(=O)COCCCCI 34a_200012148704_100000188475 [0,1,1,0,0,0|1,0,0]=3 4114 B11R0.4 CCOC(=O)COCCCCN 34a_100000750430_100000188475 [0,1,1,0,0,0|1,0,0]=3 4115 B11R0.4 CCOC(=O)COCCCNC 2230a_106832991635_100009893628 [0,1,1,0,0,0|1,0,0]=3 4116 B11R0.4 CCOC(=O)COCCCNC 34a_100000213112_100000188475 [0,1,1,0,0,0|1,0,0]=3 4117 B11R0.4 CCOC(=O)COCCCNC 34a_100102657272_100009893628 [0,1,1,0,0,0|1,0,0]=3 4118 B11R0.4 CCOC(=O)COCCCNC 7a_106832991635_100009893628 [0,1,1,0,0,0|1,0,0]=3 4119 B11R0.4 CCOC(=O)COCCCOC 34a_100000740835_100000188475 [0,1,1,0,0,0|1,0,0]=3 4120 B11R0.4 CCOC(=O)COCCCOC 34a_100138415774_100009893628 [0,1,1,0,0,0|1,0,0]=3 4121 B11R0.4 CCOC(=O)COCCCSC 34a_100000690336_100000188475 [0,1,1,0,0,0|1,0,0]=3 4122 B11R0.4 CCOC(=O)COCCCSC 62a_100009893628_200000210301 [0,1,1,0,0,0|1,0,0]=3 4123 B11R0.4 CCOC(=O)COCCCSC 62a_200000210301_100009893628 [0,1,1,0,0,0|1,0,0]=3 4124 B11R0.4 CCOC(=O)COCCCSC 7a_100000690336_100000188475 [0,1,1,0,0,0|1,0,0]=3 4125 B11R0.4 CCOC(=O)COCCCS[13CH3] 62a_100009893628_200025704644 [0,1,1,0,0,0|1,0,0]=3 4126 B11R0.4 CCOC(=O)COCCCS[13CH3] 62a_200025704644_100009893628 [0,1,1,0,0,0|1,0,0]=3 4127 B11R0.4 CCOC(=O)COCCSCC 34a_100000212035_100000188475 [0,1,1,0,0,0|1,0,0]=3 4128 B11R0.4 CCOC(=O)COCCSCC 62a_100000088970_100000210202 [0,1,1,0,0,0|1,0,0]=3 4129 B11R0.4 CCOC(=O)COCCSCC 62a_100000210202_100000088970 [0,1,1,0,0,0|1,0,0]=3 4130 B11R0.4 CCOC(=O)COCCSCC 7a_100000212035_100000188475 [0,1,1,0,0,0|1,0,0]=3 4131 B11R0.4 CCOC(=O)COCCSCF 62a_100000088970_100015361967 [0,1,1,0,0,0|2,0,0]=4 4132 B11R0.4 CCOC(=O)COCCSCF 62a_100015361967_100000088970 [0,1,1,0,0,0|2,0,0]=4 4133 B11R0.4 CCOC(=O)CSCCCC#N 62a_100000188475_100000687738 [0,1,1,0,0,0|1,0,1]=4 4134 B11R0.4 CCOC(=O)CSCCCC#N 62a_100000687738_100000188475 [0,1,1,0,0,0|1,0,1]=4 4135 B11R0.4 CCOC(=O)CSCCCC=O 62a_100000188475_200011292268 [0,1,1,0,0,0|1,0,1]=4 4136 B11R0.4 CCOC(=O)CSCCCC=O 62a_200011292268_100000188475 [0,1,1,0,0,0|1,0,1]=4 4137 B11R0.4 CCOC(=O)CSCCCCF 62a_100000188475_100000729493 [0,1,1,0,0,0|1,0,0]=3 4138 B11R0.4 CCOC(=O)CSCCCCF 62a_100000729493_100000188475 [0,1,1,0,0,0|1,0,0]=3 4139 B11R0.4 CCOC(=O)CSCCCCO 62a_100000188475_100000210776 [0,1,1,0,0,0|1,0,0]=3 4140 B11R0.4 CCOC(=O)CSCCCCO 62a_100000210776_100000188475 [0,1,1,0,0,0|1,0,0]=3 4141 B11R0.4 CCOC(=O)CSCCCOC 62a_100000188475_100000709357 [0,1,1,0,0,0|1,0,0]=3 4142 B11R0.4 CCOC(=O)CSCCCOC 62a_100000709357_100000188475 [0,1,1,0,0,0|1,0,0]=3 4143 B11R0.4 CCOC(=O)CSCCOCF 7a_200000230590_100015361967 [0,1,1,0,0,0|2,0,0]=4 4144 B11R0.4 CCOC(=O)CSCCSCC 62a_100000188475_100000757381 [0,1,1,0,0,0|1,0,0]=3 4145 B11R0.4 CCOC(=O)CSCCSCC 62a_100000757381_100000188475 [0,1,1,0,0,0|1,0,0]=3 4146 B11R0.4 CCOC(=O)NCCOCCF 34a_100000158857_100011217306 [0,1,1,0,0,0|2,0,0]=4 4147 B11R0.4 CCOC(=O)NCCOCCO 34a_100000158857_100000211926 [0,1,1,0,0,0|2,0,0]=4 4148 B11R0.4 CCOC(=O)NCCOCSC 34a_100000158857_100011218213 [0,1,1,0,0,0|2,0,0]=4 4149 B11R0.4 CCOC(=O)NCCSCCF 62a_100011217306_200011445536 [0,1,1,0,0,0|2,0,0]=4 4150 B11R0.4 CCOC(=O)NCCSCCO 62a_100000211926_200011445536 [0,1,1,0,0,0|2,0,0]=4 4151 B11R0.4 CCOC(=O)NCCSCOC 62a_100000766300_200011445536 [0,1,1,0,0,0|2,0,0]=4 4152 B11R0.4 CCOC(=O)NCCSCSC 62a_100011218213_200011445536 [0,1,1,0,0,0|2,0,0]=4 4153 B11R0.4 CCOC(=O)OCSCCCF 62a_100011934791_100000075025 [0,1,1,0,0,0|2,0,0]=4 4154 B11R0.4 CCOC(=O)OCSCCCO 62a_100011215043_100000075025 [0,1,1,0,0,0|2,0,0]=4 4155 B11R0.4 CCOC(=O)OCSCCOC 62a_100000233755_100000075025 [0,1,1,0,0,0|2,0,0]=4 4156 B11R0.4 CCOC(=O)OCSCCSC 62a_100000212216_100000075025 [0,1,1,0,0,0|2,0,0]=4 4157 B11R0.4 CCOCCCCC(=O)OCC 34a_100121572206_100000750268 [0,1,1,0,0,0|0,0,0]=2 4158 B11R0.4 CCOCCNCC(=O)OCC 2230a_102516460346_100000188475 [0,1,1,0,0,0|1,0,0]=3 4159 B11R0.4 CCOCCNCC(=O)OCC 34a_102516460346_100000188475 [0,1,1,0,0,0|1,0,0]=3 4160 B11R0.4 CCOCCOCC(=O)OCC 34a_100000210136_100000188475 [0,1,1,0,0,0|1,0,0]=3 4161 B11R0.4 CCOCCOCC(=O)OCC 34a_100121572206_100000088970 [0,1,1,0,0,0|1,0,0]=3 4162 B11R0.4 CCOCCOCC(=O)OCC 7a_100000210136_100000188475 [0,1,1,0,0,0|1,0,0]=3 4163 B11R0.4 CCOCCSCC(=O)OCC 62a_100000188475_100011215890 [0,1,1,0,0,0|1,0,0]=3 4164 B11R0.4 CCOCCSCC(=O)OCC 62a_100000210147_100000188475 [0,1,1,0,0,0|1,0,0]=3 4165 B11R0.4 CCOCCSCC(=O)OCC 7a_200000230590_100000210202 [0,1,1,0,0,0|1,0,0]=3 4166 B11R0.4 CCOCSCCC(=O)OCC 62a_100000739092_100000765890 [0,1,1,0,0,0|1,0,0]=3 4167 B11R0.4 CCOCSCCC(=O)OCC 62a_100000765890_100000739092 [0,1,1,0,0,0|1,0,0]=3 4168 B11R0.4 CCOCSCOC(=O)OCC 62a_100000739092_100000075025 [0,1,1,0,0,0|2,0,0]=4 4169 B11R0.4 CNNC(=O)CCCCCOC 22a_100016993582_100011935119 [0,1,1,0,0,0|2,0,0]=4 4170 B11R0.4 COCC(=O)CCCCCCF 1458a_100000210968_100015922095 [0,1,1,0,0,0|2,0,0]=4 4171 B11R0.4 COCC(=O)CCCCCCO 1458a_100000210968_100000766143 [0,1,1,0,0,0|2,0,0]=4 4172 B11R0.4 COCCCCCC(=O)CCF 1458a_100011935119_100011217306 [0,1,1,0,0,0|2,0,0]=4 4173 B11R0.4 COCCCCCC(=O)CCO 1458a_100011935119_100000211926 [0,1,1,0,0,0|2,0,0]=4 4174 B11R0.4 CSCC(=O)CCCCCCF 1458a_100000184570_100015922095 [0,1,1,0,0,0|2,0,0]=4 4175 B11R0.4 CSCC(=O)CCCCCCO 1458a_100000184570_100000766143 [0,1,1,0,0,0|2,0,0]=4 4176 B11R0.4 O=C(CCF)CCCCCCO 1458a_100011996774_100011217306 [0,1,1,0,0,0|2,0,0]=4 4177 B11R0.4 O=C(CCO)CCCCCCF 1458a_100011216618_100015922095 [0,1,1,0,0,0|2,0,0]=4 4178 B11R0.4 O=C(CCO)CCCCCCO 1458a_100011216618_100000766143 [0,1,1,0,0,0|2,0,0]=4 4179 B11R0.4 O=C(CCO)CCCCCCO 1458a_100011996774_100000211926 [0,1,1,0,0,0|2,0,0]=4 4180 B11R0.5 CCCCC(=O)CC(=O)CCC 1458a_100000210183_100000747444 [0,1,1,0,0,0|1,0,1]=4 4181 B11R0.5 CCCCC(=O)CC(=O)NCC 1458a_100000210183_100000183381 [0,1,1,0,0,0|1,0,1]=4 4182 B11R0.5 CCCCC(=O)CC(=O)OCC 1458a_100000210183_100000188475 [0,1,1,0,0,0|0,0,1]=3 4183 B11R0.5 CCCCC(=O)CC(=O)OCC 1458a_100000243816_100000210211 [0,1,1,0,0,0|0,0,1]=3 4184 B11R0.5 CCCCC(C)NC(=O)CCC 11a_100000126638_100000211992 [0,1,1,0,0,0|2,0,0]=4 4185 B11R0.5 CCCCC(C)NC(=O)CCC 1626a_100000126638_100000211992 [0,1,1,0,0,0|2,0,0]=4 4186 B11R0.5 CCCCC(C)NC(=O)CCC 240690a_100000126638_100000211992 [0,1,1,0,0,0|2,0,0]=4 4187 B11R0.5 CCCCC(C)NC(=O)CCC 527a_100000126638_100000211992 [0,1,1,0,0,0|2,0,0]=4 4188 B11R0.5 CCCCC(C)NC(=O)NCC 2708a_100000126638_100015525214 [0,1,1,0,0,0|2,0,0]=4 4189 B11R0.5 CCCCC(C)NC(=O)NCC 2708a_100015525214_100000126638 [0,1,1,0,0,0|2,0,0]=4 4190 B11R0.5 CCCCC(C)NC(=O)NCC 273464a_100000126638_100015525214 [0,1,1,0,0,0|2,0,0]=4 4191 B11R0.5 CCCCC(C)NC(=O)NCC 273464a_100015525214_100000126638 [0,1,1,0,0,0|2,0,0]=4 4192 B11R0.5 CCCCC(C)NC(=O)NCC 512a_100000126638_100015525214 [0,1,1,0,0,0|2,0,0]=4 4193 B11R0.5 CCCCC(C)NC(=O)NCC 512a_100015525214_100000126638 [0,1,1,0,0,0|2,0,0]=4 4194 B11R0.5 CCCCN(C)CC(=O)CCC 2230a_100000207549_100000747444 [0,1,1,0,0,0|2,0,0]=4 4195 B11R0.5 CCCCN(C)CC(=O)CCC 269982a_100000207549_100000747444 [0,1,1,0,0,0|2,0,0]=4 4196 B11R0.5 CCCCN(C)CC(=O)NCC 2230a_100000207549_100000183381 [0,1,1,0,0,0|2,0,0]=4 4197 B11R0.5 CCCCN(C)CC(=O)NCC 2230a_100000741943_100000210211 [0,1,1,0,0,0|2,0,0]=4 4198 B11R0.5 CCCCN(C)CC(=O)NCC 269982a_100000207549_100000183381 [0,1,1,0,0,0|2,0,0]=4 4199 B11R0.5 CCCCN(C)CC(=O)NCC 269982a_100000741943_100000210211 [0,1,1,0,0,0|2,0,0]=4 4200 B11R0.5 CCCCN(C)CC(=O)OCC 2230a_100000207549_100000188475 [0,1,1,0,0,0|1,0,0]=3 4201 B11R0.5 CCCCN(C)CC(=O)OCC 2230a_100000220588_100000210211 [0,1,1,0,0,0|1,0,0]=3 4202 B11R0.5 CCCCN(C)CC(=O)OCC 269982a_100000207549_100000188475 [0,1,1,0,0,0|1,0,0]=3 4203 B11R0.5 CCCNC(=O)CC(=O)OCC 240690a_100020643023_100000243816 [0,1,1,0,0,0|1,0,1]=4 4204 B11R0.5 CCCO[C@H](C)CC(=O)OCC 7a_100009816390_100000210303 [0,1,1,0,0,0|1,0,0]=3 4205 B11R0.5 CCCSC(C)CC(=O)OCC 62a_100000210303_100009817359 [0,1,1,0,0,0|1,0,0]=3 4206 B11R0.5 CCCSC(C)CC(=O)OCC 62a_100009817359_100000210303 [0,1,1,0,0,0|1,0,0]=3 4207 B11R0.5 CCCSC(C)OC(=O)OCC 62a_100000036008_100000210303 [0,1,1,0,0,0|2,0,0]=4 4208 B11R0.5 CCCSC(C)OC(=O)OCC 62a_100000210303_100000036008 [0,1,1,0,0,0|2,0,0]=4 4209 B11R0.5 CCOC(=O)CC(=O)CCCF 1458a_100000243816_100011934791 [0,1,1,0,0,0|1,0,1]=4 4210 B11R0.5 CCOC(=O)CC(=O)CCCO 1458a_100000243816_100011215043 [0,1,1,0,0,0|1,0,1]=4 4211 B11R0.5 CCOC(=O)CC(=O)CCOC 1458a_100000243816_100000233755 [0,1,1,0,0,0|1,0,1]=4 4212 B11R0.5 CCOC(=O)CC(=O)CCOC 1458a_100000749529_100000188475 [0,1,1,0,0,0|1,0,1]=4 4213 B11R0.5 CCOC(=O)CC(=O)CCSC 1458a_100000174002_100000188475 [0,1,1,0,0,0|1,0,1]=4 4214 B11R0.5 CCOC(=O)CC(=O)CCSC 1458a_100000243816_100000751147 [0,1,1,0,0,0|1,0,1]=4 4215 B11R0.5 CCOC(=O)CC(=O)CSCC 1458a_100000230394_100000188475 [0,1,1,0,0,0|1,0,1]=4 4216 B11R0.5 CCOC(=O)CC(=O)CSCC 62a_100000210202_100000210311 [0,1,1,0,0,0|1,0,1]=4 4217 B11R0.5 CCOC(=O)CC(=O)CSCC 62a_100000210311_100000210202 [0,1,1,0,0,0|1,0,1]=4 4218 B11R0.5 CCOC(=O)CC(C)NCCO 2230a_100016997473_100009817359 [0,1,1,0,0,0|2,0,0]=4 4219 B11R0.5 CCOC(=O)CC(C)SCCF 62a_100009817359_100011217306 [0,1,1,0,0,0|2,0,0]=4 4220 B11R0.5 CCOC(=O)CC(C)SCCF 62a_100011217306_100009817359 [0,1,1,0,0,0|2,0,0]=4 4221 B11R0.5 CCOC(=O)CC(C)SCCO 62a_100000211926_100009817359 [0,1,1,0,0,0|2,0,0]=4 4222 B11R0.5 CCOC(=O)CC(C)SCCO 62a_100009817359_100000211926 [0,1,1,0,0,0|2,0,0]=4 4223 B11R0.5 CCOC(=O)CC(C)SCOC 62a_100000766300_100009817359 [0,1,1,0,0,0|2,0,0]=4 4224 B11R0.5 CCOC(=O)CC(C)SCOC 62a_100009817359_100000766300 [0,1,1,0,0,0|2,0,0]=4 4225 B11R0.5 CCOC(=O)CC(C)SCSC 62a_100009817359_100011218213 [0,1,1,0,0,0|2,0,0]=4 4226 B11R0.5 CCOC(=O)CC(C)SCSC 62a_100011218213_100009817359 [0,1,1,0,0,0|2,0,0]=4 4227 B11R0.5 CCOC(=O)CN(C)CCCF 2230a_100000220588_100011934791 [0,1,1,0,0,0|2,0,0]=4 4228 B11R0.5 CCOC(=O)CN(C)CCCO 2230a_100000213112_100000188475 [0,1,1,0,0,0|2,0,0]=4 4229 B11R0.5 CCOC(=O)CN(C)CCCO 2230a_100000220588_100000230001 [0,1,1,0,0,0|2,0,0]=4 4230 B11R0.5 CCOC(=O)CN(C)CCCO 269982a_100000213112_100000188475 [0,1,1,0,0,0|2,0,0]=4 4231 B11R0.5 CCOC(=O)CN(C)CCOC 2230a_100000220588_100011201679 [0,1,1,0,0,0|2,0,0]=4 4232 B11R0.5 CCOC(=O)CN(C)CCOC 2230a_100000743101_100000188475 [0,1,1,0,0,0|2,0,0]=4 4233 B11R0.5 CCOC(=O)CN(C)CCOC 269982a_100000743101_100000188475 [0,1,1,0,0,0|2,0,0]=4 4234 B11R0.5 CCOC(=O)CN(C)CCSC 2230a_100000220588_100000751147 [0,1,1,0,0,0|2,0,0]=4 4235 B11R0.5 CCOC(=O)CN(C)CCSC 2230a_100000686725_100000188475 [0,1,1,0,0,0|2,0,0]=4 4236 B11R0.5 CCOC(=O)CN(C)CCSC 269982a_100000686725_100000188475 [0,1,1,0,0,0|2,0,0]=4 4237 B11R0.5 CCOC(=O)C[C@@H](C)OCCF 7a_100009816390_100011217306 [0,1,1,0,0,0|2,0,0]=4 4238 B11R0.5 CCOC(=O)C[C@@H](C)OCCO 7a_100009816390_100000211926 [0,1,1,0,0,0|2,0,0]=4 4239 B11R0.5 CCOC(=O)C[C@H](O)CSCC 62a_100000210202_100000688340 [0,1,1,0,0,0|1,0,0]=3 4240 B11R0.5 CCOC(=O)C[C@H](O)CSCC 62a_100000688340_100000210202 [0,1,1,0,0,0|1,0,0]=3 4241 B11R0.5 CCOC(=O)C[C@H](O)CSCF 62a_100000688340_100015361967 [0,1,1,0,0,0|2,0,0]=4 4242 B11R0.5 CCOC(=O)C[C@H](O)CSCF 62a_100015361967_100000688340 [0,1,1,0,0,0|2,0,0]=4 4243 B11R0.5 CCOCC(=O)CC(=O)OCC 1458a_100000211967_100000188475 [0,1,1,0,0,0|1,0,1]=4 4244 B11R0.5 CCOC[C@@H](O)CC(=O)OCC 34a_100121572206_100000688340 [0,1,1,0,0,0|1,0,0]=3 4245 B11R0.62 CCCC(=O)CCC(=O)NCC 1458a_100000199579_100000210303 [0,1,1,0,0,0|1,0,1]=4 4246 B11R0.62 CCCC(=O)CCC(=O)OCC 1458a_100000183558_100000210303 [0,1,1,0,0,0|0,0,1]=3 4247 B11R0.62 CCCC(=O)CNC(=O)OCC 1458a_100000190774_100000210303 [0,1,1,0,0,0|1,0,1]=4 4248 B11R0.62 CCCC(=O)CNC(C)CCC 2230a_100000741246_100000747444 [0,1,1,0,0,0|2,0,0]=4 4249 B11R0.62 CCCC(=O)COC(C)CCC 7a_100000764384_100000747444 [0,1,1,0,0,0|2,0,0]=4 4250 B11R0.62 CCCC(=O)CSC(C)CCC 62a_100000747444_100000766640 [0,1,1,0,0,0|2,0,0]=4 4251 B11R0.62 CCCC(=O)CSC(C)CCC 62a_100000766640_100000747444 [0,1,1,0,0,0|2,0,0]=4 4252 B11R0.62 CCCC(=O)NCC(=O)OCC 188690a_100000741813_100000211992 [0,1,1,0,0,0|1,0,1]=4 4253 B11R0.62 CCCC(C)NCC(=O)NCC 2230a_100000741246_100000183381 [0,1,1,0,0,0|2,0,0]=4 4254 B11R0.62 CCCC(C)NCC(=O)NCC 2230a_100016988866_100000766640 [0,1,1,0,0,0|2,0,0]=4 4255 B11R0.62 CCCC(C)NCC(=O)NCC 270004a_100016988866_100000211909 [0,1,1,0,0,0|2,0,0]=4 4256 B11R0.62 CCCC(C)NCC(=O)OCC 2230a_100000741246_100000188475 [0,1,1,0,0,0|1,0,0]=3 4257 B11R0.62 CCCC(C)OCC(=O)NCC 34a_100000764384_100000183381 [0,1,1,0,0,0|2,0,0]=4 4258 B11R0.62 CCCC(C)OCC(=O)NCC 7a_100000764384_100000183381 [0,1,1,0,0,0|2,0,0]=4 4259 B11R0.62 CCCC(C)OCC(=O)OCC 34a_100000764384_100000188475 [0,1,1,0,0,0|1,0,0]=3 4260 B11R0.62 CCCC(C)OCC(=O)OCC 7a_100000764384_100000188475 [0,1,1,0,0,0|1,0,0]=3 4261 B11R0.62 CCCC(C)SCC(=O)NCC 62a_100000183381_100000766640 [0,1,1,0,0,0|2,0,0]=4 4262 B11R0.62 CCCC(C)SCC(=O)NCC 62a_100000766640_100000183381 [0,1,1,0,0,0|2,0,0]=4 4263 B11R0.62 CCCC(C)SCC(=O)OCC 62a_100000188475_100000766640 [0,1,1,0,0,0|1,0,0]=3 4264 B11R0.62 CCCC(C)SCC(=O)OCC 62a_100000766640_100000188475 [0,1,1,0,0,0|1,0,0]=3 4265 B11R0.62 CCCN(C)CCC(=O)NCC 2230a_100000747261_100000737597 [0,1,1,0,0,0|2,0,0]=4 4266 B11R0.62 CCCN(C)CCC(=O)NCC 269982a_100000747261_100000737597 [0,1,1,0,0,0|2,0,0]=4 4267 B11R0.62 CCCN(C)CCC(=O)OCC 2230a_100000745921_100000210303 [0,1,1,0,0,0|1,0,0]=3 4268 B11R0.62 CCCN(C)CCC(=O)OCC 2230a_100000747261_100011206558 [0,1,1,0,0,0|1,0,0]=3 4269 B11R0.62 CCCN(C)CCC(=O)OCC 269982a_100000745921_100000210303 [0,1,1,0,0,0|1,0,0]=3 4270 B11R0.62 CCCN(C)CCC(=O)OCC 269982a_100000747261_100011206558 [0,1,1,0,0,0|1,0,0]=3 4271 B11R0.62 CCNC(=O)CCC(=O)OCC 11a_100015525214_100000183558 [0,1,1,0,0,0|1,0,1]=4 4272 B11R0.62 CCNC(=O)CCC(=O)OCC 240690a_100015525214_100000183558 [0,1,1,0,0,0|1,0,1]=4 4273 B11R0.62 CCNC(C)CCC(=O)OCC 2230a_100015525214_100000748298 [0,1,1,0,0,0|1,0,0]=3 4274 B11R0.62 CCOC(=O)CCC(=O)CCF 1458a_100000183558_100011217306 [0,1,1,0,0,0|1,0,1]=4 4275 B11R0.62 CCOC(=O)CCC(=O)CCO 1458a_100000183558_100000211926 [0,1,1,0,0,0|1,0,1]=4 4276 B11R0.62 CCOC(=O)CCC(C)OCC 34a_100121572206_100000748298 [0,1,1,0,0,0|1,0,0]=3 4277 B11R0.62 CCOC(=O)CCC(C)SCC 62a_100000210202_100000748298 [0,1,1,0,0,0|1,0,0]=3 4278 B11R0.62 CCOC(=O)CCC(C)SCC 62a_100000748298_100000210202 [0,1,1,0,0,0|1,0,0]=3 4279 B11R0.62 CCOC(=O)CCC(C)SCF 62a_100000748298_100015361967 [0,1,1,0,0,0|2,0,0]=4 4280 B11R0.62 CCOC(=O)CCC(C)SCF 62a_100015361967_100000748298 [0,1,1,0,0,0|2,0,0]=4 4281 B11R0.62 CCOC(=O)CCN(C)CCF 2230a_100000745921_100011217306 [0,1,1,0,0,0|2,0,0]=4 4282 B11R0.62 CCOC(=O)CCN(C)CCF 269982a_100000745921_100011217306 [0,1,1,0,0,0|2,0,0]=4 4283 B11R0.62 CCOC(=O)CCN(C)CCO 2230a_100000210263_100011206558 [0,1,1,0,0,0|2,0,0]=4 4284 B11R0.62 CCOC(=O)CCN(C)CCO 2230a_100000745921_100000211926 [0,1,1,0,0,0|2,0,0]=4 4285 B11R0.62 CCOC(=O)CCN(C)CCO 269982a_100000210263_100011206558 [0,1,1,0,0,0|2,0,0]=4 4286 B11R0.62 CCOC(=O)CCN(C)CCO 269982a_100000745921_100000211926 [0,1,1,0,0,0|2,0,0]=4 4287 B11R0.62 CCOC(=O)CCN(C)COC 2230a_100000745921_100000766300 [0,1,1,0,0,0|2,0,0]=4 4288 B11R0.62 CCOC(=O)CCN(C)COC 269982a_100000745921_100000766300 [0,1,1,0,0,0|2,0,0]=4 4289 B11R0.62 CCOC(=O)CCN(C)CSC 2230a_100000745921_100011218213 [0,1,1,0,0,0|2,0,0]=4 4290 B11R0.62 CCOC(=O)CCN(C)CSC 269982a_100000745921_100011218213 [0,1,1,0,0,0|2,0,0]=4 4291 B11R0.62 CCOC(=O)CN[C@H](C)CCO 2230a_100000706166_100000188475 [0,1,1,0,0,0|2,0,0]=4 4292 B11R0.62 CCOC(=O)CN[C@H](C)CCO 34a_100000706166_100000188475 [0,1,1,0,0,0|2,0,0]=4 4293 B11R0.62 CCOC(=O)CN[C@H](C)COC 2230a_100000764878_100000188475 [0,1,1,0,0,0|2,0,0]=4 4294 B11R0.62 CCOC(=O)COC(C)CCBr 34a_100012276601_100000188475 [0,1,1,0,0,0|2,0,0]=4 4295 B11R0.62 CCOC(=O)CO[C@H](C)COC 34a_100011934205_100000188475 [0,1,1,0,0,0|2,0,0]=4 4296 B11R0.62 CCOC(=O)CSC(C)CCO 62a_100000188475_100009893172 [0,1,1,0,0,0|2,0,0]=4 4297 B11R0.62 CCOC(=O)CSC(C)CCO 62a_100009893172_100000188475 [0,1,1,0,0,0|2,0,0]=4 4298 B11R0.62 CCOC(=O)CSC(C)COC 62a_100000188475_100000765312 [0,1,1,0,0,0|2,0,0]=4 4299 B11R0.62 CCOC(=O)CSC(C)COC 62a_100000765312_100000188475 [0,1,1,0,0,0|2,0,0]=4 4300 B11R0.81 C#CCCC(=O)CCCCCC 1458a_100000692101_100000210757 [0,1,1,0,0,0|1,0,1]=4 4301 B11R0.81 C#CCCC(=O)CCCCCC 1458a_100102632555_100000753159 [0,1,1,0,0,0|1,0,1]=4 4302 B11R0.81 C#CCCCCC(=O)COCC 1458a_100000211967_100010269958 [0,1,1,0,0,0|0,0,2]=4 4303 B11R0.81 C#CCNC(=O)CCCCCC 11a_100000212058_100102632555 [0,1,1,0,0,0|1,0,1]=4 4304 B11R0.81 C#CCNC(=O)CCCCCC 1626a_100000212058_100102632555 [0,1,1,0,0,0|1,0,1]=4 4305 B11R0.81 C#CCNC(=O)CCCCCC 240690a_100000212058_100102632555 [0,1,1,0,0,0|1,0,1]=4 4306 B11R0.81 C#CCNC(=O)CCCCCC 527a_100000212058_100102632555 [0,1,1,0,0,0|1,0,1]=4 4307 B11R0.81 C/C=C/CC(=O)CCCCCC 1458a_100102632555_100102629194 [0,1,1,0,0,0|1,0,1]=4 4308 B11R0.81 C=C(COCCCC)OCOC 34a_100000210227_100000042856 [0,1,1,0,0,0|2,0,0]=4 4309 B11R0.81 C=C(CSCCCC)OCOC 62a_100000042856_100000210210 [0,1,1,0,0,0|2,0,0]=4 4310 B11R0.81 C=C(CSCCCC)OCOC 62a_100000210211_100000042856 [0,1,1,0,0,0|2,0,0]=4 4311 B11R0.81 C=CCCC(=O)CCCCCC 1458a_100000749702_100000210757 [0,1,1,0,0,0|1,0,1]=4 4312 B11R0.81 C=CCCC(=O)CCCCCC 1458a_100102632555_100000754431 [0,1,1,0,0,0|1,0,1]=4 4313 B11R0.81 C=CCCCCC(=O)COCC 1458a_100000211967_100011215482 [0,1,1,0,0,0|0,0,2]=4 4314 B11R0.81 C=CCNC(=O)CCCCCC 1626a_100020586998_100102632555 [0,1,1,0,0,0|1,0,1]=4 4315 B11R0.81 C=CCNC(=O)CCCCCC 240690a_100020586998_100102632555 [0,1,1,0,0,0|1,0,1]=4 4316 B11R0.81 C=CCNC(=O)CCCCCC 527a_100020586998_100102632555 [0,1,1,0,0,0|1,0,1]=4 4317 B11R0.81 C=CCOC(=O)CNCCCC 2230a_100000102301_100000033060 [0,1,1,0,0,0|1,0,1]=4 4318 B11R0.81 C=CCOC(=O)CNCCCC 7a_106832991798_100000033060 [0,1,1,0,0,0|1,0,1]=4 4319 B11R0.81 C=CCOC(=O)COCCCC 34a_100000210227_100000033060 [0,1,1,0,0,0|1,0,1]=4 4320 B11R0.81 C=CCOC(=O)COCCCC 7a_100000210227_100000033060 [0,1,1,0,0,0|1,0,1]=4 4321 B11R0.81 C=CCOC(=O)CSCCCC 62a_100000033060_100000210210 [0,1,1,0,0,0|1,0,1]=4 4322 B11R0.81 C=CCOC(=O)CSCCCC 62a_100000210211_100000033060 [0,1,1,0,0,0|1,0,1]=4 4323 B11R0.81 CC#CCC(=O)CCCCCC 1458a_100102632555_100000748600 [0,1,1,0,0,0|1,0,1]=4 4324 B11R0.81 CC/C=C\CCC(=O)COCC 1458a_100000211967_100015370543 [0,1,1,0,0,0|0,0,2]=4 4325 B11R0.81 CC=CCC(=O)CCCCCC 1458a_100102632555_100000070051 [0,1,1,0,0,0|1,0,1]=4 4326 B11R0.81 CC=CCC(=O)CCCCCC 1458a_100121576822_100000210757 [0,1,1,0,0,0|1,0,1]=4 4327 B11R0.81 CC=NNC(=O)CCCCCC 4a_100011221127_200000210099 [0,1,1,0,0,0|1,0,1]=4 4328 B11R0.81 CCC#CC(=O)CCCCCC 1458a_100011827653_100000210757 [0,1,1,0,0,0|1,0,0]=3 4329 B11R0.81 CCC#CC(=O)CCCCCF 1458a_100011827653_100000729378 [0,1,1,0,0,0|2,0,0]=4 4330 B11R0.81 CCC#CC(=O)CCCCCO 1458a_100011827653_100000746330 [0,1,1,0,0,0|2,0,0]=4 4331 B11R0.81 CCC#CC(=O)CCCCOC 1458a_100011827653_100000755781 [0,1,1,0,0,0|2,0,0]=4 4332 B11R0.81 CCC#CC(=O)CCCOCC 1458a_100011827653_100012232248 [0,1,1,0,0,0|2,0,0]=4 4333 B11R0.81 CCC#CC(=O)CCOCCC 1458a_100011827653_100011215938 [0,1,1,0,0,0|2,0,0]=4 4334 B11R0.81 CCC#CC(=O)COCCCC 1458a_100011827653_100011995733 [0,1,1,0,0,0|2,0,0]=4 4335 B11R0.81 CCC=CC(=O)CCCCCC 1458a_100000212282_100000210757 [0,1,1,0,0,0|1,0,0]=3 4336 B11R0.81 CCC=CC(=O)CCCCCF 1458a_100000212282_100000729378 [0,1,1,0,0,0|2,0,0]=4 4337 B11R0.81 CCC=CC(=O)CCCCCO 1458a_100000212282_100000746330 [0,1,1,0,0,0|2,0,0]=4 4338 B11R0.81 CCC=CC(=O)CCCCOC 1458a_100000212282_100000755781 [0,1,1,0,0,0|2,0,0]=4 4339 B11R0.81 CCC=CC(=O)CCCOCC 1458a_100000212282_100012232248 [0,1,1,0,0,0|2,0,0]=4 4340 B11R0.81 CCC=CC(=O)CCOCCC 1458a_100000212282_100011215938 [0,1,1,0,0,0|2,0,0]=4 4341 B11R0.81 CCC=CC(=O)COCCCC 1458a_100000212282_100011995733 [0,1,1,0,0,0|2,0,0]=4 4342 B11R0.81 CCC=CC(=O)NCCCCC 11a_100000209983_100000212282 [0,1,1,0,0,0|2,0,0]=4 4343 B11R0.81 CCC=CC(=O)NCCCCC 1626a_100000209983_100000212282 [0,1,1,0,0,0|2,0,0]=4 4344 B11R0.81 CCC=CC(=O)NCCCCC 240690a_100000209983_100000212282 [0,1,1,0,0,0|2,0,0]=4 4345 B11R0.81 CCCCC(=O)CCCCCF 1458a_100000210183_100000729378 [0,1,1,0,0,0|2,0,0]=4 4346 B11R0.81 CCCCC(=O)CCCCCO 1458a_100000210183_100000746330 [0,1,1,0,0,0|2,0,0]=4 4347 B11R0.81 CCCCC(=O)CCCCCO 1458a_100102619762_100000210211 [0,1,1,0,0,0|2,0,0]=4 4348 B11R0.81 CCCCC(=O)CCCCOC 1458a_100000210183_100000755781 [0,1,1,0,0,0|2,0,0]=4 4349 B11R0.81 CCCCC(=O)CCCOCC 1458a_100000210183_100012232248 [0,1,1,0,0,0|2,0,0]=4 4350 B11R0.81 CCCCC(=O)CCOCCC 1458a_100000210183_100011215938 [0,1,1,0,0,0|2,0,0]=4 4351 B11R0.81 CCCCCCC(=NNCC)C 4a_100000756455_100000210826 [0,1,1,0,0,0|2,0,0]=4 4352 B11R0.81 CCCCCCC(=O)C#CCO 1458a_100000049017_100000210757 [0,1,1,0,0,0|1,0,1]=4 4353 B11R0.81 CCCCCCC(=O)C=COC 1458a_100016268678_100000210757 [0,1,1,0,0,0|1,0,1]=4 4354 B11R0.81 CCCCCCC(=O)CCC#N 1458a_100011934036_100000210757 [0,1,1,0,0,0|1,0,1]=4 4355 B11R0.81 CCCCCCC(=O)CCC#N 1458a_100102632555_100011215226 [0,1,1,0,0,0|1,0,1]=4 4356 B11R0.81 CCCCCCC(=O)CCCC 1458a_100000210183_100000210757 [0,1,1,0,0,0|1,0,0]=3 4357 B11R0.81 CCCCCCC(=O)CCCC 1458a_100102632555_100000210211 [0,1,1,0,0,0|1,0,0]=3 4358 B11R0.81 CCCCCCC(=O)CCCF 1458a_100102632555_100011934791 [0,1,1,0,0,0|1,0,0]=3 4359 B11R0.81 CCCCCCC(=O)CCCO 1458a_100102632555_100011215043 [0,1,1,0,0,0|1,0,0]=3 4360 B11R0.81 CCCCCCC(=O)CCOC 1458a_100000749529_100000210757 [0,1,1,0,0,0|1,0,0]=3 4361 B11R0.81 CCCCCCC(=O)CCOC 1458a_100102632555_100000233755 [0,1,1,0,0,0|1,0,0]=3 4362 B11R0.81 CCCCCCC(=O)CCSC 1458a_100000174002_100000210757 [0,1,1,0,0,0|1,0,0]=3 4363 B11R0.81 CCCCCCC(=O)CCSC 1458a_100102632555_100000751147 [0,1,1,0,0,0|1,0,0]=3 4364 B11R0.81 CCCCCCC(=O)COCC 1458a_100000211967_100000210757 [0,1,1,0,0,0|0,0,0]=2 4365 B11R0.81 CCCCCCC(=O)CSCC 1458a_100000230394_100000210757 [0,1,1,0,0,0|0,1,0]=3 4366 B11R0.81 CCCCCCC(=O)NCC#N 1626a_100000734998_100102632555 [0,1,1,0,0,0|1,0,1]=4 4367 B11R0.81 CCCCCCC(=O)NCC#N 527a_100000734998_100102632555 [0,1,1,0,0,0|1,0,1]=4 4368 B11R0.81 CCCCCCC(=O)NCCC 11a_100020643023_100102632555 [0,1,1,0,0,0|1,0,0]=3 4369 B11R0.81 CCCCCCC(=O)NCCC 1626a_100020643023_100102632555 [0,1,1,0,0,0|1,0,0]=3 4370 B11R0.81 CCCCCCC(=O)NCCC 240690a_100020643023_100102632555 [0,1,1,0,0,0|1,0,0]=3 4371 B11R0.81 CCCCCCC(=O)NCCC 527a_100020643023_100102632555 [0,1,1,0,0,0|1,0,0]=3 4372 B11R0.81 CCCCCCC(=O)NCCF 11a_100000724931_100102632555 [0,1,1,0,0,0|1,0,0]=3 4373 B11R0.81 CCCCCCC(=O)NCCF 1626a_100000724931_100102632555 [0,1,1,0,0,0|1,0,0]=3 4374 B11R0.81 CCCCCCC(=O)NCCF 240690a_100000724931_100102632555 [0,1,1,0,0,0|1,0,0]=3 4375 B11R0.81 CCCCCCC(=O)NCCF 527a_100000724931_100102632555 [0,1,1,0,0,0|1,0,0]=3 4376 B11R0.81 CCCCCCC(=O)NCCO 240690a_100000210304_100102632555 [0,1,1,0,0,0|1,0,0]=3 4377 B11R0.81 CCCCCCC(=O)NCCO 527a_100000210304_100102632555 [0,1,1,0,0,0|1,0,0]=3 4378 B11R0.81 CCCCCCC(=O)NNCC 22a_100000756455_100102632555 [0,1,1,0,0,0|1,0,0]=3 4379 B11R0.81 CCCCCCC(C)OCCBr 34a_100000211926_100011215978 [0,1,1,0,0,0|1,0,1]=4 4380 B11R0.81 CCCCCCC(C)OCCC 34a_100000210258_100011215978 [0,1,1,0,0,0|1,0,1]=4 4381 B11R0.81 CCCCCCC(C)OCCC 34a_100000210265_100000210303 [0,1,1,0,0,0|1,0,1]=4 4382 B11R0.81 CCCCCCC(C)OCCC 7a_100000210265_100000210303 [0,1,1,0,0,0|1,0,1]=4 4383 B11R0.81 CCCCCCC(C)OCCF 34a_100000210265_100011217306 [0,1,1,0,0,0|1,0,1]=4 4384 B11R0.81 CCCCCCC(C)OCCF 7a_100000210265_100011217306 [0,1,1,0,0,0|1,0,1]=4 4385 B11R0.81 CCCCCCC(C)OCCN 34a_100000210304_100011215978 [0,1,1,0,0,0|1,0,1]=4 4386 B11R0.81 CCCCCCC(C)OCCO 34a_100000210265_100000211926 [0,1,1,0,0,0|1,0,1]=4 4387 B11R0.81 CCCCCCC(C)OCCO 7a_100000210265_100000211926 [0,1,1,0,0,0|1,0,1]=4 4388 B11R0.81 CCCCCCC(C)OCSC 34a_100000210265_100011218213 [0,1,1,0,0,0|1,0,1]=4 4389 B11R0.81 CCCCCCN(C)COCC 269982a_106256046315_100000739092 [0,1,1,0,0,0|2,0,0]=4 4390 B11R0.81 CCCCCNC(=O)CCCC 11a_100000209983_100000210183 [0,1,1,0,0,0|2,0,0]=4 4391 B11R0.81 CCCCCNC(=O)CCCC 1626a_100000209983_100000210183 [0,1,1,0,0,0|2,0,0]=4 4392 B11R0.81 CCCCCNC(=O)CCCC 240690a_100000209983_100000210183 [0,1,1,0,0,0|2,0,0]=4 4393 B11R0.81 CCCCCNC(=O)CCCC 527a_100000209983_100000210183 [0,1,1,0,0,0|2,0,0]=4 4394 B11R0.81 CCCCCNC(=O)CCOC 11a_100000209983_100000749529 [0,1,1,0,0,0|2,0,0]=4 4395 B11R0.81 CCCCCNC(=O)CCOC 1626a_100000209983_100000749529 [0,1,1,0,0,0|2,0,0]=4 4396 B11R0.81 CCCCCNC(=O)CCOC 240690a_100000209983_100000749529 [0,1,1,0,0,0|2,0,0]=4 4397 B11R0.81 CCCCCNC(=O)CCOC 527a_100000209983_100000749529 [0,1,1,0,0,0|2,0,0]=4 4398 B11R0.81 CCCCCNC(=O)CCSC 11a_100000209983_100000174002 [0,1,1,0,0,0|2,0,0]=4 4399 B11R0.81 CCCCCNC(=O)CCSC 1626a_100000209983_100000174002 [0,1,1,0,0,0|2,0,0]=4 4400 B11R0.81 CCCCCNC(=O)CCSC 240690a_100000209983_100000174002 [0,1,1,0,0,0|2,0,0]=4 4401 B11R0.81 CCCCCNC(=O)CCSC 527a_100000209983_100000174002 [0,1,1,0,0,0|2,0,0]=4 4402 B11R0.81 CCCCCNC(=O)CNCC 2230a_100015525214_100000230301 [0,1,1,0,0,0|2,0,0]=4 4403 B11R0.81 CCCCCNC(=O)COCC 11a_100000209983_100000211967 [0,1,1,0,0,0|1,0,0]=3 4404 B11R0.81 CCCCCNC(=O)COCC 1626a_100000209983_100000211967 [0,1,1,0,0,0|1,0,0]=3 4405 B11R0.81 CCCCCNC(=O)COCC 240690a_100000209983_100000211967 [0,1,1,0,0,0|1,0,0]=3 4406 B11R0.81 CCCCCNC(=O)COCC 34a_100121572206_100000230301 [0,1,1,0,0,0|1,0,0]=3 4407 B11R0.81 CCCCCNC(=O)COCC 527a_100000209983_100000211967 [0,1,1,0,0,0|1,0,0]=3 4408 B11R0.81 CCCCCNC(=O)CSCC 11a_100000209983_100000230394 [0,1,1,0,0,0|1,1,0]=4 4409 B11R0.81 CCCCCNC(=O)CSCC 1626a_100000209983_100000230394 [0,1,1,0,0,0|1,1,0]=4 4410 B11R0.81 CCCCCNC(=O)CSCC 240690a_100000209983_100000230394 [0,1,1,0,0,0|1,1,0]=4 4411 B11R0.81 CCCCCNC(=O)CSCC 527a_100000209983_100000230394 [0,1,1,0,0,0|1,1,0]=4 4412 B11R0.81 CCCCCNC(=O)CSCC 62a_100000210202_100000230301 [0,1,1,0,0,0|1,1,0]=4 4413 B11R0.81 CCCCCNC(=O)CSCC 62a_100000230301_100000210202 [0,1,1,0,0,0|1,1,0]=4 4414 B11R0.81 CCCCCNC(=O)NCCC 2708a_100000209983_100020643023 [0,1,1,0,0,0|2,0,0]=4 4415 B11R0.81 CCCCCNC(=O)NCCC 2708a_100020643023_100000209983 [0,1,1,0,0,0|2,0,0]=4 4416 B11R0.81 CCCCCNC(=O)NCCC 273464a_100000209983_100020643023 [0,1,1,0,0,0|2,0,0]=4 4417 B11R0.81 CCCCCNC(=O)NCCC 273464a_100020643023_100000209983 [0,1,1,0,0,0|2,0,0]=4 4418 B11R0.81 CCCCCNC(=O)NCCC 512a_100000209983_100020643023 [0,1,1,0,0,0|2,0,0]=4 4419 B11R0.81 CCCCCNC(=O)NCCC 512a_100020643023_100000209983 [0,1,1,0,0,0|2,0,0]=4 4420 B11R0.81 CCCCCNC(=O)NCCF 2708a_100000209983_100000724931 [0,1,1,0,0,0|2,0,0]=4 4421 B11R0.81 CCCCCNC(=O)NCCF 273464a_100000209983_100000724931 [0,1,1,0,0,0|2,0,0]=4 4422 B11R0.81 CCCCCNC(=O)NCCF 273464a_100000724931_100000209983 [0,1,1,0,0,0|2,0,0]=4 4423 B11R0.81 CCCCCNC(=O)NCCF 512a_100000209983_100000724931 [0,1,1,0,0,0|2,0,0]=4 4424 B11R0.81 CCCCCNC(=O)NCCO 2708a_100000209983_100000210304 [0,1,1,0,0,0|2,0,0]=4 4425 B11R0.81 CCCCCNC(=O)NCCO 273464a_100000209983_100000210304 [0,1,1,0,0,0|2,0,0]=4 4426 B11R0.81 CCCCCNC(=O)NCCO 273464a_100000210304_100000209983 [0,1,1,0,0,0|2,0,0]=4 4427 B11R0.81 CCCCCNC(=O)NCCO 512a_100000209983_100000210304 [0,1,1,0,0,0|2,0,0]=4 4428 B11R0.81 CCCCCNC(=O)NNCC 273464a_100000209983_100000756455 [0,1,1,0,0,0|2,0,0]=4 4429 B11R0.81 CCCCCNC(=O)NNCC 512a_100000209983_100000756455 [0,1,1,0,0,0|2,0,0]=4 4430 B11R0.81 CCCCCNC(=O)NNCC 512a_100000756455_100000209983 [0,1,1,0,0,0|2,0,0]=4 4431 B11R0.81 CCCCNCC(=O)NCCC 2230a_100000102301_100000183358 [0,1,1,0,0,0|2,0,0]=4 4432 B11R0.81 CCCCNCC(=O)NCCC 2230a_100000174927_100000210211 [0,1,1,0,0,0|2,0,0]=4 4433 B11R0.81 CCCCNCC(=O)NCCC 7a_106832991798_100000183358 [0,1,1,0,0,0|2,0,0]=4 4434 B11R0.81 CCCCNCC(=O)NCCF 2230a_100000725713_100000210211 [0,1,1,0,0,0|2,0,0]=4 4435 B11R0.81 CCCCNCC(=O)OCCC 2230a_100000102301_200011215008 [0,1,1,0,0,0|1,0,0]=3 4436 B11R0.81 CCCCNCC(=O)OCCC 7a_106832991798_200011215008 [0,1,1,0,0,0|1,0,0]=3 4437 B11R0.81 CCCCNNC(=O)COCC 22a_100025702795_100000211967 [0,1,1,0,0,0|2,0,0]=4 4438 B11R0.81 CCCCOCC(=O)CCCC 1458a_100000210183_100011995733 [0,1,1,0,0,0|2,0,0]=4 4439 B11R0.81 CCCCOCC(=O)CCCC 1458a_100000757543_100000210211 [0,1,1,0,0,0|2,0,0]=4 4440 B11R0.81 CCCCOCC(=O)CCCF 1458a_100000757543_100011934791 [0,1,1,0,0,0|2,0,0]=4 4441 B11R0.81 CCCCOCC(=O)CCCO 1458a_100000757543_100011215043 [0,1,1,0,0,0|2,0,0]=4 4442 B11R0.81 CCCCOCC(=O)CCOC 1458a_100000749529_100011995733 [0,1,1,0,0,0|2,0,0]=4 4443 B11R0.81 CCCCOCC(=O)CCOC 1458a_100000757543_100000233755 [0,1,1,0,0,0|2,0,0]=4 4444 B11R0.81 CCCCOCC(=O)CCSC 1458a_100000174002_100011995733 [0,1,1,0,0,0|2,0,0]=4 4445 B11R0.81 CCCCOCC(=O)CCSC 1458a_100000757543_100000751147 [0,1,1,0,0,0|2,0,0]=4 4446 B11R0.81 CCCCOCC(=O)COCC 1458a_100000211967_100011995733 [0,1,1,0,0,0|1,0,0]=3 4447 B11R0.81 CCCCOCC(=O)CSCC 1458a_100000230394_100011995733 [0,1,1,0,0,0|1,1,0]=4 4448 B11R0.81 CCCCOCC(=O)NCCC 11a_100020643023_100000757543 [0,1,1,0,0,0|2,0,0]=4 4449 B11R0.81 CCCCOCC(=O)NCCC 1626a_100020643023_100000757543 [0,1,1,0,0,0|2,0,0]=4 4450 B11R0.81 CCCCOCC(=O)NCCC 240690a_100020643023_100000757543 [0,1,1,0,0,0|2,0,0]=4 4451 B11R0.81 CCCCOCC(=O)NCCC 34a_100000210227_100000183358 [0,1,1,0,0,0|2,0,0]=4 4452 B11R0.81 CCCCOCC(=O)NCCC 527a_100020643023_100000757543 [0,1,1,0,0,0|2,0,0]=4 4453 B11R0.81 CCCCOCC(=O)NCCC 7a_100000210227_100000183358 [0,1,1,0,0,0|2,0,0]=4 4454 B11R0.81 CCCCOCC(=O)NCCF 11a_100000724931_100000757543 [0,1,1,0,0,0|2,0,0]=4 4455 B11R0.81 CCCCOCC(=O)NCCF 1626a_100000724931_100000757543 [0,1,1,0,0,0|2,0,0]=4 4456 B11R0.81 CCCCOCC(=O)NCCF 240690a_100000724931_100000757543 [0,1,1,0,0,0|2,0,0]=4 4457 B11R0.81 CCCCOCC(=O)NCCF 527a_100000724931_100000757543 [0,1,1,0,0,0|2,0,0]=4 4458 B11R0.81 CCCCOCC(=O)NCCO 240690a_100000210304_100000757543 [0,1,1,0,0,0|2,0,0]=4 4459 B11R0.81 CCCCOCC(=O)NCCO 527a_100000210304_100000757543 [0,1,1,0,0,0|2,0,0]=4 4460 B11R0.81 CCCCOCC(=O)NNCC 22a_100000756455_100000757543 [0,1,1,0,0,0|2,0,0]=4 4461 B11R0.81 CCCCOCC(=O)OCCC 34a_100000210227_200011215008 [0,1,1,0,0,0|1,0,0]=3 4462 B11R0.81 CCCCOCC(=O)OCCC 7a_100000210227_200011215008 [0,1,1,0,0,0|1,0,0]=3 4463 B11R0.81 CCCCSCC(=O)CCCC 1458a_100000191162_100000210211 [0,1,1,0,0,0|2,0,0]=4 4464 B11R0.81 CCCCSCC(=O)CCCF 1458a_100000191162_100011934791 [0,1,1,0,0,0|2,0,0]=4 4465 B11R0.81 CCCCSCC(=O)CCCO 1458a_100000191162_100011215043 [0,1,1,0,0,0|2,0,0]=4 4466 B11R0.81 CCCCSCC(=O)CCOC 1458a_100000191162_100000233755 [0,1,1,0,0,0|2,0,0]=4 4467 B11R0.81 CCCCSCC(=O)CCSC 1458a_100000191162_100000751147 [0,1,1,0,0,0|2,0,0]=4 4468 B11R0.81 CCCCSCC(=O)NCCC 11a_100020643023_100000191162 [0,1,1,0,0,0|2,0,0]=4 4469 B11R0.81 CCCCSCC(=O)NCCC 1626a_100020643023_100000191162 [0,1,1,0,0,0|2,0,0]=4 4470 B11R0.81 CCCCSCC(=O)NCCC 240690a_100020643023_100000191162 [0,1,1,0,0,0|2,0,0]=4 4471 B11R0.81 CCCCSCC(=O)NCCC 527a_100020643023_100000191162 [0,1,1,0,0,0|2,0,0]=4 4472 B11R0.81 CCCCSCC(=O)NCCC 62a_100000183358_100000210210 [0,1,1,0,0,0|2,0,0]=4 4473 B11R0.81 CCCCSCC(=O)NCCC 62a_100000210211_100000183358 [0,1,1,0,0,0|2,0,0]=4 4474 B11R0.81 CCCCSCC(=O)NCCF 11a_100000724931_100000191162 [0,1,1,0,0,0|2,0,0]=4 4475 B11R0.81 CCCCSCC(=O)NCCF 1626a_100000724931_100000191162 [0,1,1,0,0,0|2,0,0]=4 4476 B11R0.81 CCCCSCC(=O)NCCF 240690a_100000724931_100000191162 [0,1,1,0,0,0|2,0,0]=4 4477 B11R0.81 CCCCSCC(=O)NCCF 527a_100000724931_100000191162 [0,1,1,0,0,0|2,0,0]=4 4478 B11R0.81 CCCCSCC(=O)NCCO 240690a_100000210304_100000191162 [0,1,1,0,0,0|2,0,0]=4 4479 B11R0.81 CCCCSCC(=O)NCCO 527a_100000210304_100000191162 [0,1,1,0,0,0|2,0,0]=4 4480 B11R0.81 CCCCSCC(=O)NNCC 22a_100000756455_100000191162 [0,1,1,0,0,0|2,0,0]=4 4481 B11R0.81 CCCCSCC(=O)OCCC 62a_100000210211_200011215008 [0,1,1,0,0,0|1,0,0]=3 4482 B11R0.81 CCCCSCC(=O)OCCC 62a_200011215008_100000210210 [0,1,1,0,0,0|1,0,0]=3 4483 B11R0.81 CCCNC(=O)CCCCCO 240690a_100020643023_100102619762 [0,1,1,0,0,0|2,0,0]=4 4484 B11R0.81 CCCNC(=O)CCCNCC 2230a_100015525214_100011194427 [0,1,1,0,0,0|2,0,0]=4 4485 B11R0.81 CCCNC(=O)CCCSCC 62a_100000210202_100011194427 [0,1,1,0,0,0|2,0,0]=4 4486 B11R0.81 CCCNC(=O)CCCSCC 62a_100011194427_100000210202 [0,1,1,0,0,0|2,0,0]=4 4487 B11R0.81 CCCOC(=O)CNCCCF 2230a_100015189416_200011215008 [0,1,1,0,0,0|2,0,0]=4 4488 B11R0.81 CCCOC(=O)CNCCCF 34a_100015189416_200011215008 [0,1,1,0,0,0|2,0,0]=4 4489 B11R0.81 CCCOC(=O)CNCCOC 2230a_100000209980_200011215008 [0,1,1,0,0,0|2,0,0]=4 4490 B11R0.81 CCCOC(=O)CNCCSC 2230a_100020590264_200011215008 [0,1,1,0,0,0|2,0,0]=4 4491 B11R0.81 CCCOC(=O)COCCCBr 34a_100011217188_200011215008 [0,1,1,0,0,0|2,0,0]=4 4492 B11R0.81 CCCOC(=O)COCCCCl 34a_100000230001_200011215008 [0,1,1,0,0,0|2,0,0]=4 4493 B11R0.81 CCCOC(=O)COCCCF 34a_100000759539_200011215008 [0,1,1,0,0,0|2,0,0]=4 4494 B11R0.81 CCCOC(=O)COCCCN 34a_100000182051_200011215008 [0,1,1,0,0,0|2,0,0]=4 4495 B11R0.81 CCCOC(=O)COCCOC 34a_100000210237_200011215008 [0,1,1,0,0,0|2,0,0]=4 4496 B11R0.81 CCCOC(=O)COCCSC 34a_100000230434_200011215008 [0,1,1,0,0,0|2,0,0]=4 4497 B11R0.81 CCCOC(=O)COCCSC 7a_100000230434_200011215008 [0,1,1,0,0,0|2,0,0]=4 4498 B11R0.81 CCCOC(=O)CSCCCF 62a_100011934791_200011215008 [0,1,1,0,0,0|2,0,0]=4 4499 B11R0.81 CCCOC(=O)CSCCCF 62a_200011215008_100011934791 [0,1,1,0,0,0|2,0,0]=4 4500 B11R0.81 CCCOC(=O)CSCCCO 62a_100011215043_200011215008 [0,1,1,0,0,0|2,0,0]=4 4501 B11R0.81 CCCOC(=O)CSCCCO 62a_200011215008_100011215043 [0,1,1,0,0,0|2,0,0]=4 4502 B11R0.81 CCCOC(=O)CSCCOC 62a_100000233755_200011215008 [0,1,1,0,0,0|2,0,0]=4 4503 B11R0.81 CCCOC(=O)CSCCOC 62a_200011215008_100000233755 [0,1,1,0,0,0|2,0,0]=4 4504 B11R0.81 CCCOC(=O)CSCCSC 62a_100000212216_200011215008 [0,1,1,0,0,0|2,0,0]=4 4505 B11R0.81 CCCOC(=O)CSCCSC 62a_200011215008_100000751147 [0,1,1,0,0,0|2,0,0]=4 4506 B11R0.81 CCCOC(=O)CSCOCC 62a_100000739092_200011215008 [0,1,1,0,0,0|2,0,0]=4 4507 B11R0.81 CCCOC(=O)CSCOCC 62a_200011215008_100000739092 [0,1,1,0,0,0|2,0,0]=4 4508 B11R0.81 CCCOC(=O)OCSCCC 62a_100000210303_200000139673 [0,1,1,0,0,0|2,0,0]=4 4509 B11R0.81 CCCOCCC(=O)CCOC 1458a_100000749529_100011215938 [0,1,1,0,0,0|2,0,0]=4 4510 B11R0.81 CCCOCCC(=O)CCSC 1458a_100000174002_100011215938 [0,1,1,0,0,0|2,0,0]=4 4511 B11R0.81 CCCOCCC(=O)COCC 1458a_100000211967_100011215938 [0,1,1,0,0,0|1,0,0]=3 4512 B11R0.81 CCCOCCC(=O)CSCC 1458a_100000230394_100011215938 [0,1,1,0,0,0|1,1,0]=4 4513 B11R0.81 CCCOCOC(=O)OCCC 34a_100000210258_200000139673 [0,1,1,0,0,0|2,0,0]=4 4514 B11R0.81 CCNNC(=O)CCCCCO 22a_100000756455_100102619762 [0,1,1,0,0,0|2,0,0]=4 4515 B11R0.81 CCOCC(=O)CCCCC#N 1458a_100000211967_100000211819 [0,1,1,0,0,0|1,0,1]=4 4516 B11R0.81 CCOCC(=O)CCCCCF 1458a_100000211967_100000729378 [0,1,1,0,0,0|1,0,0]=3 4517 B11R0.81 CCOCC(=O)CCCCCO 1458a_100000211967_100000746330 [0,1,1,0,0,0|1,0,0]=3 4518 B11R0.81 CCOCC(=O)CCCCOC 1458a_100000211967_100000755781 [0,1,1,0,0,0|1,0,0]=3 4519 B11R0.81 CCOCC(=O)CCOCCO 1458a_100000211967_100011215305 [0,1,1,0,0,0|2,0,0]=4 4520 B11R0.81 CCOCC(=O)NCCCCO 240690a_100000750430_100000211967 [0,1,1,0,0,0|2,0,0]=4 4521 B11R0.81 CCOCC(=O)NCCCCO 527a_100000750430_100000211967 [0,1,1,0,0,0|2,0,0]=4 4522 B11R0.81 CCOCC(=O)NCCCOC 1626a_100150723488_100000211967 [0,1,1,0,0,0|2,0,0]=4 4523 B11R0.81 CCOCC(=O)NCCCOC 240690a_100150723488_100000211967 [0,1,1,0,0,0|2,0,0]=4 4524 B11R0.81 CCOCC(=O)NCCCOC 34a_100121572206_100000183178 [0,1,1,0,0,0|2,0,0]=4 4525 B11R0.81 CCOCC(=O)NCCCOC 527a_100150723488_100000211967 [0,1,1,0,0,0|2,0,0]=4 4526 B11R0.81 CCOCC(=O)NCCCSC 11a_100000749238_100000211967 [0,1,1,0,0,0|2,0,0]=4 4527 B11R0.81 CCOCC(=O)NCCCSC 1626a_100000749238_100000211967 [0,1,1,0,0,0|2,0,0]=4 4528 B11R0.81 CCOCC(=O)NCCCSC 240690a_100000749238_100000211967 [0,1,1,0,0,0|2,0,0]=4 4529 B11R0.81 CCOCC(=O)NCCCSC 527a_100000749238_100000211967 [0,1,1,0,0,0|2,0,0]=4 4530 B11R0.81 CCOCC(=O)NCCSCC 11a_100000106463_100000211967 [0,1,1,0,0,0|2,0,0]=4 4531 B11R0.81 CCOCC(=O)NCCSCC 1626a_100000106463_100000211967 [0,1,1,0,0,0|2,0,0]=4 4532 B11R0.81 CCOCC(=O)NCCSCC 240690a_100000106463_100000211967 [0,1,1,0,0,0|2,0,0]=4 4533 B11R0.81 CCOCC(=O)NCCSCC 527a_100000106463_100000211967 [0,1,1,0,0,0|2,0,0]=4 4534 B11R0.81 CCOCCCC(=O)CCOC 1458a_100000749529_100012232248 [0,1,1,0,0,0|2,0,0]=4 4535 B11R0.81 CCOCCCC(=O)CCSC 1458a_100000174002_100012232248 [0,1,1,0,0,0|2,0,0]=4 4536 B11R0.81 CCOCCCC(=O)COCC 1458a_100000211967_100012232248 [0,1,1,0,0,0|1,0,0]=3 4537 B11R0.81 CCOCCCC(=O)CSCC 1458a_100000230394_100012232248 [0,1,1,0,0,0|1,1,0]=4 4538 B11R0.81 CCOCCNC(=O)COCC 11a_100011200944_100000211967 [0,1,1,0,0,0|2,0,0]=4 4539 B11R0.81 CCOCCNC(=O)COCC 1626a_102516460346_100000211967 [0,1,1,0,0,0|2,0,0]=4 4540 B11R0.81 CCOCCNC(=O)COCC 240690a_100011200944_100000211967 [0,1,1,0,0,0|2,0,0]=4 4541 B11R0.81 CCOCCNC(=O)COCC 527a_100011200944_100000211967 [0,1,1,0,0,0|2,0,0]=4 4542 B11R0.81 CCOCCOC(=O)COCC 34a_100121572206_200000101388 [0,1,1,0,0,0|2,0,0]=4 4543 B11R0.81 CCSCC(=O)CCCCCF 1458a_100000230394_100000729378 [0,1,1,0,0,0|1,1,0]=4 4544 B11R0.81 CCSCC(=O)CCCCCO 1458a_100000230394_100000746330 [0,1,1,0,0,0|1,1,0]=4 4545 B11R0.81 CCSCC(=O)CCCCOC 1458a_100000230394_100000755781 [0,1,1,0,0,0|1,1,0]=4 4546 B11R0.81 COCCC(=O)CCCCCF 1458a_100000749529_100000729378 [0,1,1,0,0,0|2,0,0]=4 4547 B11R0.81 COCCC(=O)CCCCCO 1458a_100000749529_100000746330 [0,1,1,0,0,0|2,0,0]=4 4548 B11R0.81 COCCC(=O)CCCCCO 1458a_100102619762_100000233755 [0,1,1,0,0,0|2,0,0]=4 4549 B11R0.81 COCCCCC(=O)CCOC 1458a_100000749529_100000755781 [0,1,1,0,0,0|2,0,0]=4 4550 B11R0.81 COCCCCC(=O)CCSC 1458a_100000174002_100000755781 [0,1,1,0,0,0|2,0,0]=4 4551 B11R0.81 CSCCC(=O)CCCCCF 1458a_100000174002_100000729378 [0,1,1,0,0,0|2,0,0]=4 4552 B11R0.81 CSCCC(=O)CCCCCO 1458a_100000174002_100000746330 [0,1,1,0,0,0|2,0,0]=4 4553 B11R0.81 CSCCC(=O)CCCCCO 1458a_100102619762_100000751147 [0,1,1,0,0,0|2,0,0]=4 4554 B11R0.81 O=C(CCCCCO)NCCF 240690a_100000724931_100102619762 [0,1,1,0,0,0|2,0,0]=4 4555 B11R0.81 O=C(CCCCCO)NCCO 240690a_100000210304_100102619762 [0,1,1,0,0,0|2,0,0]=4 4556 B11R0.81 O=C(CCCF)CCCCCO 1458a_100102619762_100011934791 [0,1,1,0,0,0|2,0,0]=4 4557 B11R0.81 O=C(CCCO)CCCCCO 1458a_100102619762_100011215043 [0,1,1,0,0,0|2,0,0]=4 4558 B11R0.142 C/C=C(\C)/C(=O)CCCCCC 1458a_100020587367_100000210757 [0,1,1,0,0,0|1,0,1]=4 4559 B11R0.142 CCC(C)C(=O)CCCCCF 1458a_100011192722_100000729378 [0,1,1,0,0,0|2,0,0]=4 4560 B11R0.142 CCC(C)C(=O)CCCCCO 1458a_100011192722_100000746330 [0,1,1,0,0,0|2,0,0]=4 4561 B11R0.142 CCC(C)C(=O)CCCCCO 1458a_100102619762_100000758301 [0,1,1,0,0,0|2,0,0]=4 4562 B11R0.142 CCC(C)C(=O)CCCCOC 1458a_100011192722_100000755781 [0,1,1,0,0,0|2,0,0]=4 4563 B11R0.142 CCC(O)C(=O)CCCCCF 1458a_100011196387_100000729378 [0,1,1,0,0,0|2,0,0]=4 4564 B11R0.142 CCC(O)C(=O)CCCCCO 1458a_100011196387_100000746330 [0,1,1,0,0,0|2,0,0]=4 4565 B11R0.142 CCC(O)C(=O)CCCCOC 1458a_100011196387_100000755781 [0,1,1,0,0,0|2,0,0]=4 4566 B11R0.142 CCCCCCC(=O)C(=O)NC 1458a_100011218921_100000210757 [0,1,1,0,0,0|2,0,0]=4 4567 B11R0.142 CCCCCCC(=O)C(C)CC 1458a_100011192722_100000210757 [0,1,1,0,0,0|1,0,0]=3 4568 B11R0.142 CCCCCCC(=O)C(C)CC 1458a_100102632555_100000758301 [0,1,1,0,0,0|1,0,0]=3 4569 B11R0.142 CCCCCCC(=O)C(C)OC 1458a_100000743197_100000210757 [0,1,1,0,0,0|2,0,0]=4 4570 B11R0.142 CCCCCCC(=O)C(C)SC 1458a_100000149566_100000210757 [0,1,1,0,0,0|2,0,0]=4 4571 B11R0.142 CCCCCCC(=O)C(O)CC 1458a_100011196387_100000210757 [0,1,1,0,0,0|1,0,0]=3 4572 B11R0.142 CCCCCCC(=O)C(O)CO 1458a_100011215603_100000210757 [0,1,1,0,0,0|2,0,0]=4 4573 B11R0.142 CCCCCCC(=O)N(C)CC 11a_100000225621_100102632555 [0,1,1,0,0,0|1,0,0]=3 4574 B11R0.142 CCCCCCC(=O)N(C)CC 1626a_100000225621_100102632555 [0,1,1,0,0,0|1,0,0]=3 4575 B11R0.142 CCCCCCC(=O)N(C)CC 240690a_100000225621_100102632555 [0,1,1,0,0,0|1,0,0]=3 4576 B11R0.142 CCCCCCC(=O)N(C)CC 527a_100000225621_100102632555 [0,1,1,0,0,0|1,0,0]=3 4577 B11R0.142 CCCCCNC(=O)C(C)CC 11a_100000209983_100011192722 [0,1,1,0,0,0|2,0,0]=4 4578 B11R0.142 CCCCCNC(=O)C(C)CC 1626a_100000209983_100011192722 [0,1,1,0,0,0|2,0,0]=4 4579 B11R0.142 CCCCCNC(=O)C(C)CC 240690a_100000209983_100011192722 [0,1,1,0,0,0|2,0,0]=4 4580 B11R0.142 CCCCCNC(=O)C(C)CC 527a_100000209983_100011192722 [0,1,1,0,0,0|2,0,0]=4 4581 B11R0.142 CCCCCNC(=O)C(O)CC 240690a_100000209983_100011196387 [0,1,1,0,0,0|2,0,0]=4 4582 B11R0.142 CCCCCNC(=O)N(C)CC 2708a_100000209983_100000225621 [0,1,1,0,0,0|2,0,0]=4 4583 B11R0.142 CCCCCNC(=O)N(C)CC 273464a_100000209983_100000225621 [0,1,1,0,0,0|2,0,0]=4 4584 B11R0.142 CCCCNCC(=O)N(C)CC 2230a_100000102301_100000738999 [0,1,1,0,0,0|2,0,0]=4 4585 B11R0.142 CCCCNCC(=O)N(C)CC 7a_106832991798_100000738999 [0,1,1,0,0,0|2,0,0]=4 4586 B11R0.142 CCCCOCC(=O)C(C)CC 1458a_100000757543_100000758301 [0,1,1,0,0,0|2,0,0]=4 4587 B11R0.142 CCCCOCC(=O)C(C)CC 1458a_100011192722_100011995733 [0,1,1,0,0,0|2,0,0]=4 4588 B11R0.142 CCCCOCC(=O)C(O)CC 1458a_100011196387_100011995733 [0,1,1,0,0,0|2,0,0]=4 4589 B11R0.142 CCCCOCC(=O)N(C)CC 11a_100000225621_100000757543 [0,1,1,0,0,0|2,0,0]=4 4590 B11R0.142 CCCCOCC(=O)N(C)CC 1626a_100000225621_100000757543 [0,1,1,0,0,0|2,0,0]=4 4591 B11R0.142 CCCCOCC(=O)N(C)CC 240690a_100000225621_100000757543 [0,1,1,0,0,0|2,0,0]=4 4592 B11R0.142 CCCCOCC(=O)N(C)CC 34a_100000210227_100000738999 [0,1,1,0,0,0|2,0,0]=4 4593 B11R0.142 CCCCOCC(=O)N(C)CC 527a_100000225621_100000757543 [0,1,1,0,0,0|2,0,0]=4 4594 B11R0.142 CCCCOCC(=O)N(C)CC 7a_100000210227_100000738999 [0,1,1,0,0,0|2,0,0]=4 4595 B11R0.142 CCCCSCC(=O)C(C)CC 1458a_100000191162_100000758301 [0,1,1,0,0,0|2,0,0]=4 4596 B11R0.142 CCCCSCC(=O)N(C)CC 11a_100000225621_100000191162 [0,1,1,0,0,0|2,0,0]=4 4597 B11R0.142 CCCCSCC(=O)N(C)CC 1626a_100000225621_100000191162 [0,1,1,0,0,0|2,0,0]=4 4598 B11R0.142 CCCCSCC(=O)N(C)CC 240690a_100000225621_100000191162 [0,1,1,0,0,0|2,0,0]=4 4599 B11R0.142 CCCCSCC(=O)N(C)CC 527a_100000225621_100000191162 [0,1,1,0,0,0|2,0,0]=4 4600 B11R0.142 CCCCSCC(=O)N(C)CC 62a_100000210211_100000738999 [0,1,1,0,0,0|2,0,0]=4 4601 B11R0.142 CCCCSCC(=O)N(C)CC 62a_100000738999_100000210210 [0,1,1,0,0,0|2,0,0]=4 4602 B11R0.142 CCCOCCC(=O)C(C)CC 1458a_100011192722_100011215938 [0,1,1,0,0,0|2,0,0]=4 4603 B11R0.142 CCCOCCC(=O)C(O)CC 1458a_100011196387_100011215938 [0,1,1,0,0,0|2,0,0]=4 4604 B11R0.142 CCN(C)C(=O)CCCCCO 240690a_100000225621_100102619762 [0,1,1,0,0,0|2,0,0]=4 4605 B11R0.142 CCOCCCC(=O)C(C)CC 1458a_100011192722_100012232248 [0,1,1,0,0,0|2,0,0]=4 4606 B11R0.142 CCOCCCC(=O)C(O)CC 1458a_100011196387_100012232248 [0,1,1,0,0,0|2,0,0]=4 4607 B11R0.155 C=C(COCCC)C(=O)OCC 34a_100000210258_100000755967 [0,1,1,0,0,0|1,0,1]=4 4608 B11R0.155 C=C(CSCCC)C(=O)OCC 62a_100000210303_100000755967 [0,1,1,0,0,0|1,0,1]=4 4609 B11R0.155 C=C(CSCCC)C(=O)OCC 62a_100000755967_100000210303 [0,1,1,0,0,0|1,0,1]=4 4610 B11R0.155 CC#CC(=O)C(C)CCCCC 1458a_100000763181_200011218191 [0,1,1,0,0,0|1,0,1]=4 4611 B11R0.155 CC=CC(=O)C(C)CCCCC 1458a_100000210699_200011218191 [0,1,1,0,0,0|1,0,1]=4 4612 B11R0.155 CCCCCC(=O)C(=O)NCC 1458a_200011297158_100000210326 [0,1,1,0,0,0|1,0,1]=4 4613 B11R0.155 CCCCCC(C)C(=O)CCC 1458a_100000211992_200011218191 [0,1,1,0,0,0|1,0,0]=3 4614 B11R0.155 CCCCCC(C)C(=O)CCC 1458a_100011215998_100000210303 [0,1,1,0,0,0|1,0,0]=3 4615 B11R0.155 CCCCCC(C)C(=O)CCF 1458a_100011215998_100011217306 [0,1,1,0,0,0|2,0,0]=4 4616 B11R0.155 CCCCCC(C)C(=O)CCO 1458a_100011215998_100000211926 [0,1,1,0,0,0|2,0,0]=4 4617 B11R0.155 CCCCCC(C)C(=O)CCO 1458a_100011216618_200011218191 [0,1,1,0,0,0|2,0,0]=4 4618 B11R0.155 CCCCCC(C)C(=O)COC 1458a_100000210968_200011218191 [0,1,1,0,0,0|2,0,0]=4 4619 B11R0.155 CCCCCC(C)C(=O)CSC 1458a_100000184570_200011218191 [0,1,1,0,0,0|2,0,0]=4 4620 B11R0.155 CCCCCC(C)C(=O)NCC 11a_100015525214_100011215998 [0,1,1,0,0,0|1,0,0]=3 4621 B11R0.155 CCCCCC(C)C(=O)NCC 240690a_100015525214_100011215998 [0,1,1,0,0,0|1,0,0]=3 4622 B11R0.155 CCCCCC(C)C(=O)NCC 527a_100015525214_100011215998 [0,1,1,0,0,0|1,0,0]=3 4623 B11R0.155 CCCCCC(C)C(=O)NNC 22a_100016993582_100011215998 [0,1,1,0,0,0|2,0,0]=4 4624 B11R0.155 CCCCCN(C)C(=O)CCC 11a_100000223495_100000211992 [0,1,1,0,0,0|2,0,0]=4 4625 B11R0.155 CCCCCN(C)C(=O)CCC 1626a_100000223495_100000211992 [0,1,1,0,0,0|2,0,0]=4 4626 B11R0.155 CCCCCN(C)C(=O)CCC 240690a_100000223495_100000211992 [0,1,1,0,0,0|2,0,0]=4 4627 B11R0.155 CCCCCN(C)C(=O)CCC 527a_100000223495_100000211992 [0,1,1,0,0,0|2,0,0]=4 4628 B11R0.155 CCCCCN(C)C(=O)NCC 2708a_100015525214_100000223495 [0,1,1,0,0,0|2,0,0]=4 4629 B11R0.155 CCCCCN(C)C(=O)NCC 273464a_100015525214_100000223495 [0,1,1,0,0,0|2,0,0]=4 4630 B11R0.155 CCCCNC(=O)C(=O)OCC 11a_100000102301_100014798877 [0,1,1,0,0,0|1,0,1]=4 4631 B11R0.155 CCCCNC(=O)C(=O)OCC 1626a_100000102301_100014798877 [0,1,1,0,0,0|1,0,1]=4 4632 B11R0.155 CCCCNC(=O)C(=O)OCC 240690a_100000102301_100014798877 [0,1,1,0,0,0|1,0,1]=4 4633 B11R0.155 CCCCNC(C)C(=O)NCC 2230a_100000102301_100000230173 [0,1,1,0,0,0|2,0,0]=4 4634 B11R0.155 CCCCNC(C)C(=O)NCC 2230a_100000736553_100000210211 [0,1,1,0,0,0|2,0,0]=4 4635 B11R0.155 CCCCNC(C)C(=O)NCC 34a_100000736553_100000210210 [0,1,1,0,0,0|2,0,0]=4 4636 B11R0.155 CCCCNC(C)C(=O)NCC 7a_106832991798_100000230173 [0,1,1,0,0,0|2,0,0]=4 4637 B11R0.155 CCCCNC(C)C(=O)OCC 2230a_100000102301_100011215307 [0,1,1,0,0,0|1,0,0]=3 4638 B11R0.155 CCCCNC(C)C(=O)OCC 7a_106832991798_100011216346 [0,1,1,0,0,0|1,0,0]=3 4639 B11R0.155 CCCCNC(F)C(=O)OCC 2230a_100000102301_100000760018 [0,1,1,0,0,0|1,0,0]=3 4640 B11R0.155 CCCCNC(F)C(=O)OCC 7a_106832991798_100000040065 [0,1,1,0,0,0|1,0,0]=3 4641 B11R0.155 CCCCN[C@@H](C)C(=O)SCC 2230a_100103168634_100000210211 [0,1,1,0,0,0|1,1,0]=4 4642 B11R0.155 CCCCOC(C)C(=O)NCC 34a_100000210227_100000230173 [0,1,1,0,0,0|2,0,0]=4 4643 B11R0.155 CCCCOC(C)C(=O)NCC 7a_100000210227_100000230173 [0,1,1,0,0,0|2,0,0]=4 4644 B11R0.155 CCCCOC(C)C(=O)OCC 34a_100000210227_100011216346 [0,1,1,0,0,0|1,0,0]=3 4645 B11R0.155 CCCCOC(C)C(=O)OCC 7a_100000210227_100011216346 [0,1,1,0,0,0|1,0,0]=3 4646 B11R0.155 CCCCOC(F)C(=O)OCC 34a_100000210227_100000760018 [0,1,1,0,0,0|1,0,0]=3 4647 B11R0.155 CCCCOC(F)C(=O)OCC 7a_100000210227_100000040065 [0,1,1,0,0,0|1,0,0]=3 4648 B11R0.155 CCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000210211 [0,1,1,0,0,0|1,0,0]=3 4649 B11R0.155 CCCCSC(C)C(=O)CCC 1458a_100000191163_100000210303 [0,1,1,0,0,0|2,0,0]=4 4650 B11R0.155 CCCCSC(C)C(=O)NCC 11a_100015525214_100000191163 [0,1,1,0,0,0|2,0,0]=4 4651 B11R0.155 CCCCSC(C)C(=O)NCC 240690a_100015525214_100000191163 [0,1,1,0,0,0|2,0,0]=4 4652 B11R0.155 CCCCSC(C)C(=O)NCC 527a_100015525214_100000191163 [0,1,1,0,0,0|2,0,0]=4 4653 B11R0.155 CCCCSC(C)C(=O)NCC 62a_100000210211_100000230173 [0,1,1,0,0,0|2,0,0]=4 4654 B11R0.155 CCCCSC(C)C(=O)NCC 62a_100000230173_100000210210 [0,1,1,0,0,0|2,0,0]=4 4655 B11R0.155 CCCCSC(C)C(=O)OCC 62a_100000210211_100011216346 [0,1,1,0,0,0|1,0,0]=3 4656 B11R0.155 CCCCSC(C)C(=O)OCC 62a_100011216346_100000210210 [0,1,1,0,0,0|1,0,0]=3 4657 B11R0.155 CCCCSC(F)C(=O)OCC 62a_100000210211_100000760018 [0,1,1,0,0,0|1,0,0]=3 4658 B11R0.155 CCCCSC(F)C(=O)OCC 62a_100000760018_100000210210 [0,1,1,0,0,0|1,0,0]=3 4659 B11R0.155 CCCSCC(=O)C(=O)OCC 62a_100000210303_100000211299 [0,1,1,0,0,0|1,0,1]=4 4660 B11R0.155 CCCSCC(=O)C(=O)OCC 62a_100000211299_100000210303 [0,1,1,0,0,0|1,0,1]=4 4661 B11R0.155 CCOC(=O)C(C)NCCCF 2230a_100015189416_100011215307 [0,1,1,0,0,0|2,0,0]=4 4662 B11R0.155 CCOC(=O)C(C)NCCCF 34a_100015189416_100011216346 [0,1,1,0,0,0|2,0,0]=4 4663 B11R0.155 CCOC(=O)C(C)NCCOC 2230a_100000209980_100011215307 [0,1,1,0,0,0|2,0,0]=4 4664 B11R0.155 CCOC(=O)C(C)NCCSC 2230a_100020590264_100011215307 [0,1,1,0,0,0|2,0,0]=4 4665 B11R0.155 CCOC(=O)C(C)OCCCBr 34a_100011217188_100011216346 [0,1,1,0,0,0|2,0,0]=4 4666 B11R0.155 CCOC(=O)C(C)OCCCCl 34a_100000230001_100011216346 [0,1,1,0,0,0|2,0,0]=4 4667 B11R0.155 CCOC(=O)C(C)OCCCF 34a_100000759539_100011216346 [0,1,1,0,0,0|2,0,0]=4 4668 B11R0.155 CCOC(=O)C(C)OCCCN 34a_100000182051_100011216346 [0,1,1,0,0,0|2,0,0]=4 4669 B11R0.155 CCOC(=O)C(C)OCCOC 34a_100000210237_100011216346 [0,1,1,0,0,0|2,0,0]=4 4670 B11R0.155 CCOC(=O)C(C)OCCSC 34a_100000230434_100011216346 [0,1,1,0,0,0|2,0,0]=4 4671 B11R0.155 CCOC(=O)C(C)OCCSC 7a_100000230434_100011216346 [0,1,1,0,0,0|2,0,0]=4 4672 B11R0.155 CCOC(=O)C(C)SCCCF 62a_100011216346_100011934791 [0,1,1,0,0,0|2,0,0]=4 4673 B11R0.155 CCOC(=O)C(C)SCCCF 62a_100011934791_100011216346 [0,1,1,0,0,0|2,0,0]=4 4674 B11R0.155 CCOC(=O)C(C)SCCCO 62a_100011215043_100011216346 [0,1,1,0,0,0|2,0,0]=4 4675 B11R0.155 CCOC(=O)C(C)SCCCO 62a_100011216346_100011215043 [0,1,1,0,0,0|2,0,0]=4 4676 B11R0.155 CCOC(=O)C(C)SCCOC 62a_100000233755_100011216346 [0,1,1,0,0,0|2,0,0]=4 4677 B11R0.155 CCOC(=O)C(C)SCCOC 62a_100011216346_100000233755 [0,1,1,0,0,0|2,0,0]=4 4678 B11R0.155 CCOC(=O)C(C)SCCSC 62a_100000212216_100011216346 [0,1,1,0,0,0|2,0,0]=4 4679 B11R0.155 CCOC(=O)C(C)SCCSC 62a_100011216346_100000751147 [0,1,1,0,0,0|2,0,0]=4 4680 B11R0.155 CCOC(=O)C(F)NCCCF 2230a_100015189416_100000760018 [0,1,1,0,0,0|2,0,0]=4 4681 B11R0.155 CCOC(=O)C(F)NCCCF 34a_100015189416_100000760018 [0,1,1,0,0,0|2,0,0]=4 4682 B11R0.155 CCOC(=O)C(F)NCCOC 2230a_100000209980_100000760018 [0,1,1,0,0,0|2,0,0]=4 4683 B11R0.155 CCOC(=O)C(F)NCCSC 2230a_100020590264_100000760018 [0,1,1,0,0,0|2,0,0]=4 4684 B11R0.155 CCOC(=O)C(F)OCCCBr 34a_100011217188_100000760018 [0,1,1,0,0,0|2,0,0]=4 4685 B11R0.155 CCOC(=O)C(F)OCCCCl 34a_100000230001_100000760018 [0,1,1,0,0,0|2,0,0]=4 4686 B11R0.155 CCOC(=O)C(F)OCCCF 34a_100000759539_100000760018 [0,1,1,0,0,0|2,0,0]=4 4687 B11R0.155 CCOC(=O)C(F)OCCCN 34a_100000182051_100000760018 [0,1,1,0,0,0|2,0,0]=4 4688 B11R0.155 CCOC(=O)C(F)OCCOC 34a_100000210237_100000760018 [0,1,1,0,0,0|2,0,0]=4 4689 B11R0.155 CCOC(=O)C(F)OCCSC 34a_100000230434_100000760018 [0,1,1,0,0,0|2,0,0]=4 4690 B11R0.155 CCOC(=O)C(F)OCCSC 7a_100000230434_100000040065 [0,1,1,0,0,0|2,0,0]=4 4691 B11R0.155 CCOC(=O)C(F)SCCCF 62a_100000760018_100011934791 [0,1,1,0,0,0|2,0,0]=4 4692 B11R0.155 CCOC(=O)C(F)SCCCF 62a_100011934791_100000760018 [0,1,1,0,0,0|2,0,0]=4 4693 B11R0.155 CCOC(=O)C(F)SCCCO 62a_100000760018_100011215043 [0,1,1,0,0,0|2,0,0]=4 4694 B11R0.155 CCOC(=O)C(F)SCCCO 62a_100011215043_100000760018 [0,1,1,0,0,0|2,0,0]=4 4695 B11R0.155 CCOC(=O)C(F)SCCOC 62a_100000233755_100000760018 [0,1,1,0,0,0|2,0,0]=4 4696 B11R0.155 CCOC(=O)C(F)SCCOC 62a_100000760018_100000233755 [0,1,1,0,0,0|2,0,0]=4 4697 B11R0.155 CCOC(=O)C(F)SCCSC 62a_100000212216_100000760018 [0,1,1,0,0,0|2,0,0]=4 4698 B11R0.155 CCOC(=O)C(F)SCCSC 62a_100000760018_100000751147 [0,1,1,0,0,0|2,0,0]=4 4699 B11R0.155 CCOC(=O)[C@H](C)OCCCF 7a_100000751109_100011934791 [0,1,1,0,0,0|2,0,0]=4 4700 B11R0.155 CCOC(=O)[C@H](C)OCCCO 7a_100000751109_100011215043 [0,1,1,0,0,0|2,0,0]=4 4701 B11R0.155 CCOC(=O)[C@H](C)OCCOC 7a_100000751109_100000233755 [0,1,1,0,0,0|2,0,0]=4 4702 B11R0.155 CCOC(=O)[C@H](C)OCCSC 7a_100000751109_100000212216 [0,1,1,0,0,0|2,0,0]=4 4703 B11R0.155 CCOCSC(C)C(=O)OCC 62a_100000739092_100011216346 [0,1,1,0,0,0|2,0,0]=4 4704 B11R0.155 CCOCSC(C)C(=O)OCC 62a_100011216346_100000739092 [0,1,1,0,0,0|2,0,0]=4 4705 B11R0.155 CCOCSC(F)C(=O)OCC 62a_100000739092_100000760018 [0,1,1,0,0,0|2,0,0]=4 4706 B11R0.155 CCOCSC(F)C(=O)OCC 62a_100000760018_100000739092 [0,1,1,0,0,0|2,0,0]=4 4707 B11R0.161 C=CC(CCCCCC)OCC 34a_200011215977_100000210202 [0,1,1,0,0,0|1,0,1]=4 4708 B11R0.161 C=CC(CCCCCC)OCC 7a_200011215977_100000210202 [0,1,1,0,0,0|1,0,1]=4 4709 B11R0.161 CCCCCCC(CC)OCC 34a_100011215785_100000210202 [0,1,1,0,0,0|1,0,1]=4 4710 B11R0.161 CCCCCCC(CC)OCC 7a_100011215785_100000210202 [0,1,1,0,0,0|1,0,1]=4 4711 B11R0.174 CCCC(=O)CCCN(C)CC 1458a_100000211992_100015186262 [0,1,1,0,0,0|2,0,0]=4 4712 B11R0.174 CCCC(=O)CNCC(C)CC 2230a_100020588543_100000747444 [0,1,1,0,0,0|2,0,0]=4 4713 B11R0.174 CCCC(=O)CNCC(O)CC 2230a_100011218483_100000747444 [0,1,1,0,0,0|2,0,0]=4 4714 B11R0.174 CCCC(=O)COC[C@@H](C)CC 7a_100009816381_100000747444 [0,1,1,0,0,0|2,0,0]=4 4715 B11R0.174 CCCC(=O)CSCC(C)CC 62a_100000747444_100000748023 [0,1,1,0,0,0|2,0,0]=4 4716 B11R0.174 CCCC(=O)CSCC(C)CC 62a_100000748023_100000747444 [0,1,1,0,0,0|2,0,0]=4 4717 B11R0.174 CCCC(=O)CSCC(O)CC 62a_100000747444_100011218378 [0,1,1,0,0,0|2,0,0]=4 4718 B11R0.174 CCCC(=O)CSCC(O)CC 62a_100011218378_100000747444 [0,1,1,0,0,0|2,0,0]=4 4719 B11R0.174 CCCC(=O)CSC[C@@H](C)CC 62a_100000747444_100009816398 [0,1,1,0,0,0|2,0,0]=4 4720 B11R0.174 CCCC(=O)CSC[C@@H](C)CC 62a_100009816398_100000747444 [0,1,1,0,0,0|2,0,0]=4 4721 B11R0.174 CCCC(=O)NCCC(C)CC 11a_100020591266_100000211992 [0,1,1,0,0,0|2,0,0]=4 4722 B11R0.174 CCCC(=O)NCCC(C)CC 1626a_100020591266_100000211992 [0,1,1,0,0,0|2,0,0]=4 4723 B11R0.174 CCCC(=O)NCCC(C)CC 240690a_100020591266_100000211992 [0,1,1,0,0,0|2,0,0]=4 4724 B11R0.174 CCCC(=O)NCCC(C)CC 527a_100020591266_100000211992 [0,1,1,0,0,0|2,0,0]=4 4725 B11R0.174 CCNC(=O)CCCC(=O)CC 1458a_100000199580_100000210202 [0,1,1,0,0,0|1,0,1]=4 4726 B11R0.174 CCNC(=O)CCNC(C)CC 2230a_100000209981_100000737597 [0,1,1,0,0,0|2,0,0]=4 4727 B11R0.174 CCNC(=O)CCNC(C)CC 34a_100025743525_100011215416 [0,1,1,0,0,0|2,0,0]=4 4728 B11R0.174 CCNC(=O)CCOC(C)CC 7a_100000210228_100000737597 [0,1,1,0,0,0|2,0,0]=4 4729 B11R0.174 CCNC(=O)CCSC(C)CC 62a_100000737597_100000758301 [0,1,1,0,0,0|2,0,0]=4 4730 B11R0.174 CCNC(=O)CCSC(C)CC 62a_100000758301_100000737597 [0,1,1,0,0,0|2,0,0]=4 4731 B11R0.174 CCNC(=O)CNCC(C)CC 2230a_100016988866_100000748023 [0,1,1,0,0,0|2,0,0]=4 4732 B11R0.174 CCNC(=O)CNCC(C)CC 2230a_100020588543_100000183381 [0,1,1,0,0,0|2,0,0]=4 4733 B11R0.174 CCNC(=O)CNCC(C)CC 270004a_100016988866_100000243153 [0,1,1,0,0,0|2,0,0]=4 4734 B11R0.174 CCNC(=O)CNCC(O)CC 2230a_100011218483_100000183381 [0,1,1,0,0,0|2,0,0]=4 4735 B11R0.174 CCNC(=O)CNCC(O)CC 2230a_100016988866_100011218378 [0,1,1,0,0,0|2,0,0]=4 4736 B11R0.174 CCNC(=O)CNC[C@@H](C)CC 2230a_100016988866_100009816398 [0,1,1,0,0,0|2,0,0]=4 4737 B11R0.174 CCNC(=O)COC[C@@H](C)CC 7a_100009816381_100000183381 [0,1,1,0,0,0|2,0,0]=4 4738 B11R0.174 CCNC(=O)CSCC(C)CC 62a_100000183381_100000748023 [0,1,1,0,0,0|2,0,0]=4 4739 B11R0.174 CCNC(=O)CSCC(C)CC 62a_100000748023_100000183381 [0,1,1,0,0,0|2,0,0]=4 4740 B11R0.174 CCNC(=O)CSCC(O)CC 62a_100000183381_100011218378 [0,1,1,0,0,0|2,0,0]=4 4741 B11R0.174 CCNC(=O)CSCC(O)CC 62a_100011218378_100000183381 [0,1,1,0,0,0|2,0,0]=4 4742 B11R0.174 CCNC(=O)CSC[C@@H](C)CC 62a_100000183381_100009816398 [0,1,1,0,0,0|2,0,0]=4 4743 B11R0.174 CCNC(=O)CSC[C@@H](C)CC 62a_100009816398_100000183381 [0,1,1,0,0,0|2,0,0]=4 4744 B11R0.174 CCNC(=O)NCCC(C)CC 2708a_100015525214_100020591266 [0,1,1,0,0,0|2,0,0]=4 4745 B11R0.174 CCNC(=O)NCCC(C)CC 2708a_100020591266_100015525214 [0,1,1,0,0,0|2,0,0]=4 4746 B11R0.174 CCNC(=O)NCCC(C)CC 273464a_100015525214_100020591266 [0,1,1,0,0,0|2,0,0]=4 4747 B11R0.174 CCNC(=O)NCCC(C)CC 273464a_100020591266_100015525214 [0,1,1,0,0,0|2,0,0]=4 4748 B11R0.174 CCNC(=O)NCCC(C)CC 512a_100015525214_100020591266 [0,1,1,0,0,0|2,0,0]=4 4749 B11R0.174 CCNC(=O)NCCC(C)CC 512a_100020591266_100015525214 [0,1,1,0,0,0|2,0,0]=4 4750 B11R0.174 CCOC(=O)CCCC(=O)CC 1458a_100000210414_100011215271 [0,1,1,0,0,0|0,0,1]=3 4751 B11R0.174 CCOC(=O)CCCC(=O)CC 1458a_100000210991_100000210202 [0,1,1,0,0,0|0,0,1]=3 4752 B11R0.174 CCOC(=O)CCCC(=O)CF 1458a_100000210991_100015361967 [0,1,1,0,0,0|1,0,1]=4 4753 B11R0.174 CCOC(=O)CCCC(=O)CO 1458a_100000210174_100011215271 [0,1,1,0,0,0|1,0,1]=4 4754 B11R0.174 CCOC(=O)CCCC(=O)NC 11a_106832991635_100000210991 [0,1,1,0,0,0|1,0,1]=4 4755 B11R0.174 CCOC(=O)CCCC(=O)NC 1626a_100102657272_100000210991 [0,1,1,0,0,0|1,0,1]=4 4756 B11R0.174 CCOC(=O)CCCC(=O)NC 240690a_100102657272_100000210991 [0,1,1,0,0,0|1,0,1]=4 4757 B11R0.174 CCOC(=O)CCCC(=O)NC 527a_100102657272_100000210991 [0,1,1,0,0,0|1,0,1]=4 4758 B11R0.174 CCOC(=O)CCCN(C)CC 2230a_100000225621_100009991533 [0,1,1,0,0,0|1,0,0]=3 4759 B11R0.174 CCOC(=O)CCCN(C)CC 269982a_100000225621_100009991533 [0,1,1,0,0,0|1,0,0]=3 4760 B11R0.174 CCOC(=O)CCNC(=O)CC 188690a_100000746078_100000210414 [0,1,1,0,0,0|1,0,1]=4 4761 B11R0.174 CCOC(=O)CCNC(C)CC 2230a_100000209981_100011206558 [0,1,1,0,0,0|1,0,0]=3 4762 B11R0.174 CCOC(=O)CCN[C@H](C)CO 2230a_100000737577_100011206558 [0,1,1,0,0,0|2,0,0]=4 4763 B11R0.174 CCOC(=O)CCOC(C)CC 7a_100000210228_100011206558 [0,1,1,0,0,0|1,0,0]=3 4764 B11R0.174 CCOC(=O)CCOC(C)CF 34a_100016041109_100000765890 [0,1,1,0,0,0|2,0,0]=4 4765 B11R0.174 CCOC(=O)CCOC(C)CF 7a_100016041109_100011206558 [0,1,1,0,0,0|2,0,0]=4 4766 B11R0.174 CCOC(=O)CCOC(C)CN 34a_100000210904_100000765890 [0,1,1,0,0,0|2,0,0]=4 4767 B11R0.174 CCOC(=O)CCSC(C)CC 62a_100000758301_100000765890 [0,1,1,0,0,0|1,0,0]=3 4768 B11R0.174 CCOC(=O)CCSC(C)CC 62a_100000765890_100000758301 [0,1,1,0,0,0|1,0,0]=3 4769 B11R0.174 CCOC(=O)CCSC(C)CO 62a_100012180447_100000765890 [0,1,1,0,0,0|2,0,0]=4 4770 B11R0.174 CCOC(=O)CCSC(C)OC 62a_100000765890_100009879195 [0,1,1,0,0,0|2,0,0]=4 4771 B11R0.174 CCOC(=O)CCSC(C)OC 62a_100009879195_100000765890 [0,1,1,0,0,0|2,0,0]=4 4772 B11R0.174 CCOC(=O)CCS[C@H](C)CO 62a_100000765890_100016084084 [0,1,1,0,0,0|2,0,0]=4 4773 B11R0.174 CCOC(=O)CCS[C@H](C)CO 62a_100016084084_100000765890 [0,1,1,0,0,0|2,0,0]=4 4774 B11R0.174 CCOC(=O)CNCC(C)CC 2230a_100020588543_100000188475 [0,1,1,0,0,0|1,0,0]=3 4775 B11R0.174 CCOC(=O)CNCC(C)CO 34a_100000744482_100000188475 [0,1,1,0,0,0|2,0,0]=4 4776 B11R0.174 CCOC(=O)CNCC(O)CC 2230a_100011218483_100000188475 [0,1,1,0,0,0|1,0,0]=3 4777 B11R0.174 CCOC(=O)CNC[C@@H](C)OC 2230a_100020591295_100000188475 [0,1,1,0,0,0|2,0,0]=4 4778 B11R0.174 CCOC(=O)CNC[C@@H](F)CO 34a_100015665980_100000188475 [0,1,1,0,0,0|2,0,0]=4 4779 B11R0.174 CCOC(=O)CNC[C@H](O)CO 2230a_100020644852_100000188475 [0,1,1,0,0,0|2,0,0]=4 4780 B11R0.174 CCOC(=O)COCC(=O)CC 34a_100000725409_100000188475 [0,1,1,0,0,0|1,0,1]=4 4781 B11R0.174 CCOC(=O)COCC(C)CN 34a_100000744482_100000188475 [0,1,1,0,0,0|2,0,0]=4 4782 B11R0.174 CCOC(=O)COCC(C)OC 34a_100000690652_100000188475 [0,1,1,0,0,0|2,0,0]=4 4783 B11R0.174 CCOC(=O)COCC(Cl)CCl 34a_100000033668_100000188475 [0,1,1,0,0,0|2,0,0]=4 4784 B11R0.174 CCOC(=O)COC[C@@H](C)CC 7a_100009816381_100000188475 [0,1,1,0,0,0|1,0,0]=3 4785 B11R0.174 CCOC(=O)COC[C@H](F)CN 34a_100015665980_100000188475 [0,1,1,0,0,0|2,0,0]=4 4786 B11R0.174 CCOC(=O)CSCC(=O)CC 62a_100000188475_100000747405 [0,1,1,0,0,0|1,0,1]=4 4787 B11R0.174 CCOC(=O)CSCC(=O)CC 62a_100000747405_100000188475 [0,1,1,0,0,0|1,0,1]=4 4788 B11R0.174 CCOC(=O)CSCC(C)CC 62a_100000188475_100000748023 [0,1,1,0,0,0|1,0,0]=3 4789 B11R0.174 CCOC(=O)CSCC(C)CC 62a_100000748023_100000188475 [0,1,1,0,0,0|1,0,0]=3 4790 B11R0.174 CCOC(=O)CSCC(O)CC 62a_100000188475_100011218378 [0,1,1,0,0,0|1,0,0]=3 4791 B11R0.174 CCOC(=O)CSCC(O)CC 62a_100011218378_100000188475 [0,1,1,0,0,0|1,0,0]=3 4792 B11R0.174 CCOC(=O)CSCC(O)CO 62a_100000188475_100011219619 [0,1,1,0,0,0|2,0,0]=4 4793 B11R0.174 CCOC(=O)CSCC(O)CO 62a_100011219619_100000188475 [0,1,1,0,0,0|2,0,0]=4 4794 B11R0.174 CCOC(=O)CSC[C@@H](C)CC 62a_100000188475_100009816398 [0,1,1,0,0,0|1,0,0]=3 4795 B11R0.174 CCOC(=O)CSC[C@@H](C)CC 62a_100009816398_100000188475 [0,1,1,0,0,0|1,0,0]=3 4796 B11R0.174 CCOC(=O)CSC[C@@H](C)CO 62a_100000059175_100000188475 [0,1,1,0,0,0|2,0,0]=4 4797 B11R0.174 CCOC(=O)CSC[C@@H](C)CO 62a_100000188475_100000059175 [0,1,1,0,0,0|2,0,0]=4 4798 B11R0.174 CCOC(=O)CSC[C@@H](O)CF 62a_100000188475_100015614560 [0,1,1,0,0,0|2,0,0]=4 4799 B11R0.174 CCOC(=O)CSC[C@@H](O)CF 62a_100015614560_100000188475 [0,1,1,0,0,0|2,0,0]=4 4800 B11R0.174 CCOC(=O)CSC[C@@H](O)CO 62a_100000188475_100009815848 [0,1,1,0,0,0|2,0,0]=4 4801 B11R0.174 CCOC(=O)CSC[C@@H](O)CO 62a_100009815848_100000188475 [0,1,1,0,0,0|2,0,0]=4 4802 B11R0.174 CCOC(=O)NCCC(=O)CC 1458a_100000210414_200011445536 [0,1,1,0,0,0|1,0,1]=4 4803 B11R0.174 CCOC(=O)NCCN(C)CC 269982a_100000225621_200011445536 [0,1,1,0,0,0|2,0,0]=4 4804 B11R0.174 CCOC(=O)OCSC(C)CC 62a_100000758301_100000075025 [0,1,1,0,0,0|2,0,0]=4 4805 B11R0.176 C=C(C)CCOCC(=O)OCC 34a_100000764851_100000188475 [0,1,1,0,0,0|1,0,1]=4 4806 B11R0.176 C=C(C)CCSCC(=O)OCC 62a_100000188475_100000730704 [0,1,1,0,0,0|1,0,1]=4 4807 B11R0.176 C=C(C)CCSCC(=O)OCC 62a_100000730704_100000188475 [0,1,1,0,0,0|1,0,1]=4 4808 B11R0.176 C=C(C)COCCC(=O)OCC 34a_100000210245_100000765890 [0,1,1,0,0,0|1,0,1]=4 4809 B11R0.176 C=C(C)CSCCC(=O)OCC 62a_100000748629_100000765890 [0,1,1,0,0,0|1,0,1]=4 4810 B11R0.176 C=C(C)CSCCC(=O)OCC 62a_100000765890_100000211660 [0,1,1,0,0,0|1,0,1]=4 4811 B11R0.176 CC#CC(=O)CCCCC(C)C 1458a_100000763181_100011216152 [0,1,1,0,0,0|1,0,1]=4 4812 B11R0.176 CC(C)CCCCC(=O)CCF 1458a_100011933920_100011217306 [0,1,1,0,0,0|2,0,0]=4 4813 B11R0.176 CC(C)CCCCC(=O)CCO 1458a_100011216618_100011216152 [0,1,1,0,0,0|2,0,0]=4 4814 B11R0.176 CC(C)CCCCC(=O)CCO 1458a_100011933920_100000211926 [0,1,1,0,0,0|2,0,0]=4 4815 B11R0.176 CC=CC(=O)CCCCC(C)C 1458a_100000210699_100011216152 [0,1,1,0,0,0|1,0,1]=4 4816 B11R0.176 CCCC(=O)CCCCC(=O)C 1458a_100000211992_100000735457 [0,1,1,0,0,0|1,0,1]=4 4817 B11R0.176 CCCC(=O)CCCCC(C)C 1458a_100000211992_100011216152 [0,1,1,0,0,0|1,0,0]=3 4818 B11R0.176 CCCC(=O)CCCCC(C)C 1458a_100011933920_100000210303 [0,1,1,0,0,0|1,0,0]=3 4819 B11R0.176 CCCC(=O)CNCCC(C)O 2230a_200000755665_100000747444 [0,1,1,0,0,0|2,0,0]=4 4820 B11R0.176 CCCC(=O)COCCC(C)C 7a_100000210254_100000747444 [0,1,1,0,0,0|2,0,0]=4 4821 B11R0.176 CCCC(=O)CSCCC(C)C 62a_100000210312_100000747444 [0,1,1,0,0,0|2,0,0]=4 4822 B11R0.176 CCCC(=O)CSCCC(C)C 62a_100000747444_100000210312 [0,1,1,0,0,0|2,0,0]=4 4823 B11R0.176 CCCC(=O)CSCCC(C)O 62a_100000747444_100012276601 [0,1,1,0,0,0|2,0,0]=4 4824 B11R0.176 CCCC(=O)CSCCC(C)O 62a_100012276601_100000747444 [0,1,1,0,0,0|2,0,0]=4 4825 B11R0.176 CCCC(=O)NCCCC(C)C 11a_200000737386_100000211992 [0,1,1,0,0,0|2,0,0]=4 4826 B11R0.176 CCCC(=O)NCCCC(C)C 1626a_200000737386_100000211992 [0,1,1,0,0,0|2,0,0]=4 4827 B11R0.176 CCCC(=O)NCCCC(C)C 240690a_200000737386_100000211992 [0,1,1,0,0,0|2,0,0]=4 4828 B11R0.176 CCCC(=O)NCCCC(C)C 527a_200000737386_100000211992 [0,1,1,0,0,0|2,0,0]=4 4829 B11R0.176 CCNC(=O)CCCCC(C)C 11a_100015525214_100011933920 [0,1,1,0,0,0|1,0,0]=3 4830 B11R0.176 CCNC(=O)CCCCC(C)C 240690a_100015525214_100011933920 [0,1,1,0,0,0|1,0,0]=3 4831 B11R0.176 CCNC(=O)CCCCC(C)C 527a_100015525214_100011933920 [0,1,1,0,0,0|1,0,0]=3 4832 B11R0.176 CCNC(=O)CCCCN(C)C 11a_100015525214_100000751710 [0,1,1,0,0,0|2,0,0]=4 4833 B11R0.176 CCNC(=O)CCCCN(C)C 240690a_100015525214_100000751710 [0,1,1,0,0,0|2,0,0]=4 4834 B11R0.176 CCNC(=O)CCCCN(C)C 527a_100015525214_100000751710 [0,1,1,0,0,0|2,0,0]=4 4835 B11R0.176 CCNC(=O)CCNCC(C)C 2230a_100000210953_100000737597 [0,1,1,0,0,0|2,0,0]=4 4836 B11R0.176 CCNC(=O)CCNCC(C)C 270004a_100025743525_100000210432 [0,1,1,0,0,0|2,0,0]=4 4837 B11R0.176 CCNC(=O)CCNCC(C)C 34a_100025743525_100000210624 [0,1,1,0,0,0|2,0,0]=4 4838 B11R0.176 CCNC(=O)CCNCC(C)O 2230a_100000210904_100000737597 [0,1,1,0,0,0|2,0,0]=4 4839 B11R0.176 CCNC(=O)CCNCC(C)O 34a_100025743525_100011218427 [0,1,1,0,0,0|2,0,0]=4 4840 B11R0.176 CCNC(=O)CCNC[C@@H](C)O 34a_100025743525_100009817552 [0,1,1,0,0,0|2,0,0]=4 4841 B11R0.176 CCNC(=O)CCSCC(C)C 62a_100000210624_100000737597 [0,1,1,0,0,0|2,0,0]=4 4842 B11R0.176 CCNC(=O)CCSCC(C)C 62a_100000737597_100000210760 [0,1,1,0,0,0|2,0,0]=4 4843 B11R0.176 CCNC(=O)CCSCC(C)O 62a_100000737597_100011218427 [0,1,1,0,0,0|2,0,0]=4 4844 B11R0.176 CCNC(=O)CCSCC(C)O 62a_100011218427_100000737597 [0,1,1,0,0,0|2,0,0]=4 4845 B11R0.176 CCNC(=O)CCSC[C@@H](C)O 62a_100000737597_100009817552 [0,1,1,0,0,0|2,0,0]=4 4846 B11R0.176 CCNC(=O)CCSC[C@@H](C)O 62a_100009817552_100000737597 [0,1,1,0,0,0|2,0,0]=4 4847 B11R0.176 CCNC(=O)CNCCC(C)C 2230a_100016988866_100000210312 [0,1,1,0,0,0|2,0,0]=4 4848 B11R0.176 CCNC(=O)CNCCC(C)O 2230a_100016988866_100012276601 [0,1,1,0,0,0|2,0,0]=4 4849 B11R0.176 CCNC(=O)CNCCC(C)O 2230a_200000755665_100000183381 [0,1,1,0,0,0|2,0,0]=4 4850 B11R0.176 CCNC(=O)COCCC(C)Br 34a_100009893172_100000183381 [0,1,1,0,0,0|2,0,0]=4 4851 B11R0.176 CCNC(=O)COCCC(C)C 34a_100000210254_100000183381 [0,1,1,0,0,0|2,0,0]=4 4852 B11R0.176 CCNC(=O)COCCC(C)C 7a_100000210254_100000183381 [0,1,1,0,0,0|2,0,0]=4 4853 B11R0.176 CCNC(=O)COCC[C@@H](C)N 34a_100000706166_100000183381 [0,1,1,0,0,0|2,0,0]=4 4854 B11R0.176 CCNC(=O)CSCCC(C)C 62a_100000183381_100000210312 [0,1,1,0,0,0|2,0,0]=4 4855 B11R0.176 CCNC(=O)CSCCC(C)C 62a_100000210312_100000183381 [0,1,1,0,0,0|2,0,0]=4 4856 B11R0.176 CCNC(=O)CSCCC(C)O 62a_100000183381_100012276601 [0,1,1,0,0,0|2,0,0]=4 4857 B11R0.176 CCNC(=O)CSCCC(C)O 62a_100012276601_100000183381 [0,1,1,0,0,0|2,0,0]=4 4858 B11R0.176 CCNC(=O)NCCCC(C)C 2708a_100015525214_200000737386 [0,1,1,0,0,0|2,0,0]=4 4859 B11R0.176 CCNC(=O)NCCCC(C)C 2708a_200000737386_100015525214 [0,1,1,0,0,0|2,0,0]=4 4860 B11R0.176 CCNC(=O)NCCCC(C)C 273464a_100015525214_200000737386 [0,1,1,0,0,0|2,0,0]=4 4861 B11R0.176 CCNC(=O)NCCCC(C)C 273464a_200000737386_100015525214 [0,1,1,0,0,0|2,0,0]=4 4862 B11R0.176 CCNC(=O)NCCCC(C)C 512a_100015525214_200000737386 [0,1,1,0,0,0|2,0,0]=4 4863 B11R0.176 CCNC(=O)NCCCC(C)C 512a_200000737386_100015525214 [0,1,1,0,0,0|2,0,0]=4 4864 B11R0.176 CCOC(=O)CCCCC(=O)C 1458a_100000070787_100000750268 [0,1,1,0,0,0|0,0,1]=3 4865 B11R0.176 CCOC(=O)CCCCC(=O)C 1458a_100011217402_200000210301 [0,1,1,0,0,0|0,0,1]=3 4866 B11R0.176 CCOC(=O)CCCCC(=O)[13CH3] 1458a_100011217402_200025704644 [0,1,1,0,0,0|0,0,1]=3 4867 B11R0.176 CCOC(=O)CCCCN(C)C 2230a_100102631434_100000750268 [0,1,1,0,0,0|1,0,0]=3 4868 B11R0.176 CCOC(=O)CCCCN(C)C 269982a_100102631434_100000750268 [0,1,1,0,0,0|1,0,0]=3 4869 B11R0.176 CCOC(=O)CCCNC(=O)C 188690a_100000211256_100015343762 [0,1,1,0,0,0|1,0,1]=4 4870 B11R0.176 CCOC(=O)CCCNC(C)C 2230a_100138425928_100009991533 [0,1,1,0,0,0|1,0,0]=3 4871 B11R0.176 CCOC(=O)CCCNC(C)C 34a_100138425928_100009991533 [0,1,1,0,0,0|1,0,0]=3 4872 B11R0.176 CCOC(=O)CCCOC(C)C 34a_100000212225_100009991533 [0,1,1,0,0,0|1,0,0]=3 4873 B11R0.176 CCOC(=O)CCCOC(C)C 7a_100012001163_100000210206 [0,1,1,0,0,0|1,0,0]=3 4874 B11R0.176 CCOC(=O)CCCSC(C)C 62a_100000210206_100009991533 [0,1,1,0,0,0|1,0,0]=3 4875 B11R0.176 CCOC(=O)CCCSC(C)C 62a_100009991533_100000210206 [0,1,1,0,0,0|1,0,0]=3 4876 B11R0.176 CCOC(=O)CCNCC(C)C 2230a_100000210953_100011206558 [0,1,1,0,0,0|1,0,0]=3 4877 B11R0.176 CCOC(=O)CCNCC(C)C 34a_100000210953_100000765890 [0,1,1,0,0,0|1,0,0]=3 4878 B11R0.176 CCOC(=O)CCNCC(C)O 2230a_100000210904_100011206558 [0,1,1,0,0,0|1,0,0]=3 4879 B11R0.176 CCOC(=O)CCNCC(C)O 34a_100000210904_100000765890 [0,1,1,0,0,0|1,0,0]=3 4880 B11R0.176 CCOC(=O)CCNCC(F)F 34a_100000765723_100000765890 [0,1,1,0,0,0|2,0,0]=4 4881 B11R0.176 CCOC(=O)CCOCC(=O)C 34a_100000211253_100000765890 [0,1,1,0,0,0|1,0,1]=4 4882 B11R0.176 CCOC(=O)CCOCC(C)Br 34a_100012180447_100000765890 [0,1,1,0,0,0|1,0,0]=3 4883 B11R0.176 CCOC(=O)CCOCC(C)C 34a_100000210257_100000765890 [0,1,1,0,0,0|1,0,0]=3 4884 B11R0.176 CCOC(=O)CCOCC(C)F 34a_100015925927_100000765890 [0,1,1,0,0,0|1,0,0]=3 4885 B11R0.176 CCOC(=O)CCOCC(F)F 34a_100000743014_100000765890 [0,1,1,0,0,0|2,0,0]=4 4886 B11R0.176 CCOC(=O)CCOC[C@@H](C)Cl 34a_100016084084_100000765890 [0,1,1,0,0,0|1,0,0]=3 4887 B11R0.176 CCOC(=O)CCOC[C@@H](C)N 34a_100000737577_100000765890 [0,1,1,0,0,0|1,0,0]=3 4888 B11R0.176 CCOC(=O)CCSCC(C)C 62a_100000210624_100000765890 [0,1,1,0,0,0|1,0,0]=3 4889 B11R0.176 CCOC(=O)CCSCC(C)C 62a_100000765890_100000210760 [0,1,1,0,0,0|1,0,0]=3 4890 B11R0.176 CCOC(=O)CCSCC(C)O 62a_100000765890_100011218427 [0,1,1,0,0,0|1,0,0]=3 4891 B11R0.176 CCOC(=O)CCSCC(C)O 62a_100011218427_100000765890 [0,1,1,0,0,0|1,0,0]=3 4892 B11R0.176 CCOC(=O)CCSCC(F)F 62a_100000765890_100011934356 [0,1,1,0,0,0|2,0,0]=4 4893 B11R0.176 CCOC(=O)CCSCC(F)F 62a_100011934356_100000765890 [0,1,1,0,0,0|2,0,0]=4 4894 B11R0.176 CCOC(=O)CCSC[C@@H](C)O 62a_100000765890_100009817552 [0,1,1,0,0,0|1,0,0]=3 4895 B11R0.176 CCOC(=O)CCSC[C@@H](C)O 62a_100009817552_100000765890 [0,1,1,0,0,0|1,0,0]=3 4896 B11R0.176 CCOC(=O)CNCCC(C)O 2230a_200000755665_100000188475 [0,1,1,0,0,0|1,0,0]=3 4897 B11R0.176 CCOC(=O)COCCC(=O)C 1458a_100000070787_100000088970 [0,1,1,0,0,0|1,0,1]=4 4898 B11R0.176 CCOC(=O)COCCC(=O)C 34a_100000759926_100000188475 [0,1,1,0,0,0|1,0,1]=4 4899 B11R0.176 CCOC(=O)COCCC(=O)C 7a_100000759926_100000188475 [0,1,1,0,0,0|1,0,1]=4 4900 B11R0.176 CCOC(=O)COCCC(C)Br 34a_100009893172_100000188475 [0,1,1,0,0,0|1,0,0]=3 4901 B11R0.176 CCOC(=O)COCCC(C)C 34a_100000210254_100000188475 [0,1,1,0,0,0|1,0,0]=3 4902 B11R0.176 CCOC(=O)COCCC(C)C 7a_100000210254_100000188475 [0,1,1,0,0,0|1,0,0]=3 4903 B11R0.176 CCOC(=O)COCCC(F)F 34a_100103093639_100000188475 [0,1,1,0,0,0|2,0,0]=4 4904 B11R0.176 CCOC(=O)COCCN(C)C 2230a_100102631434_100000088970 [0,1,1,0,0,0|2,0,0]=4 4905 B11R0.176 CCOC(=O)COCCN(C)C 269982a_100102631434_100000088970 [0,1,1,0,0,0|2,0,0]=4 4906 B11R0.176 CCOC(=O)COCC[C@@H](C)N 34a_100000706166_100000188475 [0,1,1,0,0,0|1,0,0]=3 4907 B11R0.176 CCOC(=O)CSCCC(=O)C 62a_100000053229_100000188475 [0,1,1,0,0,0|1,0,1]=4 4908 B11R0.176 CCOC(=O)CSCCC(=O)C 62a_100000188475_100000053229 [0,1,1,0,0,0|1,0,1]=4 4909 B11R0.176 CCOC(=O)CSCCC(C)C 62a_100000188475_100000210312 [0,1,1,0,0,0|1,0,0]=3 4910 B11R0.176 CCOC(=O)CSCCC(C)C 62a_100000210312_100000188475 [0,1,1,0,0,0|1,0,0]=3 4911 B11R0.176 CCOC(=O)CSCCC(C)O 62a_100000188475_100012276601 [0,1,1,0,0,0|1,0,0]=3 4912 B11R0.176 CCOC(=O)CSCCC(C)O 62a_100012276601_100000188475 [0,1,1,0,0,0|1,0,0]=3 4913 B11R0.176 CCOC(=O)CSCCN(C)C 62a_100000188475_100000755713 [0,1,1,0,0,0|2,0,0]=4 4914 B11R0.176 CCOC(=O)CSCOC(C)C 62a_100000188475_100000709892 [0,1,1,0,0,0|2,0,0]=4 4915 B11R0.176 CCOC(=O)CSCOC(C)C 62a_100000709892_100000188475 [0,1,1,0,0,0|2,0,0]=4 4916 B11R0.176 CCOC(=O)NCCOC(C)C 34a_100000158857_100000210206 [0,1,1,0,0,0|2,0,0]=4 4917 B11R0.176 CCOC(=O)NCCSC(C)C 62a_100000210206_200011445536 [0,1,1,0,0,0|2,0,0]=4 4918 B11R0.176 CCOC(=O)OCSCC(C)C 62a_100000210624_100000075025 [0,1,1,0,0,0|2,0,0]=4 4919 B11R0.176 CCOC(=O)OCSCC(C)O 62a_100011218427_100000075025 [0,1,1,0,0,0|2,0,0]=4 4920 B11R0.176 CCOC(=O)OCSC[C@@H](C)O 62a_100009817552_100000075025 [0,1,1,0,0,0|2,0,0]=4 4921 B11R0.176 CNNC(=O)CCCCC(C)C 22a_100016993582_100011933920 [0,1,1,0,0,0|2,0,0]=4 4922 B11R0.176 COCC(=O)CCCCC(C)C 1458a_100000210968_100011216152 [0,1,1,0,0,0|2,0,0]=4 4923 B11R0.176 CSCC(=O)CCCCC(C)C 1458a_100000184570_100011216152 [0,1,1,0,0,0|2,0,0]=4 4924 B11R0.304 CCCCCCC(C)(C)OCC 7a_200011995690_100000210202 [0,1,1,0,0,0|1,0,1]=4 4925 B11R0.304 CCCCCCS(=O)(=O)NCC 270084a_100015525214_100011361803 [0,1,1,0,0,0|2,0,0]=4 4926 B11R0.304 CCCCCCS(=O)(=O)NCC 274078a_100015525214_100011361803 [0,1,1,0,0,0|2,0,0]=4 4927 B11R0.11 C#CCCC(=O)C(C)CCCC 1458a_100000692101_200011215066 [0,1,1,0,0,0|1,0,1]=4 4928 B11R0.11 C#CCCC(=O)C(C)CCCC 1458a_100000725509_100000753159 [0,1,1,0,0,0|1,0,1]=4 4929 B11R0.11 C#CCNC(=O)C(C)CCCC 11a_100000212058_100000725509 [0,1,1,0,0,0|1,0,1]=4 4930 B11R0.11 C#CCNC(=O)C(C)CCCC 1626a_100000212058_100000725509 [0,1,1,0,0,0|1,0,1]=4 4931 B11R0.11 C#CCNC(=O)C(C)CCCC 240690a_100000212058_100000725509 [0,1,1,0,0,0|1,0,1]=4 4932 B11R0.11 C#CCNC(=O)C(C)CCCC 527a_100000212058_100000725509 [0,1,1,0,0,0|1,0,1]=4 4933 B11R0.11 C/C=C/CC(=O)C(C)CCCC 1458a_100000725509_100102629194 [0,1,1,0,0,0|1,0,1]=4 4934 B11R0.11 C=CCCC(=O)C(C)CCCC 1458a_100000725509_100000754431 [0,1,1,0,0,0|1,0,1]=4 4935 B11R0.11 C=CCCC(=O)C(C)CCCC 1458a_100000749702_200011215066 [0,1,1,0,0,0|1,0,1]=4 4936 B11R0.11 C=CCNC(=O)C(C)CCCC 1626a_100020586998_100000725509 [0,1,1,0,0,0|1,0,1]=4 4937 B11R0.11 C=CCNC(=O)C(C)CCCC 240690a_100020586998_100000725509 [0,1,1,0,0,0|1,0,1]=4 4938 B11R0.11 C=CCNC(=O)C(C)CCCC 527a_100020586998_100000725509 [0,1,1,0,0,0|1,0,1]=4 4939 B11R0.11 CC#CCC(=O)C(C)CCCC 1458a_100000725509_100000748600 [0,1,1,0,0,0|1,0,1]=4 4940 B11R0.11 CC=CCC(=O)C(C)CCCC 1458a_100000725509_100000070051 [0,1,1,0,0,0|1,0,1]=4 4941 B11R0.11 CC=CCC(=O)C(C)CCCC 1458a_100121576822_200011215066 [0,1,1,0,0,0|1,0,1]=4 4942 B11R0.11 CCC#CC(=O)C(C)CCCC 1458a_100011827653_200011215066 [0,1,1,0,0,0|1,0,0]=3 4943 B11R0.11 CCC=CC(=O)C(C)CCCC 1458a_100000212282_200011215066 [0,1,1,0,0,0|1,0,0]=3 4944 B11R0.11 CCC=CC(=O)N(C)CCCC 11a_100000207549_100000212282 [0,1,1,0,0,0|2,0,0]=4 4945 B11R0.11 CCC=CC(=O)N(C)CCCC 1626a_100000207549_100000212282 [0,1,1,0,0,0|2,0,0]=4 4946 B11R0.11 CCC=CC(=O)N(C)CCCC 240690a_100000207549_100000212282 [0,1,1,0,0,0|2,0,0]=4 4947 B11R0.11 CCCCC(=O)C(C)CCCC 1458a_100000210183_200011215066 [0,1,1,0,0,0|1,0,0]=3 4948 B11R0.11 CCCCC(=O)C(C)CCCC 1458a_100000725509_100000210211 [0,1,1,0,0,0|1,0,0]=3 4949 B11R0.11 CCCCC(=O)C(O)CCCC 1458a_100000720857_100000210211 [0,1,1,0,0,0|2,0,0]=4 4950 B11R0.11 CCCCC(=O)N(C)CCCC 11a_100000207549_100000210183 [0,1,1,0,0,0|2,0,0]=4 4951 B11R0.11 CCCCC(=O)N(C)CCCC 1626a_100000207549_100000210183 [0,1,1,0,0,0|2,0,0]=4 4952 B11R0.11 CCCCC(=O)N(C)CCCC 240690a_100000207549_100000210183 [0,1,1,0,0,0|2,0,0]=4 4953 B11R0.11 CCCCC(=O)N(C)CCCC 527a_100000207549_100000210183 [0,1,1,0,0,0|2,0,0]=4 4954 B11R0.11 CCCCC(C)C(=O)C#CCO 1458a_100000049017_200011215066 [0,1,1,0,0,0|1,0,1]=4 4955 B11R0.11 CCCCC(C)C(=O)C=COC 1458a_100016268678_200011215066 [0,1,1,0,0,0|1,0,1]=4 4956 B11R0.11 CCCCC(C)C(=O)CCC#N 1458a_100000725509_100011215226 [0,1,1,0,0,0|1,0,1]=4 4957 B11R0.11 CCCCC(C)C(=O)CCC#N 1458a_100011934036_200011215066 [0,1,1,0,0,0|1,0,1]=4 4958 B11R0.11 CCCCC(C)C(=O)CCCF 1458a_100000725509_100011934791 [0,1,1,0,0,0|1,0,0]=3 4959 B11R0.11 CCCCC(C)C(=O)CCCO 1458a_100000725509_100011215043 [0,1,1,0,0,0|1,0,0]=3 4960 B11R0.11 CCCCC(C)C(=O)CCOC 1458a_100000725509_100000233755 [0,1,1,0,0,0|1,0,0]=3 4961 B11R0.11 CCCCC(C)C(=O)CCOC 1458a_100000749529_200011215066 [0,1,1,0,0,0|1,0,0]=3 4962 B11R0.11 CCCCC(C)C(=O)CCSC 1458a_100000174002_200011215066 [0,1,1,0,0,0|1,0,0]=3 4963 B11R0.11 CCCCC(C)C(=O)CCSC 1458a_100000725509_100000751147 [0,1,1,0,0,0|1,0,0]=3 4964 B11R0.11 CCCCC(C)C(=O)COCC 1458a_100000211967_200011215066 [0,1,1,0,0,0|0,0,0]=2 4965 B11R0.11 CCCCC(C)C(=O)CSCC 1458a_100000230394_200011215066 [0,1,1,0,0,0|0,1,0]=3 4966 B11R0.11 CCCCC(C)C(=O)NCC#N 1626a_100000734998_100000725509 [0,1,1,0,0,0|1,0,1]=4 4967 B11R0.11 CCCCC(C)C(=O)NCC#N 527a_100000734998_100000725509 [0,1,1,0,0,0|1,0,1]=4 4968 B11R0.11 CCCCC(C)C(=O)NCCC 11a_100020643023_100000725509 [0,1,1,0,0,0|1,0,0]=3 4969 B11R0.11 CCCCC(C)C(=O)NCCC 1626a_100020643023_100000725509 [0,1,1,0,0,0|1,0,0]=3 4970 B11R0.11 CCCCC(C)C(=O)NCCC 240690a_100020643023_100000725509 [0,1,1,0,0,0|1,0,0]=3 4971 B11R0.11 CCCCC(C)C(=O)NCCC 527a_100020643023_100000725509 [0,1,1,0,0,0|1,0,0]=3 4972 B11R0.11 CCCCC(C)C(=O)NCCF 11a_100000724931_100000725509 [0,1,1,0,0,0|1,0,0]=3 4973 B11R0.11 CCCCC(C)C(=O)NCCF 1626a_100000724931_100000725509 [0,1,1,0,0,0|1,0,0]=3 4974 B11R0.11 CCCCC(C)C(=O)NCCF 240690a_100000724931_100000725509 [0,1,1,0,0,0|1,0,0]=3 4975 B11R0.11 CCCCC(C)C(=O)NCCF 527a_100000724931_100000725509 [0,1,1,0,0,0|1,0,0]=3 4976 B11R0.11 CCCCC(C)C(=O)NCCO 240690a_100000210304_100000725509 [0,1,1,0,0,0|1,0,0]=3 4977 B11R0.11 CCCCC(C)C(=O)NCCO 527a_100000210304_100000725509 [0,1,1,0,0,0|1,0,0]=3 4978 B11R0.11 CCCCC(C)C(=O)NNCC 22a_100000756455_100000725509 [0,1,1,0,0,0|1,0,0]=3 4979 B11R0.11 CCCCC(O)C(=O)CCCF 1458a_100000720857_100011934791 [0,1,1,0,0,0|2,0,0]=4 4980 B11R0.11 CCCCC(O)C(=O)CCCO 1458a_100000720857_100011215043 [0,1,1,0,0,0|2,0,0]=4 4981 B11R0.11 CCCCC(O)C(=O)CCOC 1458a_100000720857_100000233755 [0,1,1,0,0,0|2,0,0]=4 4982 B11R0.11 CCCCC(O)C(=O)CCSC 1458a_100000720857_100000751147 [0,1,1,0,0,0|2,0,0]=4 4983 B11R0.11 CCCCC(O)C(=O)NCCC 240690a_100020643023_100000720857 [0,1,1,0,0,0|2,0,0]=4 4984 B11R0.11 CCCCC(O)C(=O)NCCC 527a_100020643023_100000720857 [0,1,1,0,0,0|2,0,0]=4 4985 B11R0.11 CCCCC(O)C(=O)NCCF 240690a_100000724931_100000720857 [0,1,1,0,0,0|2,0,0]=4 4986 B11R0.11 CCCCC(O)C(=O)NCCF 527a_100000724931_100000720857 [0,1,1,0,0,0|2,0,0]=4 4987 B11R0.11 CCCCC(O)C(=O)NCCO 240690a_100000210304_100000720857 [0,1,1,0,0,0|2,0,0]=4 4988 B11R0.11 CCCCC(O)C(=O)NCCO 527a_100000210304_100000720857 [0,1,1,0,0,0|2,0,0]=4 4989 B11R0.11 CCCCC(O)C(=O)NNCC 22a_100000756455_100000720857 [0,1,1,0,0,0|2,0,0]=4 4990 B11R0.11 CCCCN(C)C(=O)CCOC 11a_100000207549_100000749529 [0,1,1,0,0,0|2,0,0]=4 4991 B11R0.11 CCCCN(C)C(=O)CCOC 1626a_100000207549_100000749529 [0,1,1,0,0,0|2,0,0]=4 4992 B11R0.11 CCCCN(C)C(=O)CCOC 240690a_100000207549_100000749529 [0,1,1,0,0,0|2,0,0]=4 4993 B11R0.11 CCCCN(C)C(=O)CCOC 527a_100000207549_100000749529 [0,1,1,0,0,0|2,0,0]=4 4994 B11R0.11 CCCCN(C)C(=O)CCSC 11a_100000207549_100000174002 [0,1,1,0,0,0|2,0,0]=4 4995 B11R0.11 CCCCN(C)C(=O)CCSC 1626a_100000207549_100000174002 [0,1,1,0,0,0|2,0,0]=4 4996 B11R0.11 CCCCN(C)C(=O)CCSC 240690a_100000207549_100000174002 [0,1,1,0,0,0|2,0,0]=4 4997 B11R0.11 CCCCN(C)C(=O)CCSC 527a_100000207549_100000174002 [0,1,1,0,0,0|2,0,0]=4 4998 B11R0.11 CCCCN(C)C(=O)CNCC 2230a_100015525214_100000230175 [0,1,1,0,0,0|2,0,0]=4 4999 B11R0.11 CCCCN(C)C(=O)COCC 11a_100000207549_100000211967 [0,1,1,0,0,0|1,0,0]=3 5000 B11R0.11 CCCCN(C)C(=O)COCC 1626a_100000207549_100000211967 [0,1,1,0,0,0|1,0,0]=3 5001 B11R0.11 CCCCN(C)C(=O)COCC 240690a_100000207549_100000211967 [0,1,1,0,0,0|1,0,0]=3 5002 B11R0.11 CCCCN(C)C(=O)COCC 34a_100121572206_100000230175 [0,1,1,0,0,0|1,0,0]=3 5003 B11R0.11 CCCCN(C)C(=O)COCC 527a_100000207549_100000211967 [0,1,1,0,0,0|1,0,0]=3 5004 B11R0.11 CCCCN(C)C(=O)CSCC 11a_100000207549_100000230394 [0,1,1,0,0,0|1,1,0]=4 5005 B11R0.11 CCCCN(C)C(=O)CSCC 1626a_100000207549_100000230394 [0,1,1,0,0,0|1,1,0]=4 5006 B11R0.11 CCCCN(C)C(=O)CSCC 240690a_100000207549_100000230394 [0,1,1,0,0,0|1,1,0]=4 5007 B11R0.11 CCCCN(C)C(=O)CSCC 527a_100000207549_100000230394 [0,1,1,0,0,0|1,1,0]=4 5008 B11R0.11 CCCCN(C)C(=O)CSCC 62a_100000210202_100000230175 [0,1,1,0,0,0|1,1,0]=4 5009 B11R0.11 CCCCN(C)C(=O)CSCC 62a_100000230175_100000210202 [0,1,1,0,0,0|1,1,0]=4 5010 B11R0.11 CCCCN(C)C(=O)NCCC 2708a_100020643023_100000207549 [0,1,1,0,0,0|2,0,0]=4 5011 B11R0.11 CCCCN(C)C(=O)NCCC 273464a_100020643023_100000207549 [0,1,1,0,0,0|2,0,0]=4 5012 B11R0.11 CCCCN(C)C(=O)NCCF 273464a_100000724931_100000207549 [0,1,1,0,0,0|2,0,0]=4 5013 B11R0.11 CCCCN(C)C(=O)NCCO 273464a_100000210304_100000207549 [0,1,1,0,0,0|2,0,0]=4 5014 B11R0.11 CCCNC(=O)C(C)NCCC 2230a_100025744714_100000210303 [0,1,1,0,0,0|2,0,0]=4 5015 B11R0.11 CCCNC(=O)C(C)NCCC 34a_100025744714_100000210303 [0,1,1,0,0,0|2,0,0]=4 5016 B11R0.11 CCCNC(=O)C(C)OCCC 34a_100000210258_100000230305 [0,1,1,0,0,0|2,0,0]=4 5017 B11R0.11 CCCNC(=O)C(C)SCCC 62a_100000210303_100000230305 [0,1,1,0,0,0|2,0,0]=4 5018 B11R0.11 CCCNC(=O)C(C)SCCC 62a_100000230305_100000210303 [0,1,1,0,0,0|2,0,0]=4 5019 B11R0.11 CCCOC(=O)C(C)NCCF 34a_100000724931_100000760410 [0,1,1,0,0,0|2,0,0]=4 5020 B11R0.11 CCCOC(=O)C(C)NCCO 2230a_100016997473_100000760410 [0,1,1,0,0,0|2,0,0]=4 5021 B11R0.11 CCCOC(=O)C(C)NCCO 34a_100016990907_100000760410 [0,1,1,0,0,0|2,0,0]=4 5022 B11R0.11 CCCOC(=O)C(C)OCCBr 34a_100000211926_100000760410 [0,1,1,0,0,0|2,0,0]=4 5023 B11R0.11 CCCOC(=O)C(C)OCCC 34a_100000037348_100000210303 [0,1,1,0,0,0|1,0,0]=3 5024 B11R0.11 CCCOC(=O)C(C)OCCC 34a_100000210258_100000760410 [0,1,1,0,0,0|1,0,0]=3 5025 B11R0.11 CCCOC(=O)C(C)OCCC 7a_100000037348_100000210303 [0,1,1,0,0,0|1,0,0]=3 5026 B11R0.11 CCCOC(=O)C(C)OCCF 34a_100000037348_100011217306 [0,1,1,0,0,0|2,0,0]=4 5027 B11R0.11 CCCOC(=O)C(C)OCCF 7a_100000037348_100011217306 [0,1,1,0,0,0|2,0,0]=4 5028 B11R0.11 CCCOC(=O)C(C)OCCN 34a_100000210304_100000760410 [0,1,1,0,0,0|2,0,0]=4 5029 B11R0.11 CCCOC(=O)C(C)OCCO 34a_100000037348_100000211926 [0,1,1,0,0,0|2,0,0]=4 5030 B11R0.11 CCCOC(=O)C(C)OCCO 7a_100000037348_100000211926 [0,1,1,0,0,0|2,0,0]=4 5031 B11R0.11 CCCOC(=O)C(C)OCSC 34a_100000037348_100011218213 [0,1,1,0,0,0|2,0,0]=4 5032 B11R0.11 CCCOC(=O)C(C)SCCC 62a_100000210303_100000760410 [0,1,1,0,0,0|1,0,0]=3 5033 B11R0.11 CCCOC(=O)C(C)SCCC 62a_100000760410_100000210303 [0,1,1,0,0,0|1,0,0]=3 5034 B11R0.11 CCCOC(=O)C(C)SCCF 62a_100000760410_100011217306 [0,1,1,0,0,0|2,0,0]=4 5035 B11R0.11 CCCOC(=O)C(C)SCCF 62a_100011217306_100000760410 [0,1,1,0,0,0|2,0,0]=4 5036 B11R0.11 CCCOC(=O)C(C)SCCO 62a_100000211926_100000760410 [0,1,1,0,0,0|2,0,0]=4 5037 B11R0.11 CCCOC(=O)C(C)SCCO 62a_100000760410_100000211926 [0,1,1,0,0,0|2,0,0]=4 5038 B11R0.11 CCCOC(=O)C(C)SCOC 62a_100000760410_100000766300 [0,1,1,0,0,0|2,0,0]=4 5039 B11R0.11 CCCOC(=O)C(C)SCOC 62a_100000766300_100000760410 [0,1,1,0,0,0|2,0,0]=4 5040 B11R0.11 CCCOC(=O)C(C)SCSC 62a_100000760410_100011218213 [0,1,1,0,0,0|2,0,0]=4 5041 B11R0.11 CCCOC(=O)C(C)SCSC 62a_100011218213_100000760410 [0,1,1,0,0,0|2,0,0]=4 5042 B11R0.11 CCOCC(=O)N(C)CCCO 240690a_100000213112_100000211967 [0,1,1,0,0,0|2,0,0]=4 5043 B11R0.11 CCOCC(=O)N(C)CCCO 527a_100000213112_100000211967 [0,1,1,0,0,0|2,0,0]=4 5044 B11R0.11 CCOCC(=O)N(C)CCOC 11a_100000743101_100000211967 [0,1,1,0,0,0|2,0,0]=4 5045 B11R0.11 CCOCC(=O)N(C)CCOC 1626a_100000743101_100000211967 [0,1,1,0,0,0|2,0,0]=4 5046 B11R0.11 CCOCC(=O)N(C)CCOC 240690a_100000743101_100000211967 [0,1,1,0,0,0|2,0,0]=4 5047 B11R0.11 CCOCC(=O)N(C)CCOC 527a_100000743101_100000211967 [0,1,1,0,0,0|2,0,0]=4 5048 B11R0.11 CCOCC(=O)N(C)CCSC 11a_100000686725_100000211967 [0,1,1,0,0,0|2,0,0]=4 5049 B11R0.11 CCOCC(=O)N(C)CCSC 1626a_100000686725_100000211967 [0,1,1,0,0,0|2,0,0]=4 5050 B11R0.11 CCOCC(=O)N(C)CCSC 240690a_100000686725_100000211967 [0,1,1,0,0,0|2,0,0]=4 5051 B11R0.11 CCOCC(=O)N(C)CCSC 527a_100000686725_100000211967 [0,1,1,0,0,0|2,0,0]=4 5052 B11R0.43 CCCC(=O)C(C)CN(C)CC 1458a_200015185930_100000210303 [0,1,1,0,0,0|2,0,0]=4 5053 B11R0.43 CCCC(=O)N(C)CC(C)CC 11a_100000753921_100000211992 [0,1,1,0,0,0|2,0,0]=4 5054 B11R0.43 CCCC(=O)N(C)CC(C)CC 1626a_100000753921_100000211992 [0,1,1,0,0,0|2,0,0]=4 5055 B11R0.43 CCCC(=O)N(C)CC(C)CC 240690a_100000753921_100000211992 [0,1,1,0,0,0|2,0,0]=4 5056 B11R0.43 CCCC(=O)N(C)CC(C)CC 527a_100000753921_100000211992 [0,1,1,0,0,0|2,0,0]=4 5057 B11R0.43 CCNC(=O)C(C)CN(C)CC 11a_100015525214_200015185930 [0,1,1,0,0,0|2,0,0]=4 5058 B11R0.43 CCNC(=O)C(C)CN(C)CC 240690a_100015525214_200015185930 [0,1,1,0,0,0|2,0,0]=4 5059 B11R0.43 CCNC(=O)C(C)NC(C)CC 2230a_100000209981_100000230173 [0,1,1,0,0,0|2,0,0]=4 5060 B11R0.43 CCNC(=O)C(C)NC(C)CC 2230a_100000736553_100000758301 [0,1,1,0,0,0|2,0,0]=4 5061 B11R0.43 CCNC(=O)C(C)NC(C)CC 34a_100000736553_100011215416 [0,1,1,0,0,0|2,0,0]=4 5062 B11R0.43 CCNC(=O)C(C)OC(C)CC 7a_100000210228_100000230173 [0,1,1,0,0,0|2,0,0]=4 5063 B11R0.43 CCNC(=O)C(C)SC(C)CC 62a_100000230173_100000758301 [0,1,1,0,0,0|2,0,0]=4 5064 B11R0.43 CCNC(=O)C(C)SC(C)CC 62a_100000758301_100000230173 [0,1,1,0,0,0|2,0,0]=4 5065 B11R0.43 CCNC(=O)N(C)CC(C)CC 2708a_100015525214_100000753921 [0,1,1,0,0,0|2,0,0]=4 5066 B11R0.43 CCNC(=O)N(C)CC(C)CC 273464a_100015525214_100000753921 [0,1,1,0,0,0|2,0,0]=4 5067 B11R0.43 CCOC(=O)C(C)NC(C)CC 2230a_100000209981_100011215307 [0,1,1,0,0,0|1,0,0]=3 5068 B11R0.43 CCOC(=O)C(C)N[C@H](C)CO 2230a_100000737577_100011215307 [0,1,1,0,0,0|2,0,0]=4 5069 B11R0.43 CCOC(=O)C(C)OC(C)CC 7a_100000210228_100011216346 [0,1,1,0,0,0|1,0,0]=3 5070 B11R0.43 CCOC(=O)C(C)OC(C)CF 34a_100016041109_100011216346 [0,1,1,0,0,0|2,0,0]=4 5071 B11R0.43 CCOC(=O)C(C)OC(C)CF 7a_100016041109_100011216346 [0,1,1,0,0,0|2,0,0]=4 5072 B11R0.43 CCOC(=O)C(C)OC(C)CN 34a_100000210904_100011216346 [0,1,1,0,0,0|2,0,0]=4 5073 B11R0.43 CCOC(=O)C(C)SC(C)CC 62a_100000758301_100011216346 [0,1,1,0,0,0|1,0,0]=3 5074 B11R0.43 CCOC(=O)C(C)SC(C)CC 62a_100011216346_100000758301 [0,1,1,0,0,0|1,0,0]=3 5075 B11R0.43 CCOC(=O)C(C)SC(C)CO 62a_100012180447_100011216346 [0,1,1,0,0,0|2,0,0]=4 5076 B11R0.43 CCOC(=O)C(C)SC(C)OC 62a_100009879195_100011216346 [0,1,1,0,0,0|2,0,0]=4 5077 B11R0.43 CCOC(=O)C(C)SC(C)OC 62a_100011216346_100009879195 [0,1,1,0,0,0|2,0,0]=4 5078 B11R0.43 CCOC(=O)C(C)S[C@H](C)CO 62a_100011216346_100016084084 [0,1,1,0,0,0|2,0,0]=4 5079 B11R0.43 CCOC(=O)C(C)S[C@H](C)CO 62a_100016084084_100011216346 [0,1,1,0,0,0|2,0,0]=4 5080 B11R0.43 CCOC(=O)C(F)NC(C)CC 2230a_100000209981_100000760018 [0,1,1,0,0,0|2,0,0]=4 5081 B11R0.43 CCOC(=O)C(F)OC(C)CC 7a_100000210228_100000040065 [0,1,1,0,0,0|2,0,0]=4 5082 B11R0.43 CCOC(=O)C(F)SC(C)CC 62a_100000758301_100000760018 [0,1,1,0,0,0|2,0,0]=4 5083 B11R0.43 CCOC(=O)C(F)SC(C)CC 62a_100000760018_100000758301 [0,1,1,0,0,0|2,0,0]=4 5084 B11R0.43 CCOC(=O)[C@@H](C)NC(=O)CC 188690a_100016988386_100000210414 [0,1,1,0,0,0|1,0,1]=4 5085 B11R0.43 CCOC(=O)[C@H](C)OC(C)CC 7a_100000751109_100000758301 [0,1,1,0,0,0|1,0,0]=3 5086 B11R0.43 CCOC(=O)[C@H](C)OC(C)CO 7a_100000751109_100012180447 [0,1,1,0,0,0|2,0,0]=4 5087 B11R0.43 CCSC(=O)[C@H](C)NC(C)CC 2230a_100103168634_100000758301 [0,1,1,0,0,0|1,1,0]=4 5088 B11R0.59 C=C(C)COC(C)C(=O)OCC 34a_100000210245_100011216346 [0,1,1,0,0,0|1,0,1]=4 5089 B11R0.59 C=C(C)CO[C@@H](C)C(=O)OCC 7a_100000751109_100000748629 [0,1,1,0,0,0|1,0,1]=4 5090 B11R0.59 C=C(C)CSC(C)C(=O)OCC 62a_100000748629_100011216346 [0,1,1,0,0,0|1,0,1]=4 5091 B11R0.59 C=C(C)CSC(C)C(=O)OCC 62a_100011216346_100000211660 [0,1,1,0,0,0|1,0,1]=4 5092 B11R0.59 CC#CC(=O)C(C)CCC(C)C 1458a_100000763181_100011261404 [0,1,1,0,0,0|1,0,1]=4 5093 B11R0.59 CC(C)CCC(C)C(=O)CCO 1458a_100011216618_100011261404 [0,1,1,0,0,0|2,0,0]=4 5094 B11R0.59 CC=CC(=O)C(C)CCC(C)C 1458a_100000210699_100011261404 [0,1,1,0,0,0|1,0,1]=4 5095 B11R0.59 CCCC(=O)C(C)CCC(C)C 1458a_100000211992_100011261404 [0,1,1,0,0,0|1,0,0]=3 5096 B11R0.59 CCCC(=O)N(C)CCC(C)C 11a_100000742789_100000211992 [0,1,1,0,0,0|2,0,0]=4 5097 B11R0.59 CCCC(=O)N(C)CCC(C)C 1626a_100000742789_100000211992 [0,1,1,0,0,0|2,0,0]=4 5098 B11R0.59 CCCC(=O)N(C)CCC(C)C 240690a_100000742789_100000211992 [0,1,1,0,0,0|2,0,0]=4 5099 B11R0.59 CCCC(=O)N(C)CCC(C)C 527a_100000742789_100000211992 [0,1,1,0,0,0|2,0,0]=4 5100 B11R0.59 CCNC(=O)C(C)NCC(C)C 2230a_100000210953_100000230173 [0,1,1,0,0,0|2,0,0]=4 5101 B11R0.59 CCNC(=O)C(C)NCC(C)C 2230a_100000736553_100000210760 [0,1,1,0,0,0|2,0,0]=4 5102 B11R0.59 CCNC(=O)C(C)NCC(C)C 270004a_100000736553_100000210432 [0,1,1,0,0,0|2,0,0]=4 5103 B11R0.59 CCNC(=O)C(C)NCC(C)C 34a_100000210953_100000230173 [0,1,1,0,0,0|2,0,0]=4 5104 B11R0.59 CCNC(=O)C(C)NCC(C)C 34a_100000736553_100000210624 [0,1,1,0,0,0|2,0,0]=4 5105 B11R0.59 CCNC(=O)C(C)NCC(C)O 2230a_100000210904_100000230173 [0,1,1,0,0,0|2,0,0]=4 5106 B11R0.59 CCNC(=O)C(C)NCC(C)O 2230a_100000736553_100011218427 [0,1,1,0,0,0|2,0,0]=4 5107 B11R0.59 CCNC(=O)C(C)NCC(C)O 34a_100000210904_100000230173 [0,1,1,0,0,0|2,0,0]=4 5108 B11R0.59 CCNC(=O)C(C)NCC(C)O 34a_100000736553_100011218427 [0,1,1,0,0,0|2,0,0]=4 5109 B11R0.59 CCNC(=O)C(C)NC[C@@H](C)O 2230a_100000736553_100009817552 [0,1,1,0,0,0|2,0,0]=4 5110 B11R0.59 CCNC(=O)C(C)NC[C@@H](C)O 34a_100000736553_100009817552 [0,1,1,0,0,0|2,0,0]=4 5111 B11R0.59 CCNC(=O)C(C)OCC(C)Br 34a_100012180447_100000230173 [0,1,1,0,0,0|2,0,0]=4 5112 B11R0.59 CCNC(=O)C(C)OCC(C)C 34a_100000210257_100000230173 [0,1,1,0,0,0|2,0,0]=4 5113 B11R0.59 CCNC(=O)C(C)OCC(C)F 34a_100015925927_100000230173 [0,1,1,0,0,0|2,0,0]=4 5114 B11R0.59 CCNC(=O)C(C)OC[C@@H](C)Cl 34a_100016084084_100000230173 [0,1,1,0,0,0|2,0,0]=4 5115 B11R0.59 CCNC(=O)C(C)OC[C@@H](C)N 34a_100000737577_100000230173 [0,1,1,0,0,0|2,0,0]=4 5116 B11R0.59 CCNC(=O)C(C)SCC(C)C 62a_100000210624_100000230173 [0,1,1,0,0,0|2,0,0]=4 5117 B11R0.59 CCNC(=O)C(C)SCC(C)C 62a_100000230173_100000210760 [0,1,1,0,0,0|2,0,0]=4 5118 B11R0.59 CCNC(=O)C(C)SCC(C)O 62a_100000230173_100011218427 [0,1,1,0,0,0|2,0,0]=4 5119 B11R0.59 CCNC(=O)C(C)SCC(C)O 62a_100011218427_100000230173 [0,1,1,0,0,0|2,0,0]=4 5120 B11R0.59 CCNC(=O)C(C)SC[C@@H](C)O 62a_100000230173_100009817552 [0,1,1,0,0,0|2,0,0]=4 5121 B11R0.59 CCNC(=O)C(C)SC[C@@H](C)O 62a_100009817552_100000230173 [0,1,1,0,0,0|2,0,0]=4 5122 B11R0.59 CCNC(=O)N(C)CCC(C)C 2708a_100015525214_100000742789 [0,1,1,0,0,0|2,0,0]=4 5123 B11R0.59 CCNC(=O)N(C)CCC(C)C 273464a_100015525214_100000742789 [0,1,1,0,0,0|2,0,0]=4 5124 B11R0.59 CCOC(=O)C(C)NCC(C)C 2230a_100000210953_100011215307 [0,1,1,0,0,0|1,0,0]=3 5125 B11R0.59 CCOC(=O)C(C)NCC(C)C 34a_100000210953_100011216346 [0,1,1,0,0,0|1,0,0]=3 5126 B11R0.59 CCOC(=O)C(C)NCC(C)O 2230a_100000210904_100011215307 [0,1,1,0,0,0|1,0,0]=3 5127 B11R0.59 CCOC(=O)C(C)NCC(C)O 34a_100000210904_100011216346 [0,1,1,0,0,0|1,0,0]=3 5128 B11R0.59 CCOC(=O)C(C)NCC(F)F 34a_100000765723_100011216346 [0,1,1,0,0,0|2,0,0]=4 5129 B11R0.59 CCOC(=O)C(C)OCC(=O)C 34a_100000211253_100011216346 [0,1,1,0,0,0|1,0,1]=4 5130 B11R0.59 CCOC(=O)C(C)OCC(C)Br 34a_100012180447_100011216346 [0,1,1,0,0,0|1,0,0]=3 5131 B11R0.59 CCOC(=O)C(C)OCC(C)C 34a_100000210257_100011216346 [0,1,1,0,0,0|1,0,0]=3 5132 B11R0.59 CCOC(=O)C(C)OCC(C)F 34a_100015925927_100011216346 [0,1,1,0,0,0|1,0,0]=3 5133 B11R0.59 CCOC(=O)C(C)OCC(F)F 34a_100000743014_100011216346 [0,1,1,0,0,0|2,0,0]=4 5134 B11R0.59 CCOC(=O)C(C)OC[C@@H](C)Cl 34a_100016084084_100011216346 [0,1,1,0,0,0|1,0,0]=3 5135 B11R0.59 CCOC(=O)C(C)OC[C@@H](C)N 34a_100000737577_100011216346 [0,1,1,0,0,0|1,0,0]=3 5136 B11R0.59 CCOC(=O)C(C)SCC(C)C 62a_100000210624_100011216346 [0,1,1,0,0,0|1,0,0]=3 5137 B11R0.59 CCOC(=O)C(C)SCC(C)C 62a_100011216346_100000210760 [0,1,1,0,0,0|1,0,0]=3 5138 B11R0.59 CCOC(=O)C(C)SCC(C)O 62a_100011216346_100011218427 [0,1,1,0,0,0|1,0,0]=3 5139 B11R0.59 CCOC(=O)C(C)SCC(C)O 62a_100011218427_100011216346 [0,1,1,0,0,0|1,0,0]=3 5140 B11R0.59 CCOC(=O)C(C)SCC(F)F 62a_100011216346_100011934356 [0,1,1,0,0,0|2,0,0]=4 5141 B11R0.59 CCOC(=O)C(C)SCC(F)F 62a_100011934356_100011216346 [0,1,1,0,0,0|2,0,0]=4 5142 B11R0.59 CCOC(=O)C(C)SC[C@@H](C)O 62a_100009817552_100011216346 [0,1,1,0,0,0|1,0,0]=3 5143 B11R0.59 CCOC(=O)C(C)SC[C@@H](C)O 62a_100011216346_100009817552 [0,1,1,0,0,0|1,0,0]=3 5144 B11R0.59 CCOC(=O)C(F)NCC(C)C 2230a_100000210953_100000760018 [0,1,1,0,0,0|2,0,0]=4 5145 B11R0.59 CCOC(=O)C(F)NCC(C)C 34a_100000210953_100000760018 [0,1,1,0,0,0|2,0,0]=4 5146 B11R0.59 CCOC(=O)C(F)NCC(C)O 2230a_100000210904_100000760018 [0,1,1,0,0,0|2,0,0]=4 5147 B11R0.59 CCOC(=O)C(F)NCC(C)O 34a_100000210904_100000760018 [0,1,1,0,0,0|2,0,0]=4 5148 B11R0.59 CCOC(=O)C(F)OCC(C)Br 34a_100012180447_100000760018 [0,1,1,0,0,0|2,0,0]=4 5149 B11R0.59 CCOC(=O)C(F)OCC(C)C 34a_100000210257_100000760018 [0,1,1,0,0,0|2,0,0]=4 5150 B11R0.59 CCOC(=O)C(F)OCC(C)F 34a_100015925927_100000760018 [0,1,1,0,0,0|2,0,0]=4 5151 B11R0.59 CCOC(=O)C(F)OC[C@@H](C)Cl 34a_100016084084_100000760018 [0,1,1,0,0,0|2,0,0]=4 5152 B11R0.59 CCOC(=O)C(F)OC[C@@H](C)N 34a_100000737577_100000760018 [0,1,1,0,0,0|2,0,0]=4 5153 B11R0.59 CCOC(=O)C(F)SCC(C)C 62a_100000210624_100000760018 [0,1,1,0,0,0|2,0,0]=4 5154 B11R0.59 CCOC(=O)C(F)SCC(C)C 62a_100000760018_100000210760 [0,1,1,0,0,0|2,0,0]=4 5155 B11R0.59 CCOC(=O)C(F)SCC(C)O 62a_100000760018_100011218427 [0,1,1,0,0,0|2,0,0]=4 5156 B11R0.59 CCOC(=O)C(F)SCC(C)O 62a_100011218427_100000760018 [0,1,1,0,0,0|2,0,0]=4 5157 B11R0.59 CCOC(=O)C(F)SC[C@@H](C)O 62a_100000760018_100009817552 [0,1,1,0,0,0|2,0,0]=4 5158 B11R0.59 CCOC(=O)C(F)SC[C@@H](C)O 62a_100009817552_100000760018 [0,1,1,0,0,0|2,0,0]=4 5159 B11R0.59 CCOC(=O)[C@H](C)OCC(C)C 7a_100000751109_100000210760 [0,1,1,0,0,0|1,0,0]=3 5160 B11R0.59 CCOC(=O)[C@H](C)OCC(C)O 7a_100000751109_100011218427 [0,1,1,0,0,0|1,0,0]=3 5161 B11R0.59 CCOC(=O)[C@H](C)OCC(F)F 7a_100000751109_100011934356 [0,1,1,0,0,0|2,0,0]=4 5162 B11R0.59 CCOC(=O)[C@H](C)OC[C@@H](C)O 7a_100000751109_100009817552 [0,1,1,0,0,0|1,0,0]=3 5163 B11R0.59 CCSC(=O)[C@H](C)NCC(C)C 2230a_100103168634_100000210760 [0,1,1,0,0,0|1,1,0]=4 5164 B11R0.59 CCSC(=O)[C@H](C)NCC(C)O 2230a_100103168634_100011218427 [0,1,1,0,0,0|1,1,0]=4 5165 B11R0.59 CCSC(=O)[C@H](C)NC[C@@H](C)O 2230a_100103168634_100009817552 [0,1,1,0,0,0|1,1,0]=4 5166 B11R0.59 COCC(=O)C(C)CCC(C)C 1458a_100000210968_100011261404 [0,1,1,0,0,0|2,0,0]=4 5167 B11R0.59 CSCC(=O)C(C)CCC(C)C 1458a_100000184570_100011261404 [0,1,1,0,0,0|2,0,0]=4 5168 B11R0.68 C=C(C)CC(=O)C(C)CCCC 1458a_100000725509_100000748629 [0,1,1,0,0,0|1,0,1]=4 5169 B11R0.68 CC(C)OC(=O)[C@@H](C)OCCF 34a_100015307928_100011217306 [0,1,1,0,0,0|2,0,0]=4 5170 B11R0.68 CC(C)OC(=O)[C@@H](C)OCCF 7a_100015307928_100011217306 [0,1,1,0,0,0|2,0,0]=4 5171 B11R0.68 CC(C)OC(=O)[C@@H](C)OCCO 34a_100015307928_100000211926 [0,1,1,0,0,0|2,0,0]=4 5172 B11R0.68 CC(C)OC(=O)[C@@H](C)OCCO 7a_100015307928_100000211926 [0,1,1,0,0,0|2,0,0]=4 5173 B11R0.68 CCCCC(C)C(=O)C=C(C)C 1458a_100000211388_200011215066 [0,1,1,0,0,0|1,0,1]=4 5174 B11R0.68 CCCCC(C)C(=O)C=C(C)Cl 1458a_200042562850_200011215066 [0,1,1,0,0,0|1,0,1]=4 5175 B11R0.68 CCCCC(C)C(=O)C=C(C)I 1458a_100025716642_200011215066 [0,1,1,0,0,0|1,0,1]=4 5176 B11R0.68 CCCCC(C)C(=O)CC(C)C 1458a_100000210554_200011215066 [0,1,1,0,0,0|1,0,0]=3 5177 B11R0.68 CCCCC(C)C(=O)CC(C)C 1458a_100000725509_100000210624 [0,1,1,0,0,0|1,0,0]=3 5178 B11R0.68 CCCCC(C)C(=O)CC(C)O 1458a_100000725509_100011218427 [0,1,1,0,0,0|1,0,0]=3 5179 B11R0.68 CCCCC(C)C(=O)CC(F)F 1458a_100000725509_100011934356 [0,1,1,0,0,0|2,0,0]=4 5180 B11R0.68 CCCCC(C)C(=O)CN(C)C 1458a_100000750896_200011215066 [0,1,1,0,0,0|2,0,0]=4 5181 B11R0.68 CCCCC(C)C(=O)C[C@@H](C)O 1458a_100011933948_200011215066 [0,1,1,0,0,0|1,0,0]=3 5182 B11R0.68 CCCCC(C)C(=O)C[S+](C)C 1458a_200159257847_200011215066 [0,1,1,0,0,0|2,0,0]=4 5183 B11R0.68 CCCCC(C)C(=O)NC(C)C 11a_100138425928_100000725509 [0,1,1,0,0,0|1,0,0]=3 5184 B11R0.68 CCCCC(C)C(=O)NC(C)C 1626a_100138425928_100000725509 [0,1,1,0,0,0|1,0,0]=3 5185 B11R0.68 CCCCC(C)C(=O)NC(C)C 240690a_100138425928_100000725509 [0,1,1,0,0,0|1,0,0]=3 5186 B11R0.68 CCCCC(C)C(=O)NC(C)C 527a_100138425928_100000725509 [0,1,1,0,0,0|1,0,0]=3 5187 B11R0.68 CCCCC(O)C(=O)CC(C)C 1458a_100000720857_100000210624 [0,1,1,0,0,0|2,0,0]=4 5188 B11R0.68 CCCCC(O)C(=O)CC(C)O 1458a_100000720857_100011218427 [0,1,1,0,0,0|2,0,0]=4 5189 B11R0.68 CCCCC(O)C(=O)NC(C)C 240690a_100138425928_100000720857 [0,1,1,0,0,0|2,0,0]=4 5190 B11R0.68 CCCCC(O)C(=O)NC(C)C 527a_100138425928_100000720857 [0,1,1,0,0,0|2,0,0]=4 5191 B11R0.68 CCCCN(C)C(=O)CC(C)C 11a_100000207549_100000210554 [0,1,1,0,0,0|2,0,0]=4 5192 B11R0.68 CCCCN(C)C(=O)CC(C)C 1626a_100000207549_100000210554 [0,1,1,0,0,0|2,0,0]=4 5193 B11R0.68 CCCCN(C)C(=O)CC(C)C 240690a_100000207549_100000210554 [0,1,1,0,0,0|2,0,0]=4 5194 B11R0.68 CCCCN(C)C(=O)CC(C)C 527a_100000207549_100000210554 [0,1,1,0,0,0|2,0,0]=4 5195 B11R0.68 CCCCN(C)C(=O)C[C@@H](C)O 240690a_100000207549_100011933948 [0,1,1,0,0,0|2,0,0]=4 5196 B11R0.68 CCCCN(C)C(=O)NC(C)C 2708a_100138425928_100000207549 [0,1,1,0,0,0|2,0,0]=4 5197 B11R0.68 CCCCN(C)C(=O)NC(C)C 273464a_100138425928_100000207549 [0,1,1,0,0,0|2,0,0]=4 5198 B11R0.68 CCCNC(C)C(=O)NC(C)C 2230a_100015205314_100000210303 [0,1,1,0,0,0|2,0,0]=4 5199 B11R0.68 CCCNC(C)C(=O)NC(C)C 34a_100015205314_100000210303 [0,1,1,0,0,0|2,0,0]=4 5200 B11R0.68 CCCOC(C)C(=O)NC(C)C 34a_100000210258_100000195394 [0,1,1,0,0,0|2,0,0]=4 5201 B11R0.68 CCCO[C@H](C)C(=O)OC(C)C 34a_100015307928_100000210303 [0,1,1,0,0,0|1,0,0]=3 5202 B11R0.68 CCCO[C@H](C)C(=O)OC(C)C 7a_100015307928_100000210303 [0,1,1,0,0,0|1,0,0]=3 5203 B11R0.68 CCCSC(C)C(=O)NC(C)C 62a_100000195394_100000210303 [0,1,1,0,0,0|2,0,0]=4 5204 B11R0.68 CCCSC(C)C(=O)NC(C)C 62a_100000210303_100000195394 [0,1,1,0,0,0|2,0,0]=4 5205 B11R0.68 CCOC[C@H](N)C(=O)OC(C)C 34a_100121572844_100000210202 [0,1,1,0,0,0|2,0,0]=4 5206 B11R0.68 CSCO[C@H](C)C(=O)OC(C)C 34a_100015307928_100011218213 [0,1,1,0,0,0|2,0,0]=4 5207 B11R0.73 C/C=C(\C)/C(=O)C(C)CCCC 1458a_100020587367_200011215066 [0,1,1,0,0,0|1,0,1]=4 5208 B11R0.73 CCCCC(C)C(=O)C(=O)NC 1458a_100011218921_200011215066 [0,1,1,0,0,0|2,0,0]=4 5209 B11R0.73 CCCCC(C)C(=O)C(C)CC 1458a_100000725509_100000758301 [0,1,1,0,0,0|1,0,0]=3 5210 B11R0.73 CCCCC(C)C(=O)C(C)CC 1458a_100011192722_200011215066 [0,1,1,0,0,0|1,0,0]=3 5211 B11R0.73 CCCCC(C)C(=O)C(C)OC 1458a_100000743197_200011215066 [0,1,1,0,0,0|2,0,0]=4 5212 B11R0.73 CCCCC(C)C(=O)C(C)SC 1458a_100000149566_200011215066 [0,1,1,0,0,0|2,0,0]=4 5213 B11R0.73 CCCCC(C)C(=O)C(O)CC 1458a_100011196387_200011215066 [0,1,1,0,0,0|1,0,0]=3 5214 B11R0.73 CCCCC(C)C(=O)C(O)CO 1458a_100011215603_200011215066 [0,1,1,0,0,0|2,0,0]=4 5215 B11R0.73 CCCCC(C)C(=O)N(C)CC 11a_100000225621_100000725509 [0,1,1,0,0,0|1,0,0]=3 5216 B11R0.73 CCCCC(C)C(=O)N(C)CC 1626a_100000225621_100000725509 [0,1,1,0,0,0|1,0,0]=3 5217 B11R0.73 CCCCC(C)C(=O)N(C)CC 240690a_100000225621_100000725509 [0,1,1,0,0,0|1,0,0]=3 5218 B11R0.73 CCCCC(C)C(=O)N(C)CC 527a_100000225621_100000725509 [0,1,1,0,0,0|1,0,0]=3 5219 B11R0.73 CCCCC(O)C(=O)C(C)CC 1458a_100000720857_100000758301 [0,1,1,0,0,0|2,0,0]=4 5220 B11R0.73 CCCCC(O)C(=O)N(C)CC 240690a_100000225621_100000720857 [0,1,1,0,0,0|2,0,0]=4 5221 B11R0.73 CCCCC(O)C(=O)N(C)CC 527a_100000225621_100000720857 [0,1,1,0,0,0|2,0,0]=4 5222 B11R0.73 CCCCN(C)C(=O)C(C)CC 11a_100000207549_100011192722 [0,1,1,0,0,0|2,0,0]=4 5223 B11R0.73 CCCCN(C)C(=O)C(C)CC 1626a_100000207549_100011192722 [0,1,1,0,0,0|2,0,0]=4 5224 B11R0.73 CCCCN(C)C(=O)C(C)CC 240690a_100000207549_100011192722 [0,1,1,0,0,0|2,0,0]=4 5225 B11R0.73 CCCCN(C)C(=O)C(C)CC 527a_100000207549_100011192722 [0,1,1,0,0,0|2,0,0]=4 5226 B11R0.73 CCCCN(C)C(=O)C(O)CC 240690a_100000207549_100011196387 [0,1,1,0,0,0|2,0,0]=4 5227 B11R0.73 CCCOC(C)C(=O)N(C)CC 34a_100000210258_200012002205 [0,1,1,0,0,0|2,0,0]=4 5228 B11R0.73 CCCSC(C)C(=O)N(C)CC 62a_100000210303_200012002205 [0,1,1,0,0,0|2,0,0]=4 5229 B11R0.73 CCCSC(C)C(=O)N(C)CC 62a_200012002205_100000210303 [0,1,1,0,0,0|2,0,0]=4 5230 B11R0.177 CCCC(=O)C(C)C(=O)NCC 1458a_100000211992_100000230173 [0,1,1,0,0,0|1,0,1]=4 5231 B11R0.177 CCCC(=O)C(C)C(=O)OCC 1458a_100000211992_100011216346 [0,1,1,0,0,0|0,0,1]=3 5232 B11R0.177 CCCC(=O)C(C)C(=O)OCC 1458a_100132301724_100000210303 [0,1,1,0,0,0|0,0,1]=3 5233 B11R0.177 CCCC(=O)C(F)C(=O)OCC 1458a_100000211992_100000760018 [0,1,1,0,0,0|1,0,1]=4 5234 B11R0.177 CCCN(C)C(C)C(=O)NCC 2230a_100000747261_100000230173 [0,1,1,0,0,0|2,0,0]=4 5235 B11R0.177 CCCN(C)C(C)C(=O)NCC 269982a_100000747261_100000230173 [0,1,1,0,0,0|2,0,0]=4 5236 B11R0.177 CCCN(C)C(C)C(=O)OCC 2230a_100000747261_100011215307 [0,1,1,0,0,0|1,0,0]=3 5237 B11R0.177 CCCN(C)C(C)C(=O)OCC 269982a_100000747261_100011216346 [0,1,1,0,0,0|1,0,0]=3 5238 B11R0.177 CCCN(C)C(F)C(=O)OCC 2230a_100000747261_100000760018 [0,1,1,0,0,0|2,0,0]=4 5239 B11R0.177 CCCN(C)C(F)C(=O)OCC 269982a_100000747261_100000760018 [0,1,1,0,0,0|2,0,0]=4 5240 B11R0.177 CCNC(=O)C(C)C(=O)OCC 11a_100015525214_100132301724 [0,1,1,0,0,0|1,0,1]=4 5241 B11R0.177 CCNC(=O)C(C)C(=O)OCC 240690a_100015525214_100132301724 [0,1,1,0,0,0|1,0,1]=4 5242 B11R0.177 CCNC(=O)C(C)C(=O)OCC 527a_100015525214_100132301724 [0,1,1,0,0,0|1,0,1]=4 5243 B11R0.177 CCOC(=O)C(C)C(=O)CCF 1458a_100132301724_100011217306 [0,1,1,0,0,0|1,0,1]=4 5244 B11R0.177 CCOC(=O)C(C)C(=O)CCO 1458a_100011216618_100011216346 [0,1,1,0,0,0|1,0,1]=4 5245 B11R0.177 CCOC(=O)C(C)C(=O)CCO 1458a_100132301724_100000211926 [0,1,1,0,0,0|1,0,1]=4 5246 B11R0.177 CCOC(=O)C(C)C(=O)COC 1458a_100000210968_100011216346 [0,1,1,0,0,0|1,0,1]=4 5247 B11R0.177 CCOC(=O)C(C)C(=O)CSC 1458a_100000184570_100011216346 [0,1,1,0,0,0|1,0,1]=4 5248 B11R0.177 CCOC(=O)C(C)N(C)CCO 2230a_100000210263_100011215307 [0,1,1,0,0,0|2,0,0]=4 5249 B11R0.177 CCOC(=O)C(C)N(C)CCO 269982a_100000210263_100011216346 [0,1,1,0,0,0|2,0,0]=4 5250 B11R0.191 CC#CC(=O)C(CC)CCCC 1458a_100000763181_200011216223 [0,1,1,0,0,0|1,0,1]=4 5251 B11R0.191 CC=CC(=O)C(CC)CCCC 1458a_100000210699_200011216223 [0,1,1,0,0,0|1,0,1]=4 5252 B11R0.191 CCCCC(CC)C(=O)CCC 1458a_100000211130_100000210303 [0,1,1,0,0,0|1,0,0]=3 5253 B11R0.191 CCCCC(CC)C(=O)CCC 1458a_100000211992_200011216223 [0,1,1,0,0,0|1,0,0]=3 5254 B11R0.191 CCCCC(CC)C(=O)CCF 1458a_100000211130_100011217306 [0,1,1,0,0,0|2,0,0]=4 5255 B11R0.191 CCCCC(CC)C(=O)CCO 1458a_100000211130_100000211926 [0,1,1,0,0,0|2,0,0]=4 5256 B11R0.191 CCCCC(CC)C(=O)CCO 1458a_100011216618_200011216223 [0,1,1,0,0,0|2,0,0]=4 5257 B11R0.191 CCCCC(CC)C(=O)COC 1458a_100000210968_200011216223 [0,1,1,0,0,0|2,0,0]=4 5258 B11R0.191 CCCCC(CC)C(=O)CSC 1458a_100000184570_200011216223 [0,1,1,0,0,0|2,0,0]=4 5259 B11R0.191 CCCCC(CC)C(=O)NCC 11a_100015525214_100000211130 [0,1,1,0,0,0|1,0,0]=3 5260 B11R0.191 CCCCC(CC)C(=O)NCC 240690a_100015525214_100000211130 [0,1,1,0,0,0|1,0,0]=3 5261 B11R0.191 CCCCC(CC)C(=O)NCC 527a_100015525214_100000211130 [0,1,1,0,0,0|1,0,0]=3 5262 B11R0.191 CCCCC(CC)C(=O)NNC 22a_100016993582_100000211130 [0,1,1,0,0,0|2,0,0]=4 5263 B11R0.191 CCCCC(CC)C(C)OCC 34a_200011290779_100000210202 [0,1,1,0,0,0|1,0,1]=4 5264 B11R0.191 CCCCC(CC)C(C)OCC 7a_200011290779_100000210202 [0,1,1,0,0,0|1,0,1]=4 5265 B11R0.191 CCCCC(NC)C(=O)OCC 2230a_106832991635_200009813700 [0,1,1,0,0,0|0,0,0]=2 5266 B11R0.191 CCCCC(NC)C(=O)OCC 34a_100102657272_200009813700 [0,1,1,0,0,0|0,0,0]=2 5267 B11R0.191 CCCCC(NC)C(=O)OCC 7a_106832991635_200009813700 [0,1,1,0,0,0|0,0,0]=2 5268 B11R0.191 CCCCC(OC)C(=O)OCC 34a_100138415774_200009813700 [0,1,1,0,0,0|0,0,0]=2 5269 B11R0.191 CCCCC(OC)C(=O)OCC 34a_200011215408_200000210301 [0,1,1,0,0,0|0,0,0]=2 5270 B11R0.191 CCCCC(OC)C(=O)OCC 7a_200011215408_200000210301 [0,1,1,0,0,0|0,0,0]=2 5271 B11R0.191 CCCCC(O[13CH3])C(=O)OCC 34a_200011215408_200025704644 [0,1,1,0,0,0|0,0,0]=2 5272 B11R0.191 CCCCC(O[13CH3])C(=O)OCC 7a_200011215408_200025704644 [0,1,1,0,0,0|0,0,0]=2 5273 B11R0.191 CCCCC(SC)C(=O)OCC 62a_200000210301_200009813700 [0,1,1,0,0,0|0,0,0]=2 5274 B11R0.191 CCCCC(SC)C(=O)OCC 62a_200009813700_200000210301 [0,1,1,0,0,0|0,0,0]=2 5275 B11R0.191 CCCCC(S[13CH3])C(=O)OCC 62a_200009813700_200025704644 [0,1,1,0,0,0|0,0,0]=2 5276 B11R0.191 CCCCC(S[13CH3])C(=O)OCC 62a_200025704644_200009813700 [0,1,1,0,0,0|0,0,0]=2 5277 B11R0.191 CCCCN(CC)C(=O)CCC 11a_100000207695_100000211992 [0,1,1,0,0,0|2,0,0]=4 5278 B11R0.191 CCCCN(CC)C(=O)CCC 1626a_100000207695_100000211992 [0,1,1,0,0,0|2,0,0]=4 5279 B11R0.191 CCCCN(CC)C(=O)CCC 240690a_100000207695_100000211992 [0,1,1,0,0,0|2,0,0]=4 5280 B11R0.191 CCCCN(CC)C(=O)CCC 527a_100000207695_100000211992 [0,1,1,0,0,0|2,0,0]=4 5281 B11R0.191 CCCCN(CC)C(=O)NCC 2708a_100015525214_100000207695 [0,1,1,0,0,0|2,0,0]=4 5282 B11R0.191 CCCCN(CC)C(=O)NCC 273464a_100015525214_100000207695 [0,1,1,0,0,0|2,0,0]=4 5283 B11R0.191 CCCOC(CC)C(=O)OCC 34a_100000210258_100000212269 [0,1,1,0,0,0|1,0,0]=3 5284 B11R0.191 CCCOC(CC)C(=O)OCC 34a_100011216719_100000210303 [0,1,1,0,0,0|1,0,0]=3 5285 B11R0.191 CCCOC(CC)C(=O)OCC 7a_100011216719_100000210303 [0,1,1,0,0,0|1,0,0]=3 5286 B11R0.191 CCCOC(SC)C(=O)OCC 34a_100000210258_100009893047 [0,1,1,0,0,0|1,0,0]=3 5287 B11R0.191 CCCSC(C=O)C(=O)OCC 62a_100000053139_100000210303 [0,1,1,0,0,0|1,0,1]=4 5288 B11R0.191 CCCSC(C=O)C(=O)OCC 62a_100000210303_100000053139 [0,1,1,0,0,0|1,0,1]=4 5289 B11R0.191 CCCSC(CC)C(=O)OCC 62a_100000210303_100000212269 [0,1,1,0,0,0|1,0,0]=3 5290 B11R0.191 CCCSC(CC)C(=O)OCC 62a_100000212269_100000210303 [0,1,1,0,0,0|1,0,0]=3 5291 B11R0.191 CCCSC(SC)C(=O)OCC 62a_100000210303_100009893047 [0,1,1,0,0,0|1,0,0]=3 5292 B11R0.191 CCCSC(SC)C(=O)OCC 62a_100009893047_100000210303 [0,1,1,0,0,0|1,0,0]=3 5293 B11R0.191 CCOC(=O)C(CC)NCCF 34a_100000724931_100000212269 [0,1,1,0,0,0|2,0,0]=4 5294 B11R0.191 CCOC(=O)C(CC)NCCO 2230a_100016997473_100000212269 [0,1,1,0,0,0|2,0,0]=4 5295 B11R0.191 CCOC(=O)C(CC)NCCO 34a_100016990907_100000212269 [0,1,1,0,0,0|2,0,0]=4 5296 B11R0.191 CCOC(=O)C(CC)OCCBr 34a_100000211926_100000212269 [0,1,1,0,0,0|2,0,0]=4 5297 B11R0.191 CCOC(=O)C(CC)OCCF 34a_100011216719_100011217306 [0,1,1,0,0,0|2,0,0]=4 5298 B11R0.191 CCOC(=O)C(CC)OCCF 7a_100011216719_100011217306 [0,1,1,0,0,0|2,0,0]=4 5299 B11R0.191 CCOC(=O)C(CC)OCCN 34a_100000210304_100000212269 [0,1,1,0,0,0|2,0,0]=4 5300 B11R0.191 CCOC(=O)C(CC)OCCO 34a_100011216719_100000211926 [0,1,1,0,0,0|2,0,0]=4 5301 B11R0.191 CCOC(=O)C(CC)OCCO 7a_100011216719_100000211926 [0,1,1,0,0,0|2,0,0]=4 5302 B11R0.191 CCOC(=O)C(CC)OCSC 34a_100011216719_100011218213 [0,1,1,0,0,0|2,0,0]=4 5303 B11R0.191 CCOC(=O)C(CC)SCCF 62a_100000212269_100011217306 [0,1,1,0,0,0|2,0,0]=4 5304 B11R0.191 CCOC(=O)C(CC)SCCF 62a_100011217306_100000212269 [0,1,1,0,0,0|2,0,0]=4 5305 B11R0.191 CCOC(=O)C(CC)SCCO 62a_100000211926_100000212269 [0,1,1,0,0,0|2,0,0]=4 5306 B11R0.191 CCOC(=O)C(CC)SCCO 62a_100000212269_100000211926 [0,1,1,0,0,0|2,0,0]=4 5307 B11R0.191 CCOC(=O)C(CC)SCOC 62a_100000212269_100000766300 [0,1,1,0,0,0|2,0,0]=4 5308 B11R0.191 CCOC(=O)C(CC)SCOC 62a_100000766300_100000212269 [0,1,1,0,0,0|2,0,0]=4 5309 B11R0.191 CCOC(=O)C(CC)SCSC 62a_100000212269_100011218213 [0,1,1,0,0,0|2,0,0]=4 5310 B11R0.191 CCOC(=O)C(CC)SCSC 62a_100011218213_100000212269 [0,1,1,0,0,0|2,0,0]=4 5311 B11R0.191 CCOC(=O)C(NCCF)SC 34a_100000724931_100009893047 [0,1,1,0,0,0|2,0,0]=4 5312 B11R0.191 CCOC(=O)C(NCCO)SC 34a_100016990907_100009893047 [0,1,1,0,0,0|2,0,0]=4 5313 B11R0.191 CCOC(=O)C(OCCBr)SC 34a_100000211926_100009893047 [0,1,1,0,0,0|2,0,0]=4 5314 B11R0.191 CCOC(=O)C(OCCN)SC 34a_100000210304_100009893047 [0,1,1,0,0,0|2,0,0]=4 5315 B11R0.191 CCOC(=O)C(SC)SCCF 62a_100009893047_100011217306 [0,1,1,0,0,0|2,0,0]=4 5316 B11R0.191 CCOC(=O)C(SC)SCCF 62a_100011217306_100009893047 [0,1,1,0,0,0|2,0,0]=4 5317 B11R0.191 CCOC(=O)C(SC)SCCO 62a_100000211926_100009893047 [0,1,1,0,0,0|2,0,0]=4 5318 B11R0.191 CCOC(=O)C(SC)SCCO 62a_100009893047_100000211926 [0,1,1,0,0,0|2,0,0]=4 5319 B11R0.191 CCOC(=O)C(SC)SCOC 62a_100000766300_100009893047 [0,1,1,0,0,0|2,0,0]=4 5320 B11R0.191 CCOC(=O)C(SC)SCOC 62a_100009893047_100000766300 [0,1,1,0,0,0|2,0,0]=4 5321 B11R0.191 CCOC(=O)C(SC)SCSC 62a_100009893047_100011218213 [0,1,1,0,0,0|2,0,0]=4 5322 B11R0.191 CCOC(=O)C(SC)SCSC 62a_100011218213_100009893047 [0,1,1,0,0,0|2,0,0]=4 5323 B11R0.247 CCCCC(C)(C)C(=O)CCC 1458a_100011216040_100000210303 [0,1,1,0,0,0|1,0,0]=3 5324 B11R0.247 CCCCC(C)(C)C(=O)CCF 1458a_100011216040_100011217306 [0,1,1,0,0,0|2,0,0]=4 5325 B11R0.247 CCCCC(C)(C)C(=O)CCO 1458a_100011216040_100000211926 [0,1,1,0,0,0|2,0,0]=4 5326 B11R0.247 CCCCC(C)(C)C(=O)NCC 11a_100015525214_100011216040 [0,1,1,0,0,0|1,0,0]=3 5327 B11R0.247 CCCCC(C)(C)C(=O)NCC 240690a_100015525214_100011216040 [0,1,1,0,0,0|1,0,0]=3 5328 B11R0.247 CCCCC(C)(C)C(=O)NCC 527a_100015525214_100011216040 [0,1,1,0,0,0|1,0,0]=3 5329 B11R0.247 CCCCC(C)(C)C(=O)NNC 22a_100016993582_100011216040 [0,1,1,0,0,0|2,0,0]=4 5330 B11R0.247 CCCCC(C)(O)C(=O)CCC 1458a_100000137666_100000210303 [0,1,1,0,0,0|1,0,0]=3 5331 B11R0.247 CCCCC(C)(O)C(=O)CCF 1458a_100000137666_100011217306 [0,1,1,0,0,0|2,0,0]=4 5332 B11R0.247 CCCCC(C)(O)C(=O)CCO 1458a_100000137666_100000211926 [0,1,1,0,0,0|2,0,0]=4 5333 B11R0.247 CCCCC(C)(O)C(=O)NCC 240690a_100015525214_100000137666 [0,1,1,0,0,0|1,0,0]=3 5334 B11R0.247 CCCCC(C)(O)C(=O)NNC 22a_100016993582_100000137666 [0,1,1,0,0,0|2,0,0]=4 5335 B11R0.247 CCCCC(F)(F)C(=O)CCC 1458a_100000100317_100000210303 [0,1,1,0,0,0|2,0,0]=4 5336 B11R0.247 CCCCC(F)(F)C(=O)NCC 11a_100015525214_100000100317 [0,1,1,0,0,0|2,0,0]=4 5337 B11R0.247 CCCCC(F)(F)C(=O)NCC 240690a_100015525214_100000100317 [0,1,1,0,0,0|2,0,0]=4 5338 B11R0.247 CCCCC(F)(F)C(=O)NCC 527a_100015525214_100000100317 [0,1,1,0,0,0|2,0,0]=4 5339 B11R0.247 CCCOC(C)(C)C(=O)OCC 34a_100000686869_100000210303 [0,1,1,0,0,0|1,0,0]=3 5340 B11R0.247 CCCOC(C)(C)C(=O)OCC 7a_100000686869_100000210303 [0,1,1,0,0,0|1,0,0]=3 5341 B11R0.247 CCCOC(F)(F)C(=O)OCC 34a_100000210258_100000210910 [0,1,1,0,0,0|2,0,0]=4 5342 B11R0.247 CCCSC(C)(C)C(=O)OCC 62a_100000210303_100011216345 [0,1,1,0,0,0|1,0,0]=3 5343 B11R0.247 CCCSC(C)(C)C(=O)OCC 62a_100011216345_100000210303 [0,1,1,0,0,0|1,0,0]=3 5344 B11R0.247 CCCSC(F)(F)C(=O)OCC 62a_100000210303_100000210910 [0,1,1,0,0,0|2,0,0]=4 5345 B11R0.247 CCCSC(F)(F)C(=O)OCC 62a_100000210910_100000210303 [0,1,1,0,0,0|2,0,0]=4 5346 B11R0.247 CCNC(=O)C(C)(C)CSCC 62a_100000210202_100011895991 [0,1,1,0,0,0|2,0,0]=4 5347 B11R0.247 CCNC(=O)C(C)(C)CSCC 62a_100011895991_100000210202 [0,1,1,0,0,0|2,0,0]=4 5348 B11R0.247 CCNCC(C)(C)C(=O)OCC 2230a_100015525214_100011219049 [0,1,1,0,0,0|1,0,0]=3 5349 B11R0.247 CCOC(=O)C(C)(C)COCF 7a_100011765865_100015361967 [0,1,1,0,0,0|2,0,0]=4 5350 B11R0.247 CCOC(=O)C(C)(C)CSCC 62a_100000210202_100011219049 [0,1,1,0,0,0|1,0,0]=3 5351 B11R0.247 CCOC(=O)C(C)(C)CSCC 62a_100011219049_100000210202 [0,1,1,0,0,0|1,0,0]=3 5352 B11R0.247 CCOC(=O)C(C)(C)CSCF 62a_100011219049_100015361967 [0,1,1,0,0,0|2,0,0]=4 5353 B11R0.247 CCOC(=O)C(C)(C)CSCF 62a_100015361967_100011219049 [0,1,1,0,0,0|2,0,0]=4 5354 B11R0.247 CCOC(=O)C(C)(C)NCCO 2230a_100016997473_100011216345 [0,1,1,0,0,0|2,0,0]=4 5355 B11R0.247 CCOC(=O)C(C)(C)OCCF 34a_100000686869_100011217306 [0,1,1,0,0,0|2,0,0]=4 5356 B11R0.247 CCOC(=O)C(C)(C)OCCF 7a_100000686869_100011217306 [0,1,1,0,0,0|2,0,0]=4 5357 B11R0.247 CCOC(=O)C(C)(C)OCCO 34a_100000686869_100000211926 [0,1,1,0,0,0|2,0,0]=4 5358 B11R0.247 CCOC(=O)C(C)(C)OCCO 7a_100000686869_100000211926 [0,1,1,0,0,0|2,0,0]=4 5359 B11R0.247 CCOC(=O)C(C)(C)OCSC 34a_100000686869_100011218213 [0,1,1,0,0,0|2,0,0]=4 5360 B11R0.247 CCOC(=O)C(C)(C)SCCF 62a_100011216345_100011217306 [0,1,1,0,0,0|2,0,0]=4 5361 B11R0.247 CCOC(=O)C(C)(C)SCCF 62a_100011217306_100011216345 [0,1,1,0,0,0|2,0,0]=4 5362 B11R0.247 CCOC(=O)C(C)(C)SCCO 62a_100000211926_100011216345 [0,1,1,0,0,0|2,0,0]=4 5363 B11R0.247 CCOC(=O)C(C)(C)SCCO 62a_100011216345_100000211926 [0,1,1,0,0,0|2,0,0]=4 5364 B11R0.247 CCOC(=O)C(C)(C)SCOC 62a_100000766300_100011216345 [0,1,1,0,0,0|2,0,0]=4 5365 B11R0.247 CCOC(=O)C(C)(C)SCOC 62a_100011216345_100000766300 [0,1,1,0,0,0|2,0,0]=4 5366 B11R0.247 CCOC(=O)C(C)(C)SCSC 62a_100011216345_100011218213 [0,1,1,0,0,0|2,0,0]=4 5367 B11R0.247 CCOC(=O)C(C)(C)SCSC 62a_100011218213_100011216345 [0,1,1,0,0,0|2,0,0]=4 5368 B11R0.247 CCOC(=O)C(F)(F)CSCC 62a_100000210202_100009817193 [0,1,1,0,0,0|2,0,0]=4 5369 B11R0.247 CCOC(=O)C(F)(F)CSCC 62a_100009817193_100000210202 [0,1,1,0,0,0|2,0,0]=4 5370 B11R0.247 CCOCC(C)(C)C(=O)OCC 7a_100011765865_100000210202 [0,1,1,0,0,0|1,0,0]=3 5371 B11R0.247 CCOCC(F)(F)C(=O)OCC 34a_100121572206_100009817193 [0,1,1,0,0,0|2,0,0]=4 5372 B11R0.18 C/C=C(\C)/C(=O)C(CC)CCC 1458a_100020587367_100011219200 [0,1,1,0,0,0|1,0,1]=4 5373 B11R0.18 CCCC(CC)C(=O)C(=O)NC 1458a_100011218921_100011219200 [0,1,1,0,0,0|2,0,0]=4 5374 B11R0.18 CCCC(CC)C(=O)C(C)CC 1458a_100011192722_100011219200 [0,1,1,0,0,0|1,0,0]=3 5375 B11R0.18 CCCC(CC)C(=O)C(C)CC 1458a_100011416436_100000758301 [0,1,1,0,0,0|1,0,0]=3 5376 B11R0.18 CCCC(CC)C(=O)C(C)OC 1458a_100000743197_100011219200 [0,1,1,0,0,0|2,0,0]=4 5377 B11R0.18 CCCC(CC)C(=O)C(C)SC 1458a_100000149566_100011219200 [0,1,1,0,0,0|2,0,0]=4 5378 B11R0.18 CCCC(CC)C(=O)C(O)CC 1458a_100011196387_100011219200 [0,1,1,0,0,0|1,0,0]=3 5379 B11R0.18 CCCC(CC)C(=O)C(O)CO 1458a_100011215603_100011219200 [0,1,1,0,0,0|2,0,0]=4 5380 B11R0.18 CCCC(CC)C(=O)N(C)CC 11a_100000225621_100011416436 [0,1,1,0,0,0|1,0,0]=3 5381 B11R0.18 CCCC(CC)C(=O)N(C)CC 1626a_100000225621_100011416436 [0,1,1,0,0,0|1,0,0]=3 5382 B11R0.18 CCCC(CC)C(=O)N(C)CC 240690a_100000225621_100011416436 [0,1,1,0,0,0|1,0,0]=3 5383 B11R0.18 CCCC(CC)C(=O)N(C)CC 527a_100000225621_100011416436 [0,1,1,0,0,0|1,0,0]=3 5384 B11R0.18 CCCN(CC)C(=O)C(C)CC 11a_100000226822_100011192722 [0,1,1,0,0,0|2,0,0]=4 5385 B11R0.18 CCCN(CC)C(=O)C(C)CC 1626a_100000226822_100011192722 [0,1,1,0,0,0|2,0,0]=4 5386 B11R0.18 CCCN(CC)C(=O)C(C)CC 240690a_100000226822_100011192722 [0,1,1,0,0,0|2,0,0]=4 5387 B11R0.18 CCCN(CC)C(=O)C(C)CC 527a_100000226822_100011192722 [0,1,1,0,0,0|2,0,0]=4 5388 B11R0.18 CCCN(CC)C(=O)C(O)CC 240690a_100000226822_100011196387 [0,1,1,0,0,0|2,0,0]=4 5389 B11R0.53 CCCC(=O)C(CC)N(C)CC 1458a_100011345578_100000210303 [0,1,1,0,0,0|2,0,0]=4 5390 B11R0.53 CCCC(=O)N(CC)C(C)CC 11a_100000732650_100000211992 [0,1,1,0,0,0|2,0,0]=4 5391 B11R0.53 CCCC(=O)N(CC)C(C)CC 1626a_100000732650_100000211992 [0,1,1,0,0,0|2,0,0]=4 5392 B11R0.53 CCCC(=O)N(CC)C(C)CC 240690a_100000732650_100000211992 [0,1,1,0,0,0|2,0,0]=4 5393 B11R0.53 CCCC(=O)N(CC)C(C)CC 527a_100000732650_100000211992 [0,1,1,0,0,0|2,0,0]=4 5394 B11R0.53 CCNC(=O)C(CC)N(C)CC 240690a_100015525214_100011345578 [0,1,1,0,0,0|2,0,0]=4 5395 B11R0.53 CCNC(=O)C(CC)N(C)CC 527a_100015525214_100011345578 [0,1,1,0,0,0|2,0,0]=4 5396 B11R0.53 CCNC(=O)N(CC)C(C)CC 2708a_100015525214_100000732650 [0,1,1,0,0,0|2,0,0]=4 5397 B11R0.53 CCNC(=O)N(CC)C(C)CC 273464a_100015525214_100000732650 [0,1,1,0,0,0|2,0,0]=4 5398 B11R0.53 CCOC(=O)C(CC)C(=O)CC 1458a_100000210414_100000212269 [0,1,1,0,0,0|0,0,1]=3 5399 B11R0.53 CCOC(=O)C(CC)C(=O)CO 1458a_100000210174_100000212269 [0,1,1,0,0,0|1,0,1]=4 5400 B11R0.53 CCOC(=O)C(CC)N(C)CC 2230a_100000225621_100000212269 [0,1,1,0,0,0|1,0,0]=3 5401 B11R0.53 CCOC(=O)C(CC)N(C)CC 269982a_100000225621_100000212269 [0,1,1,0,0,0|1,0,0]=3 5402 B11R0.53 CCOC(=O)C(NC)C(=O)CC 7a_106832991635_100000687759 [0,1,1,0,0,0|1,0,1]=4 5403 B11R0.53 CCOC(=O)C(SC)C(=O)CC 1458a_100000210414_100009893047 [0,1,1,0,0,0|1,0,1]=4 5404 B11R0.53 CCOC(=O)C(SC)C(=O)CC 62a_100000687759_200000210301 [0,1,1,0,0,0|1,0,1]=4 5405 B11R0.53 CCOC(=O)C(SC)C(=O)CC 62a_200000210301_100000687759 [0,1,1,0,0,0|1,0,1]=4 5406 B11R0.53 CCOC(=O)C(SC)N(C)CC 269982a_100000225621_100009893047 [0,1,1,0,0,0|2,0,0]=4 5407 B11R0.53 CCOC(=O)C(S[13CH3])C(=O)CC 62a_100000687759_200025704644 [0,1,1,0,0,0|1,0,1]=4 5408 B11R0.53 CCOC(=O)C(S[13CH3])C(=O)CC 62a_200025704644_100000687759 [0,1,1,0,0,0|1,0,1]=4 5409 B11R0.56 CCCC(=O)N(CC)CC(C)C 11a_100000738554_100000211992 [0,1,1,0,0,0|2,0,0]=4 5410 B11R0.56 CCCC(=O)N(CC)CC(C)C 1626a_100000738554_100000211992 [0,1,1,0,0,0|2,0,0]=4 5411 B11R0.56 CCCC(=O)N(CC)CC(C)C 240690a_100000738554_100000211992 [0,1,1,0,0,0|2,0,0]=4 5412 B11R0.56 CCCC(=O)N(CC)CC(C)C 527a_100000738554_100000211992 [0,1,1,0,0,0|2,0,0]=4 5413 B11R0.56 CCCC(=O)N(CC)C[C@H](C)O 240690a_100000729506_100000211992 [0,1,1,0,0,0|2,0,0]=4 5414 B11R0.56 CCCC(=O)N(CC)C[C@H](C)O 527a_100000729506_100000211992 [0,1,1,0,0,0|2,0,0]=4 5415 B11R0.56 CCNC(=O)N(CC)CC(C)C 2708a_100015525214_100000738554 [0,1,1,0,0,0|2,0,0]=4 5416 B11R0.56 CCNC(=O)N(CC)CC(C)C 273464a_100015525214_100000738554 [0,1,1,0,0,0|2,0,0]=4 5417 B11R0.56 CCNC(=O)N(CC)C[C@H](C)O 2708a_100015525214_100000729506 [0,1,1,0,0,0|2,0,0]=4 5418 B11R0.56 CCNC(=O)N(CC)C[C@H](C)O 273464a_100015525214_100000729506 [0,1,1,0,0,0|2,0,0]=4 5419 B11R0.56 CCOC(=O)C(CC(C)C)NC 2230a_106832991635_100010269446 [0,1,1,0,0,0|1,0,0]=3 5420 B11R0.56 CCOC(=O)C(CC(C)C)NC 34a_100102657272_100010269446 [0,1,1,0,0,0|1,0,0]=3 5421 B11R0.56 CCOC(=O)C(CC(C)C)NC 7a_106832991635_100010269446 [0,1,1,0,0,0|1,0,0]=3 5422 B11R0.56 CCOC(=O)C(CC(C)C)OC 34a_100011626094_200000210301 [0,1,1,0,0,0|1,0,0]=3 5423 B11R0.56 CCOC(=O)C(CC(C)C)OC 34a_100138415774_100010269446 [0,1,1,0,0,0|1,0,0]=3 5424 B11R0.56 CCOC(=O)C(CC(C)C)OC 7a_100011626094_200000210301 [0,1,1,0,0,0|1,0,0]=3 5425 B11R0.56 CCOC(=O)C(CC(C)C)O[13CH3] 34a_100011626094_200025704644 [0,1,1,0,0,0|1,0,0]=3 5426 B11R0.56 CCOC(=O)C(CC(C)C)O[13CH3] 7a_100011626094_200025704644 [0,1,1,0,0,0|1,0,0]=3 5427 B11R0.56 CCOC(=O)C(CC(C)C)SC 62a_100010269446_200000210301 [0,1,1,0,0,0|1,0,0]=3 5428 B11R0.56 CCOC(=O)C(CC(C)C)SC 62a_200000210301_100010269446 [0,1,1,0,0,0|1,0,0]=3 5429 B11R0.56 CCOC(=O)C(CC(C)C)S[13CH3] 62a_100010269446_200025704644 [0,1,1,0,0,0|1,0,0]=3 5430 B11R0.56 CCOC(=O)C(CC(C)C)S[13CH3] 62a_200025704644_100010269446 [0,1,1,0,0,0|1,0,0]=3 5431 B11R0.56 CCOC(=O)C(CC)NC(C)C 2230a_100138425928_100000212269 [0,1,1,0,0,0|1,0,0]=3 5432 B11R0.56 CCOC(=O)C(CC)NC(C)C 34a_100138425928_100000212269 [0,1,1,0,0,0|1,0,0]=3 5433 B11R0.56 CCOC(=O)C(CC)OC(C)C 34a_100000212225_100000212269 [0,1,1,0,0,0|1,0,0]=3 5434 B11R0.56 CCOC(=O)C(CC)OC(C)C 34a_100011216719_100000210206 [0,1,1,0,0,0|1,0,0]=3 5435 B11R0.56 CCOC(=O)C(CC)OC(C)C 7a_100011216719_100000210206 [0,1,1,0,0,0|1,0,0]=3 5436 B11R0.56 CCOC(=O)C(CC)SC(C)C 62a_100000210206_100000212269 [0,1,1,0,0,0|1,0,0]=3 5437 B11R0.56 CCOC(=O)C(CC)SC(C)C 62a_100000212269_100000210206 [0,1,1,0,0,0|1,0,0]=3 5438 B11R0.56 CCOC(=O)C(NC(C)C)SC 34a_100138425928_100009893047 [0,1,1,0,0,0|2,0,0]=4 5439 B11R0.56 CCOC(=O)C(OC(C)C)SC 34a_100000212225_100009893047 [0,1,1,0,0,0|2,0,0]=4 5440 B11R0.56 CCOC(=O)C(SC)SC(C)C 62a_100000210206_100009893047 [0,1,1,0,0,0|2,0,0]=4 5441 B11R0.56 CCOC(=O)C(SC)SC(C)C 62a_100009893047_100000210206 [0,1,1,0,0,0|2,0,0]=4 5442 B11R0.56 CCOC(=O)[C@H](CC)NC(=O)C 188690a_100025709693_100015343762 [0,1,1,0,0,0|1,0,1]=4 5443 B11R0.57 CCCC(=O)C(SCC)C(C)C 1458a_100000750736_100000210303 [0,1,1,0,0,0|2,0,0]=4 5444 B11R0.57 CCCC(=O)N(CCC)C(C)C 11a_106256033942_100000211992 [0,1,1,0,0,0|2,0,0]=4 5445 B11R0.57 CCCC(=O)N(CCC)C(C)C 1626a_106256033942_100000211992 [0,1,1,0,0,0|2,0,0]=4 5446 B11R0.57 CCCC(=O)N(CCC)C(C)C 240690a_106256033942_100000211992 [0,1,1,0,0,0|2,0,0]=4 5447 B11R0.57 CCCC(=O)N(CCC)C(C)C 527a_106256033942_100000211992 [0,1,1,0,0,0|2,0,0]=4 5448 B11R0.57 CCCC(C(=O)C)C(=O)OCC 1458a_100000070787_100000695697 [0,1,1,0,0,0|0,0,1]=3 5449 B11R0.57 CCCC(C(=O)OCC)N(C)C 2230a_100102631434_100000695697 [0,1,1,0,0,0|1,0,0]=3 5450 B11R0.57 CCCC(C(=O)OCC)N(C)C 269982a_100102631434_100000695697 [0,1,1,0,0,0|1,0,0]=3 5451 B11R0.57 CCCN(C(=O)NCC)C(C)C 2708a_100015525214_106256033942 [0,1,1,0,0,0|2,0,0]=4 5452 B11R0.57 CCCN(C(=O)NCC)C(C)C 273464a_100015525214_106256033942 [0,1,1,0,0,0|2,0,0]=4 5453 B11R0.57 CCNC(=O)C(SCC)C(C)C 11a_100015525214_100000750736 [0,1,1,0,0,0|2,0,0]=4 5454 B11R0.57 CCNC(=O)C(SCC)C(C)C 240690a_100015525214_100000750736 [0,1,1,0,0,0|2,0,0]=4 5455 B11R0.57 CCNC(=O)C(SCC)C(C)C 527a_100015525214_100000750736 [0,1,1,0,0,0|2,0,0]=4 5456 B11R0.57 CCOC(=O)C(OCC)C(=O)C 34a_100121572206_100009831564 [0,1,1,0,0,0|1,0,1]=4 5457 B11R0.57 CCOC(=O)C(OCC)C(C)C 34a_100121572206_100000740032 [0,1,1,0,0,0|1,0,0]=3 5458 B11R0.57 CCOC(=O)C(SCC)C(=O)C 62a_100000210202_100000211040 [0,1,1,0,0,0|1,0,1]=4 5459 B11R0.57 CCOC(=O)C(SCC)C(=O)C 62a_100000211040_100000210202 [0,1,1,0,0,0|1,0,1]=4 5460 B11R0.57 CCOC(=O)C(SCC)C(C)C 62a_100000210202_100000740032 [0,1,1,0,0,0|1,0,0]=3 5461 B11R0.57 CCOC(=O)C(SCC)C(C)C 62a_100000740032_100000210202 [0,1,1,0,0,0|1,0,0]=3 5462 B11R0.57 CCOC(=O)C(SCF)C(C)C 62a_100000740032_100015361967 [0,1,1,0,0,0|2,0,0]=4 5463 B11R0.57 CCOC(=O)C(SCF)C(C)C 62a_100015361967_100000740032 [0,1,1,0,0,0|2,0,0]=4 5464 B11R0.61 CC#CC(=O)C(CCC)CCC 1458a_100000763181_200011218217 [0,1,1,0,0,0|1,0,1]=4 5465 B11R0.61 CC=CC(=O)C(CCC)CCC 1458a_100000210699_200011218217 [0,1,1,0,0,0|1,0,1]=4 5466 B11R0.61 CCCC(=O)C(CCC)CCC 1458a_100000211992_200011218217 [0,1,1,0,0,0|1,0,0]=3 5467 B11R0.61 CCCC(=O)C(CCC)CCC 1458a_100011215354_100000210303 [0,1,1,0,0,0|1,0,0]=3 5468 B11R0.61 CCCC(=O)C(CCC)OCC 34a_200011216804_100000210202 [0,1,1,0,0,0|1,0,0]=3 5469 B11R0.61 CCCC(=O)C(CCC)OCC 7a_200011216804_100000210202 [0,1,1,0,0,0|1,0,0]=3 5470 B11R0.61 CCCC(=O)C(CCC)OCF 34a_200011216804_100015361967 [0,1,1,0,0,0|2,0,0]=4 5471 B11R0.61 CCCC(=O)C(CCC)OCF 7a_200011216804_100015361967 [0,1,1,0,0,0|2,0,0]=4 5472 B11R0.61 CCCC(=O)C(OCC)OCC 1458a_100000082760_100000210303 [0,1,1,0,0,0|2,0,0]=4 5473 B11R0.61 CCCC(=O)N(CCC)CCC 11a_100000210455_100000211992 [0,1,1,0,0,0|2,0,0]=4 5474 B11R0.61 CCCC(=O)N(CCC)CCC 1626a_100000210455_100000211992 [0,1,1,0,0,0|2,0,0]=4 5475 B11R0.61 CCCC(=O)N(CCC)CCC 240690a_100000210455_100000211992 [0,1,1,0,0,0|2,0,0]=4 5476 B11R0.61 CCCC(=O)N(CCC)CCC 527a_100000210455_100000211992 [0,1,1,0,0,0|2,0,0]=4 5477 B11R0.61 CCCC(=O)N(CCC)CCO 240690a_100000211420_100000211992 [0,1,1,0,0,0|2,0,0]=4 5478 B11R0.61 CCCC(CCC)C(=O)CCF 1458a_100011215354_100011217306 [0,1,1,0,0,0|2,0,0]=4 5479 B11R0.61 CCCC(CCC)C(=O)CCO 1458a_100011215354_100000211926 [0,1,1,0,0,0|2,0,0]=4 5480 B11R0.61 CCCC(CCC)C(=O)CCO 1458a_100011216618_200011218217 [0,1,1,0,0,0|2,0,0]=4 5481 B11R0.61 CCCC(CCC)C(=O)COC 1458a_100000210968_200011218217 [0,1,1,0,0,0|2,0,0]=4 5482 B11R0.61 CCCC(CCC)C(=O)CSC 1458a_100000184570_200011218217 [0,1,1,0,0,0|2,0,0]=4 5483 B11R0.61 CCCC(CCC)C(=O)NCC 11a_100015525214_100011215354 [0,1,1,0,0,0|1,0,0]=3 5484 B11R0.61 CCCC(CCC)C(=O)NCC 240690a_100015525214_100011215354 [0,1,1,0,0,0|1,0,0]=3 5485 B11R0.61 CCCC(CCC)C(=O)NCC 527a_100015525214_100011215354 [0,1,1,0,0,0|1,0,0]=3 5486 B11R0.61 CCCC(CCC)C(=O)NNC 22a_100016993582_100011215354 [0,1,1,0,0,0|2,0,0]=4 5487 B11R0.61 CCCC(NCC)C(=O)OCC 2230a_100015525214_100000695697 [0,1,1,0,0,0|0,0,0]=2 5488 B11R0.61 CCCC(OCC)C(=O)OCC 34a_100121572206_100000695697 [0,1,1,0,0,0|0,0,0]=2 5489 B11R0.61 CCCC(OCC)C(=O)OCC 34a_200011218214_100000210202 [0,1,1,0,0,0|0,0,0]=2 5490 B11R0.61 CCCC(OCC)C(=O)OCC 7a_200011218214_100000210202 [0,1,1,0,0,0|0,0,0]=2 5491 B11R0.61 CCCC(OCF)C(=O)OCC 34a_200011218214_100015361967 [0,1,1,0,0,0|1,0,0]=3 5492 B11R0.61 CCCC(OCF)C(=O)OCC 7a_200011218214_100015361967 [0,1,1,0,0,0|1,0,0]=3 5493 B11R0.61 CCCC(SCC)C(=O)OCC 62a_100000210202_100000695697 [0,1,1,0,0,0|0,0,0]=2 5494 B11R0.61 CCCC(SCC)C(=O)OCC 62a_100000695697_100000210202 [0,1,1,0,0,0|0,0,0]=2 5495 B11R0.61 CCCC(SCF)C(=O)OCC 62a_100000695697_100015361967 [0,1,1,0,0,0|1,0,0]=3 5496 B11R0.61 CCCC(SCF)C(=O)OCC 62a_100015361967_100000695697 [0,1,1,0,0,0|1,0,0]=3 5497 B11R0.61 CCCN(CCC)C(=O)NCC 2708a_100015525214_100000210455 [0,1,1,0,0,0|2,0,0]=4 5498 B11R0.61 CCCN(CCC)C(=O)NCC 273464a_100015525214_100000210455 [0,1,1,0,0,0|2,0,0]=4 5499 B11R0.61 CCCN(CCO)C(=O)NCC 2708a_100015525214_100000211420 [0,1,1,0,0,0|2,0,0]=4 5500 B11R0.61 CCCN(CCO)C(=O)NCC 273464a_100015525214_100000211420 [0,1,1,0,0,0|2,0,0]=4 5501 B11R0.61 CCNC(=O)C(OCC)OCC 11a_100015525214_100000082760 [0,1,1,0,0,0|2,0,0]=4 5502 B11R0.61 CCNC(=O)C(OCC)OCC 240690a_100015525214_100000082760 [0,1,1,0,0,0|2,0,0]=4 5503 B11R0.61 CCNC(=O)C(OCC)OCC 527a_100015525214_100000082760 [0,1,1,0,0,0|2,0,0]=4 5504 B11R0.61 CCOC(=O)C(OCC)OCC 34a_100121572206_100000033883 [0,1,1,0,0,0|1,0,0]=3 5505 B11R0.61 CCOC(=O)C(OCC)SCC 62a_100000033883_100000210202 [0,1,1,0,0,0|1,0,0]=3 5506 B11R0.61 CCOC(=O)C(OCC)SCC 62a_100000210202_100000033883 [0,1,1,0,0,0|1,0,0]=3 5507 B11R0.61 CCOC(=O)C(OCC)SCF 62a_100000033883_100015361967 [0,1,1,0,0,0|2,0,0]=4 5508 B11R0.61 CCOC(=O)C(OCC)SCF 62a_100015361967_100000033883 [0,1,1,0,0,0|2,0,0]=4 5509 B11R0.133 C=C(C)CC(=O)C(CC)CCC 1458a_100011416436_100000748629 [0,1,1,0,0,0|1,0,1]=4 5510 B11R0.133 CCCC(CC)C(=O)C=C(C)C 1458a_100000211388_100011219200 [0,1,1,0,0,0|1,0,1]=4 5511 B11R0.133 CCCC(CC)C(=O)C=C(C)Cl 1458a_200042562850_100011219200 [0,1,1,0,0,0|1,0,1]=4 5512 B11R0.133 CCCC(CC)C(=O)C=C(C)I 1458a_100025716642_100011219200 [0,1,1,0,0,0|1,0,1]=4 5513 B11R0.133 CCCC(CC)C(=O)CC(C)C 1458a_100000210554_100011219200 [0,1,1,0,0,0|1,0,0]=3 5514 B11R0.133 CCCC(CC)C(=O)CC(C)C 1458a_100011416436_100000210624 [0,1,1,0,0,0|1,0,0]=3 5515 B11R0.133 CCCC(CC)C(=O)CC(C)O 1458a_100011416436_100011218427 [0,1,1,0,0,0|1,0,0]=3 5516 B11R0.133 CCCC(CC)C(=O)CC(F)F 1458a_100011416436_100011934356 [0,1,1,0,0,0|2,0,0]=4 5517 B11R0.133 CCCC(CC)C(=O)CN(C)C 1458a_100000750896_100011219200 [0,1,1,0,0,0|2,0,0]=4 5518 B11R0.133 CCCC(CC)C(=O)C[C@@H](C)O 1458a_100011933948_100011219200 [0,1,1,0,0,0|1,0,0]=3 5519 B11R0.133 CCCC(CC)C(=O)C[S+](C)C 1458a_200159257847_100011219200 [0,1,1,0,0,0|2,0,0]=4 5520 B11R0.133 CCCC(CC)C(=O)NC(C)C 11a_100138425928_100011416436 [0,1,1,0,0,0|1,0,0]=3 5521 B11R0.133 CCCC(CC)C(=O)NC(C)C 1626a_100138425928_100011416436 [0,1,1,0,0,0|1,0,0]=3 5522 B11R0.133 CCCC(CC)C(=O)NC(C)C 240690a_100138425928_100011416436 [0,1,1,0,0,0|1,0,0]=3 5523 B11R0.133 CCCC(CC)C(=O)NC(C)C 527a_100138425928_100011416436 [0,1,1,0,0,0|1,0,0]=3 5524 B11R0.133 CCCN(CC)C(=O)CC(C)C 11a_100000226822_100000210554 [0,1,1,0,0,0|2,0,0]=4 5525 B11R0.133 CCCN(CC)C(=O)CC(C)C 1626a_100000226822_100000210554 [0,1,1,0,0,0|2,0,0]=4 5526 B11R0.133 CCCN(CC)C(=O)CC(C)C 240690a_100000226822_100000210554 [0,1,1,0,0,0|2,0,0]=4 5527 B11R0.133 CCCN(CC)C(=O)CC(C)C 527a_100000226822_100000210554 [0,1,1,0,0,0|2,0,0]=4 5528 B11R0.133 CCCN(CC)C(=O)C[C@@H](C)O 240690a_100000226822_100011933948 [0,1,1,0,0,0|2,0,0]=4 5529 B11R0.133 CCCN(CC)C(=O)NC(C)C 2708a_100138425928_100000226822 [0,1,1,0,0,0|2,0,0]=4 5530 B11R0.133 CCCN(CC)C(=O)NC(C)C 273464a_100138425928_100000226822 [0,1,1,0,0,0|2,0,0]=4 5531 B11R0.133 CCNC(CC)C(=O)NC(C)C 2230a_100015525214_200011763342 [0,1,1,0,0,0|2,0,0]=4 5532 B11R0.133 CCOC(CC)C(=O)NC(C)C 34a_100121572206_200011763342 [0,1,1,0,0,0|2,0,0]=4 5533 B11R0.133 CCSC(CC)C(=O)NC(C)C 62a_100000210202_200011763342 [0,1,1,0,0,0|2,0,0]=4 5534 B11R0.133 CCSC(CC)C(=O)NC(C)C 62a_200011763342_100000210202 [0,1,1,0,0,0|2,0,0]=4 5535 B11R0.241 CC#CC(=O)C(C)(CC)CCC 1458a_100000763181_200000040151 [0,1,1,0,0,0|1,0,1]=4 5536 B11R0.241 CC=CC(=O)C(C)(CC)CCC 1458a_100000210699_200000040151 [0,1,1,0,0,0|1,0,1]=4 5537 B11R0.241 CCCC(=O)C(C)(CC)CCC 1458a_100000211992_200000040151 [0,1,1,0,0,0|1,0,0]=3 5538 B11R0.241 CCCC(=O)C(C)(CC)CCC 1458a_200000724995_100000210303 [0,1,1,0,0,0|1,0,0]=3 5539 B11R0.241 CCCC(C)(CC)C(=O)CCF 1458a_200000724995_100011217306 [0,1,1,0,0,0|2,0,0]=4 5540 B11R0.241 CCCC(C)(CC)C(=O)CCO 1458a_100011216618_200000040151 [0,1,1,0,0,0|2,0,0]=4 5541 B11R0.241 CCCC(C)(CC)C(=O)CCO 1458a_200000724995_100000211926 [0,1,1,0,0,0|2,0,0]=4 5542 B11R0.241 CCCC(C)(CC)C(=O)COC 1458a_100000210968_200000040151 [0,1,1,0,0,0|2,0,0]=4 5543 B11R0.241 CCCC(C)(CC)C(=O)CSC 1458a_100000184570_200000040151 [0,1,1,0,0,0|2,0,0]=4 5544 B11R0.241 CCCC(C)(CC)C(=O)NCC 11a_100015525214_200000724995 [0,1,1,0,0,0|1,0,0]=3 5545 B11R0.241 CCCC(C)(CC)C(=O)NCC 240690a_100015525214_200000724995 [0,1,1,0,0,0|1,0,0]=3 5546 B11R0.241 CCCC(C)(CC)C(=O)NCC 527a_100015525214_200000724995 [0,1,1,0,0,0|1,0,0]=3 5547 B11R0.241 CCCC(C)(CC)C(=O)NNC 22a_100016993582_200000724995 [0,1,1,0,0,0|2,0,0]=4 5548 B11R1.7 CNS(=O)(=O)C1CCCCC1 270084a_100102657272_100011219266 [1,1,0,0,0,0|2,0,0]=4 5549 B11R1.7 CNS(=O)(=O)C1CCCCC1 274078a_100102657272_100011219266 [1,1,0,0,0,0|2,0,0]=4 5550 B11R1.12 CCC(NC)C1CCCCC1 269862a_106832991636_100011216311 [1,1,0,0,0,0|1,0,1]=4 5551 B11R1.12 CCC(OC)C1CCCCC1 34a_100011215090_200000210301 [1,1,0,0,0,0|0,0,2]=4 5552 B11R1.12 CCC(OC)C1CCCCC1 7a_100011215090_200000210301 [1,1,0,0,0,0|0,0,2]=4 5553 B11R1.12 CCC(O[13CH3])C1CCCCC1 34a_100011215090_200025704644 [1,1,0,0,0,0|0,0,2]=4 5554 B11R1.12 CCC(O[13CH3])C1CCCCC1 7a_100011215090_200025704644 [1,1,0,0,0,0|0,0,2]=4 5555 B11R1.12 CCN(CC)C1CCCCC1 2230a_100000201195_100000210202 [1,1,0,0,0,0|2,0,0]=4 5556 B11R1.12 CCN(CC)C1CCCCC1 269956a_100000042499_100000210327 [1,1,0,0,0,0|2,0,0]=4 5557 B11R1.12 CCN(CC)C1CCCCC1 269982a_100000201195_100000204670 [1,1,0,0,0,0|2,0,0]=4 5558 B11R1.12 CCN(CC)C1CCCCC1 269982a_100000724800_100000210327 [1,1,0,0,0,0|2,0,0]=4 5559 B11R1.12 CCN(CC)C1CCCCC1 270004a_100000724800_100000210434 [1,1,0,0,0,0|2,0,0]=4 5560 B11R1.12 CCN(CC)C1CCCCC1 34a_100000201195_100000210202 [1,1,0,0,0,0|2,0,0]=4 5561 B11R1.12 CCN(CF)C1CCCCC1 269982a_100000201195_100015361967 [1,1,0,0,0,0|2,0,0]=4 5562 B11R1.12 CCN(CF)C1CCCCC1 34a_100000201195_100015361967 [1,1,0,0,0,0|2,0,0]=4 5563 B11R1.12 CC[C@H](NC)C1CCCCC1 2230a_100020639352_200000210301 [1,1,0,0,0,0|1,0,1]=4 5564 B11R1.12 CC[C@H](NC)C1CCCCC1 34a_100020639352_200000210301 [1,1,0,0,0,0|1,0,1]=4 5565 B11R1.12 CC[C@H](N[13CH3])C1CCCCC1 2230a_100020639352_200025704644 [1,1,0,0,0,0|1,0,1]=4 5566 B11R1.12 CC[C@H](N[13CH3])C1CCCCC1 34a_100020639352_200025704644 [1,1,0,0,0,0|1,0,1]=4 5567 B11R1.22 C#CC(=O)C1CCC(CC1)C 1458a_100000211873_200011216234 [1,1,0,0,0,0|0,0,2]=4 5568 B11R1.22 C=C1CCC(CC1)C(=O)CC 1458a_200000138047_100000210202 [1,1,0,0,0,0|0,0,1]=3 5569 B11R1.22 C=C1CCC(CC1)C(=O)CF 1458a_200000138047_100015361967 [1,1,0,0,0,0|1,0,1]=4 5570 B11R1.22 C=C1CCC(CC1)C(=O)NC 11a_106832991635_200000138047 [1,1,0,0,0,0|1,0,1]=4 5571 B11R1.22 C=C1CCC(CC1)C(=O)NC 1626a_100102657272_200000138047 [1,1,0,0,0,0|1,0,1]=4 5572 B11R1.22 C=C1CCC(CC1)C(=O)NC 240690a_100102657272_200000138047 [1,1,0,0,0,0|1,0,1]=4 5573 B11R1.22 C=C1CCC(CC1)C(=O)NC 527a_100102657272_200000138047 [1,1,0,0,0,0|1,0,1]=4 5574 B11R1.22 C=C1CCN(CC1)C(=O)CC 11a_100000752442_100000210414 [1,1,0,0,0,0|1,0,1]=4 5575 B11R1.22 C=C1CCN(CC1)C(=O)CC 1626a_100000752442_100000210414 [1,1,0,0,0,0|1,0,1]=4 5576 B11R1.22 C=C1CCN(CC1)C(=O)CC 240690a_100000752442_100000210414 [1,1,0,0,0,0|1,0,1]=4 5577 B11R1.22 C=C1CCN(CC1)C(=O)CC 527a_100000752442_100000210414 [1,1,0,0,0,0|1,0,1]=4 5578 B11R1.22 C=CC(=O)C1CCC(CC1)C 1458a_100000185746_200011216234 [1,1,0,0,0,0|0,0,2]=4 5579 B11R1.22 CC1CCC(CC1)C(=O)CO 1458a_100000210174_200011216234 [1,1,0,0,0,0|1,0,0]=3 5580 B11R1.22 CC1CCN(CC1)C(=O)CO 240690a_100000188429_100000210174 [1,1,0,0,0,0|2,0,0]=4 5581 B11R1.22 CC1CCN(CC1)C(=O)CO 527a_100000188429_100000210174 [1,1,0,0,0,0|2,0,0]=4 5582 B11R1.22 CCC(=O)C1CC=C(CC1)C 1458a_100000137427_100000210202 [1,1,0,0,0,0|0,0,2]=4 5583 B11R1.22 CCC(=O)C1CCC(=O)NC1 1458a_100000740907_100000210202 [1,1,0,0,0,0|1,0,1]=4 5584 B11R1.22 CCC(=O)C1CCC(CC1)C 1458a_100000210414_200011216234 [1,1,0,0,0,0|0,0,0]=2 5585 B11R1.22 CCC(=O)C1CCC(CC1)O 1458a_100000743365_100000210202 [1,1,0,0,0,0|0,0,0]=2 5586 B11R1.22 CCC(=O)C1CCN(CC1)C 1458a_100000743488_100000210202 [1,1,0,0,0,0|1,0,0]=3 5587 B11R1.22 CCC(=O)N1CCC(CC1)C 240690a_100000188429_100000210414 [1,1,0,0,0,0|1,0,0]=3 5588 B11R1.22 CCC(=O)N1CCC(CC1)C 527a_100000188429_100000210414 [1,1,0,0,0,0|1,0,0]=3 5589 B11R1.22 CCC(=O)N1CCC(CC1)F 11a_100015193889_100000210414 [1,1,0,0,0,0|1,0,0]=3 5590 B11R1.22 CCC(=O)N1CCC(CC1)F 1626a_100015193889_100000210414 [1,1,0,0,0,0|1,0,0]=3 5591 B11R1.22 CCC(=O)N1CCC(CC1)F 240690a_100015193889_100000210414 [1,1,0,0,0,0|1,0,0]=3 5592 B11R1.22 CCC(=O)N1CCC(CC1)F 527a_100015193889_100000210414 [1,1,0,0,0,0|1,0,0]=3 5593 B11R1.22 CCC(=O)N1CCC(CC1)O 240690a_100025773856_100000210414 [1,1,0,0,0,0|1,0,0]=3 5594 B11R1.22 CCC(=O)N1CCC(CC1)O 527a_100025773856_100000210414 [1,1,0,0,0,0|1,0,0]=3 5595 B11R1.22 CCC(=O)N1CCN(CC1)C 11a_100000188432_100000210414 [1,1,0,0,0,0|2,0,0]=4 5596 B11R1.22 CCC(=O)N1CCN(CC1)C 2230a_100000749825_200000210301 [1,1,0,0,0,0|2,0,0]=4 5597 B11R1.22 CCC(=O)N1CCN(CC1)C 240690a_100000188432_100000210414 [1,1,0,0,0,0|2,0,0]=4 5598 B11R1.22 CCC(=O)N1CCN(CC1)C 269982a_100000749825_200000210301 [1,1,0,0,0,0|2,0,0]=4 5599 B11R1.22 CCC(=O)N1CCN(CC1)C 527a_100000188432_100000210414 [1,1,0,0,0,0|2,0,0]=4 5600 B11R1.22 CCC(=O)N1CCN(CC1)[13CH3] 2230a_100000749825_200025704644 [1,1,0,0,0,0|2,0,0]=4 5601 B11R1.22 CCC(=O)N1CCN(CC1)[13CH3] 269982a_100000749825_200025704644 [1,1,0,0,0,0|2,0,0]=4 5602 B11R1.22 CCC(=O)N1CCS(=O)CC1 240690a_100000752083_100000210414 [1,1,0,0,0,0|2,0,0]=4 5603 B11R1.22 CCC(=O)N1CCS(=O)CC1 527a_100000752083_100000210414 [1,1,0,0,0,0|2,0,0]=4 5604 B11R1.22 CCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000210202 [1,1,0,0,0,0|0,0,0]=2 5605 B11R1.22 CCN(C)C1CCC(CC1)C 269982a_100000225621_200011216234 [1,1,0,0,0,0|2,0,0]=4 5606 B11R1.22 CCN(C)[C@H]1CC[C@H](CC1)O 2230a_100020636401_100000210202 [1,1,0,0,0,0|2,0,0]=4 5607 B11R1.22 CCN(C)[C@H]1CC[C@H](CC1)O 269982a_100020636401_100000204670 [1,1,0,0,0,0|2,0,0]=4 5608 B11R1.22 CN1CCC(CC1)C(=O)CF 1458a_100000743488_100015361967 [1,1,0,0,0,0|2,0,0]=4 5609 B11R1.22 CNC(=O)C1CCC(CC1)O 1626a_100102657272_100000743365 [1,1,0,0,0,0|1,0,0]=3 5610 B11R1.22 CNC(=O)C1CCC(CC1)O 240690a_100102657272_100000743365 [1,1,0,0,0,0|1,0,0]=3 5611 B11R1.22 CNC(=O)C1CCC(CC1)O 527a_100102657272_100000743365 [1,1,0,0,0,0|1,0,0]=3 5612 B11R1.22 CNC(=O)C1CCN(CC1)C 2230a_100000746005_200000210301 [1,1,0,0,0,0|2,0,0]=4 5613 B11R1.22 CNC(=O)C1CCN(CC1)C 240690a_100102657272_100000743488 [1,1,0,0,0,0|2,0,0]=4 5614 B11R1.22 CNC(=O)C1CCN(CC1)C 269982a_100000746005_200000210301 [1,1,0,0,0,0|2,0,0]=4 5615 B11R1.22 CNC(=O)C1CCN(CC1)C 34a_100000746005_200000210301 [1,1,0,0,0,0|2,0,0]=4 5616 B11R1.22 CNC(=O)C1CCN(CC1)C 527a_100102657272_100000743488 [1,1,0,0,0,0|2,0,0]=4 5617 B11R1.22 CNC(=O)C1CCN(CC1)[13CH3] 2230a_100000746005_200025704644 [1,1,0,0,0,0|2,0,0]=4 5618 B11R1.22 CNC(=O)C1CCN(CC1)[13CH3] 269982a_100000746005_200025704644 [1,1,0,0,0,0|2,0,0]=4 5619 B11R1.22 CNC(=O)C1CCN(CC1)[13CH3] 34a_100000746005_200025704644 [1,1,0,0,0,0|2,0,0]=4 5620 B11R1.22 CNC(=O)N1CCC(CC1)C 2708a_100102657272_100000188429 [1,1,0,0,0,0|2,0,0]=4 5621 B11R1.22 CNC(=O)N1CCC(CC1)C 273464a_100102657272_100000188429 [1,1,0,0,0,0|2,0,0]=4 5622 B11R1.22 CNC(=O)N1CCC(CC1)F 2708a_100102657272_100015193889 [1,1,0,0,0,0|2,0,0]=4 5623 B11R1.22 CNC(=O)N1CCC(CC1)F 273464a_100102657272_100015193889 [1,1,0,0,0,0|2,0,0]=4 5624 B11R1.22 CNC(=O)N1CCC(CC1)O 2708a_100102657272_100025773856 [1,1,0,0,0,0|2,0,0]=4 5625 B11R1.22 CNC(=O)N1CCC(CC1)O 273464a_100102657272_100025773856 [1,1,0,0,0,0|2,0,0]=4 5626 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 11a_106832991635_100009815934 [1,1,0,0,0,0|1,0,0]=3 5627 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 1626a_100102657272_100009815934 [1,1,0,0,0,0|1,0,0]=3 5628 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 240690a_100102657272_100009815934 [1,1,0,0,0,0|1,0,0]=3 5629 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 527a_100102657272_100009815934 [1,1,0,0,0,0|1,0,0]=3 5630 B11R1.22 COC(=O)C1CCN(CC1)C 2230a_100000212072_200000210301 [1,1,0,0,0,0|1,0,0]=3 5631 B11R1.22 COC(=O)C1CCN(CC1)C 269982a_100000212072_200000210301 [1,1,0,0,0,0|1,0,0]=3 5632 B11R1.22 COC(=O)C1CCN(CC1)[13CH3] 2230a_100000212072_200025704644 [1,1,0,0,0,0|1,0,0]=3 5633 B11R1.22 COC(=O)C1CCN(CC1)[13CH3] 269982a_100000212072_200025704644 [1,1,0,0,0,0|1,0,0]=3 5634 B11R1.22 COC(=O)N1CCN(CC1)C 2230a_100000742817_200000210301 [1,1,0,0,0,0|2,0,0]=4 5635 B11R1.22 COC(=O)N1CCN(CC1)C 269982a_100000742817_200000210301 [1,1,0,0,0,0|2,0,0]=4 5636 B11R1.22 COC(=O)N1CCN(CC1)[13CH3] 2230a_100000742817_200025704644 [1,1,0,0,0,0|2,0,0]=4 5637 B11R1.22 COC(=O)N1CCN(CC1)[13CH3] 269982a_100000742817_200025704644 [1,1,0,0,0,0|2,0,0]=4 5638 B11R1.22 C[C@H]1CC[C@@H](CC1)C(=O)CF 1458a_100009815934_100015361967 [1,1,0,0,0,0|1,0,0]=3 5639 B11R1.22 O=C(CF)C1CCC(CC1)O 1458a_100000743365_100015361967 [1,1,0,0,0,0|1,0,0]=3 5640 B11R1.22 O=C(CO)N1CCC(CC1)F 240690a_100015193889_100000210174 [1,1,0,0,0,0|2,0,0]=4 5641 B11R1.22 O=C(CO)N1CCC(CC1)F 527a_100015193889_100000210174 [1,1,0,0,0,0|2,0,0]=4 5642 B11R1.22 O=C(CO)N1CCC(CC1)O 240690a_100025773856_100000210174 [1,1,0,0,0,0|2,0,0]=4 5643 B11R1.22 O=C(CO)N1CCC(CC1)O 527a_100025773856_100000210174 [1,1,0,0,0,0|2,0,0]=4 5644 B11R1.23 CC1CCCC(C1)C(=O)CF 1458a_100011215569_100015361967 [1,1,0,0,0,0|1,0,0]=3 5645 B11R1.23 CCC(=O)C1CCCC(C1)C 1458a_100011215569_100000210202 [1,1,0,0,0,0|0,0,0]=2 5646 B11R1.23 CCC(=O)C1CCCC(C1)O 1458a_100000707227_100000210202 [1,1,0,0,0,0|0,0,0]=2 5647 B11R1.23 CCC(=O)C1CCCN(C1)C 1458a_100015257587_100000210202 [1,1,0,0,0,0|1,0,0]=3 5648 B11R1.23 CCC(=O)C1CCNC(=O)C1 1458a_100000132800_100000210202 [1,1,0,0,0,0|1,0,1]=4 5649 B11R1.23 CCC(=O)C1CN(CCO1)C 1458a_100011543126_100000210202 [1,1,0,0,0,0|2,0,0]=4 5650 B11R1.23 CCC(=O)N1CCCC(C1)F 11a_100000697950_100000210414 [1,1,0,0,0,0|1,0,0]=3 5651 B11R1.23 CCC(=O)N1CCCC(C1)F 1626a_100000697950_100000210414 [1,1,0,0,0,0|1,0,0]=3 5652 B11R1.23 CCC(=O)N1CCCC(C1)F 240690a_100000697950_100000210414 [1,1,0,0,0,0|1,0,0]=3 5653 B11R1.23 CCC(=O)N1CCCC(C1)F 527a_100000697950_100000210414 [1,1,0,0,0,0|1,0,0]=3 5654 B11R1.23 CCC(=O)N1CCCC(C1)O 240690a_100000211013_100000210414 [1,1,0,0,0,0|1,0,0]=3 5655 B11R1.23 CCC(=O)N1CCCC(C1)O 527a_100000211013_100000210414 [1,1,0,0,0,0|1,0,0]=3 5656 B11R1.23 CCC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000210414 [1,1,0,0,0,0|1,0,0]=3 5657 B11R1.23 CCC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000210414 [1,1,0,0,0,0|1,0,0]=3 5658 B11R1.23 CCC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000210414 [1,1,0,0,0,0|1,0,0]=3 5659 B11R1.23 CCC(=O)N1CCOC(C1)C 11a_100000729577_100000210414 [1,1,0,0,0,0|2,0,0]=4 5660 B11R1.23 CCC(=O)N1CCOC(C1)C 1626a_100000729577_100000210414 [1,1,0,0,0,0|2,0,0]=4 5661 B11R1.23 CCC(=O)N1CCOC(C1)C 240690a_100000729577_100000210414 [1,1,0,0,0,0|2,0,0]=4 5662 B11R1.23 CCC(=O)N1CCOC(C1)C 527a_100000729577_100000210414 [1,1,0,0,0,0|2,0,0]=4 5663 B11R1.23 CCC(=O)N1CCOC(C1)O 11a_100000688207_100000210414 [1,1,0,0,0,0|2,0,0]=4 5664 B11R1.23 CCC(=O)N1CCOC(C1)O 240690a_100000688207_100000210414 [1,1,0,0,0,0|2,0,0]=4 5665 B11R1.23 CCC(=O)N1CCOC(C1)O 527a_100000688207_100000210414 [1,1,0,0,0,0|2,0,0]=4 5666 B11R1.23 CCC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_100000210202 [1,1,0,0,0,0|1,0,1]=4 5667 B11R1.23 CN1CCCC(C1)C(=O)CF 1458a_100015257587_100015361967 [1,1,0,0,0,0|2,0,0]=4 5668 B11R1.23 CNC(=O)C1CCCC(C1)C 11a_106832991635_100011215569 [1,1,0,0,0,0|1,0,0]=3 5669 B11R1.23 CNC(=O)C1CCCC(C1)C 1626a_100102657272_100011215569 [1,1,0,0,0,0|1,0,0]=3 5670 B11R1.23 CNC(=O)C1CCCC(C1)C 240690a_100102657272_100011215569 [1,1,0,0,0,0|1,0,0]=3 5671 B11R1.23 CNC(=O)C1CCCC(C1)C 527a_100102657272_100011215569 [1,1,0,0,0,0|1,0,0]=3 5672 B11R1.23 CNC(=O)C1CCCC(C1)O 1626a_100102657272_100000707227 [1,1,0,0,0,0|1,0,0]=3 5673 B11R1.23 CNC(=O)C1CCCC(C1)O 240690a_100102657272_100000707227 [1,1,0,0,0,0|1,0,0]=3 5674 B11R1.23 CNC(=O)C1CCCN(C1)C 11a_106832991635_100015257587 [1,1,0,0,0,0|2,0,0]=4 5675 B11R1.23 CNC(=O)C1CCCN(C1)C 2230a_100000754358_200000210301 [1,1,0,0,0,0|2,0,0]=4 5676 B11R1.23 CNC(=O)C1CCCN(C1)C 240690a_100102657272_100015257587 [1,1,0,0,0,0|2,0,0]=4 5677 B11R1.23 CNC(=O)C1CCCN(C1)C 269982a_100000754358_200000210301 [1,1,0,0,0,0|2,0,0]=4 5678 B11R1.23 CNC(=O)C1CCCN(C1)C 34a_100000754358_200000210301 [1,1,0,0,0,0|2,0,0]=4 5679 B11R1.23 CNC(=O)C1CCCN(C1)[13CH3] 2230a_100000754358_200025704644 [1,1,0,0,0,0|2,0,0]=4 5680 B11R1.23 CNC(=O)C1CCCN(C1)[13CH3] 269982a_100000754358_200025704644 [1,1,0,0,0,0|2,0,0]=4 5681 B11R1.23 CNC(=O)C1CCCN(C1)[13CH3] 34a_100000754358_200025704644 [1,1,0,0,0,0|2,0,0]=4 5682 B11R1.23 CNC(=O)N1CCCC(C1)F 2708a_100102657272_100000697950 [1,1,0,0,0,0|2,0,0]=4 5683 B11R1.23 CNC(=O)N1CCCC(C1)F 273464a_100102657272_100000697950 [1,1,0,0,0,0|2,0,0]=4 5684 B11R1.23 CNC(=O)N1CCCC(C1)O 2708a_100102657272_100000211013 [1,1,0,0,0,0|2,0,0]=4 5685 B11R1.23 CNC(=O)N1CCCC(C1)O 273464a_100102657272_100000211013 [1,1,0,0,0,0|2,0,0]=4 5686 B11R1.23 CNC(=O)N1CCC[C@@H](C1)C 2708a_100102657272_100000717927 [1,1,0,0,0,0|2,0,0]=4 5687 B11R1.23 CNC(=O)N1CCC[C@@H](C1)C 273464a_100102657272_100000717927 [1,1,0,0,0,0|2,0,0]=4 5688 B11R1.23 COC(=O)C1CN(CCO1)C 2230a_100000751517_200000210301 [1,1,0,0,0,0|2,0,0]=4 5689 B11R1.23 COC(=O)C1CN(CCO1)C 269982a_100000751517_200000210301 [1,1,0,0,0,0|2,0,0]=4 5690 B11R1.23 COC(=O)C1CN(CCO1)C 34a_100000751517_200000210301 [1,1,0,0,0,0|2,0,0]=4 5691 B11R1.23 COC(=O)C1CN(CCO1)[13CH3] 2230a_100000751517_200025704644 [1,1,0,0,0,0|2,0,0]=4 5692 B11R1.23 COC(=O)C1CN(CCO1)[13CH3] 269982a_100000751517_200025704644 [1,1,0,0,0,0|2,0,0]=4 5693 B11R1.23 COC(=O)C1CN(CCO1)[13CH3] 34a_100000751517_200025704644 [1,1,0,0,0,0|2,0,0]=4 5694 B11R1.23 COC(=O)[C@H]1CCCN(C1)C 2230a_100016988859_200000210301 [1,1,0,0,0,0|1,0,0]=3 5695 B11R1.23 COC(=O)[C@H]1CCCN(C1)C 269982a_100016988859_200000210301 [1,1,0,0,0,0|1,0,0]=3 5696 B11R1.23 COC(=O)[C@H]1CCCN(C1)[13CH3] 2230a_100016988859_200025704644 [1,1,0,0,0,0|1,0,0]=3 5697 B11R1.23 COC(=O)[C@H]1CCCN(C1)[13CH3] 269982a_100016988859_200025704644 [1,1,0,0,0,0|1,0,0]=3 5698 B11R1.23 C[C@H]1CCCN(C1)C(=O)CO 240690a_100000717927_100000210174 [1,1,0,0,0,0|2,0,0]=4 5699 B11R1.23 C[C@H]1CCCN(C1)C(=O)CO 527a_100000717927_100000210174 [1,1,0,0,0,0|2,0,0]=4 5700 B11R1.23 O=C(CF)C1CCCC(C1)O 1458a_100000707227_100015361967 [1,1,0,0,0,0|1,0,0]=3 5701 B11R1.23 O=C(CO)N1CCCC(C1)F 240690a_100000697950_100000210174 [1,1,0,0,0,0|2,0,0]=4 5702 B11R1.23 O=C(CO)N1CCCC(C1)F 527a_100000697950_100000210174 [1,1,0,0,0,0|2,0,0]=4 5703 B11R1.23 O=C(CO)N1CCCC(C1)O 240690a_100000211013_100000210174 [1,1,0,0,0,0|2,0,0]=4 5704 B11R1.23 O=C(CO)N1CCCC(C1)O 527a_100000211013_100000210174 [1,1,0,0,0,0|2,0,0]=4 5705 B11R1.36 C=C(C)C(=O)C1CCCCC1 1458a_100000185857_100000210327 [1,1,0,0,0,0|0,0,1]=3 5706 B11R1.36 C=C(C)C(=O)C1CCCOC1 1458a_100000185857_100000693364 [1,1,0,0,0,0|1,0,1]=4 5707 B11R1.36 C=C(C)C(=O)C1CCOCC1 1458a_100000185857_100011324220 [1,1,0,0,0,0|1,0,1]=4 5708 B11R1.36 CC(=O)C(=O)N1CCCCC1 1458a_200011297168_200000210301 [1,1,0,0,0,0|1,0,1]=4 5709 B11R1.36 CC(C)C(=O)C1=CCCCC1 1458a_100000765259_100000210206 [1,1,0,0,0,0|0,0,2]=4 5710 B11R1.36 CC(C)C(=O)C1C=CCCC1 1458a_100000210198_100000751183 [1,1,0,0,0,0|0,0,2]=4 5711 B11R1.36 CC(C)C(=O)C1CCCCC1 1458a_100000210198_100000210327 [1,1,0,0,0,0|0,0,0]=2 5712 B11R1.36 CC(C)C(=O)C1CCCCC1 1458a_100000210647_100000210206 [1,1,0,0,0,0|0,0,0]=2 5713 B11R1.36 CC(C)C(=O)C1CCCCO1 1458a_100000748299_100000210206 [1,1,0,0,0,0|1,0,0]=3 5714 B11R1.36 CC(C)C(=O)C1CCCOC1 1458a_100000210198_100000693364 [1,1,0,0,0,0|1,0,0]=3 5715 B11R1.36 CC(C)C(=O)C1CCCOC1 1458a_100000741522_100000210206 [1,1,0,0,0,0|1,0,0]=3 5716 B11R1.36 CC(C)C(=O)C1CCOCC1 1458a_100000195482_100000210206 [1,1,0,0,0,0|1,0,0]=3 5717 B11R1.36 CC(C)C(=O)C1CCOCC1 1458a_100000210198_100011324220 [1,1,0,0,0,0|1,0,0]=3 5718 B11R1.36 CC(C)C(=O)C1CCSCC1 1458a_100000755232_100000210206 [1,1,0,0,0,0|1,0,0]=3 5719 B11R1.36 CC(C)C(=O)C1COCCO1 1458a_100000045528_100000210206 [1,1,0,0,0,0|2,0,0]=4 5720 B11R1.36 CC(C)C(=O)C1SCCCS1 1458a_100000028545_100000210206 [1,1,0,0,0,0|2,0,0]=4 5721 B11R1.36 CC(C)C(=O)N1CCCOC1 11a_100000131196_100000210198 [1,1,0,0,0,0|2,0,0]=4 5722 B11R1.36 CC(C)C(=O)N1CCCOC1 240690a_100000131196_100000210198 [1,1,0,0,0,0|2,0,0]=4 5723 B11R1.36 CC(C)C(=O)N1CCOCC1 11a_100015191051_100000210198 [1,1,0,0,0,0|2,0,0]=4 5724 B11R1.36 CC(C)C(=O)N1CCOCC1 1626a_100015191051_100000210198 [1,1,0,0,0,0|2,0,0]=4 5725 B11R1.36 CC(C)C(=O)N1CCOCC1 240690a_100015191051_100000210198 [1,1,0,0,0,0|2,0,0]=4 5726 B11R1.36 CC(C)C(=O)N1CCOCC1 527a_100015191051_100000210198 [1,1,0,0,0,0|2,0,0]=4 5727 B11R1.36 CC(C)C(=O)N1CCSCC1 11a_100000737611_100000210198 [1,1,0,0,0,0|2,0,0]=4 5728 B11R1.36 CC(C)C(=O)N1CCSCC1 240690a_100000737611_100000210198 [1,1,0,0,0,0|2,0,0]=4 5729 B11R1.36 CC(C)C(=O)N1CCSCC1 527a_100000737611_100000210198 [1,1,0,0,0,0|2,0,0]=4 5730 B11R1.36 CC(C)C(=O)[C@H]1CC=CCC1 1458a_100009820709_100000210206 [1,1,0,0,0,0|0,0,2]=4 5731 B11R1.36 CC(C)N(C)C1CCCCC1 2230a_100000207522_100000210206 [1,1,0,0,0,0|2,0,0]=4 5732 B11R1.36 CC(C)N(C)C1CCCCC1 2230a_100025770988_200000210301 [1,1,0,0,0,0|2,0,0]=4 5733 B11R1.36 CC(C)N(C)C1CCCCC1 269982a_100000207522_100000210206 [1,1,0,0,0,0|2,0,0]=4 5734 B11R1.36 CC(C)N(C)C1CCCCC1 269982a_100025770988_200000210301 [1,1,0,0,0,0|2,0,0]=4 5735 B11R1.36 CC(C)N(C)C1CCCCC1 269982a_200000211004_100000210327 [1,1,0,0,0,0|2,0,0]=4 5736 B11R1.36 CC(C)N(C)C1CCCCC1 270004a_200000211004_100000210434 [1,1,0,0,0,0|2,0,0]=4 5737 B11R1.36 CC(C)N(C)C1CCCCC1 34a_100000207522_100000210206 [1,1,0,0,0,0|2,0,0]=4 5738 B11R1.36 CC(C)N(C)C1CCCCC1 34a_100025770988_200000210301 [1,1,0,0,0,0|2,0,0]=4 5739 B11R1.36 CC(C)N([13CH3])C1CCCCC1 2230a_100025770988_200025704644 [1,1,0,0,0,0|2,0,0]=4 5740 B11R1.36 CC(C)N([13CH3])C1CCCCC1 269982a_100025770988_200025704644 [1,1,0,0,0,0|2,0,0]=4 5741 B11R1.36 CC(C)N([13CH3])C1CCCCC1 34a_100025770988_200025704644 [1,1,0,0,0,0|2,0,0]=4 5742 B11R1.36 CC(F)C(=O)C1C=CCCC1 1458a_100000062450_100000751183 [1,1,0,0,0,0|0,0,2]=4 5743 B11R1.36 CC(F)C(=O)C1CCCCC1 1458a_100000062450_100000210327 [1,1,0,0,0,0|0,0,0]=2 5744 B11R1.36 CC(F)C(=O)C1CCCOC1 1458a_100000062450_100000693364 [1,1,0,0,0,0|1,0,0]=3 5745 B11R1.36 CC(F)C(=O)C1CCOCC1 1458a_100000062450_100011324220 [1,1,0,0,0,0|1,0,0]=3 5746 B11R1.36 CC(F)C(=O)N1CCCOC1 11a_100000131196_100000062450 [1,1,0,0,0,0|2,0,0]=4 5747 B11R1.36 CC(F)C(=O)N1CCCOC1 240690a_100000131196_100000062450 [1,1,0,0,0,0|2,0,0]=4 5748 B11R1.36 CC(F)C(=O)N1CCOCC1 11a_100015191051_100000062450 [1,1,0,0,0,0|2,0,0]=4 5749 B11R1.36 CC(F)C(=O)N1CCOCC1 1626a_100015191051_100000062450 [1,1,0,0,0,0|2,0,0]=4 5750 B11R1.36 CC(F)C(=O)N1CCOCC1 240690a_100015191051_100000062450 [1,1,0,0,0,0|2,0,0]=4 5751 B11R1.36 CC(F)C(=O)N1CCOCC1 527a_100015191051_100000062450 [1,1,0,0,0,0|2,0,0]=4 5752 B11R1.36 CC(F)C(=O)N1CCSCC1 11a_100000737611_100000062450 [1,1,0,0,0,0|2,0,0]=4 5753 B11R1.36 CC(F)C(=O)N1CCSCC1 240690a_100000737611_100000062450 [1,1,0,0,0,0|2,0,0]=4 5754 B11R1.36 CC(F)C(=O)N1CCSCC1 527a_100000737611_100000062450 [1,1,0,0,0,0|2,0,0]=4 5755 B11R1.36 CN(C)C(=O)C1CCCCC1 11a_100102631434_100000210647 [1,1,0,0,0,0|1,0,0]=3 5756 B11R1.36 CN(C)C(=O)C1CCCCC1 1626a_100102631434_100000210647 [1,1,0,0,0,0|1,0,0]=3 5757 B11R1.36 CN(C)C(=O)C1CCCCC1 240690a_100102631434_100000210647 [1,1,0,0,0,0|1,0,0]=3 5758 B11R1.36 CN(C)C(=O)C1CCCCC1 527a_100102631434_100000210647 [1,1,0,0,0,0|1,0,0]=3 5759 B11R1.36 CN(C)C(=O)C1CCCCO1 11a_100102631434_100000748299 [1,1,0,0,0,0|2,0,0]=4 5760 B11R1.36 CN(C)C(=O)C1CCCCO1 1626a_100102631434_100000748299 [1,1,0,0,0,0|2,0,0]=4 5761 B11R1.36 CN(C)C(=O)C1CCCCO1 240690a_100102631434_100000748299 [1,1,0,0,0,0|2,0,0]=4 5762 B11R1.36 CN(C)C(=O)C1CCCCO1 527a_100102631434_100000748299 [1,1,0,0,0,0|2,0,0]=4 5763 B11R1.36 CN(C)C(=O)C1CCCOC1 11a_100102631434_100000741522 [1,1,0,0,0,0|2,0,0]=4 5764 B11R1.36 CN(C)C(=O)C1CCCOC1 1626a_100102631434_100000741522 [1,1,0,0,0,0|2,0,0]=4 5765 B11R1.36 CN(C)C(=O)C1CCCOC1 240690a_100102631434_100000741522 [1,1,0,0,0,0|2,0,0]=4 5766 B11R1.36 CN(C)C(=O)C1CCCOC1 527a_100102631434_100000741522 [1,1,0,0,0,0|2,0,0]=4 5767 B11R1.36 CN(C)C(=O)C1CCOCC1 11a_100102631434_100000195482 [1,1,0,0,0,0|2,0,0]=4 5768 B11R1.36 CN(C)C(=O)C1CCOCC1 1626a_100102631434_100000195482 [1,1,0,0,0,0|2,0,0]=4 5769 B11R1.36 CN(C)C(=O)C1CCOCC1 240690a_100102631434_100000195482 [1,1,0,0,0,0|2,0,0]=4 5770 B11R1.36 CN(C)C(=O)C1CCOCC1 527a_100102631434_100000195482 [1,1,0,0,0,0|2,0,0]=4 5771 B11R1.36 CN(C)C(=O)C1CCSCC1 11a_100102631434_100000755232 [1,1,0,0,0,0|2,0,0]=4 5772 B11R1.36 CN(C)C(=O)C1CCSCC1 1626a_100102631434_100000755232 [1,1,0,0,0,0|2,0,0]=4 5773 B11R1.36 CN(C)C(=O)C1CCSCC1 240690a_100102631434_100000755232 [1,1,0,0,0,0|2,0,0]=4 5774 B11R1.36 CN(C)C(=O)C1CCSCC1 527a_100102631434_100000755232 [1,1,0,0,0,0|2,0,0]=4 5775 B11R1.36 C[C@@H](O)C(=O)C1C=CCCC1 1458a_100000717761_100000751183 [1,1,0,0,0,0|0,0,2]=4 5776 B11R1.36 C[C@@H](O)C(=O)C1CCCCC1 1458a_100000717761_100000210327 [1,1,0,0,0,0|0,0,0]=2 5777 B11R1.36 C[C@@H](O)C(=O)C1CCCOC1 1458a_100000717761_100000693364 [1,1,0,0,0,0|1,0,0]=3 5778 B11R1.36 C[C@@H](O)C(=O)C1CCOCC1 1458a_100000717761_100011324220 [1,1,0,0,0,0|1,0,0]=3 5779 B11R1.36 C[C@@H](O)C(=O)N1CCCOC1 240690a_100000131196_100000717761 [1,1,0,0,0,0|2,0,0]=4 5780 B11R1.36 C[C@@H](O)C(=O)N1CCOCC1 240690a_100015191051_100000717761 [1,1,0,0,0,0|2,0,0]=4 5781 B11R1.36 C[C@@H](O)C(=O)N1CCSCC1 240690a_100000737611_100000717761 [1,1,0,0,0,0|2,0,0]=4 5782 B11R1.36 C[C@H](O)C(=O)C1C=CCCC1 1458a_217856618621_100000751183 [1,1,0,0,0,0|0,0,2]=4 5783 B11R1.36 C[C@H](O)C(=O)C1CCCCC1 1458a_217856618621_100000210327 [1,1,0,0,0,0|0,0,0]=2 5784 B11R1.36 C[C@H](O)C(=O)C1CCCOC1 1458a_217856618621_100000693364 [1,1,0,0,0,0|1,0,0]=3 5785 B11R1.36 C[C@H](O)C(=O)C1CCOCC1 1458a_217856618621_100011324220 [1,1,0,0,0,0|1,0,0]=3 5786 B11R1.36 C[C@H](O)C(=O)N1CCCOC1 240690a_100000131196_217856618621 [1,1,0,0,0,0|2,0,0]=4 5787 B11R1.36 C[C@H](O)C(=O)N1CCOCC1 1626a_100015191051_217856618621 [1,1,0,0,0,0|2,0,0]=4 5788 B11R1.36 C[C@H](O)C(=O)N1CCOCC1 240690a_100015191051_217856618621 [1,1,0,0,0,0|2,0,0]=4 5789 B11R1.36 C[C@H](O)C(=O)N1CCSCC1 240690a_100000737611_217856618621 [1,1,0,0,0,0|2,0,0]=4 5790 B11R1.36 O=C(C(O)O)C1CCCCC1 1458a_100000233687_100000210327 [1,1,0,0,0,0|1,0,0]=3 5791 B11R1.36 O=C(C(O)O)C1CCCOC1 1458a_100000233687_100000693364 [1,1,0,0,0,0|2,0,0]=4 5792 B11R1.36 O=C(C(O)O)C1CCOCC1 1458a_100000233687_100011324220 [1,1,0,0,0,0|2,0,0]=4 5793 B11R1.36 [13CH3]C(=O)C(=O)N1CCCCC1 1458a_200011297168_200025704644 [1,1,0,0,0,0|1,0,1]=4 5794 B11R1.222 CC1CCCCC1C(=O)CF 1458a_100011215568_100015361967 [1,1,0,0,0,0|1,0,0]=3 5795 B11R1.222 CC1CCCCN1C(=O)CO 240690a_100000211376_100000210174 [1,1,0,0,0,0|2,0,0]=4 5796 B11R1.222 CC1CCCCN1C(=O)CO 527a_100000211376_100000210174 [1,1,0,0,0,0|2,0,0]=4 5797 B11R1.222 CCC(=O)C1CCCCC1=O 1458a_100000210414_100000204591 [1,1,0,0,0,0|0,0,1]=3 5798 B11R1.222 CCC(=O)C1CCCCC1C 1458a_100011215568_100000210202 [1,1,0,0,0,0|0,0,0]=2 5799 B11R1.222 CCC(=O)C1CCCCC1O 1458a_100011803323_100000210202 [1,1,0,0,0,0|0,0,0]=2 5800 B11R1.222 CCC(=O)C1CCCNC1=O 1458a_100000087122_100000210202 [1,1,0,0,0,0|1,0,1]=4 5801 B11R1.222 CCC(=O)C1CCCNC1=O 1458a_100000210414_100000687798 [1,1,0,0,0,0|1,0,1]=4 5802 B11R1.222 CCC(=O)C1COCCC1=O 1458a_100000210414_100012180262 [1,1,0,0,0,0|1,0,1]=4 5803 B11R1.222 CCC(=O)N1CCCCC1C 11a_100000211376_100000210414 [1,1,0,0,0,0|1,0,0]=3 5804 B11R1.222 CCC(=O)N1CCCCC1C 1626a_100000211376_100000210414 [1,1,0,0,0,0|1,0,0]=3 5805 B11R1.222 CCC(=O)N1CCCCC1C 240690a_100000211376_100000210414 [1,1,0,0,0,0|1,0,0]=3 5806 B11R1.222 CCC(=O)N1CCCCC1C 527a_100000211376_100000210414 [1,1,0,0,0,0|1,0,0]=3 5807 B11R1.222 CCC(=O)N1CCOC[C@@H]1C 11a_100009815349_100000210414 [1,1,0,0,0,0|2,0,0]=4 5808 B11R1.222 CCC(=O)N1CCOC[C@@H]1C 240690a_100009815349_100000210414 [1,1,0,0,0,0|2,0,0]=4 5809 B11R1.222 CCC(=O)N1CCOC[C@@H]1C 527a_100009815349_100000210414 [1,1,0,0,0,0|2,0,0]=4 5810 B11R1.222 CCC(=O)[C@H]1CCCCN1C 1458a_100000767060_100000210202 [1,1,0,0,0,0|1,0,0]=3 5811 B11R1.222 CCN(C)C1CCCCC1F 269982a_100000225621_100015423560 [1,1,0,0,0,0|2,0,0]=4 5812 B11R1.222 CCN(C)C1CCCCC1O 269982a_100000225621_100000038908 [1,1,0,0,0,0|2,0,0]=4 5813 B11R1.222 CCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000204670 [1,1,0,0,0,0|2,0,0]=4 5814 B11R1.222 CN1CCCC[C@@H]1C(=O)CF 1458a_100000767060_100015361967 [1,1,0,0,0,0|2,0,0]=4 5815 B11R1.222 CNC(=O)C1CCCCC1C 11a_106832991635_100011215568 [1,1,0,0,0,0|1,0,0]=3 5816 B11R1.222 CNC(=O)C1CCCCC1C 1626a_100102657272_100011215568 [1,1,0,0,0,0|1,0,0]=3 5817 B11R1.222 CNC(=O)C1CCCCC1C 240690a_100102657272_100011215568 [1,1,0,0,0,0|1,0,0]=3 5818 B11R1.222 CNC(=O)C1CCCCC1C 527a_100102657272_100011215568 [1,1,0,0,0,0|1,0,0]=3 5819 B11R1.222 CNC(=O)C1CCCCN1C 2230a_100011209383_200000210301 [1,1,0,0,0,0|2,0,0]=4 5820 B11R1.222 CNC(=O)C1CCCCN1C 269982a_100011209383_200000210301 [1,1,0,0,0,0|2,0,0]=4 5821 B11R1.222 CNC(=O)C1CCCCN1C 34a_100011209383_200000210301 [1,1,0,0,0,0|2,0,0]=4 5822 B11R1.222 CNC(=O)C1CCCCN1[13CH3] 2230a_100011209383_200025704644 [1,1,0,0,0,0|2,0,0]=4 5823 B11R1.222 CNC(=O)C1CCCCN1[13CH3] 269982a_100011209383_200025704644 [1,1,0,0,0,0|2,0,0]=4 5824 B11R1.222 CNC(=O)C1CCCCN1[13CH3] 34a_100011209383_200025704644 [1,1,0,0,0,0|2,0,0]=4 5825 B11R1.222 CNC(=O)N1CCCCC1C 2708a_100102657272_100000211376 [1,1,0,0,0,0|2,0,0]=4 5826 B11R1.222 CNC(=O)N1CCCCC1C 273464a_100102657272_100000211376 [1,1,0,0,0,0|2,0,0]=4 5827 B11R1.222 CNC(=O)[C@H]1CCCCN1C 11a_106832991635_100000767060 [1,1,0,0,0,0|2,0,0]=4 5828 B11R1.222 CNC(=O)[C@H]1CCCCN1C 1626a_100102657272_100000767060 [1,1,0,0,0,0|2,0,0]=4 5829 B11R1.222 CNC(=O)[C@H]1CCCCN1C 240690a_100102657272_100000767060 [1,1,0,0,0,0|2,0,0]=4 5830 B11R1.222 CNC(=O)[C@H]1CCCCN1C 527a_100102657272_100000767060 [1,1,0,0,0,0|2,0,0]=4 5831 B11R1.222 COC(=O)C1CCCCN1C 2230a_100000734855_200000210301 [1,1,0,0,0,0|1,0,0]=3 5832 B11R1.222 COC(=O)C1CCCCN1C 269982a_100000734855_200000210301 [1,1,0,0,0,0|1,0,0]=3 5833 B11R1.222 COC(=O)C1CCCCN1C 34a_100000734855_200000210301 [1,1,0,0,0,0|1,0,0]=3 5834 B11R1.222 COC(=O)C1CCCCN1[13CH3] 2230a_100000734855_200025704644 [1,1,0,0,0,0|1,0,0]=3 5835 B11R1.222 COC(=O)C1CCCCN1[13CH3] 269982a_100000734855_200025704644 [1,1,0,0,0,0|1,0,0]=3 5836 B11R1.222 COC(=O)C1CCCCN1[13CH3] 34a_100000734855_200025704644 [1,1,0,0,0,0|1,0,0]=3 5837 B11R1.222 COC(=O)C1COCCN1C 2230a_100000765174_200000210301 [1,1,0,0,0,0|2,0,0]=4 5838 B11R1.222 COC(=O)C1COCCN1C 34a_100000765174_200000210301 [1,1,0,0,0,0|2,0,0]=4 5839 B11R1.222 COC(=O)C1COCCN1[13CH3] 2230a_100000765174_200025704644 [1,1,0,0,0,0|2,0,0]=4 5840 B11R1.222 COC(=O)C1COCCN1[13CH3] 34a_100000765174_200025704644 [1,1,0,0,0,0|2,0,0]=4 5841 B11R1.222 O=C(CF)C1CCCCC1O 1458a_100011803323_100015361967 [1,1,0,0,0,0|1,0,0]=3 5842 B11R1.222 O=C(CO)C1CCCCC1=O 1458a_100000210174_100000204591 [1,1,0,0,0,0|1,0,1]=4 5843 B11R1.878 CC1(CCCCC1)C(=O)CF 1458a_100000762840_100015361967 [1,1,0,0,0,0|1,0,0]=3 5844 B11R1.878 CC1(CCOCC1)C(=O)CF 1458a_100000749465_100015361967 [1,1,0,0,0,0|2,0,0]=4 5845 B11R1.878 CCC(=O)C1(CCCCC1)C 1458a_100000762840_100000210202 [1,1,0,0,0,0|0,0,0]=2 5846 B11R1.878 CCC(=O)C1(CCCCC1)F 1458a_100000069003_100000210202 [1,1,0,0,0,0|0,0,0]=2 5847 B11R1.878 CCC(=O)C1(CCCCC1)O 1458a_100000242742_100000210202 [1,1,0,0,0,0|0,0,0]=2 5848 B11R1.878 CCC(=O)C1(CCOCC1)C 1458a_100000749465_100000210202 [1,1,0,0,0,0|1,0,0]=3 5849 B11R1.878 CCC(=O)C1(CCOCC1)F 1458a_100009845733_100000210202 [1,1,0,0,0,0|1,0,0]=3 5850 B11R1.878 CCC(=O)C1(CCOCC1)O 1458a_100000751969_100000210202 [1,1,0,0,0,0|1,0,0]=3 5851 B11R1.878 CNC(=O)C1(CCCCC1)C 11a_106832991635_100000762840 [1,1,0,0,0,0|1,0,0]=3 5852 B11R1.878 CNC(=O)C1(CCCCC1)C 1626a_100102657272_100000762840 [1,1,0,0,0,0|1,0,0]=3 5853 B11R1.878 CNC(=O)C1(CCCCC1)C 240690a_100102657272_100000762840 [1,1,0,0,0,0|1,0,0]=3 5854 B11R1.878 CNC(=O)C1(CCCCC1)C 527a_100102657272_100000762840 [1,1,0,0,0,0|1,0,0]=3 5855 B11R1.878 CNC(=O)C1(CCCCC1)F 11a_106832991635_100000069003 [1,1,0,0,0,0|1,0,0]=3 5856 B11R1.878 CNC(=O)C1(CCCCC1)F 1626a_100102657272_100000069003 [1,1,0,0,0,0|1,0,0]=3 5857 B11R1.878 CNC(=O)C1(CCCCC1)F 240690a_100102657272_100000069003 [1,1,0,0,0,0|1,0,0]=3 5858 B11R1.878 CNC(=O)C1(CCCCC1)F 527a_100102657272_100000069003 [1,1,0,0,0,0|1,0,0]=3 5859 B11R1.878 CNC(=O)C1(CCCCC1)O 240690a_100102657272_100000242742 [1,1,0,0,0,0|1,0,0]=3 5860 B11R1.878 CNC(=O)C1(CCOCC1)C 11a_106832991635_100000749465 [1,1,0,0,0,0|2,0,0]=4 5861 B11R1.878 CNC(=O)C1(CCOCC1)C 1626a_100102657272_100000749465 [1,1,0,0,0,0|2,0,0]=4 5862 B11R1.878 CNC(=O)C1(CCOCC1)C 240690a_100102657272_100000749465 [1,1,0,0,0,0|2,0,0]=4 5863 B11R1.878 CNC(=O)C1(CCOCC1)C 527a_100102657272_100000749465 [1,1,0,0,0,0|2,0,0]=4 5864 B11R1.878 CNC(=O)C1(CCOCC1)F 11a_106832991635_100009845733 [1,1,0,0,0,0|2,0,0]=4 5865 B11R1.878 CNC(=O)C1(CCOCC1)F 1626a_100102657272_100009845733 [1,1,0,0,0,0|2,0,0]=4 5866 B11R1.878 CNC(=O)C1(CCOCC1)F 240690a_100102657272_100009845733 [1,1,0,0,0,0|2,0,0]=4 5867 B11R1.878 CNC(=O)C1(CCOCC1)F 527a_100102657272_100009845733 [1,1,0,0,0,0|2,0,0]=4 5868 B11R1.878 CNC(=O)C1(CCOCC1)O 240690a_100102657272_100000751969 [1,1,0,0,0,0|2,0,0]=4 5869 B11R1.878 O=C(CF)C1(CCCCC1)F 1458a_100000069003_100015361967 [1,1,0,0,0,0|1,0,0]=3 5870 B11R1.878 O=C(CF)C1(CCCCC1)O 1458a_100000242742_100015361967 [1,1,0,0,0,0|1,0,0]=3 5871 B11R1.878 O=C(CF)C1(CCOCC1)F 1458a_100009845733_100015361967 [1,1,0,0,0,0|2,0,0]=4 5872 B11R1.878 O=C(CF)C1(CCOCC1)O 1458a_100000751969_100015361967 [1,1,0,0,0,0|2,0,0]=4 5873 B11R1.1 C=C1CCC(CC1)COCC 34a_100000074039_100000210202 [1,1,0,0,0,0|0,0,2]=4 5874 B11R1.1 CC1CCC(CC1)COCF 34a_100000701341_100015361967 [1,1,0,0,0,0|1,0,1]=4 5875 B11R1.1 CCCNC1CCC(CC1)C 270004a_100020643023_100000185489 [1,1,0,0,0,0|2,0,0]=4 5876 B11R1.1 CCCNC1CCC(CC1)O 270004a_100020643023_100000764474 [1,1,0,0,0,0|2,0,0]=4 5877 B11R1.1 CCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000210303 [1,1,0,0,0,0|2,0,0]=4 5878 B11R1.1 CCCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000210303 [1,1,0,0,0,0|2,0,0]=4 5879 B11R1.1 CCCOC1CCC(CC1)C 34a_100000210258_200011216234 [1,1,0,0,0,0|2,0,0]=4 5880 B11R1.1 CCCOC1CCC(CC1)C 34a_100000210714_100000210303 [1,1,0,0,0,0|2,0,0]=4 5881 B11R1.1 CCCOC1CCC(CC1)C 7a_100000210714_100000210303 [1,1,0,0,0,0|2,0,0]=4 5882 B11R1.1 CCCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000210303 [1,1,0,0,0,0|2,0,0]=4 5883 B11R1.1 CCCSC1CCC(CC1)C 62a_100000210303_200011216234 [1,1,0,0,0,0|2,0,0]=4 5884 B11R1.1 CCNCC1CCC(CC1)C 2230a_103436935547_100000210202 [1,1,0,0,0,0|1,0,1]=4 5885 B11R1.1 CCNCC1CCC(CC1)C 34a_103436935547_100000210202 [1,1,0,0,0,0|1,0,1]=4 5886 B11R1.1 CCOCC1CCC(=O)CC1 34a_100000062911_100000210202 [1,1,0,0,0,0|0,0,2]=4 5887 B11R1.1 CCOCC1CCC(CC1)C 34a_100000701341_100000210202 [1,1,0,0,0,0|0,0,1]=3 5888 B11R1.1 CCOCC1CCN(CC1)C 2230a_100000755292_200000210301 [1,1,0,0,0,0|1,0,1]=4 5889 B11R1.1 CCOCC1CCN(CC1)C 269982a_100000755292_200000210301 [1,1,0,0,0,0|1,0,1]=4 5890 B11R1.1 CCOCC1CCN(CC1)C 34a_100000755292_200000210301 [1,1,0,0,0,0|1,0,1]=4 5891 B11R1.1 CCOCC1CCN(CC1)[13CH3] 2230a_100000755292_200025704644 [1,1,0,0,0,0|1,0,1]=4 5892 B11R1.1 CCOCC1CCN(CC1)[13CH3] 269982a_100000755292_200025704644 [1,1,0,0,0,0|1,0,1]=4 5893 B11R1.1 CCOCC1CCN(CC1)[13CH3] 34a_100000755292_200025704644 [1,1,0,0,0,0|1,0,1]=4 5894 B11R1.1 CCOCN1CCC(CC1)C 269982a_100000188429_100000739092 [1,1,0,0,0,0|1,0,1]=4 5895 B11R1.1 CCOCN1CCC(CC1)F 269982a_100015193889_100000739092 [1,1,0,0,0,0|1,0,1]=4 5896 B11R1.1 CCOCN1CCC(CC1)O 269982a_100025773856_100000739092 [1,1,0,0,0,0|1,0,1]=4 5897 B11R1.1 CCOC[C@H]1CC[C@@H](CC1)N 34a_100009821084_100000210202 [1,1,0,0,0,0|0,0,1]=3 5898 B11R1.1 N[C@H]1CC[C@@H](CC1)COCF 34a_100009821084_100015361967 [1,1,0,0,0,0|1,0,1]=4 5899 B11R1.17 CCCNC1CCCCC1C 2230a_100000211402_100000210303 [1,1,0,0,0,0|2,0,0]=4 5900 B11R1.17 CCCNC1CCCCC1C 269862a_100020643023_100000210921 [1,1,0,0,0,0|2,0,0]=4 5901 B11R1.17 CCCNC1CCCCC1C 270004a_100020643023_100000210921 [1,1,0,0,0,0|2,0,0]=4 5902 B11R1.17 CCCNC1CCCCC1C 34a_100000211402_100000210303 [1,1,0,0,0,0|2,0,0]=4 5903 B11R1.17 CCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000210303 [1,1,0,0,0,0|2,0,0]=4 5904 B11R1.17 CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000210303 [1,1,0,0,0,0|2,0,0]=4 5905 B11R1.17 CCCOC1CCCCC1C 34a_100000211207_100000210303 [1,1,0,0,0,0|2,0,0]=4 5906 B11R1.17 CCCOC1CCCCC1C 7a_100000211207_100000210303 [1,1,0,0,0,0|2,0,0]=4 5907 B11R1.17 CCCOC1CCCCC1Cl 34a_100000038908_100000210303 [1,1,0,0,0,0|2,0,0]=4 5908 B11R1.17 CCCOC1CCCCC1Cl 7a_100000038908_100000210303 [1,1,0,0,0,0|2,0,0]=4 5909 B11R1.17 CCCOC1CCCCC1F 34a_100000210258_100015423560 [1,1,0,0,0,0|2,0,0]=4 5910 B11R1.17 CCCOC1CCCCC1O 34a_100000210258_100000038908 [1,1,0,0,0,0|2,0,0]=4 5911 B11R1.17 CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000210303 [1,1,0,0,0,0|2,0,0]=4 5912 B11R1.17 CCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210303 [1,1,0,0,0,0|2,0,0]=4 5913 B11R1.17 CCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000210303 [1,1,0,0,0,0|2,0,0]=4 5914 B11R1.17 CCCSC1CCCCC1F 62a_100000210303_100015423560 [1,1,0,0,0,0|2,0,0]=4 5915 B11R1.17 CCCSC1CCCCC1F 62a_100015423560_100000210303 [1,1,0,0,0,0|2,0,0]=4 5916 B11R1.17 CCCSC1CCCCC1O 62a_100000038908_100000210303 [1,1,0,0,0,0|2,0,0]=4 5917 B11R1.17 CCCSC1CCCCC1O 62a_100000210303_100000038908 [1,1,0,0,0,0|2,0,0]=4 5918 B11R1.17 CCNCC1CCCCC1O 34a_100011216029_100000210202 [1,1,0,0,0,0|1,0,1]=4 5919 B11R1.17 CCOCC1CCCCC1=O 34a_100009861125_100000210202 [1,1,0,0,0,0|0,0,2]=4 5920 B11R1.17 CCOCC1CCCCC1=O 7a_100009861125_100000210202 [1,1,0,0,0,0|0,0,2]=4 5921 B11R1.17 CCOCC1CCCCN1C 34a_100000225079_100000210202 [1,1,0,0,0,0|1,0,1]=4 5922 B11R1.17 CCOCC1CCCCN1C 34a_100121572206_100015186950 [1,1,0,0,0,0|1,0,1]=4 5923 B11R1.17 CCOCC1COCCC1N 34a_214813039666_100000210202 [1,1,0,0,0,0|1,0,1]=4 5924 B11R1.17 CCOCN1CCCCC1C 269982a_100000211376_100000739092 [1,1,0,0,0,0|1,0,1]=4 5925 B11R1.24 CCCNC1CCCC(C1)C 2230a_100011194320_100000210303 [1,1,0,0,0,0|2,0,0]=4 5926 B11R1.24 CCCNC1CCCC(C1)C 270004a_100020643023_100000183594 [1,1,0,0,0,0|2,0,0]=4 5927 B11R1.24 CCCNC1CCCC(C1)C 34a_100011194320_100000210303 [1,1,0,0,0,0|2,0,0]=4 5928 B11R1.24 CCCNC1CCCC(C1)O 2230a_100015190357_100000210303 [1,1,0,0,0,0|2,0,0]=4 5929 B11R1.24 CCCNC1CCCC(C1)O 270004a_100020643023_100012613340 [1,1,0,0,0,0|2,0,0]=4 5930 B11R1.24 CCCOC1CCCC(C1)C 34a_100000211399_100000210303 [1,1,0,0,0,0|2,0,0]=4 5931 B11R1.24 CCNCC1CCCC(C1)O 2230a_100011254705_100000210202 [1,1,0,0,0,0|1,0,1]=4 5932 B11R1.24 CCOCC1CCCN(C1)C 34a_100121572206_100015183302 [1,1,0,0,0,0|1,0,1]=4 5933 B11R1.24 CCOCC1CNCC(C1)C 34a_200012821172_100000210202 [1,1,0,0,0,0|1,0,1]=4 5934 B11R1.24 CCOCN1CCCC(C1)F 269982a_100000697950_100000739092 [1,1,0,0,0,0|1,0,1]=4 5935 B11R1.24 CCOCN1CCCC(C1)O 269982a_100000211013_100000739092 [1,1,0,0,0,0|1,0,1]=4 5936 B11R1.24 CCOCN1CCC[C@@H](C1)C 269982a_100000717927_100000739092 [1,1,0,0,0,0|1,0,1]=4 5937 B11R1.28 BrCCCOC1CCCCC1 34a_100011217188_100000210327 [1,1,0,0,0,0|2,0,0]=4 5938 B11R1.28 BrCCOCC1CCCCC1 34a_100000211926_100000211423 [1,1,0,0,0,0|0,0,1]=3 5939 B11R1.28 BrCCOCC1CCCCO1 34a_100000211926_100000211543 [1,1,0,0,0,0|1,0,1]=4 5940 B11R1.28 BrCCOCC1CCCOC1 34a_100000211926_100000741521 [1,1,0,0,0,0|1,0,1]=4 5941 B11R1.28 BrCCOCC1CCOCC1 34a_100000211926_100000754603 [1,1,0,0,0,0|1,0,1]=4 5942 B11R1.28 C#CCOCC1CCCCC1 34a_100000210247_100000211423 [1,1,0,0,0,0|0,0,2]=4 5943 B11R1.28 C#CCOCC1CCCCC1 34a_100000212181_100000184674 [1,1,0,0,0,0|0,0,2]=4 5944 B11R1.28 C#CCOCC1CCCCC1 7a_100000212181_100000038162 [1,1,0,0,0,0|0,0,2]=4 5945 B11R1.28 C=CCOCC1CCCCC1 34a_100000212181_100015514636 [1,1,0,0,0,0|0,0,2]=4 5946 B11R1.28 C=CCOCC1CCCCC1 34a_200000210373_100000211423 [1,1,0,0,0,0|0,0,2]=4 5947 B11R1.28 C=CCOCC1CCCCC1 7a_100000212181_100015514636 [1,1,0,0,0,0|0,0,2]=4 5948 B11R1.28 CCC=NNC1CCCCC1 4a_100000709804_100000210100 [1,1,0,0,0,0|2,0,0]=4 5949 B11R1.28 CCCCNC1CCCCC1 2230a_100000182618_100000210211 [1,1,0,0,0,0|1,0,1]=4 5950 B11R1.28 CCCCNC1CCCCC1 270004a_100000102301_100000210434 [1,1,0,0,0,0|1,0,1]=4 5951 B11R1.28 CCCCNC1CCCCC1 34a_100000182618_100000210210 [1,1,0,0,0,0|1,0,1]=4 5952 B11R1.28 CCCCNC1CCCCC1 7a_106832991798_100000210327 [1,1,0,0,0,0|1,0,1]=4 5953 B11R1.28 CCCCOC1CCCCC1 34a_100000210227_100000210327 [1,1,0,0,0,0|1,0,1]=4 5954 B11R1.28 CCCCOC1CCCCC1 34a_100000210231_100000210210 [1,1,0,0,0,0|1,0,1]=4 5955 B11R1.28 CCCCOC1CCCCC1 7a_100000210227_100000210327 [1,1,0,0,0,0|1,0,1]=4 5956 B11R1.28 CCCCOC1CCCCC1 7a_100000210231_100000210211 [1,1,0,0,0,0|1,0,1]=4 5957 B11R1.28 CCCCSC1CCCCC1 62a_100000210211_100000210327 [1,1,0,0,0,0|1,0,1]=4 5958 B11R1.28 CCCCSC1CCCCC1 62a_100000210327_100000210210 [1,1,0,0,0,0|1,0,1]=4 5959 B11R1.28 CCCNCC1CCCCC1 2230a_100000210473_100000210303 [1,1,0,0,0,0|1,0,1]=4 5960 B11R1.28 CCCNCC1CCCCC1 269862a_100020643023_100000211278 [1,1,0,0,0,0|1,0,1]=4 5961 B11R1.28 CCCNCC1CCCCC1 34a_100000210473_100000210303 [1,1,0,0,0,0|1,0,1]=4 5962 B11R1.28 CCCOCC1CCCCC1 34a_100000210258_100000211423 [1,1,0,0,0,0|0,0,1]=3 5963 B11R1.28 CCCOCC1CCCCC1 34a_100000212181_100000210303 [1,1,0,0,0,0|0,0,1]=3 5964 B11R1.28 CCCOCC1CCCCC1 7a_100000212181_100000210303 [1,1,0,0,0,0|0,0,1]=3 5965 B11R1.28 CCCOCC1CCCCN1 34a_100000210821_100000210303 [1,1,0,0,0,0|1,0,1]=4 5966 B11R1.28 CCCOCC1CCCCO1 34a_100000210258_100000211543 [1,1,0,0,0,0|1,0,1]=4 5967 B11R1.28 CCCOCC1CCCCO1 34a_100000211370_100000210303 [1,1,0,0,0,0|1,0,1]=4 5968 B11R1.28 CCCOCC1CCCCO1 7a_100000211370_100000210303 [1,1,0,0,0,0|1,0,1]=4 5969 B11R1.28 CCCOCC1CCCNC1 34a_100000211344_100000210303 [1,1,0,0,0,0|1,0,1]=4 5970 B11R1.28 CCCOCC1CCCOC1 34a_100000210258_100000741521 [1,1,0,0,0,0|1,0,1]=4 5971 B11R1.28 CCCOCC1CCCOC1 34a_100000741520_100000210303 [1,1,0,0,0,0|1,0,1]=4 5972 B11R1.28 CCCOCC1CCNCC1 34a_100000738675_100000210303 [1,1,0,0,0,0|1,0,1]=4 5973 B11R1.28 CCCOCC1CCOCC1 34a_100000210258_100000754603 [1,1,0,0,0,0|1,0,1]=4 5974 B11R1.28 CCCOCC1CCOCC1 34a_100000749013_100000210303 [1,1,0,0,0,0|1,0,1]=4 5975 B11R1.28 CCCOCC1CCSCC1 34a_100000070558_100000210303 [1,1,0,0,0,0|1,0,1]=4 5976 B11R1.28 CCCOCC1CCSCC1 7a_100000070558_100000210303 [1,1,0,0,0,0|1,0,1]=4 5977 B11R1.28 CCCSCC1CCCCC1 62a_100000210303_100000211423 [1,1,0,0,0,0|0,1,1]=4 5978 B11R1.28 CCCSCC1CCCCC1 62a_100000211423_100000210303 [1,1,0,0,0,0|0,1,1]=4 5979 B11R1.28 CCNCCC1CCCCC1 2230a_100000738074_100000210202 [1,1,0,0,0,0|1,0,1]=4 5980 B11R1.28 CCNCCC1CCCCC1 2230a_100015525214_100012355289 [1,1,0,0,0,0|1,0,1]=4 5981 B11R1.28 CCNCCC1CCCCC1 270004a_100015525214_100011713444 [1,1,0,0,0,0|1,0,1]=4 5982 B11R1.28 CCNCCC1CCCCC1 34a_100000738074_100000210202 [1,1,0,0,0,0|1,0,1]=4 5983 B11R1.28 CCNCOC1CCCCC1 2230a_100015525214_100011935260 [1,1,0,0,0,0|1,0,1]=4 5984 B11R1.28 CCNN=CC1CCCCC1 4a_100000756455_100000211278 [1,1,0,0,0,0|1,0,0]=3 5985 B11R1.28 CCNN=CC1CCCOC1 4a_100000756455_100000753300 [1,1,0,0,0,0|2,0,0]=4 5986 B11R1.28 CCNN=CC1CCOCC1 4a_100000756455_100000749017 [1,1,0,0,0,0|2,0,0]=4 5987 B11R1.28 CCNN=CC1CCSCC1 4a_100000756455_100000067145 [1,1,0,0,0,0|2,0,0]=4 5988 B11R1.28 CCOCCC1CCCCC1 34a_100011217863_100000210202 [1,1,0,0,0,0|0,0,1]=3 5989 B11R1.28 CCOCCC1CCCCC1 34a_100121572206_100011209188 [1,1,0,0,0,0|0,0,1]=3 5990 B11R1.28 CCOCCC1CCCCC1 7a_100011217863_100000210202 [1,1,0,0,0,0|0,0,1]=3 5991 B11R1.28 CCOCCC1CCCCN1 34a_100000211664_100000210202 [1,1,0,0,0,0|1,0,1]=4 5992 B11R1.28 CCOCCC1CCCNC1 34a_100000752241_100000210202 [1,1,0,0,0,0|1,0,1]=4 5993 B11R1.28 CCOCCC1CCNCC1 34a_100015190746_100000210202 [1,1,0,0,0,0|1,0,1]=4 5994 B11R1.28 CCOCCC1CCOCC1 34a_100011933979_100000210202 [1,1,0,0,0,0|1,0,1]=4 5995 B11R1.28 CCOCCC1CCOCC1 34a_100121572206_100011934994 [1,1,0,0,0,0|1,0,1]=4 5996 B11R1.28 CCOCCC1CCOCC1 7a_100011933979_100000210202 [1,1,0,0,0,0|1,0,1]=4 5997 B11R1.28 CCOCCN1CCCCC1 34a_100121572206_100000739454 [1,1,0,0,0,0|1,0,1]=4 5998 B11R1.28 CCOCOC1CCCCC1 34a_100121572206_100011935260 [1,1,0,0,0,0|0,0,1]=3 5999 B11R1.28 CCOCSC1CCCCC1 62a_100000210327_100000739092 [1,1,0,0,0,0|0,0,1]=3 6000 B11R1.28 CCOCSC1CCCCC1 62a_100000739092_100000210327 [1,1,0,0,0,0|0,0,1]=3 6001 B11R1.28 CCOCSC1CCCOC1 62a_100000739092_100000693364 [1,1,0,0,0,0|1,0,1]=4 6002 B11R1.28 CCOCSC1CCOCC1 62a_100000739092_100011324220 [1,1,0,0,0,0|1,0,1]=4 6003 B11R1.28 CCOCSC1CCSCC1 62a_100000739092_100000069128 [1,1,0,0,0,0|1,0,1]=4 6004 B11R1.28 CCSCCC1CCCCC1 62a_100000210202_100012355289 [1,1,0,0,0,0|0,1,1]=4 6005 B11R1.28 CCSCCC1CCCCC1 62a_100012355289_100000210202 [1,1,0,0,0,0|0,1,1]=4 6006 B11R1.28 CCSCOC1CCCCC1 62a_100000210202_100011935260 [1,1,0,0,0,0|0,1,1]=4 6007 B11R1.28 CCSCOC1CCCCC1 62a_100011935260_100000210202 [1,1,0,0,0,0|0,1,1]=4 6008 B11R1.28 CNCCCC1CCCCC1 2230a_100011211642_200000210301 [1,1,0,0,0,0|1,0,1]=4 6009 B11R1.28 CNCCCC1CCCCC1 2230a_106832991635_100011713725 [1,1,0,0,0,0|1,0,1]=4 6010 B11R1.28 CNCCCC1CCCCC1 34a_100011211642_200000210301 [1,1,0,0,0,0|1,0,1]=4 6011 B11R1.28 CNCCCC1CCCCC1 34a_100102657272_100011713725 [1,1,0,0,0,0|1,0,1]=4 6012 B11R1.28 CNCCCC1CCCCC1 7a_106832991635_100011713725 [1,1,0,0,0,0|1,0,1]=4 6013 B11R1.28 CNCCOC1CCCCC1 2230a_106832991635_100011211530 [1,1,0,0,0,0|2,0,0]=4 6014 B11R1.28 CNCCOC1CCCCC1 34a_100015206981_200000210301 [1,1,0,0,0,0|2,0,0]=4 6015 B11R1.28 CNCCOC1CCCCC1 34a_100102657272_100011211530 [1,1,0,0,0,0|2,0,0]=4 6016 B11R1.28 CNCCOC1CCCCC1 7a_106832991635_100011211530 [1,1,0,0,0,0|2,0,0]=4 6017 B11R1.28 COCCCC1CCCCC1 34a_100000198086_200000210301 [1,1,0,0,0,0|1,0,1]=4 6018 B11R1.28 COCCCC1CCCCC1 34a_100138415774_100011713725 [1,1,0,0,0,0|1,0,1]=4 6019 B11R1.28 COCCCC1CCCCC1 7a_100000198086_200000210301 [1,1,0,0,0,0|1,0,1]=4 6020 B11R1.28 COCCNC1CCCCC1 2230a_100000182618_100011201679 [1,1,0,0,0,0|2,0,0]=4 6021 B11R1.28 COCCNC1CCCCC1 270004a_100000209980_100000210434 [1,1,0,0,0,0|2,0,0]=4 6022 B11R1.28 COCCNC1CCCCC1 34a_100000182618_100011201679 [1,1,0,0,0,0|2,0,0]=4 6023 B11R1.28 COCCNC1CCCCC1 34a_100000200466_200000210301 [1,1,0,0,0,0|2,0,0]=4 6024 B11R1.28 COCCOC1CCCCC1 34a_100000210231_100011201679 [1,1,0,0,0,0|2,0,0]=4 6025 B11R1.28 COCCOC1CCCCC1 34a_100000210237_100000210327 [1,1,0,0,0,0|2,0,0]=4 6026 B11R1.28 COCCOC1CCCCC1 34a_100011249652_200000210301 [1,1,0,0,0,0|2,0,0]=4 6027 B11R1.28 COCCOC1CCCCC1 34a_100138415774_100011211530 [1,1,0,0,0,0|2,0,0]=4 6028 B11R1.28 COCCOC1CCCCC1 7a_100000210231_100000233755 [1,1,0,0,0,0|2,0,0]=4 6029 B11R1.28 COCCOC1CCCCC1 7a_100011249652_200000210301 [1,1,0,0,0,0|2,0,0]=4 6030 B11R1.28 COCCSC1CCCCC1 62a_100000210327_100000233755 [1,1,0,0,0,0|2,0,0]=4 6031 B11R1.28 COCCSC1CCCCC1 62a_100000233755_100000210327 [1,1,0,0,0,0|2,0,0]=4 6032 B11R1.28 COCNCC1CCCCC1 2230a_100000210473_100000766300 [1,1,0,0,0,0|1,0,1]=4 6033 B11R1.28 COCSCC1CCCCC1 62a_100000211423_100000766300 [1,1,0,0,0,0|0,1,1]=4 6034 B11R1.28 COCSCC1CCCCC1 62a_100000766300_100000211423 [1,1,0,0,0,0|0,1,1]=4 6035 B11R1.28 CSCCCC1CCCCC1 62a_100011713725_200000210301 [1,1,0,0,0,0|1,0,1]=4 6036 B11R1.28 CSCCCC1CCCCC1 62a_200000210301_100011713725 [1,1,0,0,0,0|1,0,1]=4 6037 B11R1.28 CSCCNC1CCCCC1 2230a_100000182618_100000751147 [1,1,0,0,0,0|2,0,0]=4 6038 B11R1.28 CSCCNC1CCCCC1 270004a_100020590264_100000210434 [1,1,0,0,0,0|2,0,0]=4 6039 B11R1.28 CSCCNC1CCCCC1 34a_100000182618_100000212216 [1,1,0,0,0,0|2,0,0]=4 6040 B11R1.28 CSCCOC1CCCCC1 34a_100000210231_100000212216 [1,1,0,0,0,0|2,0,0]=4 6041 B11R1.28 CSCCOC1CCCCC1 34a_100000230434_100000210327 [1,1,0,0,0,0|2,0,0]=4 6042 B11R1.28 CSCCOC1CCCCC1 62a_100011211530_200000210301 [1,1,0,0,0,0|2,0,0]=4 6043 B11R1.28 CSCCOC1CCCCC1 62a_200000210301_100011211530 [1,1,0,0,0,0|2,0,0]=4 6044 B11R1.28 CSCCOC1CCCCC1 7a_100000210231_100000212216 [1,1,0,0,0,0|2,0,0]=4 6045 B11R1.28 CSCCOC1CCCCC1 7a_100000230434_100000210327 [1,1,0,0,0,0|2,0,0]=4 6046 B11R1.28 CSCCSC1CCCCC1 62a_100000210327_100000751147 [1,1,0,0,0,0|2,0,0]=4 6047 B11R1.28 CSCCSC1CCCCC1 62a_100000212216_100000210327 [1,1,0,0,0,0|2,0,0]=4 6048 B11R1.28 CSCNCC1CCCCC1 2230a_100000210473_100011218213 [1,1,0,0,0,0|1,0,1]=4 6049 B11R1.28 CSCNCC1CCCCC1 34a_100000210473_100011218213 [1,1,0,0,0,0|1,0,1]=4 6050 B11R1.28 CSCOCC1CCCCC1 34a_100000212181_100011218213 [1,1,0,0,0,0|0,0,1]=3 6051 B11R1.28 CSCOCC1CCCCN1 34a_100000210821_100011218213 [1,1,0,0,0,0|1,0,1]=4 6052 B11R1.28 CSCOCC1CCCCO1 34a_100000211370_100011218213 [1,1,0,0,0,0|1,0,1]=4 6053 B11R1.28 CSCOCC1CCCNC1 34a_100000211344_100011218213 [1,1,0,0,0,0|1,0,1]=4 6054 B11R1.28 CSCOCC1CCCOC1 34a_100000741520_100011218213 [1,1,0,0,0,0|1,0,1]=4 6055 B11R1.28 CSCOCC1CCNCC1 34a_100000738675_100011218213 [1,1,0,0,0,0|1,0,1]=4 6056 B11R1.28 CSCOCC1CCOCC1 34a_100000749013_100011218213 [1,1,0,0,0,0|1,0,1]=4 6057 B11R1.28 CSCOCC1CCSCC1 34a_100000070558_100011218213 [1,1,0,0,0,0|1,0,1]=4 6058 B11R1.28 CSCSCC1CCCCC1 62a_100000211423_100011218213 [1,1,0,0,0,0|0,1,1]=4 6059 B11R1.28 CSCSCC1CCCCC1 62a_100011218213_100000211423 [1,1,0,0,0,0|0,1,1]=4 6060 B11R1.28 ClCCCOC1CCCCC1 34a_100000230001_100000210327 [1,1,0,0,0,0|2,0,0]=4 6061 B11R1.28 FCCCNC1CCCCC1 2230a_100000182618_100011934791 [1,1,0,0,0,0|2,0,0]=4 6062 B11R1.28 FCCCNC1CCCCC1 270004a_100015189416_100000210434 [1,1,0,0,0,0|2,0,0]=4 6063 B11R1.28 FCCCNC1CCCCC1 34a_100000182618_100011934791 [1,1,0,0,0,0|2,0,0]=4 6064 B11R1.28 FCCCNC1CCCCC1 34a_100015189416_100000210327 [1,1,0,0,0,0|2,0,0]=4 6065 B11R1.28 FCCCOC1CCCCC1 34a_100000210231_100011934791 [1,1,0,0,0,0|2,0,0]=4 6066 B11R1.28 FCCCOC1CCCCC1 34a_100000759539_100000210327 [1,1,0,0,0,0|2,0,0]=4 6067 B11R1.28 FCCCOC1CCCCC1 7a_100000210231_100011934791 [1,1,0,0,0,0|2,0,0]=4 6068 B11R1.28 FCCCSC1CCCCC1 62a_100000210327_100011934791 [1,1,0,0,0,0|2,0,0]=4 6069 B11R1.28 FCCCSC1CCCCC1 62a_100011934791_100000210327 [1,1,0,0,0,0|2,0,0]=4 6070 B11R1.28 FCCNCC1CCCCC1 2230a_100000210473_100011217306 [1,1,0,0,0,0|1,0,1]=4 6071 B11R1.28 FCCNCC1CCCCC1 269862a_100000724931_100000211278 [1,1,0,0,0,0|1,0,1]=4 6072 B11R1.28 FCCNCC1CCCCC1 34a_100000210473_100011217306 [1,1,0,0,0,0|1,0,1]=4 6073 B11R1.28 FCCNCC1CCCCC1 34a_100000724931_100000211423 [1,1,0,0,0,0|1,0,1]=4 6074 B11R1.28 FCCOCC1CCCCC1 34a_100000212181_100011217306 [1,1,0,0,0,0|0,0,1]=3 6075 B11R1.28 FCCOCC1CCCCC1 7a_100000212181_100011217306 [1,1,0,0,0,0|0,0,1]=3 6076 B11R1.28 FCCOCC1CCCCN1 34a_100000210821_100011217306 [1,1,0,0,0,0|1,0,1]=4 6077 B11R1.28 FCCOCC1CCCCO1 34a_100000211370_100011217306 [1,1,0,0,0,0|1,0,1]=4 6078 B11R1.28 FCCOCC1CCCCO1 7a_100000211370_100011217306 [1,1,0,0,0,0|1,0,1]=4 6079 B11R1.28 FCCOCC1CCCNC1 34a_100000211344_100011217306 [1,1,0,0,0,0|1,0,1]=4 6080 B11R1.28 FCCOCC1CCCOC1 34a_100000741520_100011217306 [1,1,0,0,0,0|1,0,1]=4 6081 B11R1.28 FCCOCC1CCNCC1 34a_100000738675_100011217306 [1,1,0,0,0,0|1,0,1]=4 6082 B11R1.28 FCCOCC1CCOCC1 34a_100000749013_100011217306 [1,1,0,0,0,0|1,0,1]=4 6083 B11R1.28 FCCOCC1CCSCC1 34a_100000070558_100011217306 [1,1,0,0,0,0|1,0,1]=4 6084 B11R1.28 FCCOCC1CCSCC1 7a_100000070558_100011217306 [1,1,0,0,0,0|1,0,1]=4 6085 B11R1.28 FCCSCC1CCCCC1 62a_100000211423_100011217306 [1,1,0,0,0,0|0,1,1]=4 6086 B11R1.28 FCCSCC1CCCCC1 62a_100011217306_100000211423 [1,1,0,0,0,0|0,1,1]=4 6087 B11R1.28 FCOCCC1CCCCC1 34a_100011217863_100015361967 [1,1,0,0,0,0|1,0,1]=4 6088 B11R1.28 FCOCCC1CCCCC1 7a_100011217863_100015361967 [1,1,0,0,0,0|1,0,1]=4 6089 B11R1.28 N#CCOCC1CCCCC1 7a_100000212181_100011215382 [1,1,0,0,0,0|0,0,2]=4 6090 B11R1.28 NCCCOC1CCCCC1 34a_100000182051_100000210327 [1,1,0,0,0,0|2,0,0]=4 6091 B11R1.28 NCCOCC1CCCCC1 34a_100000210304_100000211423 [1,1,0,0,0,0|0,0,1]=3 6092 B11R1.28 NCCOCC1CCCCO1 34a_100000210304_100000211543 [1,1,0,0,0,0|1,0,1]=4 6093 B11R1.28 NCCOCC1CCCOC1 34a_100000210304_100000741521 [1,1,0,0,0,0|1,0,1]=4 6094 B11R1.28 NCCOCC1CCOCC1 34a_100000210304_100000754603 [1,1,0,0,0,0|1,0,1]=4 6095 B11R1.28 O=CCOCC1CCCCC1 34a_100000212181_200009817547 [1,1,0,0,0,0|0,0,2]=4 6096 B11R1.28 O=CCOCC1CCCCC1 7a_100000212181_200015260668 [1,1,0,0,0,0|0,0,2]=4 6097 B11R1.28 OCCCNC1CCCCC1 2230a_100000182618_100000230001 [1,1,0,0,0,0|2,0,0]=4 6098 B11R1.28 OCCCNC1CCCCC1 270004a_100000182051_100000210434 [1,1,0,0,0,0|2,0,0]=4 6099 B11R1.28 OCCCNC1CCCCC1 34a_100000182618_100000230001 [1,1,0,0,0,0|2,0,0]=4 6100 B11R1.28 OCCCOC1CCCCC1 34a_100000210231_100000230001 [1,1,0,0,0,0|2,0,0]=4 6101 B11R1.28 OCCCOC1CCCCC1 7a_100000210231_100011215043 [1,1,0,0,0,0|2,0,0]=4 6102 B11R1.28 OCCCSC1CCCCC1 62a_100000210327_100011215043 [1,1,0,0,0,0|2,0,0]=4 6103 B11R1.28 OCCCSC1CCCCC1 62a_100011215043_100000210327 [1,1,0,0,0,0|2,0,0]=4 6104 B11R1.28 OCCNCC1CCCCC1 2230a_100000210473_100000211926 [1,1,0,0,0,0|1,0,1]=4 6105 B11R1.28 OCCNCC1CCCCC1 2230a_100016997473_100000211423 [1,1,0,0,0,0|1,0,1]=4 6106 B11R1.28 OCCNCC1CCCCC1 269862a_100000210304_100000211278 [1,1,0,0,0,0|1,0,1]=4 6107 B11R1.28 OCCNCC1CCCCC1 34a_100000210473_100000211926 [1,1,0,0,0,0|1,0,1]=4 6108 B11R1.28 OCCNCC1CCCCC1 34a_100016990907_100000211423 [1,1,0,0,0,0|1,0,1]=4 6109 B11R1.28 OCCOCC1CCCCC1 34a_100000212181_100000211926 [1,1,0,0,0,0|0,0,1]=3 6110 B11R1.28 OCCOCC1CCCCC1 7a_100000212181_100000211926 [1,1,0,0,0,0|0,0,1]=3 6111 B11R1.28 OCCOCC1CCCCN1 34a_100000210821_100000211926 [1,1,0,0,0,0|1,0,1]=4 6112 B11R1.28 OCCOCC1CCCCO1 34a_100000211370_100000211926 [1,1,0,0,0,0|1,0,1]=4 6113 B11R1.28 OCCOCC1CCCCO1 7a_100000211370_100000211926 [1,1,0,0,0,0|1,0,1]=4 6114 B11R1.28 OCCOCC1CCCNC1 34a_100000211344_100000211926 [1,1,0,0,0,0|1,0,1]=4 6115 B11R1.28 OCCOCC1CCCOC1 34a_100000741520_100000211926 [1,1,0,0,0,0|1,0,1]=4 6116 B11R1.28 OCCOCC1CCNCC1 34a_100000738675_100000211926 [1,1,0,0,0,0|1,0,1]=4 6117 B11R1.28 OCCOCC1CCOCC1 34a_100000749013_100000211926 [1,1,0,0,0,0|1,0,1]=4 6118 B11R1.28 OCCOCC1CCSCC1 34a_100000070558_100000211926 [1,1,0,0,0,0|1,0,1]=4 6119 B11R1.28 OCCOCC1CCSCC1 7a_100000070558_100000211926 [1,1,0,0,0,0|1,0,1]=4 6120 B11R1.28 OCCSCC1CCCCC1 62a_100000211423_100000211926 [1,1,0,0,0,0|0,1,1]=4 6121 B11R1.28 OCCSCC1CCCCC1 62a_100000211926_100000211423 [1,1,0,0,0,0|0,1,1]=4 6122 B11R1.28 [13CH3]NCCCC1CCCCC1 2230a_100011211642_200025704644 [1,1,0,0,0,0|1,0,1]=4 6123 B11R1.28 [13CH3]NCCCC1CCCCC1 34a_100011211642_200025704644 [1,1,0,0,0,0|1,0,1]=4 6124 B11R1.28 [13CH3]NCCOC1CCCCC1 34a_100015206981_200025704644 [1,1,0,0,0,0|2,0,0]=4 6125 B11R1.28 [13CH3]OCCCC1CCCCC1 34a_100000198086_200025704644 [1,1,0,0,0,0|1,0,1]=4 6126 B11R1.28 [13CH3]OCCCC1CCCCC1 7a_100000198086_200025704644 [1,1,0,0,0,0|1,0,1]=4 6127 B11R1.28 [13CH3]OCCNC1CCCCC1 34a_100000200466_200025704644 [1,1,0,0,0,0|2,0,0]=4 6128 B11R1.28 [13CH3]OCCOC1CCCCC1 34a_100011249652_200025704644 [1,1,0,0,0,0|2,0,0]=4 6129 B11R1.28 [13CH3]OCCOC1CCCCC1 7a_100011249652_200025704644 [1,1,0,0,0,0|2,0,0]=4 6130 B11R1.28 [13CH3]SCCCC1CCCCC1 62a_100011713725_200025704644 [1,1,0,0,0,0|1,0,1]=4 6131 B11R1.28 [13CH3]SCCCC1CCCCC1 62a_200025704644_100011713725 [1,1,0,0,0,0|1,0,1]=4 6132 B11R1.28 [13CH3]SCCOC1CCCCC1 62a_100011211530_200025704644 [1,1,0,0,0,0|2,0,0]=4 6133 B11R1.28 [13CH3]SCCOC1CCCCC1 62a_200025704644_100011211530 [1,1,0,0,0,0|2,0,0]=4 6134 B11R1.40 CCC(=O)C=C1CCCCC1 1458a_100000743792_100000210202 [1,1,0,0,0,0|1,0,1]=4 6135 B11R1.40 CCC(=O)CC1CCCCC1 1458a_100000210414_100000211423 [1,1,0,0,0,0|1,0,1]=4 6136 B11R1.40 CCC(=O)CC1CCCCC1 1458a_100000211666_100000210202 [1,1,0,0,0,0|1,0,1]=4 6137 B11R1.40 CCC(=O)NC1CCCCC1 11a_100000182618_100000210414 [1,1,0,0,0,0|2,0,0]=4 6138 B11R1.40 CCC(=O)NC1CCCCC1 1626a_100000182618_100000210414 [1,1,0,0,0,0|2,0,0]=4 6139 B11R1.40 CCC(=O)NC1CCCCC1 240690a_100000182618_100000210414 [1,1,0,0,0,0|2,0,0]=4 6140 B11R1.40 CCC(=O)NC1CCCCC1 527a_100000182618_100000210414 [1,1,0,0,0,0|2,0,0]=4 6141 B11R1.40 CCC(C)NC1CCCCC1 2230a_100000182618_100000758301 [1,1,0,0,0,0|2,0,0]=4 6142 B11R1.40 CCC(C)NC1CCCCC1 270004a_100000209981_100000210434 [1,1,0,0,0,0|2,0,0]=4 6143 B11R1.40 CCC(C)NC1CCCCC1 34a_100000182618_100011215416 [1,1,0,0,0,0|2,0,0]=4 6144 B11R1.40 CCC(C)OC1CCCCC1 34a_100000210231_100011215416 [1,1,0,0,0,0|2,0,0]=4 6145 B11R1.40 CCC(C)OC1CCCCC1 7a_100000210228_100000210327 [1,1,0,0,0,0|2,0,0]=4 6146 B11R1.40 CCC(C)OC1CCCCC1 7a_100000210231_100000758301 [1,1,0,0,0,0|2,0,0]=4 6147 B11R1.40 CCC(C)SC1CCCCC1 62a_100000210327_100000758301 [1,1,0,0,0,0|2,0,0]=4 6148 B11R1.40 CCC(C)SC1CCCCC1 62a_100000758301_100000210327 [1,1,0,0,0,0|2,0,0]=4 6149 B11R1.40 CCN(C)CC1CCCCC1 2230a_100000225621_100000211423 [1,1,0,0,0,0|1,0,1]=4 6150 B11R1.40 CCN(C)CC1CCCCC1 2230a_100000736448_100000210202 [1,1,0,0,0,0|1,0,1]=4 6151 B11R1.40 CCN(C)CC1CCCCC1 269982a_100000225621_100000211423 [1,1,0,0,0,0|1,0,1]=4 6152 B11R1.40 CCN(C)CC1CCCCC1 269982a_100000736448_100000204670 [1,1,0,0,0,0|1,0,1]=4 6153 B11R1.40 CCN(C)CC1CCCCC1 34a_100000736448_100000210202 [1,1,0,0,0,0|1,0,1]=4 6154 B11R1.91 CC(=O)C=CC1CCCCC1 1458a_100102566626_200000210301 [1,1,0,0,0,0|1,0,1]=4 6155 B11R1.91 CC(Br)COC1CCCCC1 34a_100012180447_100000210327 [1,1,0,0,0,0|2,0,0]=4 6156 B11R1.91 CC(C)CNC1CCCCC1 2230a_100000182618_100000210760 [1,1,0,0,0,0|2,0,0]=4 6157 B11R1.91 CC(C)CNC1CCCCC1 270004a_100000182618_100000210432 [1,1,0,0,0,0|2,0,0]=4 6158 B11R1.91 CC(C)CNC1CCCCC1 270004a_100000210953_100000210434 [1,1,0,0,0,0|2,0,0]=4 6159 B11R1.91 CC(C)CNC1CCCCC1 34a_100000182618_100000210624 [1,1,0,0,0,0|2,0,0]=4 6160 B11R1.91 CC(C)CNC1CCCCC1 34a_100000210953_100000210327 [1,1,0,0,0,0|2,0,0]=4 6161 B11R1.91 CC(C)COC1CCCCC1 34a_100000210231_100000210624 [1,1,0,0,0,0|2,0,0]=4 6162 B11R1.91 CC(C)COC1CCCCC1 34a_100000210257_100000210327 [1,1,0,0,0,0|2,0,0]=4 6163 B11R1.91 CC(C)COC1CCCCC1 7a_100000210231_100000210760 [1,1,0,0,0,0|2,0,0]=4 6164 B11R1.91 CC(C)CSC1CCCCC1 62a_100000210327_100000210760 [1,1,0,0,0,0|2,0,0]=4 6165 B11R1.91 CC(C)CSC1CCCCC1 62a_100000210624_100000210327 [1,1,0,0,0,0|2,0,0]=4 6166 B11R1.91 CC(C)NCC1CCCCC1 2230a_100000210473_100000210206 [1,1,0,0,0,0|1,0,1]=4 6167 B11R1.91 CC(C)NCC1CCCCC1 2230a_100138425928_100000211423 [1,1,0,0,0,0|1,0,1]=4 6168 B11R1.91 CC(C)NCC1CCCCC1 34a_100000210473_100000210206 [1,1,0,0,0,0|1,0,1]=4 6169 B11R1.91 CC(C)NCC1CCCCC1 34a_100138425928_100000211423 [1,1,0,0,0,0|1,0,1]=4 6170 B11R1.91 CC(C)OCC1CCCCC1 34a_100000212181_100000210206 [1,1,0,0,0,0|0,0,1]=3 6171 B11R1.91 CC(C)OCC1CCCCC1 34a_100000212225_100000211423 [1,1,0,0,0,0|0,0,1]=3 6172 B11R1.91 CC(C)OCC1CCCCC1 7a_100000212181_100000210206 [1,1,0,0,0,0|0,0,1]=3 6173 B11R1.91 CC(C)OCC1CCCCN1 34a_100000210821_100000210206 [1,1,0,0,0,0|1,0,1]=4 6174 B11R1.91 CC(C)OCC1CCCCO1 34a_100000211370_100000210206 [1,1,0,0,0,0|1,0,1]=4 6175 B11R1.91 CC(C)OCC1CCCCO1 34a_100000212225_100000211543 [1,1,0,0,0,0|1,0,1]=4 6176 B11R1.91 CC(C)OCC1CCCCO1 7a_100000211370_100000210206 [1,1,0,0,0,0|1,0,1]=4 6177 B11R1.91 CC(C)OCC1CCCNC1 34a_100000211344_100000210206 [1,1,0,0,0,0|1,0,1]=4 6178 B11R1.91 CC(C)OCC1CCCOC1 34a_100000212225_100000741521 [1,1,0,0,0,0|1,0,1]=4 6179 B11R1.91 CC(C)OCC1CCCOC1 34a_100000741520_100000210206 [1,1,0,0,0,0|1,0,1]=4 6180 B11R1.91 CC(C)OCC1CCNCC1 34a_100000738675_100000210206 [1,1,0,0,0,0|1,0,1]=4 6181 B11R1.91 CC(C)OCC1CCOCC1 34a_100000212225_100000754603 [1,1,0,0,0,0|1,0,1]=4 6182 B11R1.91 CC(C)OCC1CCOCC1 34a_100000749013_100000210206 [1,1,0,0,0,0|1,0,1]=4 6183 B11R1.91 CC(C)OCC1CCSCC1 34a_100000070558_100000210206 [1,1,0,0,0,0|1,0,1]=4 6184 B11R1.91 CC(C)OCC1CCSCC1 7a_100000070558_100000210206 [1,1,0,0,0,0|1,0,1]=4 6185 B11R1.91 CC(C)SCC1CCCCC1 62a_100000210206_100000211423 [1,1,0,0,0,0|0,1,1]=4 6186 B11R1.91 CC(C)SCC1CCCCC1 62a_100000211423_100000210206 [1,1,0,0,0,0|0,1,1]=4 6187 B11R1.91 CC(F)COC1CCCCC1 34a_100015925927_100000210327 [1,1,0,0,0,0|2,0,0]=4 6188 B11R1.91 CC(O)CNC1CCCCC1 2230a_100000182618_100011218427 [1,1,0,0,0,0|2,0,0]=4 6189 B11R1.91 CC(O)CNC1CCCCC1 270004a_100000210904_100000210434 [1,1,0,0,0,0|2,0,0]=4 6190 B11R1.91 CC(O)CNC1CCCCC1 34a_100000182618_100011218427 [1,1,0,0,0,0|2,0,0]=4 6191 B11R1.91 CC(O)CNC1CCCCC1 34a_100000210904_100000210327 [1,1,0,0,0,0|2,0,0]=4 6192 B11R1.91 CC(O)COC1CCCCC1 34a_100000210231_100011218427 [1,1,0,0,0,0|2,0,0]=4 6193 B11R1.91 CC(O)COC1CCCCC1 7a_100000210231_100011218427 [1,1,0,0,0,0|2,0,0]=4 6194 B11R1.91 CC(O)CSC1CCCCC1 62a_100000210327_100011218427 [1,1,0,0,0,0|2,0,0]=4 6195 B11R1.91 CC(O)CSC1CCCCC1 62a_100011218427_100000210327 [1,1,0,0,0,0|2,0,0]=4 6196 B11R1.91 C[C@@H](Cl)COC1CCCCC1 34a_100016084084_100000210327 [1,1,0,0,0,0|2,0,0]=4 6197 B11R1.91 C[C@@H](N)COC1CCCCC1 34a_100000737577_100000210327 [1,1,0,0,0,0|2,0,0]=4 6198 B11R1.91 C[C@@H](O)CNC1CCCCC1 2230a_100000182618_100009817552 [1,1,0,0,0,0|2,0,0]=4 6199 B11R1.91 C[C@@H](O)CNC1CCCCC1 34a_100000182618_100009817552 [1,1,0,0,0,0|2,0,0]=4 6200 B11R1.91 C[C@@H](O)COC1CCCCC1 34a_100000210231_100009817552 [1,1,0,0,0,0|2,0,0]=4 6201 B11R1.91 C[C@@H](O)COC1CCCCC1 7a_100000210231_100009817552 [1,1,0,0,0,0|2,0,0]=4 6202 B11R1.91 C[C@@H](O)CSC1CCCCC1 62a_100000210327_100009817552 [1,1,0,0,0,0|2,0,0]=4 6203 B11R1.91 C[C@@H](O)CSC1CCCCC1 62a_100009817552_100000210327 [1,1,0,0,0,0|2,0,0]=4 6204 B11R1.91 [13CH3]C(=O)C=CC1CCCCC1 1458a_100102566626_200025704644 [1,1,0,0,0,0|1,0,1]=4 6205 B11R1.900 CC1(CCCCC1)COCF 34a_100000688186_100015361967 [1,1,0,0,0,0|1,0,1]=4 6206 B11R1.900 CC1(CCCCC1)COCF 7a_100000688186_100015361967 [1,1,0,0,0,0|1,0,1]=4 6207 B11R1.900 CCCNC1(CCCCC1)C 2230a_100000741114_100000210303 [1,1,0,0,0,0|2,0,0]=4 6208 B11R1.900 CCCNC1(CCCCC1)C 34a_100000741114_100000210303 [1,1,0,0,0,0|2,0,0]=4 6209 B11R1.900 CCCOC1(CCCCC1)C 34a_100011215885_100000210303 [1,1,0,0,0,0|2,0,0]=4 6210 B11R1.900 CCCOC1(CCCCC1)C 7a_100011215885_100000210303 [1,1,0,0,0,0|2,0,0]=4 6211 B11R1.900 CCNCC1(CCCCC1)C 2230a_100000706052_100000210202 [1,1,0,0,0,0|1,0,1]=4 6212 B11R1.900 CCNCC1(CCCCC1)C 269862a_100015525214_100011935227 [1,1,0,0,0,0|1,0,1]=4 6213 B11R1.900 CCNCC1(CCCCC1)C 34a_100000706052_100000210202 [1,1,0,0,0,0|1,0,1]=4 6214 B11R1.900 CCNCC1(CCCCC1)O 2230a_100000748649_100000210202 [1,1,0,0,0,0|1,0,1]=4 6215 B11R1.900 CCNCC1(CCCCC1)O 34a_100000748649_100000210202 [1,1,0,0,0,0|1,0,1]=4 6216 B11R1.900 CCOCC1(CCCCC1)C 34a_100000688186_100000210202 [1,1,0,0,0,0|0,0,1]=3 6217 B11R1.900 CCOCC1(CCCCC1)C 7a_100000688186_100000210202 [1,1,0,0,0,0|0,0,1]=3 6218 B11R1.900 CCOCC1(CCCCC1)F 34a_100000090305_100000210202 [1,1,0,0,0,0|0,0,1]=3 6219 B11R1.900 CCOCC1(CCCCC1)F 7a_100000090305_100000210202 [1,1,0,0,0,0|0,0,1]=3 6220 B11R1.900 CCOCC1(CCCCC1)N 34a_100000740034_100000210202 [1,1,0,0,0,0|0,0,1]=3 6221 B11R1.900 CCOCC1(CCNCC1)F 34a_100016990393_100000210202 [1,1,0,0,0,0|1,0,1]=4 6222 B11R1.900 CCOCC1(CCOCC1)C 34a_100000704393_100000210202 [1,1,0,0,0,0|1,0,1]=4 6223 B11R1.900 CCOCC1(CCOCC1)C 7a_100000704393_100000210202 [1,1,0,0,0,0|1,0,1]=4 6224 B11R1.900 CCOCC1(CCOCC1)N 34a_100000751404_100000210202 [1,1,0,0,0,0|1,0,1]=4 6225 B11R1.900 FCOCC1(CCCCC1)F 34a_100000090305_100015361967 [1,1,0,0,0,0|1,0,1]=4 6226 B11R1.900 FCOCC1(CCCCC1)F 7a_100000090305_100015361967 [1,1,0,0,0,0|1,0,1]=4 6227 B11R1.900 NC1(CCCCC1)COCF 34a_100000740034_100015361967 [1,1,0,0,0,0|1,0,1]=4 6228 B11R1.15 CCCC(=O)C1CCC(C1)O 1458a_100000688591_100000210303 [0,1,0,0,1,0|1,0,0]=3 6229 B11R1.15 CCCC(=O)C1CCN(C1)C 1458a_100000739633_100000210303 [0,1,0,0,1,0|2,0,0]=4 6230 B11R1.15 CCCC(=O)N1CCC(C1)O 240690a_100011215560_100000211992 [0,1,0,0,1,0|2,0,0]=4 6231 B11R1.15 CCCC(=O)N1CCC(C1)O 527a_100011215560_100000211992 [0,1,0,0,1,0|2,0,0]=4 6232 B11R1.15 CCCC(=O)N1CC[C@@H](C1)F 11a_100015203821_100000211992 [0,1,0,0,1,0|2,0,0]=4 6233 B11R1.15 CCCC(=O)N1CC[C@@H](C1)F 1626a_100015203821_100000211992 [0,1,0,0,1,0|2,0,0]=4 6234 B11R1.15 CCCC(=O)N1CC[C@@H](C1)F 240690a_100015203821_100000211992 [0,1,0,0,1,0|2,0,0]=4 6235 B11R1.15 CCCC(=O)N1CC[C@@H](C1)F 527a_100015203821_100000211992 [0,1,0,0,1,0|2,0,0]=4 6236 B11R1.15 CCCC(=O)N1CC[C@H](C1)C 11a_100016987628_100000211992 [0,1,0,0,1,0|2,0,0]=4 6237 B11R1.15 CCCC(=O)N1CC[C@H](C1)C 240690a_100016987628_100000211992 [0,1,0,0,1,0|2,0,0]=4 6238 B11R1.15 CCCC(=O)N1CC[C@H](C1)C 527a_100016987628_100000211992 [0,1,0,0,1,0|2,0,0]=4 6239 B11R1.15 CCNC(=O)C1CCC(C1)O 240690a_100015525214_100000688591 [0,1,0,0,1,0|1,0,0]=3 6240 B11R1.15 CCNC(=O)C1CCN(C1)C 240690a_100015525214_100000739633 [0,1,0,0,1,0|2,0,0]=4 6241 B11R1.15 CCNC(=O)C1CCN(C1)C 527a_100015525214_100000739633 [0,1,0,0,1,0|2,0,0]=4 6242 B11R1.15 CCNC(=O)N1CCC(C1)O 2708a_100015525214_100011215560 [0,1,0,0,1,0|2,0,0]=4 6243 B11R1.15 CCNC(=O)N1CCC(C1)O 273464a_100015525214_100011215560 [0,1,0,0,1,0|2,0,0]=4 6244 B11R1.15 CCNC(=O)N1CC[C@@H](C1)F 2708a_100015525214_100015203821 [0,1,0,0,1,0|2,0,0]=4 6245 B11R1.15 CCNC(=O)N1CC[C@@H](C1)F 273464a_100015525214_100015203821 [0,1,0,0,1,0|2,0,0]=4 6246 B11R1.15 CCNC(=O)N1CC[C@H](C1)C 2708a_100015525214_100016987628 [0,1,0,0,1,0|2,0,0]=4 6247 B11R1.15 CCNC(=O)N1CC[C@H](C1)C 273464a_100015525214_100016987628 [0,1,0,0,1,0|2,0,0]=4 6248 B11R1.15 CCOC(=O)C1CCN(C1)C 2230a_100016987290_200000210301 [0,1,0,0,1,0|1,0,0]=3 6249 B11R1.15 CCOC(=O)C1CCN(C1)C 269982a_100016987290_200000210301 [0,1,0,0,1,0|1,0,0]=3 6250 B11R1.15 CCOC(=O)C1CCN(C1)[13CH3] 2230a_100016987290_200025704644 [0,1,0,0,1,0|1,0,0]=3 6251 B11R1.15 CCOC(=O)C1CCN(C1)[13CH3] 269982a_100016987290_200025704644 [0,1,0,0,1,0|1,0,0]=3 6252 B11R1.15 CNNC(=O)C1CCC(C1)O 22a_100016993582_100000688591 [0,1,0,0,1,0|2,0,0]=4 6253 B11R1.15 O=C(CCF)C1CCC(C1)O 1458a_100000688591_100011217306 [0,1,0,0,1,0|2,0,0]=4 6254 B11R1.15 O=C(CCO)C1CCC(C1)O 1458a_100000688591_100000211926 [0,1,0,0,1,0|2,0,0]=4 6255 B11R1.29 C#CCCC(=O)C1CCCC1 1458a_100000210718_100000753159 [0,1,0,0,1,0|1,0,1]=4 6256 B11R1.29 C#CCCC(=O)C1CCCC1 1458a_100000692101_100000179811 [0,1,0,0,1,0|1,0,1]=4 6257 B11R1.29 C#CCNC(=O)C1CCCC1 11a_100000212058_100000210718 [0,1,0,0,1,0|1,0,1]=4 6258 B11R1.29 C#CCNC(=O)C1CCCC1 1626a_100000212058_100000210718 [0,1,0,0,1,0|1,0,1]=4 6259 B11R1.29 C#CCNC(=O)C1CCCC1 240690a_100000212058_100000210718 [0,1,0,0,1,0|1,0,1]=4 6260 B11R1.29 C#CCNC(=O)C1CCCC1 527a_100000212058_100000210718 [0,1,0,0,1,0|1,0,1]=4 6261 B11R1.29 C/C=C/CC(=O)C1CCCC1 1458a_100000210718_100102629194 [0,1,0,0,1,0|1,0,1]=4 6262 B11R1.29 C=CCCC(=O)C1CCCC1 1458a_100000210718_100000754431 [0,1,0,0,1,0|1,0,1]=4 6263 B11R1.29 C=CCCC(=O)C1CCCC1 1458a_100000749702_100000179811 [0,1,0,0,1,0|1,0,1]=4 6264 B11R1.29 C=CCNC(=O)C1CCCC1 1626a_100020586998_100000210718 [0,1,0,0,1,0|1,0,1]=4 6265 B11R1.29 C=CCNC(=O)C1CCCC1 240690a_100020586998_100000210718 [0,1,0,0,1,0|1,0,1]=4 6266 B11R1.29 C=CCNC(=O)C1CCCC1 527a_100020586998_100000210718 [0,1,0,0,1,0|1,0,1]=4 6267 B11R1.29 CC#CCC(=O)C1CCCC1 1458a_100000210718_100000748600 [0,1,0,0,1,0|1,0,1]=4 6268 B11R1.29 CC(OCCF)C1CCCC1 34a_100011216366_100011217306 [0,1,0,0,1,0|1,0,1]=4 6269 B11R1.29 CC(OCCF)C1CCCC1 7a_100011216366_100011217306 [0,1,0,0,1,0|1,0,1]=4 6270 B11R1.29 CC(OCCO)C1CCCC1 34a_100011216366_100000211926 [0,1,0,0,1,0|1,0,1]=4 6271 B11R1.29 CC(OCCO)C1CCCC1 7a_100011216366_100000211926 [0,1,0,0,1,0|1,0,1]=4 6272 B11R1.29 CC=CCC(=O)C1CCCC1 1458a_100000210718_100000070051 [0,1,0,0,1,0|1,0,1]=4 6273 B11R1.29 CC=CCC(=O)C1CCCC1 1458a_100121576822_100000179811 [0,1,0,0,1,0|1,0,1]=4 6274 B11R1.29 CC=NNC(=O)C1CCCC1 4a_100000189808_200000210099 [0,1,0,0,1,0|1,0,1]=4 6275 B11R1.29 CCC#CC(=O)C1CCCC1 1458a_100011827653_100000179811 [0,1,0,0,1,0|1,0,0]=3 6276 B11R1.29 CCC#CC(=O)C1CCOC1 1458a_100011827653_100000690089 [0,1,0,0,1,0|2,0,0]=4 6277 B11R1.29 CCC=CC(=O)C1CCCC1 1458a_100000212282_100000179811 [0,1,0,0,1,0|1,0,0]=3 6278 B11R1.29 CCC=CC(=O)C1CCOC1 1458a_100000212282_100000690089 [0,1,0,0,1,0|2,0,0]=4 6279 B11R1.29 CCC=CC(=O)N1CCCC1 240690a_100000188435_100000212282 [0,1,0,0,1,0|2,0,0]=4 6280 B11R1.29 CCCCC(=O)C1CCCC1 1458a_100000210183_100000179811 [0,1,0,0,1,0|1,0,0]=3 6281 B11R1.29 CCCCC(=O)C1CCCC1 1458a_100000210718_100000210211 [0,1,0,0,1,0|1,0,0]=3 6282 B11R1.29 CCCCC(=O)C1CCCS1 1458a_100012002731_100000210211 [0,1,0,0,1,0|2,0,0]=4 6283 B11R1.29 CCCCC(=O)C1CCOC1 1458a_100000210183_100000690089 [0,1,0,0,1,0|2,0,0]=4 6284 B11R1.29 CCCCC(=O)C1CCOC1 1458a_100011219752_100000210211 [0,1,0,0,1,0|2,0,0]=4 6285 B11R1.29 CCCCC(=O)N1CCCC1 240690a_100000188435_100000210183 [0,1,0,0,1,0|2,0,0]=4 6286 B11R1.29 CCCCC(=O)N1CCCC1 527a_100000188435_100000210183 [0,1,0,0,1,0|2,0,0]=4 6287 B11R1.29 CCCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210211 [0,1,0,0,1,0|2,0,0]=4 6288 B11R1.29 CCCNC(=O)C1CCCC1 11a_100020643023_100000210718 [0,1,0,0,1,0|1,0,0]=3 6289 B11R1.29 CCCNC(=O)C1CCCC1 1626a_100020643023_100000210718 [0,1,0,0,1,0|1,0,0]=3 6290 B11R1.29 CCCNC(=O)C1CCCC1 240690a_100020643023_100000210718 [0,1,0,0,1,0|1,0,0]=3 6291 B11R1.29 CCCNC(=O)C1CCCC1 527a_100020643023_100000210718 [0,1,0,0,1,0|1,0,0]=3 6292 B11R1.29 CCCNC(=O)C1CCCS1 11a_100020643023_100012002731 [0,1,0,0,1,0|2,0,0]=4 6293 B11R1.29 CCCNC(=O)C1CCCS1 1626a_100020643023_100012002731 [0,1,0,0,1,0|2,0,0]=4 6294 B11R1.29 CCCNC(=O)C1CCCS1 240690a_100020643023_100012002731 [0,1,0,0,1,0|2,0,0]=4 6295 B11R1.29 CCCNC(=O)C1CCCS1 527a_100020643023_100012002731 [0,1,0,0,1,0|2,0,0]=4 6296 B11R1.29 CCCNC(=O)C1CCOC1 11a_100020643023_100011219752 [0,1,0,0,1,0|2,0,0]=4 6297 B11R1.29 CCCNC(=O)C1CCOC1 1626a_100020643023_100011219752 [0,1,0,0,1,0|2,0,0]=4 6298 B11R1.29 CCCNC(=O)C1CCOC1 240690a_100020643023_100011219752 [0,1,0,0,1,0|2,0,0]=4 6299 B11R1.29 CCCNC(=O)C1CCOC1 527a_100020643023_100011219752 [0,1,0,0,1,0|2,0,0]=4 6300 B11R1.29 CCCNC(=O)N1CCCC1 2708a_100020643023_100000188435 [0,1,0,0,1,0|2,0,0]=4 6301 B11R1.29 CCCNC(=O)N1CCCC1 273464a_100020643023_100000188435 [0,1,0,0,1,0|2,0,0]=4 6302 B11R1.29 CCCNC(=O)[C@@H]1CCCO1 11a_100020643023_100000686382 [0,1,0,0,1,0|2,0,0]=4 6303 B11R1.29 CCCNC(=O)[C@@H]1CCCO1 1626a_100020643023_100000686382 [0,1,0,0,1,0|2,0,0]=4 6304 B11R1.29 CCCNC(=O)[C@@H]1CCCO1 240690a_100020643023_100000686382 [0,1,0,0,1,0|2,0,0]=4 6305 B11R1.29 CCCNC(=O)[C@@H]1CCCO1 527a_100020643023_100000686382 [0,1,0,0,1,0|2,0,0]=4 6306 B11R1.29 CCCOC(C)C1CCCC1 34a_100011216366_100000210303 [0,1,0,0,1,0|1,0,1]=4 6307 B11R1.29 CCCOC(C)C1CCCC1 7a_100011216366_100000210303 [0,1,0,0,1,0|1,0,1]=4 6308 B11R1.29 CCNCC(=O)N1CCCC1 2230a_100000751844_100000210202 [0,1,0,0,1,0|2,0,0]=4 6309 B11R1.29 CCNCC(=O)N1CCCC1 2230a_100015525214_100000183516 [0,1,0,0,1,0|2,0,0]=4 6310 B11R1.29 CCNN=C(C)C1CCCC1 4a_100000756455_100000749594 [0,1,0,0,1,0|2,0,0]=4 6311 B11R1.29 CCNNC(=O)C1CCCC1 22a_100000756455_100000210718 [0,1,0,0,1,0|1,0,0]=3 6312 B11R1.29 CCNNC(=O)C1CCCS1 22a_100000756455_100012002731 [0,1,0,0,1,0|2,0,0]=4 6313 B11R1.29 CCNNC(=O)C1CCOC1 22a_100000756455_100011219752 [0,1,0,0,1,0|2,0,0]=4 6314 B11R1.29 CCNNC(=O)[C@@H]1CCCO1 22a_100000756455_100000686382 [0,1,0,0,1,0|2,0,0]=4 6315 B11R1.29 CCOCC(=O)C1CCCC1 1458a_100000211967_100000179811 [0,1,0,0,1,0|0,0,0]=2 6316 B11R1.29 CCOCC(=O)C1CCOC1 1458a_100000211967_100000690089 [0,1,0,0,1,0|1,0,0]=3 6317 B11R1.29 CCOCC(=O)N1CCCC1 240690a_100000188435_100000211967 [0,1,0,0,1,0|1,0,0]=3 6318 B11R1.29 CCOCC(=O)N1CCCC1 34a_100121572206_100000183516 [0,1,0,0,1,0|1,0,0]=3 6319 B11R1.29 CCOCC(=O)N1CCCC1 527a_100000188435_100000211967 [0,1,0,0,1,0|1,0,0]=3 6320 B11R1.29 CCOCC(=O)N1CCCC1 7a_200000752455_100000210202 [0,1,0,0,1,0|1,0,0]=3 6321 B11R1.29 CCOCC(=O)N1CCSC1 11a_100011215254_100000211967 [0,1,0,0,1,0|2,0,0]=4 6322 B11R1.29 CCOCC(=O)N1CCSC1 240690a_100011215254_100000211967 [0,1,0,0,1,0|2,0,0]=4 6323 B11R1.29 CCOCC(=O)N1CCSC1 527a_100011215254_100000211967 [0,1,0,0,1,0|2,0,0]=4 6324 B11R1.29 CCOCN(C)C1CCCC1 269982a_100000207505_100000739092 [0,1,0,0,1,0|2,0,0]=4 6325 B11R1.29 CCSCC(=O)C1CCCC1 1458a_100000230394_100000179811 [0,1,0,0,1,0|0,1,0]=3 6326 B11R1.29 CCSCC(=O)C1CCOC1 1458a_100000230394_100000690089 [0,1,0,0,1,0|1,1,0]=4 6327 B11R1.29 CCSCC(=O)N1CCCC1 240690a_100000188435_100000230394 [0,1,0,0,1,0|1,1,0]=4 6328 B11R1.29 CCSCC(=O)N1CCCC1 527a_100000188435_100000230394 [0,1,0,0,1,0|1,1,0]=4 6329 B11R1.29 CCSCC(=O)N1CCCC1 62a_100000183516_100000210202 [0,1,0,0,1,0|1,1,0]=4 6330 B11R1.29 CCSCC(=O)N1CCCC1 62a_100000210202_100000183516 [0,1,0,0,1,0|1,1,0]=4 6331 B11R1.29 CNCCC(=O)N1CCCC1 2230a_106832991635_100011194422 [0,1,0,0,1,0|2,0,0]=4 6332 B11R1.29 CNCCC(=O)N1CCCC1 34a_100102657272_100011194422 [0,1,0,0,1,0|2,0,0]=4 6333 B11R1.29 CNCCC(=O)N1CCCC1 7a_106832991635_100011194422 [0,1,0,0,1,0|2,0,0]=4 6334 B11R1.29 COC=CC(=O)C1CCCC1 1458a_100016268678_100000179811 [0,1,0,0,1,0|1,0,1]=4 6335 B11R1.29 COCCC(=O)C1CCCC1 1458a_100000210718_100000233755 [0,1,0,0,1,0|1,0,0]=3 6336 B11R1.29 COCCC(=O)C1CCCC1 1458a_100000749529_100000179811 [0,1,0,0,1,0|1,0,0]=3 6337 B11R1.29 COCCC(=O)C1CCCS1 1458a_100012002731_100000233755 [0,1,0,0,1,0|2,0,0]=4 6338 B11R1.29 COCCC(=O)C1CCOC1 1458a_100000749529_100000690089 [0,1,0,0,1,0|2,0,0]=4 6339 B11R1.29 COCCC(=O)C1CCOC1 1458a_100011219752_100000233755 [0,1,0,0,1,0|2,0,0]=4 6340 B11R1.29 COCCC(=O)N1CCCC1 240690a_100000188435_100000749529 [0,1,0,0,1,0|2,0,0]=4 6341 B11R1.29 COCCC(=O)N1CCCC1 34a_100138415774_100011194422 [0,1,0,0,1,0|2,0,0]=4 6342 B11R1.29 COCCC(=O)N1CCCC1 527a_100000188435_100000749529 [0,1,0,0,1,0|2,0,0]=4 6343 B11R1.29 COCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000233755 [0,1,0,0,1,0|2,0,0]=4 6344 B11R1.29 CSCCC(=O)C1CCCC1 1458a_100000174002_100000179811 [0,1,0,0,1,0|1,0,0]=3 6345 B11R1.29 CSCCC(=O)C1CCCC1 1458a_100000210718_100000751147 [0,1,0,0,1,0|1,0,0]=3 6346 B11R1.29 CSCCC(=O)C1CCCS1 1458a_100012002731_100000751147 [0,1,0,0,1,0|2,0,0]=4 6347 B11R1.29 CSCCC(=O)C1CCOC1 1458a_100000174002_100000690089 [0,1,0,0,1,0|2,0,0]=4 6348 B11R1.29 CSCCC(=O)C1CCOC1 1458a_100011219752_100000751147 [0,1,0,0,1,0|2,0,0]=4 6349 B11R1.29 CSCCC(=O)N1CCCC1 240690a_100000188435_100000174002 [0,1,0,0,1,0|2,0,0]=4 6350 B11R1.29 CSCCC(=O)N1CCCC1 527a_100000188435_100000174002 [0,1,0,0,1,0|2,0,0]=4 6351 B11R1.29 CSCCC(=O)N1CCCC1 62a_100011194422_200000210301 [0,1,0,0,1,0|2,0,0]=4 6352 B11R1.29 CSCCC(=O)N1CCCC1 62a_200000210301_100011194422 [0,1,0,0,1,0|2,0,0]=4 6353 B11R1.29 CSCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000751147 [0,1,0,0,1,0|2,0,0]=4 6354 B11R1.29 CSCOC(C)C1CCCC1 34a_100011216366_100011218213 [0,1,0,0,1,0|1,0,1]=4 6355 B11R1.29 N#CCCC(=O)C1CCCC1 1458a_100000210718_100011215226 [0,1,0,0,1,0|1,0,1]=4 6356 B11R1.29 N#CCCC(=O)C1CCCC1 1458a_100011934036_100000179811 [0,1,0,0,1,0|1,0,1]=4 6357 B11R1.29 N#CCNC(=O)C1CCCC1 1626a_100000734998_100000210718 [0,1,0,0,1,0|1,0,1]=4 6358 B11R1.29 N#CCNC(=O)C1CCCC1 527a_100000734998_100000210718 [0,1,0,0,1,0|1,0,1]=4 6359 B11R1.29 O=C(C#CCO)C1CCCC1 1458a_100000049017_100000179811 [0,1,0,0,1,0|1,0,1]=4 6360 B11R1.29 O=C(CCCF)C1CCCC1 1458a_100000210718_100011934791 [0,1,0,0,1,0|1,0,0]=3 6361 B11R1.29 O=C(CCCF)C1CCCS1 1458a_100012002731_100011934791 [0,1,0,0,1,0|2,0,0]=4 6362 B11R1.29 O=C(CCCF)C1CCOC1 1458a_100011219752_100011934791 [0,1,0,0,1,0|2,0,0]=4 6363 B11R1.29 O=C(CCCF)[C@@H]1CCCO1 1458a_100000686382_100011934791 [0,1,0,0,1,0|2,0,0]=4 6364 B11R1.29 O=C(CCCO)C1CCCC1 1458a_100000210718_100011215043 [0,1,0,0,1,0|1,0,0]=3 6365 B11R1.29 O=C(CCCO)C1CCCS1 1458a_100012002731_100011215043 [0,1,0,0,1,0|2,0,0]=4 6366 B11R1.29 O=C(CCCO)C1CCOC1 1458a_100011219752_100011215043 [0,1,0,0,1,0|2,0,0]=4 6367 B11R1.29 O=C(CCCO)[C@@H]1CCCO1 1458a_100000686382_100011215043 [0,1,0,0,1,0|2,0,0]=4 6368 B11R1.29 O=C(COCF)N1CCCC1 7a_200000752455_100015361967 [0,1,0,0,1,0|2,0,0]=4 6369 B11R1.29 O=C(NCCF)C1CCCC1 11a_100000724931_100000210718 [0,1,0,0,1,0|1,0,0]=3 6370 B11R1.29 O=C(NCCF)C1CCCC1 1626a_100000724931_100000210718 [0,1,0,0,1,0|1,0,0]=3 6371 B11R1.29 O=C(NCCF)C1CCCC1 240690a_100000724931_100000210718 [0,1,0,0,1,0|1,0,0]=3 6372 B11R1.29 O=C(NCCF)C1CCCC1 527a_100000724931_100000210718 [0,1,0,0,1,0|1,0,0]=3 6373 B11R1.29 O=C(NCCF)C1CCCS1 11a_100000724931_100012002731 [0,1,0,0,1,0|2,0,0]=4 6374 B11R1.29 O=C(NCCF)C1CCCS1 1626a_100000724931_100012002731 [0,1,0,0,1,0|2,0,0]=4 6375 B11R1.29 O=C(NCCF)C1CCCS1 240690a_100000724931_100012002731 [0,1,0,0,1,0|2,0,0]=4 6376 B11R1.29 O=C(NCCF)C1CCCS1 527a_100000724931_100012002731 [0,1,0,0,1,0|2,0,0]=4 6377 B11R1.29 O=C(NCCF)C1CCOC1 11a_100000724931_100011219752 [0,1,0,0,1,0|2,0,0]=4 6378 B11R1.29 O=C(NCCF)C1CCOC1 1626a_100000724931_100011219752 [0,1,0,0,1,0|2,0,0]=4 6379 B11R1.29 O=C(NCCF)C1CCOC1 240690a_100000724931_100011219752 [0,1,0,0,1,0|2,0,0]=4 6380 B11R1.29 O=C(NCCF)C1CCOC1 527a_100000724931_100011219752 [0,1,0,0,1,0|2,0,0]=4 6381 B11R1.29 O=C(NCCF)N1CCCC1 273464a_100000724931_100000188435 [0,1,0,0,1,0|2,0,0]=4 6382 B11R1.29 O=C(NCCF)[C@@H]1CCCO1 11a_100000724931_100000686382 [0,1,0,0,1,0|2,0,0]=4 6383 B11R1.29 O=C(NCCF)[C@@H]1CCCO1 1626a_100000724931_100000686382 [0,1,0,0,1,0|2,0,0]=4 6384 B11R1.29 O=C(NCCF)[C@@H]1CCCO1 240690a_100000724931_100000686382 [0,1,0,0,1,0|2,0,0]=4 6385 B11R1.29 O=C(NCCF)[C@@H]1CCCO1 527a_100000724931_100000686382 [0,1,0,0,1,0|2,0,0]=4 6386 B11R1.29 O=C(NCCO)C1CCCC1 240690a_100000210304_100000210718 [0,1,0,0,1,0|1,0,0]=3 6387 B11R1.29 O=C(NCCO)C1CCCC1 527a_100000210304_100000210718 [0,1,0,0,1,0|1,0,0]=3 6388 B11R1.29 O=C(NCCO)C1CCCS1 240690a_100000210304_100012002731 [0,1,0,0,1,0|2,0,0]=4 6389 B11R1.29 O=C(NCCO)C1CCCS1 527a_100000210304_100012002731 [0,1,0,0,1,0|2,0,0]=4 6390 B11R1.29 O=C(NCCO)C1CCOC1 240690a_100000210304_100011219752 [0,1,0,0,1,0|2,0,0]=4 6391 B11R1.29 O=C(NCCO)C1CCOC1 527a_100000210304_100011219752 [0,1,0,0,1,0|2,0,0]=4 6392 B11R1.29 O=C(NCCO)N1CCCC1 273464a_100000210304_100000188435 [0,1,0,0,1,0|2,0,0]=4 6393 B11R1.29 O=C(NCCO)[C@@H]1CCCO1 240690a_100000210304_100000686382 [0,1,0,0,1,0|2,0,0]=4 6394 B11R1.29 O=C(NCCO)[C@@H]1CCCO1 527a_100000210304_100000686382 [0,1,0,0,1,0|2,0,0]=4 6395 B11R1.29 [13CH3]SCCC(=O)N1CCCC1 62a_100011194422_200025704644 [0,1,0,0,1,0|2,0,0]=4 6396 B11R1.29 [13CH3]SCCC(=O)N1CCCC1 62a_200025704644_100011194422 [0,1,0,0,1,0|2,0,0]=4 6397 B11R1.31 C/C=C(\C)/C(=O)C1CCCC1 1458a_100020587367_100000179811 [0,1,0,0,1,0|1,0,1]=4 6398 B11R1.31 CCC(C)C(=O)C1CCCC1 1458a_100000210718_100000758301 [0,1,0,0,1,0|1,0,0]=3 6399 B11R1.31 CCC(C)C(=O)C1CCCC1 1458a_100011192722_100000179811 [0,1,0,0,1,0|1,0,0]=3 6400 B11R1.31 CCC(C)C(=O)C1CCCS1 1458a_100012002731_100000758301 [0,1,0,0,1,0|2,0,0]=4 6401 B11R1.31 CCC(C)C(=O)C1CCOC1 1458a_100011192722_100000690089 [0,1,0,0,1,0|2,0,0]=4 6402 B11R1.31 CCC(C)C(=O)C1CCOC1 1458a_100011219752_100000758301 [0,1,0,0,1,0|2,0,0]=4 6403 B11R1.31 CCC(C)C(=O)N1CCCC1 240690a_100000188435_100011192722 [0,1,0,0,1,0|2,0,0]=4 6404 B11R1.31 CCC(C)C(=O)N1CCCC1 527a_100000188435_100011192722 [0,1,0,0,1,0|2,0,0]=4 6405 B11R1.31 CCC(C)C(=O)[C@@H]1CCCO1 1458a_100000686382_100000758301 [0,1,0,0,1,0|2,0,0]=4 6406 B11R1.31 CCC(O)C(=O)C1CCCC1 1458a_100011196387_100000179811 [0,1,0,0,1,0|1,0,0]=3 6407 B11R1.31 CCC(O)C(=O)C1CCOC1 1458a_100011196387_100000690089 [0,1,0,0,1,0|2,0,0]=4 6408 B11R1.31 CCC(O)C(=O)N1CCCC1 240690a_100000188435_100011196387 [0,1,0,0,1,0|2,0,0]=4 6409 B11R1.31 CCN(C)C(=O)C1CCCC1 11a_100000225621_100000210718 [0,1,0,0,1,0|1,0,0]=3 6410 B11R1.31 CCN(C)C(=O)C1CCCC1 1626a_100000225621_100000210718 [0,1,0,0,1,0|1,0,0]=3 6411 B11R1.31 CCN(C)C(=O)C1CCCC1 240690a_100000225621_100000210718 [0,1,0,0,1,0|1,0,0]=3 6412 B11R1.31 CCN(C)C(=O)C1CCCC1 527a_100000225621_100000210718 [0,1,0,0,1,0|1,0,0]=3 6413 B11R1.31 CCN(C)C(=O)C1CCCS1 11a_100000225621_100012002731 [0,1,0,0,1,0|2,0,0]=4 6414 B11R1.31 CCN(C)C(=O)C1CCCS1 1626a_100000225621_100012002731 [0,1,0,0,1,0|2,0,0]=4 6415 B11R1.31 CCN(C)C(=O)C1CCCS1 240690a_100000225621_100012002731 [0,1,0,0,1,0|2,0,0]=4 6416 B11R1.31 CCN(C)C(=O)C1CCCS1 527a_100000225621_100012002731 [0,1,0,0,1,0|2,0,0]=4 6417 B11R1.31 CCN(C)C(=O)C1CCOC1 11a_100000225621_100011219752 [0,1,0,0,1,0|2,0,0]=4 6418 B11R1.31 CCN(C)C(=O)C1CCOC1 1626a_100000225621_100011219752 [0,1,0,0,1,0|2,0,0]=4 6419 B11R1.31 CCN(C)C(=O)C1CCOC1 240690a_100000225621_100011219752 [0,1,0,0,1,0|2,0,0]=4 6420 B11R1.31 CCN(C)C(=O)C1CCOC1 527a_100000225621_100011219752 [0,1,0,0,1,0|2,0,0]=4 6421 B11R1.31 CCN(C)C(=O)[C@@H]1CCCO1 11a_100000225621_100000686382 [0,1,0,0,1,0|2,0,0]=4 6422 B11R1.31 CCN(C)C(=O)[C@@H]1CCCO1 1626a_100000225621_100000686382 [0,1,0,0,1,0|2,0,0]=4 6423 B11R1.31 CCN(C)C(=O)[C@@H]1CCCO1 240690a_100000225621_100000686382 [0,1,0,0,1,0|2,0,0]=4 6424 B11R1.31 CCN(C)C(=O)[C@@H]1CCCO1 527a_100000225621_100000686382 [0,1,0,0,1,0|2,0,0]=4 6425 B11R1.31 CNC(=O)C(=O)C1CCCC1 1458a_100011218921_100000179811 [0,1,0,0,1,0|2,0,0]=4 6426 B11R1.31 COC(C)C(=O)C1CCCC1 1458a_100000743197_100000179811 [0,1,0,0,1,0|2,0,0]=4 6427 B11R1.31 CSC(C)C(=O)C1CCCC1 1458a_100000149566_100000179811 [0,1,0,0,1,0|2,0,0]=4 6428 B11R1.31 O=C(C(O)CO)C1CCCC1 1458a_100011215603_100000179811 [0,1,0,0,1,0|2,0,0]=4 6429 B11R1.33 CCNS(=O)(=O)C1CCCC1 270084a_100015525214_100000748936 [0,1,0,0,1,0|2,0,0]=4 6430 B11R1.33 CCNS(=O)(=O)C1CCCC1 274078a_100015525214_100000748936 [0,1,0,0,1,0|2,0,0]=4 6431 B11R1.33 CCOC(C)(C)C1CCCC1 34a_100000745555_100000210202 [0,1,0,0,1,0|1,0,1]=4 6432 B11R1.33 CCOC(C)(C)C1CCCC1 7a_100000745555_100000210202 [0,1,0,0,1,0|1,0,1]=4 6433 B11R1.77 C=C(C)CC(=O)C1CCCC1 1458a_100000210718_100000748629 [0,1,0,0,1,0|1,0,1]=4 6434 B11R1.77 CC(=CC(=O)C1CCCC1)C 1458a_100000211388_100000179811 [0,1,0,0,1,0|1,0,1]=4 6435 B11R1.77 CC(=CC(=O)C1CCCC1)Cl 1458a_200042562850_100000179811 [0,1,0,0,1,0|1,0,1]=4 6436 B11R1.77 CC(=CC(=O)C1CCCC1)I 1458a_100025716642_100000179811 [0,1,0,0,1,0|1,0,1]=4 6437 B11R1.77 CC(C)CC(=O)C1CCCC1 1458a_100000210554_100000179811 [0,1,0,0,1,0|1,0,0]=3 6438 B11R1.77 CC(C)CC(=O)C1CCCC1 1458a_100000210718_100000210624 [0,1,0,0,1,0|1,0,0]=3 6439 B11R1.77 CC(C)CC(=O)C1CCCS1 1458a_100012002731_100000210624 [0,1,0,0,1,0|2,0,0]=4 6440 B11R1.77 CC(C)CC(=O)C1CCOC1 1458a_100000210554_100000690089 [0,1,0,0,1,0|2,0,0]=4 6441 B11R1.77 CC(C)CC(=O)C1CCOC1 1458a_100011219752_100000210624 [0,1,0,0,1,0|2,0,0]=4 6442 B11R1.77 CC(C)CC(=O)N1CCCC1 240690a_100000188435_100000210554 [0,1,0,0,1,0|2,0,0]=4 6443 B11R1.77 CC(C)CC(=O)N1CCCC1 527a_100000188435_100000210554 [0,1,0,0,1,0|2,0,0]=4 6444 B11R1.77 CC(C)CC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210624 [0,1,0,0,1,0|2,0,0]=4 6445 B11R1.77 CC(C)NC(=O)C1CCCC1 11a_100138425928_100000210718 [0,1,0,0,1,0|1,0,0]=3 6446 B11R1.77 CC(C)NC(=O)C1CCCC1 1626a_100138425928_100000210718 [0,1,0,0,1,0|1,0,0]=3 6447 B11R1.77 CC(C)NC(=O)C1CCCC1 240690a_100138425928_100000210718 [0,1,0,0,1,0|1,0,0]=3 6448 B11R1.77 CC(C)NC(=O)C1CCCC1 527a_100138425928_100000210718 [0,1,0,0,1,0|1,0,0]=3 6449 B11R1.77 CC(C)NC(=O)C1CCCS1 11a_100138425928_100012002731 [0,1,0,0,1,0|2,0,0]=4 6450 B11R1.77 CC(C)NC(=O)C1CCCS1 1626a_100138425928_100012002731 [0,1,0,0,1,0|2,0,0]=4 6451 B11R1.77 CC(C)NC(=O)C1CCCS1 240690a_100138425928_100012002731 [0,1,0,0,1,0|2,0,0]=4 6452 B11R1.77 CC(C)NC(=O)C1CCCS1 527a_100138425928_100012002731 [0,1,0,0,1,0|2,0,0]=4 6453 B11R1.77 CC(C)NC(=O)C1CCOC1 11a_100138425928_100011219752 [0,1,0,0,1,0|2,0,0]=4 6454 B11R1.77 CC(C)NC(=O)C1CCOC1 1626a_100138425928_100011219752 [0,1,0,0,1,0|2,0,0]=4 6455 B11R1.77 CC(C)NC(=O)C1CCOC1 240690a_100138425928_100011219752 [0,1,0,0,1,0|2,0,0]=4 6456 B11R1.77 CC(C)NC(=O)C1CCOC1 527a_100138425928_100011219752 [0,1,0,0,1,0|2,0,0]=4 6457 B11R1.77 CC(C)NC(=O)N1CCCC1 2708a_100138425928_100000188435 [0,1,0,0,1,0|2,0,0]=4 6458 B11R1.77 CC(C)NC(=O)N1CCCC1 273464a_100138425928_100000188435 [0,1,0,0,1,0|2,0,0]=4 6459 B11R1.77 CC(C)NC(=O)[C@@H]1CCCO1 11a_100138425928_100000686382 [0,1,0,0,1,0|2,0,0]=4 6460 B11R1.77 CC(C)NC(=O)[C@@H]1CCCO1 1626a_100138425928_100000686382 [0,1,0,0,1,0|2,0,0]=4 6461 B11R1.77 CC(C)NC(=O)[C@@H]1CCCO1 240690a_100138425928_100000686382 [0,1,0,0,1,0|2,0,0]=4 6462 B11R1.77 CC(C)NC(=O)[C@@H]1CCCO1 527a_100138425928_100000686382 [0,1,0,0,1,0|2,0,0]=4 6463 B11R1.77 CC(C)OC(C)C1CCCC1 34a_100011216366_100000210206 [0,1,0,0,1,0|1,0,1]=4 6464 B11R1.77 CC(C)OC(C)C1CCCC1 7a_100011216366_100000210206 [0,1,0,0,1,0|1,0,1]=4 6465 B11R1.77 CC(O)CC(=O)C1CCCC1 1458a_100000210718_100011218427 [0,1,0,0,1,0|1,0,0]=3 6466 B11R1.77 CC(O)CC(=O)C1CCCS1 1458a_100012002731_100011218427 [0,1,0,0,1,0|2,0,0]=4 6467 B11R1.77 CC(O)CC(=O)C1CCOC1 1458a_100011219752_100011218427 [0,1,0,0,1,0|2,0,0]=4 6468 B11R1.77 CC(O)CC(=O)[C@@H]1CCCO1 1458a_100000686382_100011218427 [0,1,0,0,1,0|2,0,0]=4 6469 B11R1.77 CN(C)CC(=O)C1CCCC1 1458a_100000750896_100000179811 [0,1,0,0,1,0|2,0,0]=4 6470 B11R1.77 C[C@@H](O)CC(=O)C1CCCC1 1458a_100011933948_100000179811 [0,1,0,0,1,0|1,0,0]=3 6471 B11R1.77 C[C@@H](O)CC(=O)C1CCOC1 1458a_100011933948_100000690089 [0,1,0,0,1,0|2,0,0]=4 6472 B11R1.77 C[C@@H](O)CC(=O)N1CCCC1 240690a_100000188435_100011933948 [0,1,0,0,1,0|2,0,0]=4 6473 B11R1.77 C[S+](C)CC(=O)C1CCCC1 1458a_200159257847_100000179811 [0,1,0,0,1,0|2,0,0]=4 6474 B11R1.77 O=C(CC(F)F)C1CCCC1 1458a_100000210718_100011934356 [0,1,0,0,1,0|2,0,0]=4 6475 B11R1.199 CC1CCCC1C(=O)CCF 1458a_100000690547_100011217306 [0,1,0,0,1,0|2,0,0]=4 6476 B11R1.199 CC1CCCC1C(=O)CCO 1458a_100000690547_100000211926 [0,1,0,0,1,0|2,0,0]=4 6477 B11R1.199 CCCC(=O)C1CCCC1=O 1458a_100000211992_100000211823 [0,1,0,0,1,0|1,0,1]=4 6478 B11R1.199 CCCC(=O)C1CCCC1C 1458a_100000690547_100000210303 [0,1,0,0,1,0|1,0,0]=3 6479 B11R1.199 CCCC(=O)N1CCC[C@@H]1C 240690a_100020605311_100000211992 [0,1,0,0,1,0|2,0,0]=4 6480 B11R1.199 CCCC(=O)N1CCC[C@@H]1C 527a_100020605311_100000211992 [0,1,0,0,1,0|2,0,0]=4 6481 B11R1.199 CCCC(=O)N1CCC[C@H]1C 11a_100015189458_100000211992 [0,1,0,0,1,0|2,0,0]=4 6482 B11R1.199 CCCC(=O)N1CCC[C@H]1C 240690a_100015189458_100000211992 [0,1,0,0,1,0|2,0,0]=4 6483 B11R1.199 CCCC(=O)N1CCC[C@H]1C 527a_100015189458_100000211992 [0,1,0,0,1,0|2,0,0]=4 6484 B11R1.199 CCCC(=O)[C@@H]1CCCN1C 1458a_100009816429_100000210303 [0,1,0,0,1,0|2,0,0]=4 6485 B11R1.199 CCNC(=O)C1CCCC1C 11a_100015525214_100000690547 [0,1,0,0,1,0|1,0,0]=3 6486 B11R1.199 CCNC(=O)C1CCCC1C 240690a_100015525214_100000690547 [0,1,0,0,1,0|1,0,0]=3 6487 B11R1.199 CCNC(=O)C1CCCC1C 527a_100015525214_100000690547 [0,1,0,0,1,0|1,0,0]=3 6488 B11R1.199 CCNC(=O)N1CCC[C@@H]1C 2708a_100015525214_100020605311 [0,1,0,0,1,0|2,0,0]=4 6489 B11R1.199 CCNC(=O)N1CCC[C@@H]1C 273464a_100015525214_100020605311 [0,1,0,0,1,0|2,0,0]=4 6490 B11R1.199 CCNC(=O)N1CCC[C@H]1C 2708a_100015525214_100015189458 [0,1,0,0,1,0|2,0,0]=4 6491 B11R1.199 CCNC(=O)N1CCC[C@H]1C 273464a_100015525214_100015189458 [0,1,0,0,1,0|2,0,0]=4 6492 B11R1.199 CCNC(=O)[C@@H]1CCCN1C 11a_100015525214_100009816429 [0,1,0,0,1,0|2,0,0]=4 6493 B11R1.199 CCNC(=O)[C@@H]1CCCN1C 2230a_100020641767_200000210301 [0,1,0,0,1,0|2,0,0]=4 6494 B11R1.199 CCNC(=O)[C@@H]1CCCN1C 240690a_100015525214_100009816429 [0,1,0,0,1,0|2,0,0]=4 6495 B11R1.199 CCNC(=O)[C@@H]1CCCN1C 269982a_100020641767_200000210301 [0,1,0,0,1,0|2,0,0]=4 6496 B11R1.199 CCNC(=O)[C@@H]1CCCN1C 34a_100020641767_200000210301 [0,1,0,0,1,0|2,0,0]=4 6497 B11R1.199 CCNC(=O)[C@@H]1CCCN1C 527a_100015525214_100009816429 [0,1,0,0,1,0|2,0,0]=4 6498 B11R1.199 CCNC(=O)[C@@H]1CCCN1[13CH3] 2230a_100020641767_200025704644 [0,1,0,0,1,0|2,0,0]=4 6499 B11R1.199 CCNC(=O)[C@@H]1CCCN1[13CH3] 269982a_100020641767_200025704644 [0,1,0,0,1,0|2,0,0]=4 6500 B11R1.199 CCNC(=O)[C@@H]1CCCN1[13CH3] 34a_100020641767_200025704644 [0,1,0,0,1,0|2,0,0]=4 6501 B11R1.199 CCOC(=O)[C@@H]1CCCN1C 2230a_100000703725_200000210301 [0,1,0,0,1,0|1,0,0]=3 6502 B11R1.199 CCOC(=O)[C@@H]1CCCN1C 269982a_100000703725_200000210301 [0,1,0,0,1,0|1,0,0]=3 6503 B11R1.199 CCOC(=O)[C@@H]1CCCN1[13CH3] 2230a_100000703725_200025704644 [0,1,0,0,1,0|1,0,0]=3 6504 B11R1.199 CCOC(=O)[C@@H]1CCCN1[13CH3] 269982a_100000703725_200025704644 [0,1,0,0,1,0|1,0,0]=3 6505 B11R1.199 CCOC(=O)[C@@H]1CSCN1C 269982a_100016989239_200000210301 [0,1,0,0,1,0|2,0,0]=4 6506 B11R1.199 CCOC(=O)[C@@H]1CSCN1[13CH3] 269982a_100016989239_200025704644 [0,1,0,0,1,0|2,0,0]=4 6507 B11R1.199 CNNC(=O)C1CCCC1C 22a_100016993582_100000690547 [0,1,0,0,1,0|2,0,0]=4 6508 B11R1.819 CC1(CCCC1)C(=O)CCF 1458a_100000239728_100011217306 [0,1,0,0,1,0|2,0,0]=4 6509 B11R1.819 CC1(CCCC1)C(=O)CCO 1458a_100000239728_100000211926 [0,1,0,0,1,0|2,0,0]=4 6510 B11R1.819 CCCC(=O)C1(CCCC1)C 1458a_100000239728_100000210303 [0,1,0,0,1,0|1,0,0]=3 6511 B11R1.819 CCCC(=O)C1(CCCC1)O 1458a_100000242637_100000210303 [0,1,0,0,1,0|1,0,0]=3 6512 B11R1.819 CCCC(=O)C1(CCCO1)C 1458a_100000684770_100000210303 [0,1,0,0,1,0|2,0,0]=4 6513 B11R1.819 CCNC(=O)C1(CCCC1)C 11a_100015525214_100000239728 [0,1,0,0,1,0|1,0,0]=3 6514 B11R1.819 CCNC(=O)C1(CCCC1)C 240690a_100015525214_100000239728 [0,1,0,0,1,0|1,0,0]=3 6515 B11R1.819 CCNC(=O)C1(CCCC1)C 527a_100015525214_100000239728 [0,1,0,0,1,0|1,0,0]=3 6516 B11R1.819 CCNC(=O)C1(CCCC1)O 240690a_100015525214_100000242637 [0,1,0,0,1,0|1,0,0]=3 6517 B11R1.819 CCNC(=O)C1(CCCC1)O 527a_100015525214_100000242637 [0,1,0,0,1,0|1,0,0]=3 6518 B11R1.819 CCNC(=O)C1(CCCO1)C 11a_100015525214_100000684770 [0,1,0,0,1,0|2,0,0]=4 6519 B11R1.819 CCNC(=O)C1(CCCO1)C 240690a_100015525214_100000684770 [0,1,0,0,1,0|2,0,0]=4 6520 B11R1.819 CCNC(=O)C1(CCCO1)C 527a_100015525214_100000684770 [0,1,0,0,1,0|2,0,0]=4 6521 B11R1.819 CNNC(=O)C1(CCCC1)C 22a_100016993582_100000239728 [0,1,0,0,1,0|2,0,0]=4 6522 B11R1.819 CNNC(=O)C1(CCCC1)O 22a_100016993582_100000242637 [0,1,0,0,1,0|2,0,0]=4 6523 B11R1.819 O=C(CCF)C1(CCCC1)O 1458a_100000242637_100011217306 [0,1,0,0,1,0|2,0,0]=4 6524 B11R1.819 O=C(CCO)C1(CCCC1)O 1458a_100000242637_100000211926 [0,1,0,0,1,0|2,0,0]=4 6525 B13R1.19 C=C1CCN(CC1)CC(=O)OCC 2230a_100000752442_100000188475 [0,1,0,0,0,1|1,0,1]=4 6526 B13R1.19 C=C1CCN(CC1)CC(=O)OCC 269982a_100000752442_100000188475 [0,1,0,0,0,1|1,0,1]=4 6527 B13R1.19 C=C1CCN(CC1)CC(=O)OCC 34a_100000752442_100000188475 [0,1,0,0,0,1|1,0,1]=4 6528 B13R1.19 CC1CCC(CC1)CC(=O)CCF 1458a_100011215564_100011217306 [0,1,0,0,0,1|2,0,0]=4 6529 B13R1.19 CC1CCC(CC1)CC(=O)CCO 1458a_100011215564_100000211926 [0,1,0,0,0,1|2,0,0]=4 6530 B13R1.19 CC1CCC(CC1)NC(=O)CS[13CH3] 62a_100000180146_200025704644 [0,1,0,0,0,1|2,0,0]=4 6531 B13R1.19 CC1CCC(CC1)NC(=O)CS[13CH3] 62a_200025704644_100000180146 [0,1,0,0,0,1|2,0,0]=4 6532 B13R1.19 CC=CC(=O)N[C@H]1CC[C@@H](CC1)C 1626a_100020625639_100000210699 [0,1,0,0,0,1|1,0,1]=4 6533 B13R1.19 CC=CC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_100000210699 [0,1,0,0,0,1|1,0,1]=4 6534 B13R1.19 CC=CC(=O)N[C@H]1CC[C@H](CC1)O 1626a_100020628982_100000210699 [0,1,0,0,0,1|1,0,1]=4 6535 B13R1.19 CC=CC(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100000210699 [0,1,0,0,0,1|1,0,1]=4 6536 B13R1.19 CCCC(=O)C=C1CCC(CC1)C 1458a_100000756110_100000210303 [0,1,0,0,0,1|1,0,1]=4 6537 B13R1.19 CCCC(=O)CC1CCC(CC1)C 1458a_100011215564_100000210303 [0,1,0,0,0,1|1,0,0]=3 6538 B13R1.19 CCCC(=O)CC1CCC(CC1)O 1458a_100012184027_100000210303 [0,1,0,0,0,1|1,0,0]=3 6539 B13R1.19 CCCC(=O)CC1CCN(CC1)C 1458a_100000700355_100000210303 [0,1,0,0,0,1|2,0,0]=4 6540 B13R1.19 CCCC(=O)CN1CCC(CC1)C 1458a_100000238061_100000210303 [0,1,0,0,0,1|2,0,0]=4 6541 B13R1.19 CCCC(=O)CN1CCC(CC1)C 2230a_100000188429_100000747444 [0,1,0,0,0,1|2,0,0]=4 6542 B13R1.19 CCCC(=O)CN1CCC(CC1)C 269982a_100000188429_100000747444 [0,1,0,0,0,1|2,0,0]=4 6543 B13R1.19 CCCC(=O)CN1CCC(CC1)F 2230a_100015193889_100000747444 [0,1,0,0,0,1|2,0,0]=4 6544 B13R1.19 CCCC(=O)CN1CCC(CC1)F 269982a_100015193889_100000747444 [0,1,0,0,0,1|2,0,0]=4 6545 B13R1.19 CCCC(=O)CN1CCC(CC1)O 2230a_100025773856_100000747444 [0,1,0,0,0,1|2,0,0]=4 6546 B13R1.19 CCCC(=O)CN1CCC(CC1)O 269982a_100025773856_100000747444 [0,1,0,0,0,1|2,0,0]=4 6547 B13R1.19 CCCC(=O)NC1CCN(CC1)C 11a_100000198570_100000211992 [0,1,0,0,0,1|2,0,0]=4 6548 B13R1.19 CCCC(=O)NC1CCN(CC1)C 240690a_100000198570_100000211992 [0,1,0,0,0,1|2,0,0]=4 6549 B13R1.19 CCCC(=O)NC1CCN(CC1)C 527a_100000198570_100000211992 [0,1,0,0,0,1|2,0,0]=4 6550 B13R1.19 CCCC(=O)N[C@H]1CC[C@@H](CC1)C 1626a_100020625639_100000211992 [0,1,0,0,0,1|1,0,0]=3 6551 B13R1.19 CCCC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_100000211992 [0,1,0,0,0,1|1,0,0]=3 6552 B13R1.19 CCCC(=O)N[C@H]1CC[C@@H](CC1)C 527a_100020625639_100000211992 [0,1,0,0,0,1|1,0,0]=3 6553 B13R1.19 CCCC(=O)N[C@H]1CC[C@H](CC1)O 1626a_100020628982_100000211992 [0,1,0,0,0,1|1,0,0]=3 6554 B13R1.19 CCCC(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100000211992 [0,1,0,0,0,1|1,0,0]=3 6555 B13R1.19 CCNC(=O)C=C1CCC(CC1)C 11a_100015525214_100000756110 [0,1,0,0,0,1|1,0,1]=4 6556 B13R1.19 CCNC(=O)C=C1CCC(CC1)C 240690a_100015525214_100000756110 [0,1,0,0,0,1|1,0,1]=4 6557 B13R1.19 CCNC(=O)CC1CCC(CC1)C 11a_100015525214_100011215564 [0,1,0,0,0,1|1,0,0]=3 6558 B13R1.19 CCNC(=O)CC1CCC(CC1)C 240690a_100015525214_100011215564 [0,1,0,0,0,1|1,0,0]=3 6559 B13R1.19 CCNC(=O)CC1CCC(CC1)C 527a_100015525214_100011215564 [0,1,0,0,0,1|1,0,0]=3 6560 B13R1.19 CCNC(=O)CC1CCC(CC1)O 240690a_100015525214_100012184027 [0,1,0,0,0,1|1,0,0]=3 6561 B13R1.19 CCNC(=O)CC1CCC(CC1)O 527a_100015525214_100012184027 [0,1,0,0,0,1|1,0,0]=3 6562 B13R1.19 CCNC(=O)CC1CCN(CC1)C 11a_100015525214_100000700355 [0,1,0,0,0,1|2,0,0]=4 6563 B13R1.19 CCNC(=O)CC1CCN(CC1)C 240690a_100015525214_100000700355 [0,1,0,0,0,1|2,0,0]=4 6564 B13R1.19 CCNC(=O)CN1CCC(CC1)C 11a_100015525214_100000238061 [0,1,0,0,0,1|2,0,0]=4 6565 B13R1.19 CCNC(=O)CN1CCC(CC1)C 2230a_100000188429_100000183381 [0,1,0,0,0,1|2,0,0]=4 6566 B13R1.19 CCNC(=O)CN1CCC(CC1)C 240690a_100015525214_100000238061 [0,1,0,0,0,1|2,0,0]=4 6567 B13R1.19 CCNC(=O)CN1CCC(CC1)C 269982a_100000188429_100000183381 [0,1,0,0,0,1|2,0,0]=4 6568 B13R1.19 CCNC(=O)CN1CCC(CC1)C 34a_100000188429_100000183381 [0,1,0,0,0,1|2,0,0]=4 6569 B13R1.19 CCNC(=O)CN1CCC(CC1)C 527a_100015525214_100000238061 [0,1,0,0,0,1|2,0,0]=4 6570 B13R1.19 CCNC(=O)CN1CCC(CC1)F 2230a_100015193889_100000183381 [0,1,0,0,0,1|2,0,0]=4 6571 B13R1.19 CCNC(=O)CN1CCC(CC1)F 269982a_100015193889_100000183381 [0,1,0,0,0,1|2,0,0]=4 6572 B13R1.19 CCNC(=O)CN1CCC(CC1)F 34a_100015193889_100000183381 [0,1,0,0,0,1|2,0,0]=4 6573 B13R1.19 CCNC(=O)CN1CCC(CC1)O 2230a_100025773856_100000183381 [0,1,0,0,0,1|2,0,0]=4 6574 B13R1.19 CCNC(=O)CN1CCC(CC1)O 269982a_100025773856_100000183381 [0,1,0,0,0,1|2,0,0]=4 6575 B13R1.19 CCNC(=O)NC1CCN(CC1)C 2708a_100000198570_100015525214 [0,1,0,0,0,1|2,0,0]=4 6576 B13R1.19 CCNC(=O)NC1CCN(CC1)C 2708a_100015525214_100000198570 [0,1,0,0,0,1|2,0,0]=4 6577 B13R1.19 CCNC(=O)NC1CCN(CC1)C 273464a_100000198570_100015525214 [0,1,0,0,0,1|2,0,0]=4 6578 B13R1.19 CCNC(=O)NC1CCN(CC1)C 273464a_100015525214_100000198570 [0,1,0,0,0,1|2,0,0]=4 6579 B13R1.19 CCNC(=O)NC1CCN(CC1)C 512a_100000198570_100015525214 [0,1,0,0,0,1|2,0,0]=4 6580 B13R1.19 CCNC(=O)NC1CCN(CC1)C 512a_100015525214_100000198570 [0,1,0,0,0,1|2,0,0]=4 6581 B13R1.19 CCNC(=O)N[C@H]1CC[C@@H](CC1)C 2708a_100015525214_100020625639 [0,1,0,0,0,1|1,0,0]=3 6582 B13R1.19 CCNC(=O)N[C@H]1CC[C@@H](CC1)C 2708a_100020625639_100015525214 [0,1,0,0,0,1|1,0,0]=3 6583 B13R1.19 CCNC(=O)N[C@H]1CC[C@@H](CC1)C 273464a_100015525214_100020625639 [0,1,0,0,0,1|1,0,0]=3 6584 B13R1.19 CCNC(=O)N[C@H]1CC[C@@H](CC1)C 273464a_100020625639_100015525214 [0,1,0,0,0,1|1,0,0]=3 6585 B13R1.19 CCNC(=O)N[C@H]1CC[C@H](CC1)O 2708a_100015525214_100020628982 [0,1,0,0,0,1|1,0,0]=3 6586 B13R1.19 CCNC(=O)N[C@H]1CC[C@H](CC1)O 2708a_100020628982_100015525214 [0,1,0,0,0,1|1,0,0]=3 6587 B13R1.19 CCNC(=O)N[C@H]1CC[C@H](CC1)O 273464a_100015525214_100020628982 [0,1,0,0,0,1|1,0,0]=3 6588 B13R1.19 CCNC(=O)N[C@H]1CC[C@H](CC1)O 273464a_100020628982_100015525214 [0,1,0,0,0,1|1,0,0]=3 6589 B13R1.19 CCNC(=O)N[C@H]1CC[C@H](CC1)O 512a_100015525214_100020628982 [0,1,0,0,0,1|1,0,0]=3 6590 B13R1.19 CCOC(=O)CC1CCN(CC1)C 2230a_100015189868_200000210301 [0,1,0,0,0,1|1,0,0]=3 6591 B13R1.19 CCOC(=O)CC1CCN(CC1)C 269982a_100015189868_200000210301 [0,1,0,0,0,1|1,0,0]=3 6592 B13R1.19 CCOC(=O)CC1CCN(CC1)[13CH3] 2230a_100015189868_200025704644 [0,1,0,0,0,1|1,0,0]=3 6593 B13R1.19 CCOC(=O)CC1CCN(CC1)[13CH3] 269982a_100015189868_200025704644 [0,1,0,0,0,1|1,0,0]=3 6594 B13R1.19 CCOC(=O)CN1CCC(CC1)C 2230a_100000188429_100000188475 [0,1,0,0,0,1|1,0,0]=3 6595 B13R1.19 CCOC(=O)CN1CCC(CC1)C 269982a_100000188429_100000188475 [0,1,0,0,0,1|1,0,0]=3 6596 B13R1.19 CCOC(=O)CN1CCC(CC1)C 34a_100000188429_100000188475 [0,1,0,0,0,1|1,0,0]=3 6597 B13R1.19 CCOC(=O)CN1CCC(CC1)F 2230a_100015193889_100000188475 [0,1,0,0,0,1|1,0,0]=3 6598 B13R1.19 CCOC(=O)CN1CCC(CC1)F 269982a_100015193889_100000188475 [0,1,0,0,0,1|1,0,0]=3 6599 B13R1.19 CCOC(=O)CN1CCC(CC1)F 34a_100015193889_100000188475 [0,1,0,0,0,1|1,0,0]=3 6600 B13R1.19 CCOC(=O)CN1CCC(CC1)O 2230a_100025773856_100000188475 [0,1,0,0,0,1|1,0,0]=3 6601 B13R1.19 CCOC(=O)CN1CCC(CC1)O 269982a_100025773856_100000188475 [0,1,0,0,0,1|1,0,0]=3 6602 B13R1.19 CCOC(=O)CN1CCN(CC1)C 2230a_100000188432_100000188475 [0,1,0,0,0,1|2,0,0]=4 6603 B13R1.19 CCOC(=O)CN1CCN(CC1)C 2230a_100000234358_200000210301 [0,1,0,0,0,1|2,0,0]=4 6604 B13R1.19 CCOC(=O)CN1CCN(CC1)C 269982a_100000188432_100000188475 [0,1,0,0,0,1|2,0,0]=4 6605 B13R1.19 CCOC(=O)CN1CCN(CC1)C 269982a_100000234358_200000210301 [0,1,0,0,0,1|2,0,0]=4 6606 B13R1.19 CCOC(=O)CN1CCN(CC1)[13CH3] 2230a_100000234358_200025704644 [0,1,0,0,0,1|2,0,0]=4 6607 B13R1.19 CCOC(=O)CN1CCN(CC1)[13CH3] 269982a_100000234358_200025704644 [0,1,0,0,0,1|2,0,0]=4 6608 B13R1.19 CCOC(=O)CN1CCS(=O)CC1 2230a_100000752083_100000188475 [0,1,0,0,0,1|2,0,0]=4 6609 B13R1.19 CCOC(=O)CN1CCS(=O)CC1 269982a_100000752083_100000188475 [0,1,0,0,0,1|2,0,0]=4 6610 B13R1.19 CCOC(=O)NC1CCN(CC1)C 2230a_100011206634_200000210301 [0,1,0,0,0,1|1,0,0]=3 6611 B13R1.19 CCOC(=O)NC1CCN(CC1)C 269982a_100011206634_200000210301 [0,1,0,0,0,1|1,0,0]=3 6612 B13R1.19 CCOC(=O)NC1CCN(CC1)[13CH3] 2230a_100011206634_200025704644 [0,1,0,0,0,1|1,0,0]=3 6613 B13R1.19 CCOC(=O)NC1CCN(CC1)[13CH3] 269982a_100011206634_200025704644 [0,1,0,0,0,1|1,0,0]=3 6614 B13R1.19 CNCC(=O)NC1CCC(CC1)C 2230a_106832991635_100000180146 [0,1,0,0,0,1|2,0,0]=4 6615 B13R1.19 CNCC(=O)NC1CCC(CC1)C 34a_100102657272_100000180146 [0,1,0,0,0,1|2,0,0]=4 6616 B13R1.19 CNCC(=O)NC1CCC(CC1)C 7a_106832991635_100000180146 [0,1,0,0,0,1|2,0,0]=4 6617 B13R1.19 CNNC(=O)CC1CCC(CC1)C 22a_100016993582_100011215564 [0,1,0,0,0,1|2,0,0]=4 6618 B13R1.19 CNNC(=O)CC1CCC(CC1)O 22a_100016993582_100012184027 [0,1,0,0,0,1|2,0,0]=4 6619 B13R1.19 CNNC(=O)N[C@H]1CC[C@@H](CC1)C 273464a_100020625639_100016993582 [0,1,0,0,0,1|2,0,0]=4 6620 B13R1.19 CNNC(=O)N[C@H]1CC[C@H](CC1)O 273464a_100020628982_100016993582 [0,1,0,0,0,1|2,0,0]=4 6621 B13R1.19 CNNC(=O)N[C@H]1CC[C@H](CC1)O 512a_100016993582_100020628982 [0,1,0,0,0,1|2,0,0]=4 6622 B13R1.19 COCC(=O)NC1CCC(CC1)C 34a_100138415774_100000180146 [0,1,0,0,0,1|2,0,0]=4 6623 B13R1.19 COCC(=O)N[C@H]1CC[C@@H](CC1)C 1626a_100020625639_100000210968 [0,1,0,0,0,1|2,0,0]=4 6624 B13R1.19 COCC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_100000210968 [0,1,0,0,0,1|2,0,0]=4 6625 B13R1.19 COCC(=O)N[C@H]1CC[C@@H](CC1)C 527a_100020625639_100000210968 [0,1,0,0,0,1|2,0,0]=4 6626 B13R1.19 COCC(=O)N[C@H]1CC[C@H](CC1)O 1626a_100020628982_100000210968 [0,1,0,0,0,1|2,0,0]=4 6627 B13R1.19 COCC(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100000210968 [0,1,0,0,0,1|2,0,0]=4 6628 B13R1.19 CSCC(=O)NC1CCC(CC1)C 62a_100000180146_200000210301 [0,1,0,0,0,1|2,0,0]=4 6629 B13R1.19 CSCC(=O)NC1CCC(CC1)C 62a_200000210301_100000180146 [0,1,0,0,0,1|2,0,0]=4 6630 B13R1.19 CSCC(=O)N[C@H]1CC[C@@H](CC1)C 1626a_100020625639_100000184570 [0,1,0,0,0,1|2,0,0]=4 6631 B13R1.19 CSCC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_100000184570 [0,1,0,0,0,1|2,0,0]=4 6632 B13R1.19 CSCC(=O)N[C@H]1CC[C@@H](CC1)C 527a_100020625639_100000184570 [0,1,0,0,0,1|2,0,0]=4 6633 B13R1.19 CSCC(=O)N[C@H]1CC[C@H](CC1)O 1626a_100020628982_100000184570 [0,1,0,0,0,1|2,0,0]=4 6634 B13R1.19 CSCC(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100000184570 [0,1,0,0,0,1|2,0,0]=4 6635 B13R1.19 C[C@H]1CC[C@@H](CC1)NC(=O)CCO 240690a_100020625639_100011216618 [0,1,0,0,0,1|2,0,0]=4 6636 B13R1.19 O=C(CCF)CC1CCC(CC1)O 1458a_100012184027_100011217306 [0,1,0,0,0,1|2,0,0]=4 6637 B13R1.19 O=C(CCO)CC1CCC(CC1)O 1458a_100012184027_100000211926 [0,1,0,0,0,1|2,0,0]=4 6638 B13R1.19 O=C(CCO)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100011216618 [0,1,0,0,0,1|2,0,0]=4 6639 B13R1.20 CC1CCCC(C1)CC(=O)CCF 1458a_100000748788_100011217306 [0,1,0,0,0,1|2,0,0]=4 6640 B13R1.20 CC1CCCC(C1)CC(=O)CCO 1458a_100000748788_100000211926 [0,1,0,0,0,1|2,0,0]=4 6641 B13R1.20 CC1CCCC(C1)NC(=O)CCO 240690a_100011194320_100011216618 [0,1,0,0,0,1|2,0,0]=4 6642 B13R1.20 CC=CC(=O)NC1CCCC(C1)C 11a_100011194320_100000210699 [0,1,0,0,0,1|1,0,1]=4 6643 B13R1.20 CC=CC(=O)NC1CCCC(C1)C 1626a_100011194320_100000210699 [0,1,0,0,0,1|1,0,1]=4 6644 B13R1.20 CC=CC(=O)NC1CCCC(C1)C 240690a_100011194320_100000210699 [0,1,0,0,0,1|1,0,1]=4 6645 B13R1.20 CC=CC(=O)NC1CCCC(C1)O 1626a_100015190357_100000210699 [0,1,0,0,0,1|1,0,1]=4 6646 B13R1.20 CC=CC(=O)NC1CCCC(C1)O 240690a_100015190357_100000210699 [0,1,0,0,0,1|1,0,1]=4 6647 B13R1.20 CCCC(=O)CC1CCCC(C1)C 1458a_100000748788_100000210303 [0,1,0,0,0,1|1,0,0]=3 6648 B13R1.20 CCCC(=O)CC1CCCN(C1)C 1458a_100000211992_100015183302 [0,1,0,0,0,1|2,0,0]=4 6649 B13R1.20 CCCC(=O)CN1CCCC(C1)F 2230a_100000697950_100000747444 [0,1,0,0,0,1|2,0,0]=4 6650 B13R1.20 CCCC(=O)CN1CCCC(C1)F 269982a_100000697950_100000747444 [0,1,0,0,0,1|2,0,0]=4 6651 B13R1.20 CCCC(=O)CN1CCCC(C1)O 2230a_100000211013_100000747444 [0,1,0,0,0,1|2,0,0]=4 6652 B13R1.20 CCCC(=O)CN1CCCC(C1)O 269982a_100000211013_100000747444 [0,1,0,0,0,1|2,0,0]=4 6653 B13R1.20 CCCC(=O)CN1CCC[C@@H](C1)C 2230a_100000717927_100000747444 [0,1,0,0,0,1|2,0,0]=4 6654 B13R1.20 CCCC(=O)CN1CCC[C@@H](C1)C 269982a_100000717927_100000747444 [0,1,0,0,0,1|2,0,0]=4 6655 B13R1.20 CCCC(=O)NC1CCCC(C1)C 11a_100011194320_100000211992 [0,1,0,0,0,1|1,0,0]=3 6656 B13R1.20 CCCC(=O)NC1CCCC(C1)C 1626a_100011194320_100000211992 [0,1,0,0,0,1|1,0,0]=3 6657 B13R1.20 CCCC(=O)NC1CCCC(C1)C 240690a_100011194320_100000211992 [0,1,0,0,0,1|1,0,0]=3 6658 B13R1.20 CCCC(=O)NC1CCCC(C1)C 527a_100011194320_100000211992 [0,1,0,0,0,1|1,0,0]=3 6659 B13R1.20 CCCC(=O)NC1CCCC(C1)O 1626a_100015190357_100000211992 [0,1,0,0,0,1|1,0,0]=3 6660 B13R1.20 CCCC(=O)NC1CCCC(C1)O 240690a_100015190357_100000211992 [0,1,0,0,0,1|1,0,0]=3 6661 B13R1.20 CCCC(=O)N[C@H]1CCCN(C1)C 240690a_100016992120_100000211992 [0,1,0,0,0,1|2,0,0]=4 6662 B13R1.20 CCCC(=O)N[C@H]1CCCN(C1)C 527a_100016992120_100000211992 [0,1,0,0,0,1|2,0,0]=4 6663 B13R1.20 CCNC(=O)CC1CCCC(C1)C 11a_100015525214_100000748788 [0,1,0,0,0,1|1,0,0]=3 6664 B13R1.20 CCNC(=O)CC1CCCC(C1)C 240690a_100015525214_100000748788 [0,1,0,0,0,1|1,0,0]=3 6665 B13R1.20 CCNC(=O)CC1CCCC(C1)C 527a_100015525214_100000748788 [0,1,0,0,0,1|1,0,0]=3 6666 B13R1.20 CCNC(=O)CN1CCCC(C1)F 2230a_100000697950_100000183381 [0,1,0,0,0,1|2,0,0]=4 6667 B13R1.20 CCNC(=O)CN1CCCC(C1)F 269982a_100000697950_100000183381 [0,1,0,0,0,1|2,0,0]=4 6668 B13R1.20 CCNC(=O)CN1CCCC(C1)F 34a_100000697950_100000183381 [0,1,0,0,0,1|2,0,0]=4 6669 B13R1.20 CCNC(=O)CN1CCCC(C1)O 2230a_100000211013_100000183381 [0,1,0,0,0,1|2,0,0]=4 6670 B13R1.20 CCNC(=O)CN1CCCC(C1)O 269982a_100000211013_100000183381 [0,1,0,0,0,1|2,0,0]=4 6671 B13R1.20 CCNC(=O)CN1CCC[C@@H](C1)C 2230a_100000717927_100000183381 [0,1,0,0,0,1|2,0,0]=4 6672 B13R1.20 CCNC(=O)CN1CCC[C@@H](C1)C 269982a_100000717927_100000183381 [0,1,0,0,0,1|2,0,0]=4 6673 B13R1.20 CCNC(=O)CN1CCC[C@@H](C1)C 34a_100000717927_100000183381 [0,1,0,0,0,1|2,0,0]=4 6674 B13R1.20 CCNC(=O)NC1CCCC(C1)C 2708a_100011194320_100015525214 [0,1,0,0,0,1|1,0,0]=3 6675 B13R1.20 CCNC(=O)NC1CCCC(C1)C 2708a_100015525214_100011194320 [0,1,0,0,0,1|1,0,0]=3 6676 B13R1.20 CCNC(=O)NC1CCCC(C1)C 273464a_100011194320_100015525214 [0,1,0,0,0,1|1,0,0]=3 6677 B13R1.20 CCNC(=O)NC1CCCC(C1)C 273464a_100015525214_100011194320 [0,1,0,0,0,1|1,0,0]=3 6678 B13R1.20 CCNC(=O)NC1CCCC(C1)C 512a_100011194320_100015525214 [0,1,0,0,0,1|1,0,0]=3 6679 B13R1.20 CCNC(=O)NC1CCCC(C1)C 512a_100015525214_100011194320 [0,1,0,0,0,1|1,0,0]=3 6680 B13R1.20 CCNC(=O)NC1CCCC(C1)O 2708a_100015525214_100015190357 [0,1,0,0,0,1|1,0,0]=3 6681 B13R1.20 CCNC(=O)NC1CCCC(C1)O 273464a_100015190357_100015525214 [0,1,0,0,0,1|1,0,0]=3 6682 B13R1.20 CCNC(=O)NC1CCCC(C1)O 273464a_100015525214_100015190357 [0,1,0,0,0,1|1,0,0]=3 6683 B13R1.20 CCNC(=O)NC1CCCC(C1)O 512a_100015190357_100015525214 [0,1,0,0,0,1|1,0,0]=3 6684 B13R1.20 CCNC(=O)NC1CCCC(C1)O 512a_100015525214_100015190357 [0,1,0,0,0,1|1,0,0]=3 6685 B13R1.20 CCNC(=O)N[C@H]1CCCN(C1)C 2708a_100015525214_100016992120 [0,1,0,0,0,1|2,0,0]=4 6686 B13R1.20 CCNC(=O)N[C@H]1CCCN(C1)C 2708a_100016992120_100015525214 [0,1,0,0,0,1|2,0,0]=4 6687 B13R1.20 CCNC(=O)N[C@H]1CCCN(C1)C 273464a_100015525214_100016992120 [0,1,0,0,0,1|2,0,0]=4 6688 B13R1.20 CCNC(=O)N[C@H]1CCCN(C1)C 273464a_100016992120_100015525214 [0,1,0,0,0,1|2,0,0]=4 6689 B13R1.20 CCNC(=O)N[C@H]1CCCN(C1)C 512a_100015525214_100016992120 [0,1,0,0,0,1|2,0,0]=4 6690 B13R1.20 CCNC(=O)N[C@H]1CCCN(C1)C 512a_100016992120_100015525214 [0,1,0,0,0,1|2,0,0]=4 6691 B13R1.20 CCOC(=O)C=C1CCCN(C1)C 2230a_100015190328_200000210301 [0,1,0,0,0,1|1,0,1]=4 6692 B13R1.20 CCOC(=O)C=C1CCCN(C1)C 269982a_100015190328_200000210301 [0,1,0,0,0,1|1,0,1]=4 6693 B13R1.20 CCOC(=O)C=C1CCCN(C1)[13CH3] 2230a_100015190328_200025704644 [0,1,0,0,0,1|1,0,1]=4 6694 B13R1.20 CCOC(=O)C=C1CCCN(C1)[13CH3] 269982a_100015190328_200025704644 [0,1,0,0,0,1|1,0,1]=4 6695 B13R1.20 CCOC(=O)CC1CCCN(C1)C 2230a_100015200144_200000210301 [0,1,0,0,0,1|1,0,0]=3 6696 B13R1.20 CCOC(=O)CC1CCCN(C1)C 269982a_100015200144_200000210301 [0,1,0,0,0,1|1,0,0]=3 6697 B13R1.20 CCOC(=O)CC1CCCN(C1)[13CH3] 2230a_100015200144_200025704644 [0,1,0,0,0,1|1,0,0]=3 6698 B13R1.20 CCOC(=O)CC1CCCN(C1)[13CH3] 269982a_100015200144_200025704644 [0,1,0,0,0,1|1,0,0]=3 6699 B13R1.20 CCOC(=O)CN1CCCC(C1)F 2230a_100000697950_100000188475 [0,1,0,0,0,1|1,0,0]=3 6700 B13R1.20 CCOC(=O)CN1CCCC(C1)F 269982a_100000697950_100000188475 [0,1,0,0,0,1|1,0,0]=3 6701 B13R1.20 CCOC(=O)CN1CCCC(C1)F 34a_100000697950_100000188475 [0,1,0,0,0,1|1,0,0]=3 6702 B13R1.20 CCOC(=O)CN1CCCC(C1)O 2230a_100000211013_100000188475 [0,1,0,0,0,1|1,0,0]=3 6703 B13R1.20 CCOC(=O)CN1CCCC(C1)O 269982a_100000211013_100000188475 [0,1,0,0,0,1|1,0,0]=3 6704 B13R1.20 CCOC(=O)CN1CCC[C@@H](C1)C 2230a_100000717927_100000188475 [0,1,0,0,0,1|1,0,0]=3 6705 B13R1.20 CCOC(=O)CN1CCC[C@@H](C1)C 269982a_100000717927_100000188475 [0,1,0,0,0,1|1,0,0]=3 6706 B13R1.20 CCOC(=O)CN1CCC[C@@H](C1)C 34a_100000717927_100000188475 [0,1,0,0,0,1|1,0,0]=3 6707 B13R1.20 CCOC(=O)CN1CCOC(C1)C 2230a_100000729577_100000188475 [0,1,0,0,0,1|2,0,0]=4 6708 B13R1.20 CCOC(=O)CN1CCOC(C1)C 269982a_100000729577_100000188475 [0,1,0,0,0,1|2,0,0]=4 6709 B13R1.20 CCOC(=O)CN1CCOC(C1)C 34a_100000729577_100000188475 [0,1,0,0,0,1|2,0,0]=4 6710 B13R1.20 CCOC(=O)CN1CCOC(C1)O 2230a_100000688207_100000188475 [0,1,0,0,0,1|2,0,0]=4 6711 B13R1.20 CCOC(=O)CN1CCOC(C1)O 269982a_100000688207_100000188475 [0,1,0,0,0,1|2,0,0]=4 6712 B13R1.20 CNNC(=O)CC1CCCC(C1)C 22a_100016993582_100000748788 [0,1,0,0,0,1|2,0,0]=4 6713 B13R1.20 CNNC(=O)NC1CCCC(C1)C 273464a_100011194320_100016993582 [0,1,0,0,0,1|2,0,0]=4 6714 B13R1.20 CNNC(=O)NC1CCCC(C1)C 512a_100011194320_100016993582 [0,1,0,0,0,1|2,0,0]=4 6715 B13R1.20 CNNC(=O)NC1CCCC(C1)C 512a_100016993582_100011194320 [0,1,0,0,0,1|2,0,0]=4 6716 B13R1.20 CNNC(=O)NC1CCCC(C1)O 273464a_100015190357_100016993582 [0,1,0,0,0,1|2,0,0]=4 6717 B13R1.20 CNNC(=O)NC1CCCC(C1)O 512a_100015190357_100016993582 [0,1,0,0,0,1|2,0,0]=4 6718 B13R1.20 CNNC(=O)NC1CCCC(C1)O 512a_100016993582_100015190357 [0,1,0,0,0,1|2,0,0]=4 6719 B13R1.20 COCC(=O)NC1CCCC(C1)C 11a_100011194320_100000210968 [0,1,0,0,0,1|2,0,0]=4 6720 B13R1.20 COCC(=O)NC1CCCC(C1)C 1626a_100011194320_100000210968 [0,1,0,0,0,1|2,0,0]=4 6721 B13R1.20 COCC(=O)NC1CCCC(C1)C 240690a_100011194320_100000210968 [0,1,0,0,0,1|2,0,0]=4 6722 B13R1.20 COCC(=O)NC1CCCC(C1)C 527a_100011194320_100000210968 [0,1,0,0,0,1|2,0,0]=4 6723 B13R1.20 COCC(=O)NC1CCCC(C1)O 1626a_100015190357_100000210968 [0,1,0,0,0,1|2,0,0]=4 6724 B13R1.20 COCC(=O)NC1CCCC(C1)O 240690a_100015190357_100000210968 [0,1,0,0,0,1|2,0,0]=4 6725 B13R1.20 CSCC(=O)NC1CCCC(C1)C 11a_100011194320_100000184570 [0,1,0,0,0,1|2,0,0]=4 6726 B13R1.20 CSCC(=O)NC1CCCC(C1)C 1626a_100011194320_100000184570 [0,1,0,0,0,1|2,0,0]=4 6727 B13R1.20 CSCC(=O)NC1CCCC(C1)C 240690a_100011194320_100000184570 [0,1,0,0,0,1|2,0,0]=4 6728 B13R1.20 CSCC(=O)NC1CCCC(C1)C 527a_100011194320_100000184570 [0,1,0,0,0,1|2,0,0]=4 6729 B13R1.20 CSCC(=O)NC1CCCC(C1)O 1626a_100015190357_100000184570 [0,1,0,0,0,1|2,0,0]=4 6730 B13R1.20 CSCC(=O)NC1CCCC(C1)O 240690a_100015190357_100000184570 [0,1,0,0,0,1|2,0,0]=4 6731 B13R1.20 O=C(CCO)NC1CCCC(C1)O 240690a_100015190357_100011216618 [0,1,0,0,0,1|2,0,0]=4 6732 B13R1.44 C#CCCC(=O)CC1CCCCC1 1458a_100000211666_100000753159 [0,1,0,0,0,1|1,0,1]=4 6733 B13R1.44 C#CCCC(=O)CC1CCCCC1 1458a_100000692101_100000211423 [0,1,0,0,0,1|1,0,1]=4 6734 B13R1.44 C#CCCC(=O)NC1CCCCC1 11a_100000182618_100000692101 [0,1,0,0,0,1|1,0,1]=4 6735 B13R1.44 C#CCCC(=O)NC1CCCCC1 1626a_100000182618_100000692101 [0,1,0,0,0,1|1,0,1]=4 6736 B13R1.44 C#CCCC(=O)NC1CCCCC1 240690a_100000182618_100000692101 [0,1,0,0,0,1|1,0,1]=4 6737 B13R1.44 C#CCCC(=O)NC1CCCCC1 527a_100000182618_100000692101 [0,1,0,0,0,1|1,0,1]=4 6738 B13R1.44 C#CCNC(=O)CC1CCCCC1 11a_100000212058_100000211666 [0,1,0,0,0,1|1,0,1]=4 6739 B13R1.44 C#CCNC(=O)CC1CCCCC1 1626a_100000212058_100000211666 [0,1,0,0,0,1|1,0,1]=4 6740 B13R1.44 C#CCNC(=O)CC1CCCCC1 240690a_100000212058_100000211666 [0,1,0,0,0,1|1,0,1]=4 6741 B13R1.44 C#CCNC(=O)CC1CCCCC1 527a_100000212058_100000211666 [0,1,0,0,0,1|1,0,1]=4 6742 B13R1.44 C#CCNC(=O)NC1CCCCC1 2708a_100000182618_100000212058 [0,1,0,0,0,1|1,0,1]=4 6743 B13R1.44 C#CCNC(=O)NC1CCCCC1 2708a_100000212058_100000182618 [0,1,0,0,0,1|1,0,1]=4 6744 B13R1.44 C#CCNC(=O)NC1CCCCC1 273464a_100000182618_100000212058 [0,1,0,0,0,1|1,0,1]=4 6745 B13R1.44 C#CCNC(=O)NC1CCCCC1 273464a_100000212058_100000182618 [0,1,0,0,0,1|1,0,1]=4 6746 B13R1.44 C/C=C/CC(=O)CC1CCCCC1 1458a_100000211666_100102629194 [0,1,0,0,0,1|1,0,1]=4 6747 B13R1.44 C=CCCC(=O)CC1CCCCC1 1458a_100000211666_100000754431 [0,1,0,0,0,1|1,0,1]=4 6748 B13R1.44 C=CCCC(=O)CC1CCCCC1 1458a_100000749702_100000211423 [0,1,0,0,0,1|1,0,1]=4 6749 B13R1.44 C=CCCC(=O)NC1CCCCC1 11a_100000182618_100000749702 [0,1,0,0,0,1|1,0,1]=4 6750 B13R1.44 C=CCCC(=O)NC1CCCCC1 1626a_100000182618_100000749702 [0,1,0,0,0,1|1,0,1]=4 6751 B13R1.44 C=CCCC(=O)NC1CCCCC1 240690a_100000182618_100000749702 [0,1,0,0,0,1|1,0,1]=4 6752 B13R1.44 C=CCCC(=O)NC1CCCCC1 527a_100000182618_100000749702 [0,1,0,0,0,1|1,0,1]=4 6753 B13R1.44 C=CCNC(=O)CC1CCCCC1 1626a_100020586998_100000211666 [0,1,0,0,0,1|1,0,1]=4 6754 B13R1.44 C=CCNC(=O)CC1CCCCC1 240690a_100020586998_100000211666 [0,1,0,0,0,1|1,0,1]=4 6755 B13R1.44 C=CCNC(=O)CC1CCCCC1 527a_100020586998_100000211666 [0,1,0,0,0,1|1,0,1]=4 6756 B13R1.44 C=CCNC(=O)NC1CCCCC1 2708a_100000182618_100020586998 [0,1,0,0,0,1|1,0,1]=4 6757 B13R1.44 C=CCNC(=O)NC1CCCCC1 273464a_100000182618_100020586998 [0,1,0,0,0,1|1,0,1]=4 6758 B13R1.44 C=CCNC(=O)NC1CCCCC1 273464a_100020586998_100000182618 [0,1,0,0,0,1|1,0,1]=4 6759 B13R1.44 CC#CCC(=O)CC1CCCCC1 1458a_100000211666_100000748600 [0,1,0,0,0,1|1,0,1]=4 6760 B13R1.44 CC=CCC(=O)CC1CCCCC1 1458a_100000211666_100000070051 [0,1,0,0,0,1|1,0,1]=4 6761 B13R1.44 CC=CCC(=O)CC1CCCCC1 1458a_100121576822_100000211423 [0,1,0,0,0,1|1,0,1]=4 6762 B13R1.44 CC=CCC(=O)NC1CCCCC1 11a_100000182618_100121576822 [0,1,0,0,0,1|1,0,1]=4 6763 B13R1.44 CC=CCC(=O)NC1CCCCC1 1626a_100000182618_100121576822 [0,1,0,0,0,1|1,0,1]=4 6764 B13R1.44 CC=CCC(=O)NC1CCCCC1 240690a_100000182618_100121576822 [0,1,0,0,0,1|1,0,1]=4 6765 B13R1.44 CC=CCC(=O)NC1CCCCC1 527a_100000182618_100121576822 [0,1,0,0,0,1|1,0,1]=4 6766 B13R1.44 CC=NNC(=O)CC1CCCCC1 4a_100000189929_200000210099 [0,1,0,0,0,1|1,0,1]=4 6767 B13R1.44 CCC#CC(=O)CC1CCCCC1 1458a_100011827653_100000211423 [0,1,0,0,0,1|1,0,0]=3 6768 B13R1.44 CCC#CC(=O)CC1CCCCO1 1458a_100011827653_100000211543 [0,1,0,0,0,1|2,0,0]=4 6769 B13R1.44 CCC#CC(=O)CC1CCCOC1 1458a_100011827653_100000741521 [0,1,0,0,0,1|2,0,0]=4 6770 B13R1.44 CCC#CC(=O)CC1CCOCC1 1458a_100011827653_100000754603 [0,1,0,0,0,1|2,0,0]=4 6771 B13R1.44 CCC=CC(=O)CC1CCCCC1 1458a_100000212282_100000211423 [0,1,0,0,0,1|1,0,0]=3 6772 B13R1.44 CCC=CC(=O)CC1CCCCO1 1458a_100000212282_100000211543 [0,1,0,0,0,1|2,0,0]=4 6773 B13R1.44 CCC=CC(=O)CC1CCCOC1 1458a_100000212282_100000741521 [0,1,0,0,0,1|2,0,0]=4 6774 B13R1.44 CCC=CC(=O)CC1CCOCC1 1458a_100000212282_100000754603 [0,1,0,0,0,1|2,0,0]=4 6775 B13R1.44 CCC=CC(=O)NC1CCCCC1 11a_100000182618_100000212282 [0,1,0,0,0,1|1,0,0]=3 6776 B13R1.44 CCC=CC(=O)NC1CCCCC1 1626a_100000182618_100000212282 [0,1,0,0,0,1|1,0,0]=3 6777 B13R1.44 CCC=CC(=O)NC1CCCCC1 240690a_100000182618_100000212282 [0,1,0,0,0,1|1,0,0]=3 6778 B13R1.44 CCC=CC(=O)NC1CCCOC1 11a_100000719290_100000212282 [0,1,0,0,0,1|2,0,0]=4 6779 B13R1.44 CCC=CC(=O)NC1CCCOC1 1626a_100000719290_100000212282 [0,1,0,0,0,1|2,0,0]=4 6780 B13R1.44 CCC=CC(=O)NC1CCCOC1 240690a_100000719290_100000212282 [0,1,0,0,0,1|2,0,0]=4 6781 B13R1.44 CCC=CC(=O)NC1CCOCC1 11a_100000741149_100000212282 [0,1,0,0,0,1|2,0,0]=4 6782 B13R1.44 CCC=CC(=O)NC1CCOCC1 1626a_100000741149_100000212282 [0,1,0,0,0,1|2,0,0]=4 6783 B13R1.44 CCC=CC(=O)NC1CCOCC1 240690a_100000741149_100000212282 [0,1,0,0,0,1|2,0,0]=4 6784 B13R1.44 CCC=CC(=O)NC1CCSCC1 11a_100000748639_100000212282 [0,1,0,0,0,1|2,0,0]=4 6785 B13R1.44 CCC=CC(=O)NC1CCSCC1 1626a_100000748639_100000212282 [0,1,0,0,0,1|2,0,0]=4 6786 B13R1.44 CCC=CC(=O)NC1CCSCC1 240690a_100000748639_100000212282 [0,1,0,0,0,1|2,0,0]=4 6787 B13R1.44 CCCCC(=O)C=C1CCCCC1 1458a_100000743792_100000210211 [0,1,0,0,0,1|1,0,1]=4 6788 B13R1.44 CCCCC(=O)CC1CCCCC1 1458a_100000210183_100000211423 [0,1,0,0,0,1|1,0,0]=3 6789 B13R1.44 CCCCC(=O)CC1CCCCC1 1458a_100000211666_100000210211 [0,1,0,0,0,1|1,0,0]=3 6790 B13R1.44 CCCCC(=O)CC1CCCCO1 1458a_100000210183_100000211543 [0,1,0,0,0,1|2,0,0]=4 6791 B13R1.44 CCCCC(=O)CC1CCCCO1 1458a_100000238585_100000210211 [0,1,0,0,0,1|2,0,0]=4 6792 B13R1.44 CCCCC(=O)CC1CCCOC1 1458a_100000210183_100000741521 [0,1,0,0,0,1|2,0,0]=4 6793 B13R1.44 CCCCC(=O)CC1CCCOC1 1458a_100000741523_100000210211 [0,1,0,0,0,1|2,0,0]=4 6794 B13R1.44 CCCCC(=O)CC1CCOCC1 1458a_100000210183_100000754603 [0,1,0,0,0,1|2,0,0]=4 6795 B13R1.44 CCCCC(=O)CC1CCOCC1 1458a_100000757261_100000210211 [0,1,0,0,0,1|2,0,0]=4 6796 B13R1.44 CCCCC(=O)CN1CCCCC1 1458a_100000740322_100000210211 [0,1,0,0,0,1|2,0,0]=4 6797 B13R1.44 CCCCC(=O)NC1CCCCC1 11a_100000182618_100000210183 [0,1,0,0,0,1|1,0,0]=3 6798 B13R1.44 CCCCC(=O)NC1CCCCC1 1626a_100000182618_100000210183 [0,1,0,0,0,1|1,0,0]=3 6799 B13R1.44 CCCCC(=O)NC1CCCCC1 240690a_100000182618_100000210183 [0,1,0,0,0,1|1,0,0]=3 6800 B13R1.44 CCCCC(=O)NC1CCCCC1 527a_100000182618_100000210183 [0,1,0,0,0,1|1,0,0]=3 6801 B13R1.44 CCCCC(=O)NC1CCCOC1 11a_100000719290_100000210183 [0,1,0,0,0,1|2,0,0]=4 6802 B13R1.44 CCCCC(=O)NC1CCCOC1 1626a_100000719290_100000210183 [0,1,0,0,0,1|2,0,0]=4 6803 B13R1.44 CCCCC(=O)NC1CCCOC1 240690a_100000719290_100000210183 [0,1,0,0,0,1|2,0,0]=4 6804 B13R1.44 CCCCC(=O)NC1CCCOC1 527a_100000719290_100000210183 [0,1,0,0,0,1|2,0,0]=4 6805 B13R1.44 CCCCC(=O)NC1CCOCC1 11a_100000741149_100000210183 [0,1,0,0,0,1|2,0,0]=4 6806 B13R1.44 CCCCC(=O)NC1CCOCC1 1626a_100000741149_100000210183 [0,1,0,0,0,1|2,0,0]=4 6807 B13R1.44 CCCCC(=O)NC1CCOCC1 240690a_100000741149_100000210183 [0,1,0,0,0,1|2,0,0]=4 6808 B13R1.44 CCCCC(=O)NC1CCOCC1 527a_100000741149_100000210183 [0,1,0,0,0,1|2,0,0]=4 6809 B13R1.44 CCCCC(=O)NC1CCSCC1 11a_100000748639_100000210183 [0,1,0,0,0,1|2,0,0]=4 6810 B13R1.44 CCCCC(=O)NC1CCSCC1 1626a_100000748639_100000210183 [0,1,0,0,0,1|2,0,0]=4 6811 B13R1.44 CCCCC(=O)NC1CCSCC1 240690a_100000748639_100000210183 [0,1,0,0,0,1|2,0,0]=4 6812 B13R1.44 CCCCC(=O)NC1CCSCC1 527a_100000748639_100000210183 [0,1,0,0,0,1|2,0,0]=4 6813 B13R1.44 CCCNC(=O)C=C1CCCCC1 11a_100020643023_100000743792 [0,1,0,0,0,1|1,0,1]=4 6814 B13R1.44 CCCNC(=O)C=C1CCCCC1 1626a_100020643023_100000743792 [0,1,0,0,0,1|1,0,1]=4 6815 B13R1.44 CCCNC(=O)C=C1CCCCC1 240690a_100020643023_100000743792 [0,1,0,0,0,1|1,0,1]=4 6816 B13R1.44 CCCNC(=O)CC1CCCCC1 11a_100020643023_100000211666 [0,1,0,0,0,1|1,0,0]=3 6817 B13R1.44 CCCNC(=O)CC1CCCCC1 1626a_100020643023_100000211666 [0,1,0,0,0,1|1,0,0]=3 6818 B13R1.44 CCCNC(=O)CC1CCCCC1 240690a_100020643023_100000211666 [0,1,0,0,0,1|1,0,0]=3 6819 B13R1.44 CCCNC(=O)CC1CCCCC1 527a_100020643023_100000211666 [0,1,0,0,0,1|1,0,0]=3 6820 B13R1.44 CCCNC(=O)CC1CCCCO1 11a_100020643023_100000238585 [0,1,0,0,0,1|2,0,0]=4 6821 B13R1.44 CCCNC(=O)CC1CCCCO1 1626a_100020643023_100000238585 [0,1,0,0,0,1|2,0,0]=4 6822 B13R1.44 CCCNC(=O)CC1CCCCO1 240690a_100020643023_100000238585 [0,1,0,0,0,1|2,0,0]=4 6823 B13R1.44 CCCNC(=O)CC1CCCCO1 527a_100020643023_100000238585 [0,1,0,0,0,1|2,0,0]=4 6824 B13R1.44 CCCNC(=O)CC1CCCOC1 11a_100020643023_100000741523 [0,1,0,0,0,1|2,0,0]=4 6825 B13R1.44 CCCNC(=O)CC1CCCOC1 1626a_100020643023_100000741523 [0,1,0,0,0,1|2,0,0]=4 6826 B13R1.44 CCCNC(=O)CC1CCCOC1 240690a_100020643023_100000741523 [0,1,0,0,0,1|2,0,0]=4 6827 B13R1.44 CCCNC(=O)CC1CCCOC1 527a_100020643023_100000741523 [0,1,0,0,0,1|2,0,0]=4 6828 B13R1.44 CCCNC(=O)CC1CCOCC1 11a_100020643023_100000757261 [0,1,0,0,0,1|2,0,0]=4 6829 B13R1.44 CCCNC(=O)CC1CCOCC1 1626a_100020643023_100000757261 [0,1,0,0,0,1|2,0,0]=4 6830 B13R1.44 CCCNC(=O)CC1CCOCC1 240690a_100020643023_100000757261 [0,1,0,0,0,1|2,0,0]=4 6831 B13R1.44 CCCNC(=O)CC1CCOCC1 527a_100020643023_100000757261 [0,1,0,0,0,1|2,0,0]=4 6832 B13R1.44 CCCNC(=O)CN1CCCCC1 11a_100020643023_100000740322 [0,1,0,0,0,1|2,0,0]=4 6833 B13R1.44 CCCNC(=O)CN1CCCCC1 240690a_100020643023_100000740322 [0,1,0,0,0,1|2,0,0]=4 6834 B13R1.44 CCCNC(=O)CN1CCCCC1 527a_100020643023_100000740322 [0,1,0,0,0,1|2,0,0]=4 6835 B13R1.44 CCCNC(=O)NC1CCCCC1 2708a_100000182618_100020643023 [0,1,0,0,0,1|1,0,0]=3 6836 B13R1.44 CCCNC(=O)NC1CCCCC1 2708a_100020643023_100000182618 [0,1,0,0,0,1|1,0,0]=3 6837 B13R1.44 CCCNC(=O)NC1CCCCC1 273464a_100000182618_100020643023 [0,1,0,0,0,1|1,0,0]=3 6838 B13R1.44 CCCNC(=O)NC1CCCCC1 273464a_100020643023_100000182618 [0,1,0,0,0,1|1,0,0]=3 6839 B13R1.44 CCCNC(=O)NC1CCCOC1 2708a_100000719290_100020643023 [0,1,0,0,0,1|2,0,0]=4 6840 B13R1.44 CCCNC(=O)NC1CCCOC1 2708a_100020643023_100000719290 [0,1,0,0,0,1|2,0,0]=4 6841 B13R1.44 CCCNC(=O)NC1CCCOC1 273464a_100000719290_100020643023 [0,1,0,0,0,1|2,0,0]=4 6842 B13R1.44 CCCNC(=O)NC1CCCOC1 273464a_100020643023_100000719290 [0,1,0,0,0,1|2,0,0]=4 6843 B13R1.44 CCCNC(=O)NC1CCCOC1 512a_100000719290_100020643023 [0,1,0,0,0,1|2,0,0]=4 6844 B13R1.44 CCCNC(=O)NC1CCCOC1 512a_100020643023_100000719290 [0,1,0,0,0,1|2,0,0]=4 6845 B13R1.44 CCCNC(=O)NC1CCOCC1 2708a_100000741149_100020643023 [0,1,0,0,0,1|2,0,0]=4 6846 B13R1.44 CCCNC(=O)NC1CCOCC1 2708a_100020643023_100000741149 [0,1,0,0,0,1|2,0,0]=4 6847 B13R1.44 CCCNC(=O)NC1CCOCC1 273464a_100000741149_100020643023 [0,1,0,0,0,1|2,0,0]=4 6848 B13R1.44 CCCNC(=O)NC1CCOCC1 273464a_100020643023_100000741149 [0,1,0,0,0,1|2,0,0]=4 6849 B13R1.44 CCCNC(=O)NC1CCOCC1 512a_100000741149_100020643023 [0,1,0,0,0,1|2,0,0]=4 6850 B13R1.44 CCCNC(=O)NC1CCOCC1 512a_100020643023_100000741149 [0,1,0,0,0,1|2,0,0]=4 6851 B13R1.44 CCCNC(=O)NC1CCSCC1 2708a_100000748639_100020643023 [0,1,0,0,0,1|2,0,0]=4 6852 B13R1.44 CCCNC(=O)NC1CCSCC1 2708a_100020643023_100000748639 [0,1,0,0,0,1|2,0,0]=4 6853 B13R1.44 CCCNC(=O)NC1CCSCC1 273464a_100000748639_100020643023 [0,1,0,0,0,1|2,0,0]=4 6854 B13R1.44 CCCNC(=O)NC1CCSCC1 273464a_100020643023_100000748639 [0,1,0,0,0,1|2,0,0]=4 6855 B13R1.44 CCCNC(=O)NC1CCSCC1 512a_100000748639_100020643023 [0,1,0,0,0,1|2,0,0]=4 6856 B13R1.44 CCCNC(=O)NC1CCSCC1 512a_100020643023_100000748639 [0,1,0,0,0,1|2,0,0]=4 6857 B13R1.44 CCCOC(=O)CN1CCCOC1 2230a_100000131196_200011215008 [0,1,0,0,0,1|2,0,0]=4 6858 B13R1.44 CCCOC(=O)CN1CCCOC1 269982a_100000131196_200011215008 [0,1,0,0,0,1|2,0,0]=4 6859 B13R1.44 CCCOC(=O)CN1CCCOC1 34a_100000131196_200011215008 [0,1,0,0,0,1|2,0,0]=4 6860 B13R1.44 CCCOC(=O)CN1CCOCC1 2230a_100015191051_200011215008 [0,1,0,0,0,1|2,0,0]=4 6861 B13R1.44 CCCOC(=O)CN1CCOCC1 269982a_100015191051_200011215008 [0,1,0,0,0,1|2,0,0]=4 6862 B13R1.44 CCCOC(=O)CN1CCOCC1 34a_100015191051_200011215008 [0,1,0,0,0,1|2,0,0]=4 6863 B13R1.44 CCCOC(=O)CN1CCSCC1 2230a_100000737611_200011215008 [0,1,0,0,0,1|2,0,0]=4 6864 B13R1.44 CCCOC(=O)CN1CCSCC1 269982a_100000737611_200011215008 [0,1,0,0,0,1|2,0,0]=4 6865 B13R1.44 CCNCC(=O)NC1CCCCC1 2230a_100015207117_100000210202 [0,1,0,0,0,1|1,0,0]=3 6866 B13R1.44 CCNCC(=O)NC1CCCCC1 2230a_100015525214_100000183541 [0,1,0,0,0,1|1,0,0]=3 6867 B13R1.44 CCNCC(=O)OC1CCCCC1 2230a_100015525214_100000041653 [0,1,0,0,0,1|1,0,0]=3 6868 B13R1.44 CCNN=C(C)CC1CCCCC1 4a_100000756455_100011215996 [0,1,0,0,0,1|2,0,0]=4 6869 B13R1.44 CCNNC(=O)C=C1CCCCC1 22a_100000756455_100000743792 [0,1,0,0,0,1|1,0,1]=4 6870 B13R1.44 CCNNC(=O)CC1CCCCC1 22a_100000756455_100000211666 [0,1,0,0,0,1|1,0,0]=3 6871 B13R1.44 CCNNC(=O)CC1CCCCO1 22a_100000756455_100000238585 [0,1,0,0,0,1|2,0,0]=4 6872 B13R1.44 CCNNC(=O)CC1CCCOC1 22a_100000756455_100000741523 [0,1,0,0,0,1|2,0,0]=4 6873 B13R1.44 CCNNC(=O)CC1CCOCC1 22a_100000756455_100000757261 [0,1,0,0,0,1|2,0,0]=4 6874 B13R1.44 CCNNC(=O)CN1CCCCC1 22a_100000756455_100000740322 [0,1,0,0,0,1|2,0,0]=4 6875 B13R1.44 CCNNC(=O)NC1CCCCC1 273464a_100000182618_100000756455 [0,1,0,0,0,1|1,0,0]=3 6876 B13R1.44 CCNNC(=O)NC1CCCOC1 273464a_100000719290_100000756455 [0,1,0,0,0,1|2,0,0]=4 6877 B13R1.44 CCNNC(=O)NC1CCCOC1 512a_100000719290_100000756455 [0,1,0,0,0,1|2,0,0]=4 6878 B13R1.44 CCNNC(=O)NC1CCCOC1 512a_100000756455_100000719290 [0,1,0,0,0,1|2,0,0]=4 6879 B13R1.44 CCNNC(=O)NC1CCOCC1 273464a_100000741149_100000756455 [0,1,0,0,0,1|2,0,0]=4 6880 B13R1.44 CCNNC(=O)NC1CCOCC1 512a_100000741149_100000756455 [0,1,0,0,0,1|2,0,0]=4 6881 B13R1.44 CCNNC(=O)NC1CCOCC1 512a_100000756455_100000741149 [0,1,0,0,0,1|2,0,0]=4 6882 B13R1.44 CCNNC(=O)NC1CCSCC1 273464a_100000748639_100000756455 [0,1,0,0,0,1|2,0,0]=4 6883 B13R1.44 CCNNC(=O)NC1CCSCC1 512a_100000748639_100000756455 [0,1,0,0,0,1|2,0,0]=4 6884 B13R1.44 CCNNC(=O)NC1CCSCC1 512a_100000756455_100000748639 [0,1,0,0,0,1|2,0,0]=4 6885 B13R1.44 CCOCC(=O)CC1CCCCC1 1458a_100000211967_100000211423 [0,1,0,0,0,1|0,0,0]=2 6886 B13R1.44 CCOCC(=O)CC1CCCCO1 1458a_100000211967_100000211543 [0,1,0,0,0,1|1,0,0]=3 6887 B13R1.44 CCOCC(=O)CC1CCCOC1 1458a_100000211967_100000741521 [0,1,0,0,0,1|1,0,0]=3 6888 B13R1.44 CCOCC(=O)CC1CCOCC1 1458a_100000211967_100000754603 [0,1,0,0,0,1|1,0,0]=3 6889 B13R1.44 CCOCC(=O)NC1CCCCC1 11a_100000182618_100000211967 [0,1,0,0,0,1|0,0,0]=2 6890 B13R1.44 CCOCC(=O)NC1CCCCC1 1626a_100000182618_100000211967 [0,1,0,0,0,1|0,0,0]=2 6891 B13R1.44 CCOCC(=O)NC1CCCCC1 240690a_100000182618_100000211967 [0,1,0,0,0,1|0,0,0]=2 6892 B13R1.44 CCOCC(=O)NC1CCCCC1 34a_100121572206_100000183541 [0,1,0,0,0,1|0,0,0]=2 6893 B13R1.44 CCOCC(=O)NC1CCCCC1 527a_100000182618_100000211967 [0,1,0,0,0,1|0,0,0]=2 6894 B13R1.44 CCOCC(=O)NC1CCCOC1 11a_100000719290_100000211967 [0,1,0,0,0,1|1,0,0]=3 6895 B13R1.44 CCOCC(=O)NC1CCCOC1 1626a_100000719290_100000211967 [0,1,0,0,0,1|1,0,0]=3 6896 B13R1.44 CCOCC(=O)NC1CCCOC1 240690a_100000719290_100000211967 [0,1,0,0,0,1|1,0,0]=3 6897 B13R1.44 CCOCC(=O)NC1CCCOC1 527a_100000719290_100000211967 [0,1,0,0,0,1|1,0,0]=3 6898 B13R1.44 CCOCC(=O)NC1CCOCC1 11a_100000741149_100000211967 [0,1,0,0,0,1|1,0,0]=3 6899 B13R1.44 CCOCC(=O)NC1CCOCC1 1626a_100000741149_100000211967 [0,1,0,0,0,1|1,0,0]=3 6900 B13R1.44 CCOCC(=O)NC1CCOCC1 240690a_100000741149_100000211967 [0,1,0,0,0,1|1,0,0]=3 6901 B13R1.44 CCOCC(=O)NC1CCOCC1 527a_100000741149_100000211967 [0,1,0,0,0,1|1,0,0]=3 6902 B13R1.44 CCOCC(=O)NC1CCSCC1 11a_100000748639_100000211967 [0,1,0,0,0,1|1,0,0]=3 6903 B13R1.44 CCOCC(=O)NC1CCSCC1 1626a_100000748639_100000211967 [0,1,0,0,0,1|1,0,0]=3 6904 B13R1.44 CCOCC(=O)NC1CCSCC1 240690a_100000748639_100000211967 [0,1,0,0,0,1|1,0,0]=3 6905 B13R1.44 CCOCC(=O)NC1CCSCC1 527a_100000748639_100000211967 [0,1,0,0,0,1|1,0,0]=3 6906 B13R1.44 CCOCC(=O)OC1CCCCC1 34a_100121572206_100000041653 [0,1,0,0,0,1|0,0,0]=2 6907 B13R1.44 CCOCC(C)OC1CCCCC1 34a_100000718985_100000210327 [0,1,0,0,0,1|1,0,1]=4 6908 B13R1.44 CCOCC(C)OC1CCCCC1 7a_100000718985_100000210327 [0,1,0,0,0,1|1,0,1]=4 6909 B13R1.44 CCOCN(C)CC1CCCCC1 269982a_100000736448_100000739092 [0,1,0,0,0,1|2,0,0]=4 6910 B13R1.44 CCOC[C@@H](N)CC1CCCCC1 34a_100015184289_100000210202 [0,1,0,0,0,1|1,0,1]=4 6911 B13R1.44 CCSCC(=O)CC1CCCCC1 1458a_100000230394_100000211423 [0,1,0,0,0,1|0,1,0]=3 6912 B13R1.44 CCSCC(=O)CC1CCCCO1 1458a_100000230394_100000211543 [0,1,0,0,0,1|1,1,0]=4 6913 B13R1.44 CCSCC(=O)CC1CCCOC1 1458a_100000230394_100000741521 [0,1,0,0,0,1|1,1,0]=4 6914 B13R1.44 CCSCC(=O)CC1CCOCC1 1458a_100000230394_100000754603 [0,1,0,0,0,1|1,1,0]=4 6915 B13R1.44 CCSCC(=O)NC1CCCCC1 11a_100000182618_100000230394 [0,1,0,0,0,1|0,1,0]=3 6916 B13R1.44 CCSCC(=O)NC1CCCCC1 1626a_100000182618_100000230394 [0,1,0,0,0,1|0,1,0]=3 6917 B13R1.44 CCSCC(=O)NC1CCCCC1 240690a_100000182618_100000230394 [0,1,0,0,0,1|0,1,0]=3 6918 B13R1.44 CCSCC(=O)NC1CCCCC1 527a_100000182618_100000230394 [0,1,0,0,0,1|0,1,0]=3 6919 B13R1.44 CCSCC(=O)NC1CCCCC1 62a_100000183541_100000210202 [0,1,0,0,0,1|0,1,0]=3 6920 B13R1.44 CCSCC(=O)NC1CCCCC1 62a_100000210202_100000183541 [0,1,0,0,0,1|0,1,0]=3 6921 B13R1.44 CCSCC(=O)NC1CCCOC1 11a_100000719290_100000230394 [0,1,0,0,0,1|1,1,0]=4 6922 B13R1.44 CCSCC(=O)NC1CCCOC1 1626a_100000719290_100000230394 [0,1,0,0,0,1|1,1,0]=4 6923 B13R1.44 CCSCC(=O)NC1CCCOC1 240690a_100000719290_100000230394 [0,1,0,0,0,1|1,1,0]=4 6924 B13R1.44 CCSCC(=O)NC1CCCOC1 527a_100000719290_100000230394 [0,1,0,0,0,1|1,1,0]=4 6925 B13R1.44 CCSCC(=O)NC1CCOCC1 11a_100000741149_100000230394 [0,1,0,0,0,1|1,1,0]=4 6926 B13R1.44 CCSCC(=O)NC1CCOCC1 1626a_100000741149_100000230394 [0,1,0,0,0,1|1,1,0]=4 6927 B13R1.44 CCSCC(=O)NC1CCOCC1 240690a_100000741149_100000230394 [0,1,0,0,0,1|1,1,0]=4 6928 B13R1.44 CCSCC(=O)NC1CCOCC1 527a_100000741149_100000230394 [0,1,0,0,0,1|1,1,0]=4 6929 B13R1.44 CCSCC(=O)NC1CCSCC1 11a_100000748639_100000230394 [0,1,0,0,0,1|1,1,0]=4 6930 B13R1.44 CCSCC(=O)NC1CCSCC1 1626a_100000748639_100000230394 [0,1,0,0,0,1|1,1,0]=4 6931 B13R1.44 CCSCC(=O)NC1CCSCC1 240690a_100000748639_100000230394 [0,1,0,0,0,1|1,1,0]=4 6932 B13R1.44 CCSCC(=O)NC1CCSCC1 527a_100000748639_100000230394 [0,1,0,0,0,1|1,1,0]=4 6933 B13R1.44 CCSCC(=O)OC1CCCCC1 62a_100000041653_100000210202 [0,1,0,0,0,1|0,1,0]=3 6934 B13R1.44 CCSCC(=O)OC1CCCCC1 62a_100000210202_100000041653 [0,1,0,0,0,1|0,1,0]=3 6935 B13R1.44 CNCCC(=O)NC1CCCCC1 2230a_100000743080_200000210301 [0,1,0,0,0,1|1,0,0]=3 6936 B13R1.44 CNCCC(=O)NC1CCCCC1 2230a_106832991635_100000188762 [0,1,0,0,0,1|1,0,0]=3 6937 B13R1.44 CNCCC(=O)NC1CCCCC1 34a_100000743080_200000210301 [0,1,0,0,0,1|1,0,0]=3 6938 B13R1.44 CNCCC(=O)NC1CCCCC1 7a_106832991635_100000188762 [0,1,0,0,0,1|1,0,0]=3 6939 B13R1.44 CNCOC(=O)OC1CCOCC1 34a_100102657272_100009898885 [0,1,0,0,0,1|1,0,0]=3 6940 B13R1.44 COC=CC(=O)CC1CCCCC1 1458a_100016268678_100000211423 [0,1,0,0,0,1|1,0,1]=4 6941 B13R1.44 COC=CC(=O)NC1CCCCC1 1626a_100000182618_100016268678 [0,1,0,0,0,1|1,0,1]=4 6942 B13R1.44 COC=CC(=O)NC1CCCCC1 240690a_100000182618_100016268678 [0,1,0,0,0,1|1,0,1]=4 6943 B13R1.44 COCCC(=O)C=C1CCCCC1 1458a_100000743792_100000233755 [0,1,0,0,0,1|1,0,1]=4 6944 B13R1.44 COCCC(=O)CC1CCCCC1 1458a_100000211666_100000233755 [0,1,0,0,0,1|1,0,0]=3 6945 B13R1.44 COCCC(=O)CC1CCCCC1 1458a_100000749529_100000211423 [0,1,0,0,0,1|1,0,0]=3 6946 B13R1.44 COCCC(=O)CC1CCCCO1 1458a_100000238585_100000233755 [0,1,0,0,0,1|2,0,0]=4 6947 B13R1.44 COCCC(=O)CC1CCCCO1 1458a_100000749529_100000211543 [0,1,0,0,0,1|2,0,0]=4 6948 B13R1.44 COCCC(=O)CC1CCCOC1 1458a_100000741523_100000233755 [0,1,0,0,0,1|2,0,0]=4 6949 B13R1.44 COCCC(=O)CC1CCCOC1 1458a_100000749529_100000741521 [0,1,0,0,0,1|2,0,0]=4 6950 B13R1.44 COCCC(=O)CC1CCOCC1 1458a_100000749529_100000754603 [0,1,0,0,0,1|2,0,0]=4 6951 B13R1.44 COCCC(=O)CC1CCOCC1 1458a_100000757261_100000233755 [0,1,0,0,0,1|2,0,0]=4 6952 B13R1.44 COCCC(=O)CN1CCCCC1 1458a_100000740322_100000233755 [0,1,0,0,0,1|2,0,0]=4 6953 B13R1.44 COCCC(=O)NC1CCCCC1 11a_100000182618_100000749529 [0,1,0,0,0,1|1,0,0]=3 6954 B13R1.44 COCCC(=O)NC1CCCCC1 1626a_100000182618_100000749529 [0,1,0,0,0,1|1,0,0]=3 6955 B13R1.44 COCCC(=O)NC1CCCCC1 240690a_100000182618_100000749529 [0,1,0,0,0,1|1,0,0]=3 6956 B13R1.44 COCCC(=O)NC1CCCCC1 527a_100000182618_100000749529 [0,1,0,0,0,1|1,0,0]=3 6957 B13R1.44 COCCC(=O)NC1CCCOC1 11a_100000719290_100000749529 [0,1,0,0,0,1|2,0,0]=4 6958 B13R1.44 COCCC(=O)NC1CCCOC1 1626a_100000719290_100000749529 [0,1,0,0,0,1|2,0,0]=4 6959 B13R1.44 COCCC(=O)NC1CCCOC1 240690a_100000719290_100000749529 [0,1,0,0,0,1|2,0,0]=4 6960 B13R1.44 COCCC(=O)NC1CCCOC1 527a_100000719290_100000749529 [0,1,0,0,0,1|2,0,0]=4 6961 B13R1.44 COCCC(=O)NC1CCOCC1 11a_100000741149_100000749529 [0,1,0,0,0,1|2,0,0]=4 6962 B13R1.44 COCCC(=O)NC1CCOCC1 1626a_100000741149_100000749529 [0,1,0,0,0,1|2,0,0]=4 6963 B13R1.44 COCCC(=O)NC1CCOCC1 240690a_100000741149_100000749529 [0,1,0,0,0,1|2,0,0]=4 6964 B13R1.44 COCCC(=O)NC1CCOCC1 527a_100000741149_100000749529 [0,1,0,0,0,1|2,0,0]=4 6965 B13R1.44 COCCC(=O)NC1CCSCC1 11a_100000748639_100000749529 [0,1,0,0,0,1|2,0,0]=4 6966 B13R1.44 COCCC(=O)NC1CCSCC1 1626a_100000748639_100000749529 [0,1,0,0,0,1|2,0,0]=4 6967 B13R1.44 COCCC(=O)NC1CCSCC1 240690a_100000748639_100000749529 [0,1,0,0,0,1|2,0,0]=4 6968 B13R1.44 COCCC(=O)NC1CCSCC1 527a_100000748639_100000749529 [0,1,0,0,0,1|2,0,0]=4 6969 B13R1.44 COCOC(=O)OC1CCOCC1 34a_100138415774_100009898885 [0,1,0,0,0,1|1,0,0]=3 6970 B13R1.44 CSCCC(=O)C=C1CCCCC1 1458a_100000743792_100000751147 [0,1,0,0,0,1|1,0,1]=4 6971 B13R1.44 CSCCC(=O)CC1CCCCC1 1458a_100000174002_100000211423 [0,1,0,0,0,1|1,0,0]=3 6972 B13R1.44 CSCCC(=O)CC1CCCCC1 1458a_100000211666_100000751147 [0,1,0,0,0,1|1,0,0]=3 6973 B13R1.44 CSCCC(=O)CC1CCCCO1 1458a_100000174002_100000211543 [0,1,0,0,0,1|2,0,0]=4 6974 B13R1.44 CSCCC(=O)CC1CCCCO1 1458a_100000238585_100000751147 [0,1,0,0,0,1|2,0,0]=4 6975 B13R1.44 CSCCC(=O)CC1CCCOC1 1458a_100000174002_100000741521 [0,1,0,0,0,1|2,0,0]=4 6976 B13R1.44 CSCCC(=O)CC1CCCOC1 1458a_100000741523_100000751147 [0,1,0,0,0,1|2,0,0]=4 6977 B13R1.44 CSCCC(=O)CC1CCOCC1 1458a_100000174002_100000754603 [0,1,0,0,0,1|2,0,0]=4 6978 B13R1.44 CSCCC(=O)CC1CCOCC1 1458a_100000757261_100000751147 [0,1,0,0,0,1|2,0,0]=4 6979 B13R1.44 CSCCC(=O)CN1CCCCC1 1458a_100000740322_100000751147 [0,1,0,0,0,1|2,0,0]=4 6980 B13R1.44 CSCCC(=O)NC1CCCCC1 11a_100000182618_100000174002 [0,1,0,0,0,1|1,0,0]=3 6981 B13R1.44 CSCCC(=O)NC1CCCCC1 1626a_100000182618_100000174002 [0,1,0,0,0,1|1,0,0]=3 6982 B13R1.44 CSCCC(=O)NC1CCCCC1 240690a_100000182618_100000174002 [0,1,0,0,0,1|1,0,0]=3 6983 B13R1.44 CSCCC(=O)NC1CCCCC1 527a_100000182618_100000174002 [0,1,0,0,0,1|1,0,0]=3 6984 B13R1.44 CSCCC(=O)NC1CCCCC1 62a_100000188762_200000210301 [0,1,0,0,0,1|1,0,0]=3 6985 B13R1.44 CSCCC(=O)NC1CCCCC1 62a_200000210301_100000188762 [0,1,0,0,0,1|1,0,0]=3 6986 B13R1.44 CSCCC(=O)NC1CCCOC1 11a_100000719290_100000174002 [0,1,0,0,0,1|2,0,0]=4 6987 B13R1.44 CSCCC(=O)NC1CCCOC1 1626a_100000719290_100000174002 [0,1,0,0,0,1|2,0,0]=4 6988 B13R1.44 CSCCC(=O)NC1CCCOC1 240690a_100000719290_100000174002 [0,1,0,0,0,1|2,0,0]=4 6989 B13R1.44 CSCCC(=O)NC1CCCOC1 527a_100000719290_100000174002 [0,1,0,0,0,1|2,0,0]=4 6990 B13R1.44 CSCCC(=O)NC1CCOCC1 11a_100000741149_100000174002 [0,1,0,0,0,1|2,0,0]=4 6991 B13R1.44 CSCCC(=O)NC1CCOCC1 1626a_100000741149_100000174002 [0,1,0,0,0,1|2,0,0]=4 6992 B13R1.44 CSCCC(=O)NC1CCOCC1 240690a_100000741149_100000174002 [0,1,0,0,0,1|2,0,0]=4 6993 B13R1.44 CSCCC(=O)NC1CCOCC1 527a_100000741149_100000174002 [0,1,0,0,0,1|2,0,0]=4 6994 B13R1.44 CSCCC(=O)NC1CCSCC1 11a_100000748639_100000174002 [0,1,0,0,0,1|2,0,0]=4 6995 B13R1.44 CSCCC(=O)NC1CCSCC1 1626a_100000748639_100000174002 [0,1,0,0,0,1|2,0,0]=4 6996 B13R1.44 CSCCC(=O)NC1CCSCC1 240690a_100000748639_100000174002 [0,1,0,0,0,1|2,0,0]=4 6997 B13R1.44 CSCCC(=O)NC1CCSCC1 527a_100000748639_100000174002 [0,1,0,0,0,1|2,0,0]=4 6998 B13R1.44 CSCOC(=O)OC1CCOCC1 62a_100009898885_200000210301 [0,1,0,0,0,1|1,0,0]=3 6999 B13R1.44 CSCOC(=O)OC1CCOCC1 62a_200000210301_100009898885 [0,1,0,0,0,1|1,0,0]=3 7000 B13R1.44 N#CCCC(=O)CC1CCCCC1 1458a_100000211666_100011215226 [0,1,0,0,0,1|1,0,1]=4 7001 B13R1.44 N#CCCC(=O)CC1CCCCC1 1458a_100011934036_100000211423 [0,1,0,0,0,1|1,0,1]=4 7002 B13R1.44 N#CCCC(=O)NC1CCCCC1 11a_100000182618_100011934036 [0,1,0,0,0,1|1,0,1]=4 7003 B13R1.44 N#CCCC(=O)NC1CCCCC1 1626a_100000182618_100011934036 [0,1,0,0,0,1|1,0,1]=4 7004 B13R1.44 N#CCCC(=O)NC1CCCCC1 240690a_100000182618_100011934036 [0,1,0,0,0,1|1,0,1]=4 7005 B13R1.44 N#CCCC(=O)NC1CCCCC1 527a_100000182618_100011934036 [0,1,0,0,0,1|1,0,1]=4 7006 B13R1.44 N#CCNC(=O)CC1CCCCC1 1626a_100000734998_100000211666 [0,1,0,0,0,1|1,0,1]=4 7007 B13R1.44 N#CCNC(=O)CC1CCCCC1 527a_100000734998_100000211666 [0,1,0,0,0,1|1,0,1]=4 7008 B13R1.44 N#CCNC(=O)NC1CCCCC1 2708a_100000734998_100000182618 [0,1,0,0,0,1|1,0,1]=4 7009 B13R1.44 N#CCNC(=O)NC1CCCCC1 273464a_100000182618_100000734998 [0,1,0,0,0,1|1,0,1]=4 7010 B13R1.44 N#CCNC(=O)NC1CCCCC1 273464a_100000734998_100000182618 [0,1,0,0,0,1|1,0,1]=4 7011 B13R1.44 O=C(C#CCO)CC1CCCCC1 1458a_100000049017_100000211423 [0,1,0,0,0,1|1,0,1]=4 7012 B13R1.44 O=C(C=C1CCCCC1)CCCF 1458a_100000743792_100011934791 [0,1,0,0,0,1|1,0,1]=4 7013 B13R1.44 O=C(C=C1CCCCC1)CCCO 1458a_100000743792_100011215043 [0,1,0,0,0,1|1,0,1]=4 7014 B13R1.44 O=C(C=C1CCCCC1)NCCF 11a_100000724931_100000743792 [0,1,0,0,0,1|1,0,1]=4 7015 B13R1.44 O=C(C=C1CCCCC1)NCCF 1626a_100000724931_100000743792 [0,1,0,0,0,1|1,0,1]=4 7016 B13R1.44 O=C(C=C1CCCCC1)NCCF 240690a_100000724931_100000743792 [0,1,0,0,0,1|1,0,1]=4 7017 B13R1.44 O=C(C=C1CCCCC1)NCCO 240690a_100000210304_100000743792 [0,1,0,0,0,1|1,0,1]=4 7018 B13R1.44 O=C(CC1CCCCC1)NCCF 11a_100000724931_100000211666 [0,1,0,0,0,1|1,0,0]=3 7019 B13R1.44 O=C(CC1CCCCC1)NCCF 1626a_100000724931_100000211666 [0,1,0,0,0,1|1,0,0]=3 7020 B13R1.44 O=C(CC1CCCCC1)NCCF 240690a_100000724931_100000211666 [0,1,0,0,0,1|1,0,0]=3 7021 B13R1.44 O=C(CC1CCCCC1)NCCF 527a_100000724931_100000211666 [0,1,0,0,0,1|1,0,0]=3 7022 B13R1.44 O=C(CC1CCCCC1)NCCO 240690a_100000210304_100000211666 [0,1,0,0,0,1|1,0,0]=3 7023 B13R1.44 O=C(CC1CCCCC1)NCCO 527a_100000210304_100000211666 [0,1,0,0,0,1|1,0,0]=3 7024 B13R1.44 O=C(CC1CCCCO1)NCCF 11a_100000724931_100000238585 [0,1,0,0,0,1|2,0,0]=4 7025 B13R1.44 O=C(CC1CCCCO1)NCCF 1626a_100000724931_100000238585 [0,1,0,0,0,1|2,0,0]=4 7026 B13R1.44 O=C(CC1CCCCO1)NCCF 240690a_100000724931_100000238585 [0,1,0,0,0,1|2,0,0]=4 7027 B13R1.44 O=C(CC1CCCCO1)NCCF 527a_100000724931_100000238585 [0,1,0,0,0,1|2,0,0]=4 7028 B13R1.44 O=C(CC1CCCCO1)NCCO 240690a_100000210304_100000238585 [0,1,0,0,0,1|2,0,0]=4 7029 B13R1.44 O=C(CC1CCCCO1)NCCO 527a_100000210304_100000238585 [0,1,0,0,0,1|2,0,0]=4 7030 B13R1.44 O=C(CC1CCCOC1)NCCF 11a_100000724931_100000741523 [0,1,0,0,0,1|2,0,0]=4 7031 B13R1.44 O=C(CC1CCCOC1)NCCF 1626a_100000724931_100000741523 [0,1,0,0,0,1|2,0,0]=4 7032 B13R1.44 O=C(CC1CCCOC1)NCCF 240690a_100000724931_100000741523 [0,1,0,0,0,1|2,0,0]=4 7033 B13R1.44 O=C(CC1CCCOC1)NCCF 527a_100000724931_100000741523 [0,1,0,0,0,1|2,0,0]=4 7034 B13R1.44 O=C(CC1CCCOC1)NCCO 240690a_100000210304_100000741523 [0,1,0,0,0,1|2,0,0]=4 7035 B13R1.44 O=C(CC1CCCOC1)NCCO 527a_100000210304_100000741523 [0,1,0,0,0,1|2,0,0]=4 7036 B13R1.44 O=C(CC1CCOCC1)NCCF 11a_100000724931_100000757261 [0,1,0,0,0,1|2,0,0]=4 7037 B13R1.44 O=C(CC1CCOCC1)NCCF 1626a_100000724931_100000757261 [0,1,0,0,0,1|2,0,0]=4 7038 B13R1.44 O=C(CC1CCOCC1)NCCF 240690a_100000724931_100000757261 [0,1,0,0,0,1|2,0,0]=4 7039 B13R1.44 O=C(CC1CCOCC1)NCCF 527a_100000724931_100000757261 [0,1,0,0,0,1|2,0,0]=4 7040 B13R1.44 O=C(CC1CCOCC1)NCCO 240690a_100000210304_100000757261 [0,1,0,0,0,1|2,0,0]=4 7041 B13R1.44 O=C(CC1CCOCC1)NCCO 527a_100000210304_100000757261 [0,1,0,0,0,1|2,0,0]=4 7042 B13R1.44 O=C(CCCF)CC1CCCCC1 1458a_100000211666_100011934791 [0,1,0,0,0,1|1,0,0]=3 7043 B13R1.44 O=C(CCCF)CC1CCCCO1 1458a_100000238585_100011934791 [0,1,0,0,0,1|2,0,0]=4 7044 B13R1.44 O=C(CCCF)CC1CCCOC1 1458a_100000741523_100011934791 [0,1,0,0,0,1|2,0,0]=4 7045 B13R1.44 O=C(CCCF)CC1CCOCC1 1458a_100000757261_100011934791 [0,1,0,0,0,1|2,0,0]=4 7046 B13R1.44 O=C(CCCF)CN1CCCCC1 1458a_100000740322_100011934791 [0,1,0,0,0,1|2,0,0]=4 7047 B13R1.44 O=C(CCCO)CC1CCCCC1 1458a_100000211666_100011215043 [0,1,0,0,0,1|1,0,0]=3 7048 B13R1.44 O=C(CCCO)CC1CCCCO1 1458a_100000238585_100011215043 [0,1,0,0,0,1|2,0,0]=4 7049 B13R1.44 O=C(CCCO)CC1CCCOC1 1458a_100000741523_100011215043 [0,1,0,0,0,1|2,0,0]=4 7050 B13R1.44 O=C(CCCO)CC1CCOCC1 1458a_100000757261_100011215043 [0,1,0,0,0,1|2,0,0]=4 7051 B13R1.44 O=C(CCCO)CN1CCCCC1 1458a_100000740322_100011215043 [0,1,0,0,0,1|2,0,0]=4 7052 B13R1.44 O=C(CN1CCCCC1)NCCF 11a_100000724931_100000740322 [0,1,0,0,0,1|2,0,0]=4 7053 B13R1.44 O=C(CN1CCCCC1)NCCF 240690a_100000724931_100000740322 [0,1,0,0,0,1|2,0,0]=4 7054 B13R1.44 O=C(CN1CCCCC1)NCCF 527a_100000724931_100000740322 [0,1,0,0,0,1|2,0,0]=4 7055 B13R1.44 O=C(CN1CCCCC1)NCCO 240690a_100000210304_100000740322 [0,1,0,0,0,1|2,0,0]=4 7056 B13R1.44 O=C(CN1CCCCC1)NCCO 527a_100000210304_100000740322 [0,1,0,0,0,1|2,0,0]=4 7057 B13R1.44 O=C(CSCF)NC1CCCCC1 62a_100000183541_100015361967 [0,1,0,0,0,1|1,1,0]=4 7058 B13R1.44 O=C(CSCF)NC1CCCCC1 62a_100015361967_100000183541 [0,1,0,0,0,1|1,1,0]=4 7059 B13R1.44 O=C(CSCF)OC1CCCCC1 62a_100000041653_100015361967 [0,1,0,0,0,1|1,1,0]=4 7060 B13R1.44 O=C(CSCF)OC1CCCCC1 62a_100015361967_100000041653 [0,1,0,0,0,1|1,1,0]=4 7061 B13R1.44 O=C(NCCF)NC1CCCCC1 2708a_100000182618_100000724931 [0,1,0,0,0,1|1,0,0]=3 7062 B13R1.44 O=C(NCCF)NC1CCCCC1 273464a_100000182618_100000724931 [0,1,0,0,0,1|1,0,0]=3 7063 B13R1.44 O=C(NCCF)NC1CCCCC1 273464a_100000724931_100000182618 [0,1,0,0,0,1|1,0,0]=3 7064 B13R1.44 O=C(NCCF)NC1CCCOC1 2708a_100000719290_100000724931 [0,1,0,0,0,1|2,0,0]=4 7065 B13R1.44 O=C(NCCF)NC1CCCOC1 273464a_100000719290_100000724931 [0,1,0,0,0,1|2,0,0]=4 7066 B13R1.44 O=C(NCCF)NC1CCCOC1 273464a_100000724931_100000719290 [0,1,0,0,0,1|2,0,0]=4 7067 B13R1.44 O=C(NCCF)NC1CCCOC1 512a_100000719290_100000724931 [0,1,0,0,0,1|2,0,0]=4 7068 B13R1.44 O=C(NCCF)NC1CCOCC1 2708a_100000741149_100000724931 [0,1,0,0,0,1|2,0,0]=4 7069 B13R1.44 O=C(NCCF)NC1CCOCC1 273464a_100000724931_100000741149 [0,1,0,0,0,1|2,0,0]=4 7070 B13R1.44 O=C(NCCF)NC1CCOCC1 273464a_100000741149_100000724931 [0,1,0,0,0,1|2,0,0]=4 7071 B13R1.44 O=C(NCCF)NC1CCOCC1 512a_100000741149_100000724931 [0,1,0,0,0,1|2,0,0]=4 7072 B13R1.44 O=C(NCCF)NC1CCSCC1 2708a_100000748639_100000724931 [0,1,0,0,0,1|2,0,0]=4 7073 B13R1.44 O=C(NCCF)NC1CCSCC1 273464a_100000724931_100000748639 [0,1,0,0,0,1|2,0,0]=4 7074 B13R1.44 O=C(NCCF)NC1CCSCC1 273464a_100000748639_100000724931 [0,1,0,0,0,1|2,0,0]=4 7075 B13R1.44 O=C(NCCF)NC1CCSCC1 512a_100000748639_100000724931 [0,1,0,0,0,1|2,0,0]=4 7076 B13R1.44 O=C(NCCO)NC1CCCCC1 2708a_100000182618_100000210304 [0,1,0,0,0,1|1,0,0]=3 7077 B13R1.44 O=C(NCCO)NC1CCCCC1 273464a_100000182618_100000210304 [0,1,0,0,0,1|1,0,0]=3 7078 B13R1.44 O=C(NCCO)NC1CCCCC1 273464a_100000210304_100000182618 [0,1,0,0,0,1|1,0,0]=3 7079 B13R1.44 O=C(NCCO)NC1CCCOC1 2708a_100000719290_100000210304 [0,1,0,0,0,1|2,0,0]=4 7080 B13R1.44 O=C(NCCO)NC1CCCOC1 273464a_100000210304_100000719290 [0,1,0,0,0,1|2,0,0]=4 7081 B13R1.44 O=C(NCCO)NC1CCCOC1 273464a_100000719290_100000210304 [0,1,0,0,0,1|2,0,0]=4 7082 B13R1.44 O=C(NCCO)NC1CCCOC1 512a_100000719290_100000210304 [0,1,0,0,0,1|2,0,0]=4 7083 B13R1.44 O=C(NCCO)NC1CCOCC1 2708a_100000741149_100000210304 [0,1,0,0,0,1|2,0,0]=4 7084 B13R1.44 O=C(NCCO)NC1CCOCC1 273464a_100000210304_100000741149 [0,1,0,0,0,1|2,0,0]=4 7085 B13R1.44 O=C(NCCO)NC1CCOCC1 273464a_100000741149_100000210304 [0,1,0,0,0,1|2,0,0]=4 7086 B13R1.44 O=C(NCCO)NC1CCOCC1 512a_100000741149_100000210304 [0,1,0,0,0,1|2,0,0]=4 7087 B13R1.44 O=C(NCCO)NC1CCSCC1 2708a_100000748639_100000210304 [0,1,0,0,0,1|2,0,0]=4 7088 B13R1.44 O=C(NCCO)NC1CCSCC1 273464a_100000210304_100000748639 [0,1,0,0,0,1|2,0,0]=4 7089 B13R1.44 O=C(NCCO)NC1CCSCC1 273464a_100000748639_100000210304 [0,1,0,0,0,1|2,0,0]=4 7090 B13R1.44 O=C(NCCO)NC1CCSCC1 512a_100000748639_100000210304 [0,1,0,0,0,1|2,0,0]=4 7091 B13R1.44 [13CH3]NCCC(=O)NC1CCCCC1 2230a_100000743080_200025704644 [0,1,0,0,0,1|1,0,0]=3 7092 B13R1.44 [13CH3]NCCC(=O)NC1CCCCC1 34a_100000743080_200025704644 [0,1,0,0,0,1|1,0,0]=3 7093 B13R1.44 [13CH3]SCCC(=O)NC1CCCCC1 62a_100000188762_200025704644 [0,1,0,0,0,1|1,0,0]=3 7094 B13R1.44 [13CH3]SCCC(=O)NC1CCCCC1 62a_200025704644_100000188762 [0,1,0,0,0,1|1,0,0]=3 7095 B13R1.44 [13CH3]SCOC(=O)OC1CCOCC1 62a_100009898885_200025704644 [0,1,0,0,0,1|1,0,0]=3 7096 B13R1.44 [13CH3]SCOC(=O)OC1CCOCC1 62a_200025704644_100009898885 [0,1,0,0,0,1|1,0,0]=3 7097 B13R1.47 CC(C(=O)CCF)C1CCCCC1 1458a_100011435303_100011217306 [0,1,0,0,0,1|2,0,0]=4 7098 B13R1.47 CC(C(=O)CCO)C1CCCCC1 1458a_100011435303_100000211926 [0,1,0,0,0,1|2,0,0]=4 7099 B13R1.47 CC/C=C(\C)/C(=O)C1CCCCC1 1458a_100016988807_100000210327 [0,1,0,0,0,1|2,0,0]=4 7100 B13R1.47 CC=CC(=O)N(C)C1CCCCC1 11a_100000207522_100000210699 [0,1,0,0,0,1|1,0,1]=4 7101 B13R1.47 CC=CC(=O)N(C)C1CCCCC1 1626a_100000207522_100000210699 [0,1,0,0,0,1|1,0,1]=4 7102 B13R1.47 CC=CC(=O)N(C)C1CCCCC1 240690a_100000207522_100000210699 [0,1,0,0,0,1|1,0,1]=4 7103 B13R1.47 CCCC(=O)C(=O)N1CCCCC1 1458a_200011297168_100000210303 [0,1,0,0,0,1|2,0,0]=4 7104 B13R1.47 CCCC(=O)C(C)C1CCCCC1 1458a_100011435303_100000210303 [0,1,0,0,0,1|1,0,0]=3 7105 B13R1.47 CCCC(=O)C(O)C1CCCCC1 1458a_100000242593_100000210303 [0,1,0,0,0,1|1,0,0]=3 7106 B13R1.47 CCCC(=O)N(C)C1CCCCC1 11a_100000207522_100000211992 [0,1,0,0,0,1|1,0,0]=3 7107 B13R1.47 CCCC(=O)N(C)C1CCCCC1 1626a_100000207522_100000211992 [0,1,0,0,0,1|1,0,0]=3 7108 B13R1.47 CCCC(=O)N(C)C1CCCCC1 240690a_100000207522_100000211992 [0,1,0,0,0,1|1,0,0]=3 7109 B13R1.47 CCCC(=O)N(C)C1CCCCC1 527a_100000207522_100000211992 [0,1,0,0,0,1|1,0,0]=3 7110 B13R1.47 CCCC(=O)N(C)C1CCOCC1 11a_100020587155_100000211992 [0,1,0,0,0,1|2,0,0]=4 7111 B13R1.47 CCCC(=O)N(C)C1CCOCC1 1626a_100020587155_100000211992 [0,1,0,0,0,1|2,0,0]=4 7112 B13R1.47 CCCC(=O)N(C)C1CCOCC1 240690a_100020587155_100000211992 [0,1,0,0,0,1|2,0,0]=4 7113 B13R1.47 CCCC(=O)N(C)C1CCOCC1 527a_100020587155_100000211992 [0,1,0,0,0,1|2,0,0]=4 7114 B13R1.47 CCCC(=O)N(C)C1CCSCC1 11a_100015184757_100000211992 [0,1,0,0,0,1|2,0,0]=4 7115 B13R1.47 CCCC(=O)N(C)C1CCSCC1 240690a_100015184757_100000211992 [0,1,0,0,0,1|2,0,0]=4 7116 B13R1.47 CCCC(=O)N(C)C1CCSCC1 527a_100015184757_100000211992 [0,1,0,0,0,1|2,0,0]=4 7117 B13R1.47 CCNC(=O)C(=O)C1CCCCC1 1458a_200011297158_100000210327 [0,1,0,0,0,1|1,0,0]=3 7118 B13R1.47 CCNC(=O)C(=O)C1CCCOC1 1458a_200011297158_100000693364 [0,1,0,0,0,1|2,0,0]=4 7119 B13R1.47 CCNC(=O)C(=O)C1CCOCC1 1458a_200011297158_100011324220 [0,1,0,0,0,1|2,0,0]=4 7120 B13R1.47 CCNC(=O)C(=O)N1CCCCC1 240690a_100015525214_200011297168 [0,1,0,0,0,1|2,0,0]=4 7121 B13R1.47 CCNC(=O)C(=O)N1CCCCC1 527a_100015525214_200011297168 [0,1,0,0,0,1|2,0,0]=4 7122 B13R1.47 CCNC(=O)C(C)C1CCCCC1 11a_100015525214_100011435303 [0,1,0,0,0,1|1,0,0]=3 7123 B13R1.47 CCNC(=O)C(C)C1CCCCC1 240690a_100015525214_100011435303 [0,1,0,0,0,1|1,0,0]=3 7124 B13R1.47 CCNC(=O)C(C)C1CCCCC1 527a_100015525214_100011435303 [0,1,0,0,0,1|1,0,0]=3 7125 B13R1.47 CCNC(=O)C(O)C1CCCCC1 240690a_100015525214_100000242593 [0,1,0,0,0,1|1,0,0]=3 7126 B13R1.47 CCNC(=O)N(C)C1CCCCC1 2708a_100015525214_100000207522 [0,1,0,0,0,1|1,0,0]=3 7127 B13R1.47 CCNC(=O)N(C)C1CCCCC1 273464a_100015525214_100000207522 [0,1,0,0,0,1|1,0,0]=3 7128 B13R1.47 CCNC(=O)N(C)C1CCOCC1 2708a_100015525214_100020587155 [0,1,0,0,0,1|2,0,0]=4 7129 B13R1.47 CCNC(=O)N(C)C1CCOCC1 273464a_100015525214_100020587155 [0,1,0,0,0,1|2,0,0]=4 7130 B13R1.47 CCNC(=O)N(C)C1CCSCC1 2708a_100015525214_100015184757 [0,1,0,0,0,1|2,0,0]=4 7131 B13R1.47 CCNC(=O)N(C)C1CCSCC1 273464a_100015525214_100015184757 [0,1,0,0,0,1|2,0,0]=4 7132 B13R1.47 CCOC(=O)C(=O)N1CCCOC1 11a_100000131196_100014798877 [0,1,0,0,0,1|2,0,0]=4 7133 B13R1.47 CCOC(=O)C(=O)N1CCCOC1 240690a_100000131196_100014798877 [0,1,0,0,0,1|2,0,0]=4 7134 B13R1.47 CCOC(=O)C(=O)N1CCOCC1 11a_100015191051_100014798877 [0,1,0,0,0,1|2,0,0]=4 7135 B13R1.47 CCOC(=O)C(=O)N1CCOCC1 1626a_100015191051_100014798877 [0,1,0,0,0,1|2,0,0]=4 7136 B13R1.47 CCOC(=O)C(=O)N1CCOCC1 240690a_100015191051_100014798877 [0,1,0,0,0,1|2,0,0]=4 7137 B13R1.47 CCOC(=O)C(=O)N1CCSCC1 11a_100000737611_100014798877 [0,1,0,0,0,1|2,0,0]=4 7138 B13R1.47 CCOC(=O)C(=O)N1CCSCC1 240690a_100000737611_100014798877 [0,1,0,0,0,1|2,0,0]=4 7139 B13R1.47 CCOC(=O)C(C)N1CCCOC1 2230a_100000131196_100011215307 [0,1,0,0,0,1|2,0,0]=4 7140 B13R1.47 CCOC(=O)C(C)N1CCCOC1 269982a_100000131196_100011216346 [0,1,0,0,0,1|2,0,0]=4 7141 B13R1.47 CCOC(=O)C(C)N1CCCOC1 34a_100000131196_100011216346 [0,1,0,0,0,1|2,0,0]=4 7142 B13R1.47 CCOC(=O)C(C)N1CCOCC1 2230a_100015191051_100011215307 [0,1,0,0,0,1|2,0,0]=4 7143 B13R1.47 CCOC(=O)C(C)N1CCOCC1 269982a_100015191051_100011216346 [0,1,0,0,0,1|2,0,0]=4 7144 B13R1.47 CCOC(=O)C(C)N1CCOCC1 34a_100015191051_100011216346 [0,1,0,0,0,1|2,0,0]=4 7145 B13R1.47 CCOC(=O)C(C)N1CCSCC1 2230a_100000737611_100011215307 [0,1,0,0,0,1|2,0,0]=4 7146 B13R1.47 CCOC(=O)C(C)N1CCSCC1 269982a_100000737611_100011216346 [0,1,0,0,0,1|2,0,0]=4 7147 B13R1.47 CCOC(=O)C(F)N1CCCOC1 2230a_100000131196_100000760018 [0,1,0,0,0,1|2,0,0]=4 7148 B13R1.47 CCOC(=O)C(F)N1CCCOC1 269982a_100000131196_100000760018 [0,1,0,0,0,1|2,0,0]=4 7149 B13R1.47 CCOC(=O)C(F)N1CCCOC1 34a_100000131196_100000760018 [0,1,0,0,0,1|2,0,0]=4 7150 B13R1.47 CCOC(=O)C(F)N1CCOCC1 2230a_100015191051_100000760018 [0,1,0,0,0,1|2,0,0]=4 7151 B13R1.47 CCOC(=O)C(F)N1CCOCC1 269982a_100015191051_100000760018 [0,1,0,0,0,1|2,0,0]=4 7152 B13R1.47 CCOC(=O)C(F)N1CCOCC1 34a_100015191051_100000760018 [0,1,0,0,0,1|2,0,0]=4 7153 B13R1.47 CCOC(=O)C(F)N1CCSCC1 2230a_100000737611_100000760018 [0,1,0,0,0,1|2,0,0]=4 7154 B13R1.47 CCOC(=O)C(F)N1CCSCC1 269982a_100000737611_100000760018 [0,1,0,0,0,1|2,0,0]=4 7155 B13R1.47 CCOC(C)C(=O)C1CCCCC1 1458a_100000739345_100000210327 [0,1,0,0,0,1|1,0,1]=4 7156 B13R1.47 CN(C(=O)CCO)C1CCCCC1 240690a_100000207522_100011216618 [0,1,0,0,0,1|2,0,0]=4 7157 B13R1.47 CN(C(=O)CS[13CH3])C1CCCCC1 62a_100000183405_200025704644 [0,1,0,0,0,1|2,0,0]=4 7158 B13R1.47 CN(C(=O)CS[13CH3])C1CCCCC1 62a_200025704644_100000183405 [0,1,0,0,0,1|2,0,0]=4 7159 B13R1.47 CNCC(=O)N(C)C1CCCCC1 2230a_106832991635_100000183405 [0,1,0,0,0,1|2,0,0]=4 7160 B13R1.47 CNCC(=O)N(C)C1CCCCC1 34a_100102657272_100000183405 [0,1,0,0,0,1|2,0,0]=4 7161 B13R1.47 CNCC(=O)N(C)C1CCCCC1 7a_106832991635_100000183405 [0,1,0,0,0,1|2,0,0]=4 7162 B13R1.47 CNNC(=O)C(C)C1CCCCC1 22a_100016993582_100011435303 [0,1,0,0,0,1|2,0,0]=4 7163 B13R1.47 CNNC(=O)C(O)C1CCCCC1 22a_100016993582_100000242593 [0,1,0,0,0,1|2,0,0]=4 7164 B13R1.47 COCC(=O)N(C)C1CCCCC1 11a_100000207522_100000210968 [0,1,0,0,0,1|2,0,0]=4 7165 B13R1.47 COCC(=O)N(C)C1CCCCC1 1626a_100000207522_100000210968 [0,1,0,0,0,1|2,0,0]=4 7166 B13R1.47 COCC(=O)N(C)C1CCCCC1 240690a_100000207522_100000210968 [0,1,0,0,0,1|2,0,0]=4 7167 B13R1.47 COCC(=O)N(C)C1CCCCC1 34a_100138415774_100000183405 [0,1,0,0,0,1|2,0,0]=4 7168 B13R1.47 COCC(=O)N(C)C1CCCCC1 527a_100000207522_100000210968 [0,1,0,0,0,1|2,0,0]=4 7169 B13R1.47 CSCC(=O)N(C)C1CCCCC1 11a_100000207522_100000184570 [0,1,0,0,0,1|2,0,0]=4 7170 B13R1.47 CSCC(=O)N(C)C1CCCCC1 1626a_100000207522_100000184570 [0,1,0,0,0,1|2,0,0]=4 7171 B13R1.47 CSCC(=O)N(C)C1CCCCC1 240690a_100000207522_100000184570 [0,1,0,0,0,1|2,0,0]=4 7172 B13R1.47 CSCC(=O)N(C)C1CCCCC1 527a_100000207522_100000184570 [0,1,0,0,0,1|2,0,0]=4 7173 B13R1.47 CSCC(=O)N(C)C1CCCCC1 62a_100000183405_200000210301 [0,1,0,0,0,1|2,0,0]=4 7174 B13R1.47 CSCC(=O)N(C)C1CCCCC1 62a_200000210301_100000183405 [0,1,0,0,0,1|2,0,0]=4 7175 B13R1.47 O=C(CCF)C(O)C1CCCCC1 1458a_100000242593_100011217306 [0,1,0,0,0,1|2,0,0]=4 7176 B13R1.47 O=C(CCO)C(O)C1CCCCC1 1458a_100000242593_100000211926 [0,1,0,0,0,1|2,0,0]=4 7177 B13R1.135 C/C=C(\C)/C(=O)CC1CCCCC1 1458a_100020587367_100000211423 [0,1,0,0,0,1|1,0,1]=4 7178 B13R1.135 C/C=C(\C)/C(=O)NC1CCCCC1 11a_100000182618_100020587367 [0,1,0,0,0,1|1,0,1]=4 7179 B13R1.135 C/C=C(\C)/C(=O)NC1CCCCC1 1626a_100000182618_100020587367 [0,1,0,0,0,1|1,0,1]=4 7180 B13R1.135 CC(S[13CH3])C(=O)NC1CCCCC1 62a_100000184452_200025704644 [0,1,0,0,0,1|2,0,0]=4 7181 B13R1.135 CC(S[13CH3])C(=O)NC1CCCCC1 62a_200025704644_100000184452 [0,1,0,0,0,1|2,0,0]=4 7182 B13R1.135 CCC(=O)C(=O)NC1CCCCC1 1458a_200011297149_100000210202 [0,1,0,0,0,1|1,0,0]=3 7183 B13R1.135 CCC(C)C(=O)C=C1CCCCC1 1458a_100000743792_100000758301 [0,1,0,0,0,1|1,0,1]=4 7184 B13R1.135 CCC(C)C(=O)CC1CCCCC1 1458a_100000211666_100000758301 [0,1,0,0,0,1|1,0,0]=3 7185 B13R1.135 CCC(C)C(=O)CC1CCCCC1 1458a_100011192722_100000211423 [0,1,0,0,0,1|1,0,0]=3 7186 B13R1.135 CCC(C)C(=O)CC1CCCCO1 1458a_100000238585_100000758301 [0,1,0,0,0,1|2,0,0]=4 7187 B13R1.135 CCC(C)C(=O)CC1CCCCO1 1458a_100011192722_100000211543 [0,1,0,0,0,1|2,0,0]=4 7188 B13R1.135 CCC(C)C(=O)CC1CCCOC1 1458a_100000741523_100000758301 [0,1,0,0,0,1|2,0,0]=4 7189 B13R1.135 CCC(C)C(=O)CC1CCCOC1 1458a_100011192722_100000741521 [0,1,0,0,0,1|2,0,0]=4 7190 B13R1.135 CCC(C)C(=O)CC1CCOCC1 1458a_100000757261_100000758301 [0,1,0,0,0,1|2,0,0]=4 7191 B13R1.135 CCC(C)C(=O)CC1CCOCC1 1458a_100011192722_100000754603 [0,1,0,0,0,1|2,0,0]=4 7192 B13R1.135 CCC(C)C(=O)CN1CCCCC1 1458a_100000740322_100000758301 [0,1,0,0,0,1|2,0,0]=4 7193 B13R1.135 CCC(C)C(=O)NC1CCCCC1 11a_100000182618_100011192722 [0,1,0,0,0,1|1,0,0]=3 7194 B13R1.135 CCC(C)C(=O)NC1CCCCC1 1626a_100000182618_100011192722 [0,1,0,0,0,1|1,0,0]=3 7195 B13R1.135 CCC(C)C(=O)NC1CCCCC1 240690a_100000182618_100011192722 [0,1,0,0,0,1|1,0,0]=3 7196 B13R1.135 CCC(C)C(=O)NC1CCCCC1 527a_100000182618_100011192722 [0,1,0,0,0,1|1,0,0]=3 7197 B13R1.135 CCC(C)C(=O)NC1CCCOC1 11a_100000719290_100011192722 [0,1,0,0,0,1|2,0,0]=4 7198 B13R1.135 CCC(C)C(=O)NC1CCCOC1 1626a_100000719290_100011192722 [0,1,0,0,0,1|2,0,0]=4 7199 B13R1.135 CCC(C)C(=O)NC1CCCOC1 240690a_100000719290_100011192722 [0,1,0,0,0,1|2,0,0]=4 7200 B13R1.135 CCC(C)C(=O)NC1CCCOC1 527a_100000719290_100011192722 [0,1,0,0,0,1|2,0,0]=4 7201 B13R1.135 CCC(C)C(=O)NC1CCOCC1 11a_100000741149_100011192722 [0,1,0,0,0,1|2,0,0]=4 7202 B13R1.135 CCC(C)C(=O)NC1CCOCC1 1626a_100000741149_100011192722 [0,1,0,0,0,1|2,0,0]=4 7203 B13R1.135 CCC(C)C(=O)NC1CCOCC1 240690a_100000741149_100011192722 [0,1,0,0,0,1|2,0,0]=4 7204 B13R1.135 CCC(C)C(=O)NC1CCOCC1 527a_100000741149_100011192722 [0,1,0,0,0,1|2,0,0]=4 7205 B13R1.135 CCC(C)C(=O)NC1CCSCC1 11a_100000748639_100011192722 [0,1,0,0,0,1|2,0,0]=4 7206 B13R1.135 CCC(C)C(=O)NC1CCSCC1 1626a_100000748639_100011192722 [0,1,0,0,0,1|2,0,0]=4 7207 B13R1.135 CCC(C)C(=O)NC1CCSCC1 240690a_100000748639_100011192722 [0,1,0,0,0,1|2,0,0]=4 7208 B13R1.135 CCC(C)C(=O)NC1CCSCC1 527a_100000748639_100011192722 [0,1,0,0,0,1|2,0,0]=4 7209 B13R1.135 CCC(O)C(=O)CC1CCCCC1 1458a_100011196387_100000211423 [0,1,0,0,0,1|1,0,0]=3 7210 B13R1.135 CCC(O)C(=O)CC1CCCCO1 1458a_100011196387_100000211543 [0,1,0,0,0,1|2,0,0]=4 7211 B13R1.135 CCC(O)C(=O)CC1CCCOC1 1458a_100011196387_100000741521 [0,1,0,0,0,1|2,0,0]=4 7212 B13R1.135 CCC(O)C(=O)CC1CCOCC1 1458a_100011196387_100000754603 [0,1,0,0,0,1|2,0,0]=4 7213 B13R1.135 CCC(O)C(=O)NC1CCCCC1 240690a_100000182618_100011196387 [0,1,0,0,0,1|1,0,0]=3 7214 B13R1.135 CCC(O)C(=O)NC1CCCOC1 240690a_100000719290_100011196387 [0,1,0,0,0,1|2,0,0]=4 7215 B13R1.135 CCC(O)C(=O)NC1CCOCC1 240690a_100000741149_100011196387 [0,1,0,0,0,1|2,0,0]=4 7216 B13R1.135 CCC(O)C(=O)NC1CCSCC1 240690a_100000748639_100011196387 [0,1,0,0,0,1|2,0,0]=4 7217 B13R1.135 CCN(C)C(=O)C=C1CCCCC1 11a_100000225621_100000743792 [0,1,0,0,0,1|1,0,1]=4 7218 B13R1.135 CCN(C)C(=O)C=C1CCCCC1 1626a_100000225621_100000743792 [0,1,0,0,0,1|1,0,1]=4 7219 B13R1.135 CCN(C)C(=O)C=C1CCCCC1 240690a_100000225621_100000743792 [0,1,0,0,0,1|1,0,1]=4 7220 B13R1.135 CCN(C)C(=O)CC1CCCCC1 11a_100000225621_100000211666 [0,1,0,0,0,1|1,0,0]=3 7221 B13R1.135 CCN(C)C(=O)CC1CCCCC1 1626a_100000225621_100000211666 [0,1,0,0,0,1|1,0,0]=3 7222 B13R1.135 CCN(C)C(=O)CC1CCCCC1 240690a_100000225621_100000211666 [0,1,0,0,0,1|1,0,0]=3 7223 B13R1.135 CCN(C)C(=O)CC1CCCCC1 527a_100000225621_100000211666 [0,1,0,0,0,1|1,0,0]=3 7224 B13R1.135 CCN(C)C(=O)CC1CCCCO1 11a_100000225621_100000238585 [0,1,0,0,0,1|2,0,0]=4 7225 B13R1.135 CCN(C)C(=O)CC1CCCCO1 1626a_100000225621_100000238585 [0,1,0,0,0,1|2,0,0]=4 7226 B13R1.135 CCN(C)C(=O)CC1CCCCO1 240690a_100000225621_100000238585 [0,1,0,0,0,1|2,0,0]=4 7227 B13R1.135 CCN(C)C(=O)CC1CCCCO1 527a_100000225621_100000238585 [0,1,0,0,0,1|2,0,0]=4 7228 B13R1.135 CCN(C)C(=O)CC1CCCOC1 11a_100000225621_100000741523 [0,1,0,0,0,1|2,0,0]=4 7229 B13R1.135 CCN(C)C(=O)CC1CCCOC1 1626a_100000225621_100000741523 [0,1,0,0,0,1|2,0,0]=4 7230 B13R1.135 CCN(C)C(=O)CC1CCCOC1 240690a_100000225621_100000741523 [0,1,0,0,0,1|2,0,0]=4 7231 B13R1.135 CCN(C)C(=O)CC1CCCOC1 527a_100000225621_100000741523 [0,1,0,0,0,1|2,0,0]=4 7232 B13R1.135 CCN(C)C(=O)CC1CCOCC1 11a_100000225621_100000757261 [0,1,0,0,0,1|2,0,0]=4 7233 B13R1.135 CCN(C)C(=O)CC1CCOCC1 1626a_100000225621_100000757261 [0,1,0,0,0,1|2,0,0]=4 7234 B13R1.135 CCN(C)C(=O)CC1CCOCC1 240690a_100000225621_100000757261 [0,1,0,0,0,1|2,0,0]=4 7235 B13R1.135 CCN(C)C(=O)CC1CCOCC1 527a_100000225621_100000757261 [0,1,0,0,0,1|2,0,0]=4 7236 B13R1.135 CCN(C)C(=O)CN1CCCCC1 11a_100000225621_100000740322 [0,1,0,0,0,1|2,0,0]=4 7237 B13R1.135 CCN(C)C(=O)CN1CCCCC1 240690a_100000225621_100000740322 [0,1,0,0,0,1|2,0,0]=4 7238 B13R1.135 CCN(C)C(=O)CN1CCCCC1 527a_100000225621_100000740322 [0,1,0,0,0,1|2,0,0]=4 7239 B13R1.135 CCN(C)C(=O)NC1CCCCC1 2708a_100000182618_100000225621 [0,1,0,0,0,1|1,0,0]=3 7240 B13R1.135 CCN(C)C(=O)NC1CCCCC1 273464a_100000182618_100000225621 [0,1,0,0,0,1|1,0,0]=3 7241 B13R1.135 CCN(C)C(=O)NC1CCCOC1 2708a_100000719290_100000225621 [0,1,0,0,0,1|2,0,0]=4 7242 B13R1.135 CCN(C)C(=O)NC1CCCOC1 273464a_100000719290_100000225621 [0,1,0,0,0,1|2,0,0]=4 7243 B13R1.135 CCN(C)C(=O)NC1CCOCC1 2708a_100000741149_100000225621 [0,1,0,0,0,1|2,0,0]=4 7244 B13R1.135 CCN(C)C(=O)NC1CCOCC1 273464a_100000741149_100000225621 [0,1,0,0,0,1|2,0,0]=4 7245 B13R1.135 CCN(C)C(=O)NC1CCSCC1 2708a_100000748639_100000225621 [0,1,0,0,0,1|2,0,0]=4 7246 B13R1.135 CCN(C)C(=O)NC1CCSCC1 273464a_100000748639_100000225621 [0,1,0,0,0,1|2,0,0]=4 7247 B13R1.135 CNC(=O)C(=O)CC1CCCCC1 1458a_100011218921_100000211423 [0,1,0,0,0,1|2,0,0]=4 7248 B13R1.135 CNC(=O)C(=O)NC1CCCCC1 1626a_100000182618_100011218921 [0,1,0,0,0,1|2,0,0]=4 7249 B13R1.135 CNC(=O)C(=O)NC1CCCCC1 1626a_100102657272_200011297149 [0,1,0,0,0,1|2,0,0]=4 7250 B13R1.135 CNC(=O)C(=O)NC1CCCCC1 240690a_100000182618_100011218921 [0,1,0,0,0,1|2,0,0]=4 7251 B13R1.135 CNC(=O)C(=O)NC1CCCCC1 240690a_100102657272_200011297149 [0,1,0,0,0,1|2,0,0]=4 7252 B13R1.135 CNC(=O)C(=O)NC1CCCCC1 527a_100000182618_100011218921 [0,1,0,0,0,1|2,0,0]=4 7253 B13R1.135 CNC(=O)C(=O)NC1CCCCC1 527a_100102657272_200011297149 [0,1,0,0,0,1|2,0,0]=4 7254 B13R1.135 CNC(C)C(=O)NC1CCCCC1 2230a_106832991635_100000184452 [0,1,0,0,0,1|2,0,0]=4 7255 B13R1.135 CNC(C)C(=O)NC1CCCCC1 7a_106832991635_100000184452 [0,1,0,0,0,1|2,0,0]=4 7256 B13R1.135 COC(=O)C(=O)NC1CCCCC1 11a_100000182618_100000024059 [0,1,0,0,0,1|2,0,0]=4 7257 B13R1.135 COC(=O)C(=O)NC1CCCCC1 1626a_100000182618_100000024059 [0,1,0,0,0,1|2,0,0]=4 7258 B13R1.135 COC(=O)C(=O)NC1CCCCC1 240690a_100000182618_100000024059 [0,1,0,0,0,1|2,0,0]=4 7259 B13R1.135 COC(=O)C(=O)NC1CCCCC1 527a_100000182618_100000024059 [0,1,0,0,0,1|2,0,0]=4 7260 B13R1.135 COC(C)C(=O)CC1CCCCC1 1458a_100000743197_100000211423 [0,1,0,0,0,1|2,0,0]=4 7261 B13R1.135 COC(C)C(=O)NC1CCCCC1 11a_100000182618_100000743197 [0,1,0,0,0,1|2,0,0]=4 7262 B13R1.135 COC(C)C(=O)NC1CCCCC1 1626a_100000182618_100000743197 [0,1,0,0,0,1|2,0,0]=4 7263 B13R1.135 COC(C)C(=O)NC1CCCCC1 240690a_100000182618_100000743197 [0,1,0,0,0,1|2,0,0]=4 7264 B13R1.135 COC(C)C(=O)NC1CCCCC1 527a_100000182618_100000743197 [0,1,0,0,0,1|2,0,0]=4 7265 B13R1.135 CSC(C)C(=O)CC1CCCCC1 1458a_100000149566_100000211423 [0,1,0,0,0,1|2,0,0]=4 7266 B13R1.135 CSC(C)C(=O)NC1CCCCC1 11a_100000182618_100000149566 [0,1,0,0,0,1|2,0,0]=4 7267 B13R1.135 CSC(C)C(=O)NC1CCCCC1 1626a_100000182618_100000149566 [0,1,0,0,0,1|2,0,0]=4 7268 B13R1.135 CSC(C)C(=O)NC1CCCCC1 240690a_100000182618_100000149566 [0,1,0,0,0,1|2,0,0]=4 7269 B13R1.135 CSC(C)C(=O)NC1CCCCC1 527a_100000182618_100000149566 [0,1,0,0,0,1|2,0,0]=4 7270 B13R1.135 CSC(C)C(=O)NC1CCCCC1 62a_100000184452_200000210301 [0,1,0,0,0,1|2,0,0]=4 7271 B13R1.135 CSC(C)C(=O)NC1CCCCC1 62a_200000210301_100000184452 [0,1,0,0,0,1|2,0,0]=4 7272 B13R1.135 O=C(CC1CCCCC1)C(O)CO 1458a_100011215603_100000211423 [0,1,0,0,0,1|2,0,0]=4 7273 B13R1.135 O=C(CF)C(=O)NC1CCCCC1 1458a_200011297149_100015361967 [0,1,0,0,0,1|2,0,0]=4 7274 B13R1.135 O=C(NC1CCCCC1)C(O)CO 240690a_100000182618_100011215603 [0,1,0,0,0,1|2,0,0]=4 7275 B13R1.348 C=C(C)CC(=O)CC1CCCCC1 1458a_100000211666_100000748629 [0,1,0,0,0,1|1,0,1]=4 7276 B13R1.348 CC(=CC(=O)CC1CCCCC1)C 1458a_100000211388_100000211423 [0,1,0,0,0,1|1,0,1]=4 7277 B13R1.348 CC(=CC(=O)CC1CCCCC1)Cl 1458a_200042562850_100000211423 [0,1,0,0,0,1|1,0,1]=4 7278 B13R1.348 CC(=CC(=O)CC1CCCCC1)I 1458a_100025716642_100000211423 [0,1,0,0,0,1|1,0,1]=4 7279 B13R1.348 CC(=CC(=O)NC1CCCCC1)C 11a_100000182618_100000211388 [0,1,0,0,0,1|1,0,1]=4 7280 B13R1.348 CC(=CC(=O)NC1CCCCC1)C 1626a_100000182618_100000211388 [0,1,0,0,0,1|1,0,1]=4 7281 B13R1.348 CC(=CC(=O)NC1CCCCC1)C 240690a_100000182618_100000211388 [0,1,0,0,0,1|1,0,1]=4 7282 B13R1.348 CC(=CC(=O)NC1CCCCC1)Cl 11a_100000182618_200042562850 [0,1,0,0,0,1|1,0,1]=4 7283 B13R1.348 CC(=CC(=O)NC1CCCCC1)Cl 1626a_100000182618_200042562850 [0,1,0,0,0,1|1,0,1]=4 7284 B13R1.348 CC(=CC(=O)NC1CCCCC1)Cl 240690a_100000182618_200042562850 [0,1,0,0,0,1|1,0,1]=4 7285 B13R1.348 CC(=CC(=O)NC1CCCCC1)I 11a_100000182618_100025716642 [0,1,0,0,0,1|1,0,1]=4 7286 B13R1.348 CC(=CC(=O)NC1CCCCC1)I 1626a_100000182618_100025716642 [0,1,0,0,0,1|1,0,1]=4 7287 B13R1.348 CC(=O)CC(=O)NC1CCCCC1 1458a_100000070787_100000183541 [0,1,0,0,0,1|1,0,1]=4 7288 B13R1.348 CC(=O)CC(=O)OC1CCCCC1 1458a_100000070787_100000041653 [0,1,0,0,0,1|1,0,1]=4 7289 B13R1.348 CC(C)CC(=O)C=C1CCCCC1 1458a_100000743792_100000210624 [0,1,0,0,0,1|1,0,1]=4 7290 B13R1.348 CC(C)CC(=O)CC1CCCCC1 1458a_100000210554_100000211423 [0,1,0,0,0,1|1,0,0]=3 7291 B13R1.348 CC(C)CC(=O)CC1CCCCC1 1458a_100000211666_100000210624 [0,1,0,0,0,1|1,0,0]=3 7292 B13R1.348 CC(C)CC(=O)CC1CCCCO1 1458a_100000210554_100000211543 [0,1,0,0,0,1|2,0,0]=4 7293 B13R1.348 CC(C)CC(=O)CC1CCCCO1 1458a_100000238585_100000210624 [0,1,0,0,0,1|2,0,0]=4 7294 B13R1.348 CC(C)CC(=O)CC1CCCOC1 1458a_100000210554_100000741521 [0,1,0,0,0,1|2,0,0]=4 7295 B13R1.348 CC(C)CC(=O)CC1CCCOC1 1458a_100000741523_100000210624 [0,1,0,0,0,1|2,0,0]=4 7296 B13R1.348 CC(C)CC(=O)CC1CCOCC1 1458a_100000210554_100000754603 [0,1,0,0,0,1|2,0,0]=4 7297 B13R1.348 CC(C)CC(=O)CC1CCOCC1 1458a_100000757261_100000210624 [0,1,0,0,0,1|2,0,0]=4 7298 B13R1.348 CC(C)CC(=O)CN1CCCCC1 1458a_100000740322_100000210624 [0,1,0,0,0,1|2,0,0]=4 7299 B13R1.348 CC(C)CC(=O)NC1CCCCC1 11a_100000182618_100000210554 [0,1,0,0,0,1|1,0,0]=3 7300 B13R1.348 CC(C)CC(=O)NC1CCCCC1 1626a_100000182618_100000210554 [0,1,0,0,0,1|1,0,0]=3 7301 B13R1.348 CC(C)CC(=O)NC1CCCCC1 240690a_100000182618_100000210554 [0,1,0,0,0,1|1,0,0]=3 7302 B13R1.348 CC(C)CC(=O)NC1CCCCC1 527a_100000182618_100000210554 [0,1,0,0,0,1|1,0,0]=3 7303 B13R1.348 CC(C)CC(=O)NC1CCCOC1 11a_100000719290_100000210554 [0,1,0,0,0,1|2,0,0]=4 7304 B13R1.348 CC(C)CC(=O)NC1CCCOC1 1626a_100000719290_100000210554 [0,1,0,0,0,1|2,0,0]=4 7305 B13R1.348 CC(C)CC(=O)NC1CCCOC1 240690a_100000719290_100000210554 [0,1,0,0,0,1|2,0,0]=4 7306 B13R1.348 CC(C)CC(=O)NC1CCCOC1 527a_100000719290_100000210554 [0,1,0,0,0,1|2,0,0]=4 7307 B13R1.348 CC(C)CC(=O)NC1CCOCC1 11a_100000741149_100000210554 [0,1,0,0,0,1|2,0,0]=4 7308 B13R1.348 CC(C)CC(=O)NC1CCOCC1 1626a_100000741149_100000210554 [0,1,0,0,0,1|2,0,0]=4 7309 B13R1.348 CC(C)CC(=O)NC1CCOCC1 240690a_100000741149_100000210554 [0,1,0,0,0,1|2,0,0]=4 7310 B13R1.348 CC(C)CC(=O)NC1CCOCC1 527a_100000741149_100000210554 [0,1,0,0,0,1|2,0,0]=4 7311 B13R1.348 CC(C)CC(=O)NC1CCSCC1 11a_100000748639_100000210554 [0,1,0,0,0,1|2,0,0]=4 7312 B13R1.348 CC(C)CC(=O)NC1CCSCC1 1626a_100000748639_100000210554 [0,1,0,0,0,1|2,0,0]=4 7313 B13R1.348 CC(C)CC(=O)NC1CCSCC1 240690a_100000748639_100000210554 [0,1,0,0,0,1|2,0,0]=4 7314 B13R1.348 CC(C)CC(=O)NC1CCSCC1 527a_100000748639_100000210554 [0,1,0,0,0,1|2,0,0]=4 7315 B13R1.348 CC(C)NC(=O)C=C1CCCCC1 11a_100138425928_100000743792 [0,1,0,0,0,1|1,0,1]=4 7316 B13R1.348 CC(C)NC(=O)C=C1CCCCC1 1626a_100138425928_100000743792 [0,1,0,0,0,1|1,0,1]=4 7317 B13R1.348 CC(C)NC(=O)C=C1CCCCC1 240690a_100138425928_100000743792 [0,1,0,0,0,1|1,0,1]=4 7318 B13R1.348 CC(C)NC(=O)CC1CCCCC1 11a_100138425928_100000211666 [0,1,0,0,0,1|1,0,0]=3 7319 B13R1.348 CC(C)NC(=O)CC1CCCCC1 1626a_100138425928_100000211666 [0,1,0,0,0,1|1,0,0]=3 7320 B13R1.348 CC(C)NC(=O)CC1CCCCC1 240690a_100138425928_100000211666 [0,1,0,0,0,1|1,0,0]=3 7321 B13R1.348 CC(C)NC(=O)CC1CCCCC1 527a_100138425928_100000211666 [0,1,0,0,0,1|1,0,0]=3 7322 B13R1.348 CC(C)NC(=O)CC1CCCCO1 11a_100138425928_100000238585 [0,1,0,0,0,1|2,0,0]=4 7323 B13R1.348 CC(C)NC(=O)CC1CCCCO1 1626a_100138425928_100000238585 [0,1,0,0,0,1|2,0,0]=4 7324 B13R1.348 CC(C)NC(=O)CC1CCCCO1 240690a_100138425928_100000238585 [0,1,0,0,0,1|2,0,0]=4 7325 B13R1.348 CC(C)NC(=O)CC1CCCCO1 527a_100138425928_100000238585 [0,1,0,0,0,1|2,0,0]=4 7326 B13R1.348 CC(C)NC(=O)CC1CCCOC1 11a_100138425928_100000741523 [0,1,0,0,0,1|2,0,0]=4 7327 B13R1.348 CC(C)NC(=O)CC1CCCOC1 1626a_100138425928_100000741523 [0,1,0,0,0,1|2,0,0]=4 7328 B13R1.348 CC(C)NC(=O)CC1CCCOC1 240690a_100138425928_100000741523 [0,1,0,0,0,1|2,0,0]=4 7329 B13R1.348 CC(C)NC(=O)CC1CCCOC1 527a_100138425928_100000741523 [0,1,0,0,0,1|2,0,0]=4 7330 B13R1.348 CC(C)NC(=O)CC1CCOCC1 11a_100138425928_100000757261 [0,1,0,0,0,1|2,0,0]=4 7331 B13R1.348 CC(C)NC(=O)CC1CCOCC1 1626a_100138425928_100000757261 [0,1,0,0,0,1|2,0,0]=4 7332 B13R1.348 CC(C)NC(=O)CC1CCOCC1 240690a_100138425928_100000757261 [0,1,0,0,0,1|2,0,0]=4 7333 B13R1.348 CC(C)NC(=O)CC1CCOCC1 527a_100138425928_100000757261 [0,1,0,0,0,1|2,0,0]=4 7334 B13R1.348 CC(C)NC(=O)CN1CCCCC1 11a_100138425928_100000740322 [0,1,0,0,0,1|2,0,0]=4 7335 B13R1.348 CC(C)NC(=O)CN1CCCCC1 240690a_100138425928_100000740322 [0,1,0,0,0,1|2,0,0]=4 7336 B13R1.348 CC(C)NC(=O)CN1CCCCC1 527a_100138425928_100000740322 [0,1,0,0,0,1|2,0,0]=4 7337 B13R1.348 CC(C)NC(=O)NC1CCCCC1 2708a_100000182618_100138425928 [0,1,0,0,0,1|1,0,0]=3 7338 B13R1.348 CC(C)NC(=O)NC1CCCCC1 2708a_100138425928_100000182618 [0,1,0,0,0,1|1,0,0]=3 7339 B13R1.348 CC(C)NC(=O)NC1CCCCC1 273464a_100138425928_100000182618 [0,1,0,0,0,1|1,0,0]=3 7340 B13R1.348 CC(C)NC(=O)NC1CCCOC1 2708a_100000719290_100138425928 [0,1,0,0,0,1|2,0,0]=4 7341 B13R1.348 CC(C)NC(=O)NC1CCCOC1 2708a_100138425928_100000719290 [0,1,0,0,0,1|2,0,0]=4 7342 B13R1.348 CC(C)NC(=O)NC1CCCOC1 273464a_100138425928_100000719290 [0,1,0,0,0,1|2,0,0]=4 7343 B13R1.348 CC(C)NC(=O)NC1CCCOC1 512a_100000719290_100138425928 [0,1,0,0,0,1|2,0,0]=4 7344 B13R1.348 CC(C)NC(=O)NC1CCCOC1 512a_100138425928_100000719290 [0,1,0,0,0,1|2,0,0]=4 7345 B13R1.348 CC(C)NC(=O)NC1CCOCC1 2708a_100000741149_100138425928 [0,1,0,0,0,1|2,0,0]=4 7346 B13R1.348 CC(C)NC(=O)NC1CCOCC1 2708a_100138425928_100000741149 [0,1,0,0,0,1|2,0,0]=4 7347 B13R1.348 CC(C)NC(=O)NC1CCOCC1 273464a_100138425928_100000741149 [0,1,0,0,0,1|2,0,0]=4 7348 B13R1.348 CC(C)NC(=O)NC1CCOCC1 512a_100000741149_100138425928 [0,1,0,0,0,1|2,0,0]=4 7349 B13R1.348 CC(C)NC(=O)NC1CCOCC1 512a_100138425928_100000741149 [0,1,0,0,0,1|2,0,0]=4 7350 B13R1.348 CC(C)NC(=O)NC1CCSCC1 2708a_100000748639_100138425928 [0,1,0,0,0,1|2,0,0]=4 7351 B13R1.348 CC(C)NC(=O)NC1CCSCC1 2708a_100138425928_100000748639 [0,1,0,0,0,1|2,0,0]=4 7352 B13R1.348 CC(C)NC(=O)NC1CCSCC1 273464a_100138425928_100000748639 [0,1,0,0,0,1|2,0,0]=4 7353 B13R1.348 CC(C)NC(=O)NC1CCSCC1 512a_100000748639_100138425928 [0,1,0,0,0,1|2,0,0]=4 7354 B13R1.348 CC(C)NC(=O)NC1CCSCC1 512a_100138425928_100000748639 [0,1,0,0,0,1|2,0,0]=4 7355 B13R1.348 CC(C)OC(=O)CN1CCCOC1 2230a_100000131196_100011215430 [0,1,0,0,0,1|2,0,0]=4 7356 B13R1.348 CC(C)OC(=O)CN1CCCOC1 269982a_100000131196_100011215430 [0,1,0,0,0,1|2,0,0]=4 7357 B13R1.348 CC(C)OC(=O)CN1CCCOC1 34a_100000131196_100011215430 [0,1,0,0,0,1|2,0,0]=4 7358 B13R1.348 CC(C)OC(=O)CN1CCOCC1 2230a_100015191051_100011215430 [0,1,0,0,0,1|2,0,0]=4 7359 B13R1.348 CC(C)OC(=O)CN1CCOCC1 269982a_100015191051_100011215430 [0,1,0,0,0,1|2,0,0]=4 7360 B13R1.348 CC(C)OC(=O)CN1CCOCC1 34a_100015191051_100011215430 [0,1,0,0,0,1|2,0,0]=4 7361 B13R1.348 CC(C)OC(=O)CN1CCSCC1 2230a_100000737611_100011215430 [0,1,0,0,0,1|2,0,0]=4 7362 B13R1.348 CC(C)OC(=O)CN1CCSCC1 269982a_100000737611_100011215430 [0,1,0,0,0,1|2,0,0]=4 7363 B13R1.348 CC(O)CC(=O)C=C1CCCCC1 1458a_100000743792_100011218427 [0,1,0,0,0,1|1,0,1]=4 7364 B13R1.348 CC(O)CC(=O)CC1CCCCC1 1458a_100000211666_100011218427 [0,1,0,0,0,1|1,0,0]=3 7365 B13R1.348 CC(O)CC(=O)CC1CCCCO1 1458a_100000238585_100011218427 [0,1,0,0,0,1|2,0,0]=4 7366 B13R1.348 CC(O)CC(=O)CC1CCCOC1 1458a_100000741523_100011218427 [0,1,0,0,0,1|2,0,0]=4 7367 B13R1.348 CC(O)CC(=O)CC1CCOCC1 1458a_100000757261_100011218427 [0,1,0,0,0,1|2,0,0]=4 7368 B13R1.348 CC(O)CC(=O)CN1CCCCC1 1458a_100000740322_100011218427 [0,1,0,0,0,1|2,0,0]=4 7369 B13R1.348 CN(C)CC(=O)CC1CCCCC1 1458a_100000750896_100000211423 [0,1,0,0,0,1|2,0,0]=4 7370 B13R1.348 CN(C)CC(=O)NC1CCCCC1 11a_100000182618_100000750896 [0,1,0,0,0,1|2,0,0]=4 7371 B13R1.348 CN(C)CC(=O)NC1CCCCC1 2230a_100102631434_100000183541 [0,1,0,0,0,1|2,0,0]=4 7372 B13R1.348 CN(C)CC(=O)NC1CCCCC1 240690a_100000182618_100000750896 [0,1,0,0,0,1|2,0,0]=4 7373 B13R1.348 CN(C)CC(=O)NC1CCCCC1 269982a_100102631434_100000183541 [0,1,0,0,0,1|2,0,0]=4 7374 B13R1.348 CN(C)CC(=O)NC1CCCCC1 527a_100000182618_100000750896 [0,1,0,0,0,1|2,0,0]=4 7375 B13R1.348 CN(C)CC(=O)OC1CCCCC1 2230a_100102631434_100000041653 [0,1,0,0,0,1|2,0,0]=4 7376 B13R1.348 CN(C)CC(=O)OC1CCCCC1 269982a_100102631434_100000041653 [0,1,0,0,0,1|2,0,0]=4 7377 B13R1.348 C[C@@H](O)CC(=O)CC1CCCCC1 1458a_100011933948_100000211423 [0,1,0,0,0,1|1,0,0]=3 7378 B13R1.348 C[C@@H](O)CC(=O)CC1CCCCO1 1458a_100011933948_100000211543 [0,1,0,0,0,1|2,0,0]=4 7379 B13R1.348 C[C@@H](O)CC(=O)CC1CCCOC1 1458a_100011933948_100000741521 [0,1,0,0,0,1|2,0,0]=4 7380 B13R1.348 C[C@@H](O)CC(=O)CC1CCOCC1 1458a_100011933948_100000754603 [0,1,0,0,0,1|2,0,0]=4 7381 B13R1.348 C[C@@H](O)CC(=O)NC1CCCCC1 240690a_100000182618_100011933948 [0,1,0,0,0,1|1,0,0]=3 7382 B13R1.348 C[C@@H](O)CC(=O)NC1CCCOC1 240690a_100000719290_100011933948 [0,1,0,0,0,1|2,0,0]=4 7383 B13R1.348 C[C@@H](O)CC(=O)NC1CCOCC1 240690a_100000741149_100011933948 [0,1,0,0,0,1|2,0,0]=4 7384 B13R1.348 C[C@@H](O)CC(=O)NC1CCSCC1 240690a_100000748639_100011933948 [0,1,0,0,0,1|2,0,0]=4 7385 B13R1.348 C[S+](C)CC(=O)CC1CCCCC1 1458a_200159257847_100000211423 [0,1,0,0,0,1|2,0,0]=4 7386 B13R1.348 C[S+](C)CC(=O)NC1CCCCC1 11a_100000182618_200159257847 [0,1,0,0,0,1|2,0,0]=4 7387 B13R1.348 C[S+](C)CC(=O)NC1CCCCC1 1626a_100000182618_200159257847 [0,1,0,0,0,1|2,0,0]=4 7388 B13R1.348 C[S+](C)CC(=O)NC1CCCCC1 240690a_100000182618_200159257847 [0,1,0,0,0,1|2,0,0]=4 7389 B13R1.348 C[S+](C)CC(=O)NC1CCCCC1 527a_100000182618_200159257847 [0,1,0,0,0,1|2,0,0]=4 7390 B13R1.348 O=C(CC(F)F)CC1CCCCC1 1458a_100000211666_100011934356 [0,1,0,0,0,1|2,0,0]=4 7391 B13R1.470 CC1CCCCC1NC(=O)CCO 240690a_100000211402_100011216618 [0,1,0,0,0,1|2,0,0]=4 7392 B13R1.470 CC1CCCCC1NC(=O)CS[13CH3] 62a_100000182742_200025704644 [0,1,0,0,0,1|2,0,0]=4 7393 B13R1.470 CC1CCCCC1NC(=O)CS[13CH3] 62a_200025704644_100000182742 [0,1,0,0,0,1|2,0,0]=4 7394 B13R1.470 CC=CC(=O)NC1CCCCC1C 11a_100000211402_100000210699 [0,1,0,0,0,1|1,0,1]=4 7395 B13R1.470 CC=CC(=O)NC1CCCCC1C 1626a_100000211402_100000210699 [0,1,0,0,0,1|1,0,1]=4 7396 B13R1.470 CC=CC(=O)NC1CCCCC1C 240690a_100000211402_100000210699 [0,1,0,0,0,1|1,0,1]=4 7397 B13R1.470 CC=CC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100000210699 [0,1,0,0,0,1|1,0,1]=4 7398 B13R1.470 CC=CC(=O)N[C@@H]1CCCC[C@H]1F 11a_100015195156_100000210699 [0,1,0,0,0,1|1,0,1]=4 7399 B13R1.470 CC=CC(=O)N[C@@H]1CCCC[C@H]1F 1626a_100015195156_100000210699 [0,1,0,0,0,1|1,0,1]=4 7400 B13R1.470 CC=CC(=O)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100000210699 [0,1,0,0,0,1|1,0,1]=4 7401 B13R1.470 CCCC(=O)CC1CCCCN1C 1458a_100000211992_100015185383 [0,1,0,0,0,1|2,0,0]=4 7402 B13R1.470 CCCC(=O)CN1CCCCC1C 2230a_100000211376_100000747444 [0,1,0,0,0,1|2,0,0]=4 7403 B13R1.470 CCCC(=O)CN1CCCCC1C 269982a_100000211376_100000747444 [0,1,0,0,0,1|2,0,0]=4 7404 B13R1.470 CCCC(=O)NC1CCCCC1C 11a_100000211402_100000211992 [0,1,0,0,0,1|1,0,0]=3 7405 B13R1.470 CCCC(=O)NC1CCCCC1C 1626a_100000211402_100000211992 [0,1,0,0,0,1|1,0,0]=3 7406 B13R1.470 CCCC(=O)NC1CCCCC1C 240690a_100000211402_100000211992 [0,1,0,0,0,1|1,0,0]=3 7407 B13R1.470 CCCC(=O)NC1CCCCC1C 527a_100000211402_100000211992 [0,1,0,0,0,1|1,0,0]=3 7408 B13R1.470 CCCC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100000211992 [0,1,0,0,0,1|1,0,0]=3 7409 B13R1.470 CCCC(=O)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100000211992 [0,1,0,0,0,1|1,0,0]=3 7410 B13R1.470 CCCC(=O)N[C@@H]1CCCC[C@H]1F 11a_100015195156_100000211992 [0,1,0,0,0,1|1,0,0]=3 7411 B13R1.470 CCCC(=O)N[C@@H]1CCCC[C@H]1F 1626a_100015195156_100000211992 [0,1,0,0,0,1|1,0,0]=3 7412 B13R1.470 CCCC(=O)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100000211992 [0,1,0,0,0,1|1,0,0]=3 7413 B13R1.470 CCCC(=O)N[C@@H]1CCCC[C@H]1F 527a_100015195156_100000211992 [0,1,0,0,0,1|1,0,0]=3 7414 B13R1.470 CCCC(=O)N[C@@H]1CCOC[C@@H]1O 11a_100016994285_100000211992 [0,1,0,0,0,1|2,0,0]=4 7415 B13R1.470 CCCC(=O)N[C@@H]1CCOC[C@@H]1O 240690a_100016994285_100000211992 [0,1,0,0,0,1|2,0,0]=4 7416 B13R1.470 CCCC(=O)N[C@@H]1CCOC[C@@H]1O 527a_100016994285_100000211992 [0,1,0,0,0,1|2,0,0]=4 7417 B13R1.470 CCCC(=O)N[C@H]1CCOC[C@@H]1F 11a_100016994078_100000211992 [0,1,0,0,0,1|2,0,0]=4 7418 B13R1.470 CCCC(=O)N[C@H]1CCOC[C@@H]1F 1626a_100016994078_100000211992 [0,1,0,0,0,1|2,0,0]=4 7419 B13R1.470 CCCC(=O)N[C@H]1CCOC[C@@H]1F 240690a_100016994078_100000211992 [0,1,0,0,0,1|2,0,0]=4 7420 B13R1.470 CCCC(=O)N[C@H]1CCOC[C@@H]1F 527a_100016994078_100000211992 [0,1,0,0,0,1|2,0,0]=4 7421 B13R1.470 CCCC(=O)N[C@H]1COCC[C@@H]1O 11a_100015739063_100000211992 [0,1,0,0,0,1|2,0,0]=4 7422 B13R1.470 CCCC(=O)N[C@H]1COCC[C@@H]1O 240690a_100015739063_100000211992 [0,1,0,0,0,1|2,0,0]=4 7423 B13R1.470 CCNC(=O)CN1CCCCC1C 2230a_100000211376_100000183381 [0,1,0,0,0,1|2,0,0]=4 7424 B13R1.470 CCNC(=O)CN1CCCCC1C 269982a_100000211376_100000183381 [0,1,0,0,0,1|2,0,0]=4 7425 B13R1.470 CCNC(=O)CN1CCCCC1C 34a_100000211376_100000183381 [0,1,0,0,0,1|2,0,0]=4 7426 B13R1.470 CCNC(=O)NC1CCCCC1C 2708a_100000211402_100015525214 [0,1,0,0,0,1|1,0,0]=3 7427 B13R1.470 CCNC(=O)NC1CCCCC1C 2708a_100015525214_100000211402 [0,1,0,0,0,1|1,0,0]=3 7428 B13R1.470 CCNC(=O)NC1CCCCC1C 273464a_100000211402_100015525214 [0,1,0,0,0,1|1,0,0]=3 7429 B13R1.470 CCNC(=O)NC1CCCCC1C 273464a_100015525214_100000211402 [0,1,0,0,0,1|1,0,0]=3 7430 B13R1.470 CCNC(=O)NC1CCCCC1C 512a_100000211402_100015525214 [0,1,0,0,0,1|1,0,0]=3 7431 B13R1.470 CCNC(=O)NC1CCCCC1C 512a_100015525214_100000211402 [0,1,0,0,0,1|1,0,0]=3 7432 B13R1.470 CCNC(=O)N[C@@H]1CCCC[C@@H]1O 2708a_100015525214_100015191688 [0,1,0,0,0,1|1,0,0]=3 7433 B13R1.470 CCNC(=O)N[C@@H]1CCCC[C@@H]1O 273464a_100015525214_100015191688 [0,1,0,0,0,1|1,0,0]=3 7434 B13R1.470 CCNC(=O)N[C@@H]1CCCC[C@H]1F 2708a_100015195156_100015525214 [0,1,0,0,0,1|1,0,0]=3 7435 B13R1.470 CCNC(=O)N[C@@H]1CCCC[C@H]1F 2708a_100015525214_100015195156 [0,1,0,0,0,1|1,0,0]=3 7436 B13R1.470 CCNC(=O)N[C@@H]1CCCC[C@H]1F 273464a_100015195156_100015525214 [0,1,0,0,0,1|1,0,0]=3 7437 B13R1.470 CCNC(=O)N[C@@H]1CCCC[C@H]1F 273464a_100015525214_100015195156 [0,1,0,0,0,1|1,0,0]=3 7438 B13R1.470 CCNC(=O)N[C@@H]1CCCC[C@H]1F 512a_100015195156_100015525214 [0,1,0,0,0,1|1,0,0]=3 7439 B13R1.470 CCNC(=O)N[C@@H]1CCCC[C@H]1F 512a_100015525214_100015195156 [0,1,0,0,0,1|1,0,0]=3 7440 B13R1.470 CCNC(=O)N[C@@H]1CCOC[C@@H]1O 2708a_100015525214_100016994285 [0,1,0,0,0,1|2,0,0]=4 7441 B13R1.470 CCNC(=O)N[C@@H]1CCOC[C@@H]1O 273464a_100015525214_100016994285 [0,1,0,0,0,1|2,0,0]=4 7442 B13R1.470 CCNC(=O)N[C@@H]1CCOC[C@@H]1O 273464a_100016994285_100015525214 [0,1,0,0,0,1|2,0,0]=4 7443 B13R1.470 CCNC(=O)N[C@@H]1CCOC[C@@H]1O 512a_100015525214_100016994285 [0,1,0,0,0,1|2,0,0]=4 7444 B13R1.470 CCNC(=O)N[C@H]1CCOC[C@@H]1F 2708a_100015525214_100016994078 [0,1,0,0,0,1|2,0,0]=4 7445 B13R1.470 CCNC(=O)N[C@H]1CCOC[C@@H]1F 2708a_100016994078_100015525214 [0,1,0,0,0,1|2,0,0]=4 7446 B13R1.470 CCNC(=O)N[C@H]1CCOC[C@@H]1F 273464a_100015525214_100016994078 [0,1,0,0,0,1|2,0,0]=4 7447 B13R1.470 CCNC(=O)N[C@H]1CCOC[C@@H]1F 273464a_100016994078_100015525214 [0,1,0,0,0,1|2,0,0]=4 7448 B13R1.470 CCNC(=O)N[C@H]1CCOC[C@@H]1F 512a_100015525214_100016994078 [0,1,0,0,0,1|2,0,0]=4 7449 B13R1.470 CCNC(=O)N[C@H]1CCOC[C@@H]1F 512a_100016994078_100015525214 [0,1,0,0,0,1|2,0,0]=4 7450 B13R1.470 CCNC(=O)N[C@H]1COCC[C@@H]1O 2708a_100015525214_100015739063 [0,1,0,0,0,1|2,0,0]=4 7451 B13R1.470 CCNC(=O)N[C@H]1COCC[C@@H]1O 273464a_100015525214_100015739063 [0,1,0,0,0,1|2,0,0]=4 7452 B13R1.470 CCNC(=O)N[C@H]1COCC[C@@H]1O 273464a_100015739063_100015525214 [0,1,0,0,0,1|2,0,0]=4 7453 B13R1.470 CCNC(=O)N[C@H]1COCC[C@@H]1O 512a_100015525214_100015739063 [0,1,0,0,0,1|2,0,0]=4 7454 B13R1.470 CCOC(=O)CC1CCCCN1C 2230a_100116209990_200000210301 [0,1,0,0,0,1|1,0,0]=3 7455 B13R1.470 CCOC(=O)CC1CCCCN1C 269982a_100116209990_200000210301 [0,1,0,0,0,1|1,0,0]=3 7456 B13R1.470 CCOC(=O)CC1CCCCN1[13CH3] 2230a_100116209990_200025704644 [0,1,0,0,0,1|1,0,0]=3 7457 B13R1.470 CCOC(=O)CC1CCCCN1[13CH3] 269982a_100116209990_200025704644 [0,1,0,0,0,1|1,0,0]=3 7458 B13R1.470 CCOC(=O)CN1CCCCC1C 2230a_100000211376_100000188475 [0,1,0,0,0,1|1,0,0]=3 7459 B13R1.470 CCOC(=O)CN1CCCCC1C 269982a_100000211376_100000188475 [0,1,0,0,0,1|1,0,0]=3 7460 B13R1.470 CCOC(=O)CN1CCCCC1C 34a_100000211376_100000188475 [0,1,0,0,0,1|1,0,0]=3 7461 B13R1.470 CCOC(=O)CN1CCOC[C@@H]1C 2230a_100009815349_100000188475 [0,1,0,0,0,1|2,0,0]=4 7462 B13R1.470 CCOC(=O)CN1CCOC[C@@H]1C 269982a_100009815349_100000188475 [0,1,0,0,0,1|2,0,0]=4 7463 B13R1.470 CCOC(=O)CN1CCOC[C@@H]1C 34a_100009815349_100000188475 [0,1,0,0,0,1|2,0,0]=4 7464 B13R1.470 CNCC(=O)NC1CCCCC1C 2230a_106832991635_100000182742 [0,1,0,0,0,1|2,0,0]=4 7465 B13R1.470 CNCC(=O)NC1CCCCC1C 34a_100102657272_100000182742 [0,1,0,0,0,1|2,0,0]=4 7466 B13R1.470 CNCC(=O)NC1CCCCC1C 7a_106832991635_100000182742 [0,1,0,0,0,1|2,0,0]=4 7467 B13R1.470 CNNC(=O)NC1CCCCC1C 273464a_100000211402_100016993582 [0,1,0,0,0,1|2,0,0]=4 7468 B13R1.470 CNNC(=O)NC1CCCCC1C 512a_100000211402_100016993582 [0,1,0,0,0,1|2,0,0]=4 7469 B13R1.470 CNNC(=O)NC1CCCCC1C 512a_100016993582_100000211402 [0,1,0,0,0,1|2,0,0]=4 7470 B13R1.470 CNNC(=O)N[C@@H]1CCCC[C@H]1F 273464a_100015195156_100016993582 [0,1,0,0,0,1|2,0,0]=4 7471 B13R1.470 CNNC(=O)N[C@@H]1CCCC[C@H]1F 512a_100015195156_100016993582 [0,1,0,0,0,1|2,0,0]=4 7472 B13R1.470 CNNC(=O)N[C@@H]1CCCC[C@H]1F 512a_100016993582_100015195156 [0,1,0,0,0,1|2,0,0]=4 7473 B13R1.470 COCC(=O)NC1CCCCC1C 11a_100000211402_100000210968 [0,1,0,0,0,1|2,0,0]=4 7474 B13R1.470 COCC(=O)NC1CCCCC1C 1626a_100000211402_100000210968 [0,1,0,0,0,1|2,0,0]=4 7475 B13R1.470 COCC(=O)NC1CCCCC1C 240690a_100000211402_100000210968 [0,1,0,0,0,1|2,0,0]=4 7476 B13R1.470 COCC(=O)NC1CCCCC1C 34a_100138415774_100000182742 [0,1,0,0,0,1|2,0,0]=4 7477 B13R1.470 COCC(=O)NC1CCCCC1C 527a_100000211402_100000210968 [0,1,0,0,0,1|2,0,0]=4 7478 B13R1.470 COCC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100000210968 [0,1,0,0,0,1|2,0,0]=4 7479 B13R1.470 COCC(=O)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100000210968 [0,1,0,0,0,1|2,0,0]=4 7480 B13R1.470 COCC(=O)N[C@@H]1CCCC[C@H]1F 11a_100015195156_100000210968 [0,1,0,0,0,1|2,0,0]=4 7481 B13R1.470 COCC(=O)N[C@@H]1CCCC[C@H]1F 1626a_100015195156_100000210968 [0,1,0,0,0,1|2,0,0]=4 7482 B13R1.470 COCC(=O)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100000210968 [0,1,0,0,0,1|2,0,0]=4 7483 B13R1.470 COCC(=O)N[C@@H]1CCCC[C@H]1F 527a_100015195156_100000210968 [0,1,0,0,0,1|2,0,0]=4 7484 B13R1.470 CSCC(=O)NC1CCCCC1C 11a_100000211402_100000184570 [0,1,0,0,0,1|2,0,0]=4 7485 B13R1.470 CSCC(=O)NC1CCCCC1C 1626a_100000211402_100000184570 [0,1,0,0,0,1|2,0,0]=4 7486 B13R1.470 CSCC(=O)NC1CCCCC1C 240690a_100000211402_100000184570 [0,1,0,0,0,1|2,0,0]=4 7487 B13R1.470 CSCC(=O)NC1CCCCC1C 527a_100000211402_100000184570 [0,1,0,0,0,1|2,0,0]=4 7488 B13R1.470 CSCC(=O)NC1CCCCC1C 62a_100000182742_200000210301 [0,1,0,0,0,1|2,0,0]=4 7489 B13R1.470 CSCC(=O)NC1CCCCC1C 62a_200000210301_100000182742 [0,1,0,0,0,1|2,0,0]=4 7490 B13R1.470 CSCC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100000184570 [0,1,0,0,0,1|2,0,0]=4 7491 B13R1.470 CSCC(=O)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100000184570 [0,1,0,0,0,1|2,0,0]=4 7492 B13R1.470 CSCC(=O)N[C@@H]1CCCC[C@H]1F 11a_100015195156_100000184570 [0,1,0,0,0,1|2,0,0]=4 7493 B13R1.470 CSCC(=O)N[C@@H]1CCCC[C@H]1F 1626a_100015195156_100000184570 [0,1,0,0,0,1|2,0,0]=4 7494 B13R1.470 CSCC(=O)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100000184570 [0,1,0,0,0,1|2,0,0]=4 7495 B13R1.470 CSCC(=O)N[C@@H]1CCCC[C@H]1F 527a_100015195156_100000184570 [0,1,0,0,0,1|2,0,0]=4 7496 B13R1.470 O=C(CCO)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100011216618 [0,1,0,0,0,1|2,0,0]=4 7497 B13R1.470 O=C(CCO)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100011216618 [0,1,0,0,0,1|2,0,0]=4 7498 B13R1.1327 CCCS(=O)(=O)NC1CCCCC1 270084a_100000182618_100000211391 [0,1,0,0,0,1|2,0,0]=4 7499 B13R1.1327 CCCS(=O)(=O)NC1CCCCC1 274078a_100000182618_100000211391 [0,1,0,0,0,1|2,0,0]=4 7500 B13R1.1327 CCCS(=O)(=O)NC1CCCCC1 40a_100000182618_100000054278 [0,1,0,0,0,1|2,0,0]=4 7501 B13R1.2570 CC1(CCCCC1)NC(=O)CCO 240690a_100000741114_100011216618 [0,1,0,0,0,1|2,0,0]=4 7502 B13R1.2570 CC=CC(=O)NC1(CCCCC1)C 11a_100000741114_100000210699 [0,1,0,0,0,1|1,0,1]=4 7503 B13R1.2570 CC=CC(=O)NC1(CCCCC1)C 1626a_100000741114_100000210699 [0,1,0,0,0,1|1,0,1]=4 7504 B13R1.2570 CC=CC(=O)NC1(CCCCC1)C 240690a_100000741114_100000210699 [0,1,0,0,0,1|1,0,1]=4 7505 B13R1.2570 CCCC(=O)CC1(CCCCC1)O 1458a_100000755886_100000210303 [0,1,0,0,0,1|1,0,0]=3 7506 B13R1.2570 CCCC(=O)NC1(CCCCC1)C 11a_100000741114_100000211992 [0,1,0,0,0,1|1,0,0]=3 7507 B13R1.2570 CCCC(=O)NC1(CCCCC1)C 1626a_100000741114_100000211992 [0,1,0,0,0,1|1,0,0]=3 7508 B13R1.2570 CCCC(=O)NC1(CCCCC1)C 240690a_100000741114_100000211992 [0,1,0,0,0,1|1,0,0]=3 7509 B13R1.2570 CCCC(=O)NC1(CCCCC1)C 527a_100000741114_100000211992 [0,1,0,0,0,1|1,0,0]=3 7510 B13R1.2570 CCCC(=O)NC1(CCOCC1)C 11a_100000692449_100000211992 [0,1,0,0,0,1|2,0,0]=4 7511 B13R1.2570 CCCC(=O)NC1(CCOCC1)C 1626a_100000692449_100000211992 [0,1,0,0,0,1|2,0,0]=4 7512 B13R1.2570 CCCC(=O)NC1(CCOCC1)C 240690a_100000692449_100000211992 [0,1,0,0,0,1|2,0,0]=4 7513 B13R1.2570 CCCC(=O)NC1(CCOCC1)C 527a_100000692449_100000211992 [0,1,0,0,0,1|2,0,0]=4 7514 B13R1.2570 CCNC(=O)CC1(CCCCC1)O 240690a_100015525214_100000755886 [0,1,0,0,0,1|1,0,0]=3 7515 B13R1.2570 CCNC(=O)CC1(CCCCC1)O 527a_100015525214_100000755886 [0,1,0,0,0,1|1,0,0]=3 7516 B13R1.2570 CCNC(=O)NC1(CCCCC1)C 2708a_100015525214_100000741114 [0,1,0,0,0,1|1,0,0]=3 7517 B13R1.2570 CCNC(=O)NC1(CCCCC1)C 273464a_100000741114_100015525214 [0,1,0,0,0,1|1,0,0]=3 7518 B13R1.2570 CCNC(=O)NC1(CCCCC1)C 273464a_100015525214_100000741114 [0,1,0,0,0,1|1,0,0]=3 7519 B13R1.2570 CCNC(=O)NC1(CCCCC1)C 512a_100000741114_100015525214 [0,1,0,0,0,1|1,0,0]=3 7520 B13R1.2570 CCNC(=O)NC1(CCOCC1)C 2708a_100015525214_100000692449 [0,1,0,0,0,1|2,0,0]=4 7521 B13R1.2570 CCNC(=O)NC1(CCOCC1)C 273464a_100000692449_100015525214 [0,1,0,0,0,1|2,0,0]=4 7522 B13R1.2570 CCNC(=O)NC1(CCOCC1)C 273464a_100015525214_100000692449 [0,1,0,0,0,1|2,0,0]=4 7523 B13R1.2570 CCNC(=O)NC1(CCOCC1)C 512a_100000692449_100015525214 [0,1,0,0,0,1|2,0,0]=4 7524 B13R1.2570 CNNC(=O)CC1(CCCCC1)O 22a_100016993582_100000755886 [0,1,0,0,0,1|2,0,0]=4 7525 B13R1.2570 CNNC(=O)NC1(CCCCC1)C 273464a_100000741114_100016993582 [0,1,0,0,0,1|2,0,0]=4 7526 B13R1.2570 CNNC(=O)NC1(CCCCC1)C 512a_100000741114_100016993582 [0,1,0,0,0,1|2,0,0]=4 7527 B13R1.2570 COCC(=O)NC1(CCCCC1)C 11a_100000741114_100000210968 [0,1,0,0,0,1|2,0,0]=4 7528 B13R1.2570 COCC(=O)NC1(CCCCC1)C 1626a_100000741114_100000210968 [0,1,0,0,0,1|2,0,0]=4 7529 B13R1.2570 COCC(=O)NC1(CCCCC1)C 240690a_100000741114_100000210968 [0,1,0,0,0,1|2,0,0]=4 7530 B13R1.2570 COCC(=O)NC1(CCCCC1)C 527a_100000741114_100000210968 [0,1,0,0,0,1|2,0,0]=4 7531 B13R1.2570 CSCC(=O)NC1(CCCCC1)C 11a_100000741114_100000184570 [0,1,0,0,0,1|2,0,0]=4 7532 B13R1.2570 CSCC(=O)NC1(CCCCC1)C 1626a_100000741114_100000184570 [0,1,0,0,0,1|2,0,0]=4 7533 B13R1.2570 CSCC(=O)NC1(CCCCC1)C 240690a_100000741114_100000184570 [0,1,0,0,0,1|2,0,0]=4 7534 B13R1.2570 CSCC(=O)NC1(CCCCC1)C 527a_100000741114_100000184570 [0,1,0,0,0,1|2,0,0]=4 7535 B13R1.2570 O=C(CCF)CC1(CCCCC1)O 1458a_100000755886_100011217306 [0,1,0,0,0,1|2,0,0]=4 7536 B13R1.2570 O=C(CCO)CC1(CCCCC1)O 1458a_100000755886_100000211926 [0,1,0,0,0,1|2,0,0]=4 7537 B13R1.463 CC#CC(=O)C1CCCCCC1=O 1458a_100000763181_100000243696 [0,1,0,0,0,1|1,0,1]=4 7538 B13R1.463 CC=CC(=O)C1CCCCCC1=O 1458a_100000210699_100000243696 [0,1,0,0,0,1|1,0,1]=4 7539 B13R1.463 CCCC(=O)C1CCCCCC1=O 1458a_100000211992_100000243696 [0,1,0,0,0,1|1,0,0]=3 7540 B13R1.463 CCCC(=O)C1CCCCCN1C 1458a_100015187800_100000210303 [0,1,0,0,0,1|1,0,0]=3 7541 B13R1.463 CCCC(=O)C1CCCCNC1=O 1458a_100000211992_100000735217 [0,1,0,0,0,1|1,0,1]=4 7542 B13R1.463 CCNC(=O)C1CCCCCN1C 240690a_100015525214_100015187800 [0,1,0,0,0,1|1,0,0]=3 7543 B13R1.463 CCNC(=O)C1CCCCCN1C 527a_100015525214_100015187800 [0,1,0,0,0,1|1,0,0]=3 7544 B13R1.463 CN1CCCCCC1C(=O)CCF 1458a_100015187800_100011217306 [0,1,0,0,0,1|2,0,0]=4 7545 B13R1.463 CN1CCCCCC1C(=O)CCO 1458a_100015187800_100000211926 [0,1,0,0,0,1|2,0,0]=4 7546 B13R1.463 CNNC(=O)C1CCCCCN1C 22a_100016993582_100015187800 [0,1,0,0,0,1|2,0,0]=4 7547 B13R1.463 COCC(=O)C1CCCCCC1=O 1458a_100000210968_100000243696 [0,1,0,0,0,1|2,0,0]=4 7548 B13R1.463 CSCC(=O)C1CCCCCC1=O 1458a_100000184570_100000243696 [0,1,0,0,0,1|2,0,0]=4 7549 B13R1.463 O=C(CCO)C1CCCCCC1=O 1458a_100011216618_100000243696 [0,1,0,0,0,1|2,0,0]=4 7550 B13R1.1462 CCCC(=O)N1CCCCC(C1)O 240690a_100025706797_100000211992 [0,1,0,0,0,1|2,0,0]=4 7551 B13R1.1462 CCCC(=O)N1CCOC[C@@H](C1)O 11a_100016073750_100000211992 [0,1,0,0,0,1|2,0,0]=4 7552 B13R1.1462 CCCC(=O)N1CCOC[C@@H](C1)O 240690a_100016073750_100000211992 [0,1,0,0,0,1|2,0,0]=4 7553 B13R1.1462 CCNC(=O)N1CCCCC(C1)O 2708a_100015525214_100025706797 [0,1,0,0,0,1|2,0,0]=4 7554 B13R1.1462 CCNC(=O)N1CCCCC(C1)O 273464a_100015525214_100025706797 [0,1,0,0,0,1|2,0,0]=4 7555 B13R1.1462 CCNC(=O)N1CCOC[C@@H](C1)O 2708a_100015525214_100016073750 [0,1,0,0,0,1|2,0,0]=4 7556 B13R1.1462 CCNC(=O)N1CCOC[C@@H](C1)O 273464a_100015525214_100016073750 [0,1,0,0,0,1|2,0,0]=4 7557 B13R1.1463 CCCC(=O)N1CCCC(CC1)C 11a_100025706717_100000211992 [0,1,0,0,0,1|2,0,0]=4 7558 B13R1.1463 CCCC(=O)N1CCCC(CC1)C 1626a_100025706717_100000211992 [0,1,0,0,0,1|2,0,0]=4 7559 B13R1.1463 CCCC(=O)N1CCCC(CC1)C 240690a_100025706717_100000211992 [0,1,0,0,0,1|2,0,0]=4 7560 B13R1.1463 CCCC(=O)N1CCCC(CC1)C 527a_100025706717_100000211992 [0,1,0,0,0,1|2,0,0]=4 7561 B13R1.1463 CCCC(=O)N1CCCC(CC1)O 240690a_100015186869_100000211992 [0,1,0,0,0,1|2,0,0]=4 7562 B13R1.1463 CCCC(=O)N1CCCC(CC1)O 527a_100015186869_100000211992 [0,1,0,0,0,1|2,0,0]=4 7563 B13R1.1463 CCCC(=O)N1CCCN(CC1)C 2230a_200000743687_200000210301 [0,1,0,0,0,1|2,0,0]=4 7564 B13R1.1463 CCCC(=O)N1CCCN(CC1)C 240690a_100000211313_100000211992 [0,1,0,0,0,1|2,0,0]=4 7565 B13R1.1463 CCCC(=O)N1CCCN(CC1)C 269982a_200000743687_200000210301 [0,1,0,0,0,1|2,0,0]=4 7566 B13R1.1463 CCCC(=O)N1CCCN(CC1)[13CH3] 2230a_200000743687_200025704644 [0,1,0,0,0,1|2,0,0]=4 7567 B13R1.1463 CCCC(=O)N1CCCN(CC1)[13CH3] 269982a_200000743687_200025704644 [0,1,0,0,0,1|2,0,0]=4 7568 B13R1.1463 CCNC(=O)N1CCCC(CC1)C 2708a_100015525214_100025706717 [0,1,0,0,0,1|2,0,0]=4 7569 B13R1.1463 CCNC(=O)N1CCCC(CC1)C 273464a_100015525214_100025706717 [0,1,0,0,0,1|2,0,0]=4 7570 B13R1.1463 CCNC(=O)N1CCCC(CC1)O 2708a_100015525214_100015186869 [0,1,0,0,0,1|2,0,0]=4 7571 B13R1.1463 CCNC(=O)N1CCCC(CC1)O 273464a_100015525214_100015186869 [0,1,0,0,0,1|2,0,0]=4 7572 B13R1.1463 CCNC(=O)N1CCCN(CC1)C 2708a_100015525214_100000211313 [0,1,0,0,0,1|2,0,0]=4 7573 B13R1.1463 CCNC(=O)N1CCCN(CC1)C 273464a_100015525214_100000211313 [0,1,0,0,0,1|2,0,0]=4 7574 B13R1.1463 CCOC(=O)N1CCCN(CC1)C 2230a_100000748262_200000210301 [0,1,0,0,0,1|1,0,0]=3 7575 B13R1.1463 CCOC(=O)N1CCCN(CC1)C 269982a_100000748262_200000210301 [0,1,0,0,0,1|1,0,0]=3 7576 B13R1.1463 CCOC(=O)N1CCCN(CC1)[13CH3] 2230a_100000748262_200025704644 [0,1,0,0,0,1|1,0,0]=3 7577 B13R1.1463 CCOC(=O)N1CCCN(CC1)[13CH3] 269982a_100000748262_200025704644 [0,1,0,0,0,1|1,0,0]=3 7578 B13R1.2488 C#CCCC(=O)C1CCCCCC1 1458a_100000692101_100011217769 [0,1,0,0,0,1|1,0,1]=4 7579 B13R1.2488 C#CCCC(=O)C1CCCCCC1 1458a_100000749507_100000753159 [0,1,0,0,0,1|1,0,1]=4 7580 B13R1.2488 C#CCNC(=O)C1CCCCCC1 11a_100000212058_100000749507 [0,1,0,0,0,1|1,0,1]=4 7581 B13R1.2488 C#CCNC(=O)C1CCCCCC1 1626a_100000212058_100000749507 [0,1,0,0,0,1|1,0,1]=4 7582 B13R1.2488 C#CCNC(=O)C1CCCCCC1 240690a_100000212058_100000749507 [0,1,0,0,0,1|1,0,1]=4 7583 B13R1.2488 C#CCNC(=O)C1CCCCCC1 527a_100000212058_100000749507 [0,1,0,0,0,1|1,0,1]=4 7584 B13R1.2488 C/C=C/CC(=O)C1CCCCCC1 1458a_100000749507_100102629194 [0,1,0,0,0,1|1,0,1]=4 7585 B13R1.2488 C=CCCC(=O)C1CCCCCC1 1458a_100000749507_100000754431 [0,1,0,0,0,1|1,0,1]=4 7586 B13R1.2488 C=CCCC(=O)C1CCCCCC1 1458a_100000749702_100011217769 [0,1,0,0,0,1|1,0,1]=4 7587 B13R1.2488 C=CCNC(=O)C1CCCCCC1 1626a_100020586998_100000749507 [0,1,0,0,0,1|1,0,1]=4 7588 B13R1.2488 C=CCNC(=O)C1CCCCCC1 240690a_100020586998_100000749507 [0,1,0,0,0,1|1,0,1]=4 7589 B13R1.2488 C=CCNC(=O)C1CCCCCC1 527a_100020586998_100000749507 [0,1,0,0,0,1|1,0,1]=4 7590 B13R1.2488 CC#CCC(=O)C1CCCCCC1 1458a_100000749507_100000748600 [0,1,0,0,0,1|1,0,1]=4 7591 B13R1.2488 CC=CCC(=O)C1CCCCCC1 1458a_100000749507_100000070051 [0,1,0,0,0,1|1,0,1]=4 7592 B13R1.2488 CC=CCC(=O)C1CCCCCC1 1458a_100121576822_100011217769 [0,1,0,0,0,1|1,0,1]=4 7593 B13R1.2488 CCC#CC(=O)C1CCCCCC1 1458a_100011827653_100011217769 [0,1,0,0,0,1|1,0,0]=3 7594 B13R1.2488 CCC=CC(=O)C1CCCCCC1 1458a_100000212282_100011217769 [0,1,0,0,0,1|1,0,0]=3 7595 B13R1.2488 CCC=CC(=O)N1CCCCCC1 11a_100000185865_100000212282 [0,1,0,0,0,1|2,0,0]=4 7596 B13R1.2488 CCC=CC(=O)N1CCCCCC1 1626a_100000185865_100000212282 [0,1,0,0,0,1|2,0,0]=4 7597 B13R1.2488 CCC=CC(=O)N1CCCCCC1 240690a_100000185865_100000212282 [0,1,0,0,0,1|2,0,0]=4 7598 B13R1.2488 CCC=CC(=O)N1CCCOCC1 11a_100000685342_100000212282 [0,1,0,0,0,1|2,0,0]=4 7599 B13R1.2488 CCC=CC(=O)N1CCCOCC1 1626a_100000685342_100000212282 [0,1,0,0,0,1|2,0,0]=4 7600 B13R1.2488 CCC=CC(=O)N1CCCOCC1 240690a_100000685342_100000212282 [0,1,0,0,0,1|2,0,0]=4 7601 B13R1.2488 CCCCC(=O)C1CCC=CCC1 1458a_100000048548_100000210211 [0,1,0,0,0,1|1,0,1]=4 7602 B13R1.2488 CCCCC(=O)C1CCCCCC1 1458a_100000210183_100011217769 [0,1,0,0,0,1|1,0,0]=3 7603 B13R1.2488 CCCCC(=O)C1CCCCCC1 1458a_100000749507_100000210211 [0,1,0,0,0,1|1,0,0]=3 7604 B13R1.2488 CCCCC(=O)N1CCCCCC1 11a_100000185865_100000210183 [0,1,0,0,0,1|2,0,0]=4 7605 B13R1.2488 CCCCC(=O)N1CCCCCC1 1626a_100000185865_100000210183 [0,1,0,0,0,1|2,0,0]=4 7606 B13R1.2488 CCCCC(=O)N1CCCCCC1 240690a_100000185865_100000210183 [0,1,0,0,0,1|2,0,0]=4 7607 B13R1.2488 CCCCC(=O)N1CCCCCC1 527a_100000185865_100000210183 [0,1,0,0,0,1|2,0,0]=4 7608 B13R1.2488 CCCCC(=O)N1CCCOCC1 11a_100000685342_100000210183 [0,1,0,0,0,1|2,0,0]=4 7609 B13R1.2488 CCCCC(=O)N1CCCOCC1 1626a_100000685342_100000210183 [0,1,0,0,0,1|2,0,0]=4 7610 B13R1.2488 CCCCC(=O)N1CCCOCC1 240690a_100000685342_100000210183 [0,1,0,0,0,1|2,0,0]=4 7611 B13R1.2488 CCCCC(=O)N1CCCOCC1 527a_100000685342_100000210183 [0,1,0,0,0,1|2,0,0]=4 7612 B13R1.2488 CCCNC(=O)C1CCC=CCC1 11a_100020643023_100000048548 [0,1,0,0,0,1|1,0,1]=4 7613 B13R1.2488 CCCNC(=O)C1CCC=CCC1 1626a_100020643023_100000048548 [0,1,0,0,0,1|1,0,1]=4 7614 B13R1.2488 CCCNC(=O)C1CCC=CCC1 240690a_100020643023_100000048548 [0,1,0,0,0,1|1,0,1]=4 7615 B13R1.2488 CCCNC(=O)C1CCC=CCC1 527a_100020643023_100000048548 [0,1,0,0,0,1|1,0,1]=4 7616 B13R1.2488 CCCNC(=O)C1CCCCCC1 11a_100020643023_100000749507 [0,1,0,0,0,1|1,0,0]=3 7617 B13R1.2488 CCCNC(=O)C1CCCCCC1 1626a_100020643023_100000749507 [0,1,0,0,0,1|1,0,0]=3 7618 B13R1.2488 CCCNC(=O)C1CCCCCC1 240690a_100020643023_100000749507 [0,1,0,0,0,1|1,0,0]=3 7619 B13R1.2488 CCCNC(=O)C1CCCCCC1 527a_100020643023_100000749507 [0,1,0,0,0,1|1,0,0]=3 7620 B13R1.2488 CCCNC(=O)N1CCCCCC1 2708a_100020643023_100000185865 [0,1,0,0,0,1|2,0,0]=4 7621 B13R1.2488 CCCNC(=O)N1CCCCCC1 273464a_100020643023_100000185865 [0,1,0,0,0,1|2,0,0]=4 7622 B13R1.2488 CCCNC(=O)N1CCCOCC1 2708a_100020643023_100000685342 [0,1,0,0,0,1|2,0,0]=4 7623 B13R1.2488 CCCNC(=O)N1CCCOCC1 273464a_100020643023_100000685342 [0,1,0,0,0,1|2,0,0]=4 7624 B13R1.2488 CCNCC(=O)N1CCCCCC1 2230a_100015525214_100000182869 [0,1,0,0,0,1|2,0,0]=4 7625 B13R1.2488 CCNNC(=O)C1CCC=CCC1 22a_100000756455_100000048548 [0,1,0,0,0,1|1,0,1]=4 7626 B13R1.2488 CCNNC(=O)C1CCCCCC1 22a_100000756455_100000749507 [0,1,0,0,0,1|1,0,0]=3 7627 B13R1.2488 CCOCC(=O)C1CCCCCC1 1458a_100000211967_100011217769 [0,1,0,0,0,1|0,0,0]=2 7628 B13R1.2488 CCOCC(=O)N1CCCCCC1 11a_100000185865_100000211967 [0,1,0,0,0,1|1,0,0]=3 7629 B13R1.2488 CCOCC(=O)N1CCCCCC1 1626a_100000185865_100000211967 [0,1,0,0,0,1|1,0,0]=3 7630 B13R1.2488 CCOCC(=O)N1CCCCCC1 240690a_100000185865_100000211967 [0,1,0,0,0,1|1,0,0]=3 7631 B13R1.2488 CCOCC(=O)N1CCCCCC1 34a_100121572206_100000182869 [0,1,0,0,0,1|1,0,0]=3 7632 B13R1.2488 CCOCC(=O)N1CCCCCC1 527a_100000185865_100000211967 [0,1,0,0,0,1|1,0,0]=3 7633 B13R1.2488 CCOCC(=O)N1CCCOCC1 11a_100000685342_100000211967 [0,1,0,0,0,1|1,0,0]=3 7634 B13R1.2488 CCOCC(=O)N1CCCOCC1 1626a_100000685342_100000211967 [0,1,0,0,0,1|1,0,0]=3 7635 B13R1.2488 CCOCC(=O)N1CCCOCC1 240690a_100000685342_100000211967 [0,1,0,0,0,1|1,0,0]=3 7636 B13R1.2488 CCOCC(=O)N1CCCOCC1 527a_100000685342_100000211967 [0,1,0,0,0,1|1,0,0]=3 7637 B13R1.2488 CCOCN(C)C1CCCCCC1 269982a_100015185097_100000739092 [0,1,0,0,0,1|2,0,0]=4 7638 B13R1.2488 CCSCC(=O)C1CCCCCC1 1458a_100000230394_100011217769 [0,1,0,0,0,1|0,1,0]=3 7639 B13R1.2488 CCSCC(=O)N1CCCCCC1 11a_100000185865_100000230394 [0,1,0,0,0,1|1,1,0]=4 7640 B13R1.2488 CCSCC(=O)N1CCCCCC1 1626a_100000185865_100000230394 [0,1,0,0,0,1|1,1,0]=4 7641 B13R1.2488 CCSCC(=O)N1CCCCCC1 240690a_100000185865_100000230394 [0,1,0,0,0,1|1,1,0]=4 7642 B13R1.2488 CCSCC(=O)N1CCCCCC1 527a_100000185865_100000230394 [0,1,0,0,0,1|1,1,0]=4 7643 B13R1.2488 CCSCC(=O)N1CCCCCC1 62a_100000182869_100000210202 [0,1,0,0,0,1|1,1,0]=4 7644 B13R1.2488 CCSCC(=O)N1CCCCCC1 62a_100000210202_100000182869 [0,1,0,0,0,1|1,1,0]=4 7645 B13R1.2488 CCSCC(=O)N1CCCOCC1 11a_100000685342_100000230394 [0,1,0,0,0,1|1,1,0]=4 7646 B13R1.2488 CCSCC(=O)N1CCCOCC1 1626a_100000685342_100000230394 [0,1,0,0,0,1|1,1,0]=4 7647 B13R1.2488 CCSCC(=O)N1CCCOCC1 240690a_100000685342_100000230394 [0,1,0,0,0,1|1,1,0]=4 7648 B13R1.2488 CCSCC(=O)N1CCCOCC1 527a_100000685342_100000230394 [0,1,0,0,0,1|1,1,0]=4 7649 B13R1.2488 COC=CC(=O)C1CCCCCC1 1458a_100016268678_100011217769 [0,1,0,0,0,1|1,0,1]=4 7650 B13R1.2488 COCCC(=O)C1CCC=CCC1 1458a_100000048548_100000233755 [0,1,0,0,0,1|1,0,1]=4 7651 B13R1.2488 COCCC(=O)C1CCCCCC1 1458a_100000749507_100000233755 [0,1,0,0,0,1|1,0,0]=3 7652 B13R1.2488 COCCC(=O)C1CCCCCC1 1458a_100000749529_100011217769 [0,1,0,0,0,1|1,0,0]=3 7653 B13R1.2488 COCCC(=O)N1CCCCCC1 11a_100000185865_100000749529 [0,1,0,0,0,1|2,0,0]=4 7654 B13R1.2488 COCCC(=O)N1CCCCCC1 1626a_100000185865_100000749529 [0,1,0,0,0,1|2,0,0]=4 7655 B13R1.2488 COCCC(=O)N1CCCCCC1 240690a_100000185865_100000749529 [0,1,0,0,0,1|2,0,0]=4 7656 B13R1.2488 COCCC(=O)N1CCCCCC1 527a_100000185865_100000749529 [0,1,0,0,0,1|2,0,0]=4 7657 B13R1.2488 COCCC(=O)N1CCCOCC1 11a_100000685342_100000749529 [0,1,0,0,0,1|2,0,0]=4 7658 B13R1.2488 COCCC(=O)N1CCCOCC1 1626a_100000685342_100000749529 [0,1,0,0,0,1|2,0,0]=4 7659 B13R1.2488 COCCC(=O)N1CCCOCC1 240690a_100000685342_100000749529 [0,1,0,0,0,1|2,0,0]=4 7660 B13R1.2488 COCCC(=O)N1CCCOCC1 527a_100000685342_100000749529 [0,1,0,0,0,1|2,0,0]=4 7661 B13R1.2488 CSCCC(=O)C1CCC=CCC1 1458a_100000048548_100000751147 [0,1,0,0,0,1|1,0,1]=4 7662 B13R1.2488 CSCCC(=O)C1CCCCCC1 1458a_100000174002_100011217769 [0,1,0,0,0,1|1,0,0]=3 7663 B13R1.2488 CSCCC(=O)C1CCCCCC1 1458a_100000749507_100000751147 [0,1,0,0,0,1|1,0,0]=3 7664 B13R1.2488 CSCCC(=O)N1CCCCCC1 11a_100000185865_100000174002 [0,1,0,0,0,1|2,0,0]=4 7665 B13R1.2488 CSCCC(=O)N1CCCCCC1 1626a_100000185865_100000174002 [0,1,0,0,0,1|2,0,0]=4 7666 B13R1.2488 CSCCC(=O)N1CCCCCC1 240690a_100000185865_100000174002 [0,1,0,0,0,1|2,0,0]=4 7667 B13R1.2488 CSCCC(=O)N1CCCCCC1 527a_100000185865_100000174002 [0,1,0,0,0,1|2,0,0]=4 7668 B13R1.2488 CSCCC(=O)N1CCCOCC1 11a_100000685342_100000174002 [0,1,0,0,0,1|2,0,0]=4 7669 B13R1.2488 CSCCC(=O)N1CCCOCC1 1626a_100000685342_100000174002 [0,1,0,0,0,1|2,0,0]=4 7670 B13R1.2488 CSCCC(=O)N1CCCOCC1 240690a_100000685342_100000174002 [0,1,0,0,0,1|2,0,0]=4 7671 B13R1.2488 CSCCC(=O)N1CCCOCC1 527a_100000685342_100000174002 [0,1,0,0,0,1|2,0,0]=4 7672 B13R1.2488 N#CCCC(=O)C1CCCCCC1 1458a_100000749507_100011215226 [0,1,0,0,0,1|1,0,1]=4 7673 B13R1.2488 N#CCCC(=O)C1CCCCCC1 1458a_100011934036_100011217769 [0,1,0,0,0,1|1,0,1]=4 7674 B13R1.2488 N#CCNC(=O)C1CCCCCC1 1626a_100000734998_100000749507 [0,1,0,0,0,1|1,0,1]=4 7675 B13R1.2488 N#CCNC(=O)C1CCCCCC1 527a_100000734998_100000749507 [0,1,0,0,0,1|1,0,1]=4 7676 B13R1.2488 O=C(C#CCO)C1CCCCCC1 1458a_100000049017_100011217769 [0,1,0,0,0,1|1,0,1]=4 7677 B13R1.2488 O=C(CCCF)C1CCC=CCC1 1458a_100000048548_100011934791 [0,1,0,0,0,1|1,0,1]=4 7678 B13R1.2488 O=C(CCCF)C1CCCCCC1 1458a_100000749507_100011934791 [0,1,0,0,0,1|1,0,0]=3 7679 B13R1.2488 O=C(CCCO)C1CCC=CCC1 1458a_100000048548_100011215043 [0,1,0,0,0,1|1,0,1]=4 7680 B13R1.2488 O=C(CCCO)C1CCCCCC1 1458a_100000749507_100011215043 [0,1,0,0,0,1|1,0,0]=3 7681 B13R1.2488 O=C(NCCF)C1CCC=CCC1 11a_100000724931_100000048548 [0,1,0,0,0,1|1,0,1]=4 7682 B13R1.2488 O=C(NCCF)C1CCC=CCC1 1626a_100000724931_100000048548 [0,1,0,0,0,1|1,0,1]=4 7683 B13R1.2488 O=C(NCCF)C1CCC=CCC1 240690a_100000724931_100000048548 [0,1,0,0,0,1|1,0,1]=4 7684 B13R1.2488 O=C(NCCF)C1CCC=CCC1 527a_100000724931_100000048548 [0,1,0,0,0,1|1,0,1]=4 7685 B13R1.2488 O=C(NCCF)C1CCCCCC1 11a_100000724931_100000749507 [0,1,0,0,0,1|1,0,0]=3 7686 B13R1.2488 O=C(NCCF)C1CCCCCC1 1626a_100000724931_100000749507 [0,1,0,0,0,1|1,0,0]=3 7687 B13R1.2488 O=C(NCCF)C1CCCCCC1 240690a_100000724931_100000749507 [0,1,0,0,0,1|1,0,0]=3 7688 B13R1.2488 O=C(NCCF)C1CCCCCC1 527a_100000724931_100000749507 [0,1,0,0,0,1|1,0,0]=3 7689 B13R1.2488 O=C(NCCF)N1CCCCCC1 273464a_100000724931_100000185865 [0,1,0,0,0,1|2,0,0]=4 7690 B13R1.2488 O=C(NCCF)N1CCCOCC1 273464a_100000724931_100000685342 [0,1,0,0,0,1|2,0,0]=4 7691 B13R1.2488 O=C(NCCO)C1CCC=CCC1 240690a_100000210304_100000048548 [0,1,0,0,0,1|1,0,1]=4 7692 B13R1.2488 O=C(NCCO)C1CCC=CCC1 527a_100000210304_100000048548 [0,1,0,0,0,1|1,0,1]=4 7693 B13R1.2488 O=C(NCCO)C1CCCCCC1 240690a_100000210304_100000749507 [0,1,0,0,0,1|1,0,0]=3 7694 B13R1.2488 O=C(NCCO)C1CCCCCC1 527a_100000210304_100000749507 [0,1,0,0,0,1|1,0,0]=3 7695 B13R1.2488 O=C(NCCO)N1CCCCCC1 273464a_100000210304_100000185865 [0,1,0,0,0,1|2,0,0]=4 7696 B13R1.2488 O=C(NCCO)N1CCCOCC1 273464a_100000210304_100000685342 [0,1,0,0,0,1|2,0,0]=4 7697 B13R1.2620 C/C=C(\C)/C(=O)C1CCCCCC1 1458a_100020587367_100011217769 [0,1,0,0,0,1|1,0,1]=4 7698 B13R1.2620 CCC(C)C(=O)C1CCC=CCC1 1458a_100000048548_100000758301 [0,1,0,0,0,1|1,0,1]=4 7699 B13R1.2620 CCC(C)C(=O)C1CCCCCC1 1458a_100000749507_100000758301 [0,1,0,0,0,1|1,0,0]=3 7700 B13R1.2620 CCC(C)C(=O)C1CCCCCC1 1458a_100011192722_100011217769 [0,1,0,0,0,1|1,0,0]=3 7701 B13R1.2620 CCC(C)C(=O)N1CCCCCC1 11a_100000185865_100011192722 [0,1,0,0,0,1|2,0,0]=4 7702 B13R1.2620 CCC(C)C(=O)N1CCCCCC1 1626a_100000185865_100011192722 [0,1,0,0,0,1|2,0,0]=4 7703 B13R1.2620 CCC(C)C(=O)N1CCCCCC1 240690a_100000185865_100011192722 [0,1,0,0,0,1|2,0,0]=4 7704 B13R1.2620 CCC(C)C(=O)N1CCCCCC1 527a_100000185865_100011192722 [0,1,0,0,0,1|2,0,0]=4 7705 B13R1.2620 CCC(C)C(=O)N1CCCOCC1 11a_100000685342_100011192722 [0,1,0,0,0,1|2,0,0]=4 7706 B13R1.2620 CCC(C)C(=O)N1CCCOCC1 1626a_100000685342_100011192722 [0,1,0,0,0,1|2,0,0]=4 7707 B13R1.2620 CCC(C)C(=O)N1CCCOCC1 240690a_100000685342_100011192722 [0,1,0,0,0,1|2,0,0]=4 7708 B13R1.2620 CCC(C)C(=O)N1CCCOCC1 527a_100000685342_100011192722 [0,1,0,0,0,1|2,0,0]=4 7709 B13R1.2620 CCC(O)C(=O)C1CCCCCC1 1458a_100011196387_100011217769 [0,1,0,0,0,1|1,0,0]=3 7710 B13R1.2620 CCC(O)C(=O)N1CCCCCC1 240690a_100000185865_100011196387 [0,1,0,0,0,1|2,0,0]=4 7711 B13R1.2620 CCC(O)C(=O)N1CCCOCC1 240690a_100000685342_100011196387 [0,1,0,0,0,1|2,0,0]=4 7712 B13R1.2620 CCN(C)C(=O)C1CCC=CCC1 11a_100000225621_100000048548 [0,1,0,0,0,1|1,0,1]=4 7713 B13R1.2620 CCN(C)C(=O)C1CCC=CCC1 1626a_100000225621_100000048548 [0,1,0,0,0,1|1,0,1]=4 7714 B13R1.2620 CCN(C)C(=O)C1CCC=CCC1 240690a_100000225621_100000048548 [0,1,0,0,0,1|1,0,1]=4 7715 B13R1.2620 CCN(C)C(=O)C1CCC=CCC1 527a_100000225621_100000048548 [0,1,0,0,0,1|1,0,1]=4 7716 B13R1.2620 CCN(C)C(=O)C1CCCCCC1 11a_100000225621_100000749507 [0,1,0,0,0,1|1,0,0]=3 7717 B13R1.2620 CCN(C)C(=O)C1CCCCCC1 1626a_100000225621_100000749507 [0,1,0,0,0,1|1,0,0]=3 7718 B13R1.2620 CCN(C)C(=O)C1CCCCCC1 240690a_100000225621_100000749507 [0,1,0,0,0,1|1,0,0]=3 7719 B13R1.2620 CCN(C)C(=O)C1CCCCCC1 527a_100000225621_100000749507 [0,1,0,0,0,1|1,0,0]=3 7720 B13R1.2620 CNC(=O)C(=O)C1CCCCCC1 1458a_100011218921_100011217769 [0,1,0,0,0,1|2,0,0]=4 7721 B13R1.2620 COC(C)C(=O)C1CCCCCC1 1458a_100000743197_100011217769 [0,1,0,0,0,1|2,0,0]=4 7722 B13R1.2620 CSC(C)C(=O)C1CCCCCC1 1458a_100000149566_100011217769 [0,1,0,0,0,1|2,0,0]=4 7723 B13R1.2620 O=C(C(O)CO)C1CCCCCC1 1458a_100011215603_100011217769 [0,1,0,0,0,1|2,0,0]=4 7724 B13R1.7456 C=C(C)CC(=O)C1CCCCCC1 1458a_100000749507_100000748629 [0,1,0,0,0,1|1,0,1]=4 7725 B13R1.7456 CC(=CC(=O)C1CCCCCC1)C 1458a_100000211388_100011217769 [0,1,0,0,0,1|1,0,1]=4 7726 B13R1.7456 CC(=CC(=O)C1CCCCCC1)Cl 1458a_200042562850_100011217769 [0,1,0,0,0,1|1,0,1]=4 7727 B13R1.7456 CC(=CC(=O)C1CCCCCC1)I 1458a_100025716642_100011217769 [0,1,0,0,0,1|1,0,1]=4 7728 B13R1.7456 CC(C)CC(=O)C1CCC=CCC1 1458a_100000048548_100000210624 [0,1,0,0,0,1|1,0,1]=4 7729 B13R1.7456 CC(C)CC(=O)C1CCCCCC1 1458a_100000210554_100011217769 [0,1,0,0,0,1|1,0,0]=3 7730 B13R1.7456 CC(C)CC(=O)C1CCCCCC1 1458a_100000749507_100000210624 [0,1,0,0,0,1|1,0,0]=3 7731 B13R1.7456 CC(C)CC(=O)N1CCCCCC1 11a_100000185865_100000210554 [0,1,0,0,0,1|2,0,0]=4 7732 B13R1.7456 CC(C)CC(=O)N1CCCCCC1 1626a_100000185865_100000210554 [0,1,0,0,0,1|2,0,0]=4 7733 B13R1.7456 CC(C)CC(=O)N1CCCCCC1 240690a_100000185865_100000210554 [0,1,0,0,0,1|2,0,0]=4 7734 B13R1.7456 CC(C)CC(=O)N1CCCCCC1 527a_100000185865_100000210554 [0,1,0,0,0,1|2,0,0]=4 7735 B13R1.7456 CC(C)CC(=O)N1CCCOCC1 11a_100000685342_100000210554 [0,1,0,0,0,1|2,0,0]=4 7736 B13R1.7456 CC(C)CC(=O)N1CCCOCC1 1626a_100000685342_100000210554 [0,1,0,0,0,1|2,0,0]=4 7737 B13R1.7456 CC(C)CC(=O)N1CCCOCC1 240690a_100000685342_100000210554 [0,1,0,0,0,1|2,0,0]=4 7738 B13R1.7456 CC(C)CC(=O)N1CCCOCC1 527a_100000685342_100000210554 [0,1,0,0,0,1|2,0,0]=4 7739 B13R1.7456 CC(C)NC(=O)C1CCC=CCC1 11a_100138425928_100000048548 [0,1,0,0,0,1|1,0,1]=4 7740 B13R1.7456 CC(C)NC(=O)C1CCC=CCC1 1626a_100138425928_100000048548 [0,1,0,0,0,1|1,0,1]=4 7741 B13R1.7456 CC(C)NC(=O)C1CCC=CCC1 240690a_100138425928_100000048548 [0,1,0,0,0,1|1,0,1]=4 7742 B13R1.7456 CC(C)NC(=O)C1CCC=CCC1 527a_100138425928_100000048548 [0,1,0,0,0,1|1,0,1]=4 7743 B13R1.7456 CC(C)NC(=O)C1CCCCCC1 11a_100138425928_100000749507 [0,1,0,0,0,1|1,0,0]=3 7744 B13R1.7456 CC(C)NC(=O)C1CCCCCC1 1626a_100138425928_100000749507 [0,1,0,0,0,1|1,0,0]=3 7745 B13R1.7456 CC(C)NC(=O)C1CCCCCC1 240690a_100138425928_100000749507 [0,1,0,0,0,1|1,0,0]=3 7746 B13R1.7456 CC(C)NC(=O)C1CCCCCC1 527a_100138425928_100000749507 [0,1,0,0,0,1|1,0,0]=3 7747 B13R1.7456 CC(C)NC(=O)N1CCCCCC1 2708a_100138425928_100000185865 [0,1,0,0,0,1|2,0,0]=4 7748 B13R1.7456 CC(C)NC(=O)N1CCCCCC1 273464a_100138425928_100000185865 [0,1,0,0,0,1|2,0,0]=4 7749 B13R1.7456 CC(C)NC(=O)N1CCCOCC1 2708a_100138425928_100000685342 [0,1,0,0,0,1|2,0,0]=4 7750 B13R1.7456 CC(C)NC(=O)N1CCCOCC1 273464a_100138425928_100000685342 [0,1,0,0,0,1|2,0,0]=4 7751 B13R1.7456 CC(O)CC(=O)C1CCC=CCC1 1458a_100000048548_100011218427 [0,1,0,0,0,1|1,0,1]=4 7752 B13R1.7456 CC(O)CC(=O)C1CCCCCC1 1458a_100000749507_100011218427 [0,1,0,0,0,1|1,0,0]=3 7753 B13R1.7456 CN(C)CC(=O)C1CCCCCC1 1458a_100000750896_100011217769 [0,1,0,0,0,1|2,0,0]=4 7754 B13R1.7456 C[C@@H](O)CC(=O)C1CCCCCC1 1458a_100011933948_100011217769 [0,1,0,0,0,1|1,0,0]=3 7755 B13R1.7456 C[C@@H](O)CC(=O)N1CCCCCC1 240690a_100000185865_100011933948 [0,1,0,0,0,1|2,0,0]=4 7756 B13R1.7456 C[C@@H](O)CC(=O)N1CCCOCC1 240690a_100000685342_100011933948 [0,1,0,0,0,1|2,0,0]=4 7757 B13R1.7456 C[S+](C)CC(=O)C1CCCCCC1 1458a_200159257847_100011217769 [0,1,0,0,0,1|2,0,0]=4 7758 B13R1.7456 O=C(CC(F)F)C1CCCCCC1 1458a_100000749507_100011934356 [0,1,0,0,0,1|2,0,0]=4 7759 B13R1.26 CCC(OCCF)C1CCCCC1 34a_100011215090_100011217306 [0,2,0,0,0,0|1,0,1]=4 7760 B13R1.26 CCC(OCCF)C1CCCCC1 7a_100011215090_100011217306 [0,2,0,0,0,0|1,0,1]=4 7761 B13R1.26 CCC(OCCO)C1CCCCC1 34a_100011215090_100000211926 [0,2,0,0,0,0|1,0,1]=4 7762 B13R1.26 CCC(OCCO)C1CCCCC1 7a_100011215090_100000211926 [0,2,0,0,0,0|1,0,1]=4 7763 B13R1.26 CCC(OCSC)C1CCCCC1 34a_100011215090_100011218213 [0,2,0,0,0,0|1,0,1]=4 7764 B13R1.26 CCCOC(CC)C1CCCCC1 34a_100011215090_100000210303 [0,2,0,0,0,0|1,0,1]=4 7765 B13R1.26 CCCOC(CC)C1CCCCC1 7a_100011215090_100000210303 [0,2,0,0,0,0|1,0,1]=4 7766 B13R1.26 CCNN=C(CC)C1CCCCC1 4a_100000756455_100011216311 [0,2,0,0,0,0|2,0,0]=4 7767 B13R1.26 CCOCN(CC)C1CCCCC1 269982a_100000201195_100000739092 [0,2,0,0,0,0|2,0,0]=4 7768 B13R1.398 C/C=C/C(OCC)C1CCCCC1 34a_200016259495_100000210202 [0,2,0,0,0,0|1,0,1]=4 7769 B13R1.398 C/C=C/C(OCC)C1CCCCC1 7a_200016259495_100000210202 [0,2,0,0,0,0|1,0,1]=4 7770 B13R1.398 CCCC(OCC)C1CCCCC1 34a_100011218000_100000210202 [0,2,0,0,0,0|1,0,1]=4 7771 B13R1.398 CCCC(OCC)C1CCCCC1 7a_100011218000_100000210202 [0,2,0,0,0,0|1,0,1]=4 7772 B13R1.398 CCCN(CC=O)C1CCCCC1 2230a_100000750343_200015260668 [0,2,0,0,0,0|2,0,0]=4 7773 B13R1.398 CCCN(CC=O)C1CCCCC1 269982a_100000750343_200015260668 [0,2,0,0,0,0|2,0,0]=4 7774 B13R1.398 CCCN(CC=O)C1CCCCC1 34a_100000750343_200009817547 [0,2,0,0,0,0|2,0,0]=4 7775 B13R1.405 CCCN(C(=O)C)C1CCCCC1 11a_100000750343_100015343762 [0,2,0,0,0,0|2,0,0]=4 7776 B13R1.405 CCCN(C(=O)C)C1CCCCC1 1626a_100000750343_100015343762 [0,2,0,0,0,0|2,0,0]=4 7777 B13R1.405 CCCN(C(=O)C)C1CCCCC1 240690a_100000750343_100015343762 [0,2,0,0,0,0|2,0,0]=4 7778 B13R1.405 CCCN(C(=O)C)C1CCCCC1 527a_100000750343_100103153847 [0,2,0,0,0,0|2,0,0]=4 7779 B13R1.405 CCNC(C(=O)O)C1CCCCC1 269956a_100000742913_100000210202 [0,2,0,0,0,0|1,0,1]=4 7780 B13R1.713 CCC(OC(C)C)C1CCCCC1 34a_100011215090_100000210206 [0,2,0,0,0,0|1,0,1]=4 7781 B13R1.713 CCC(OC(C)C)C1CCCCC1 7a_100011215090_100000210206 [0,2,0,0,0,0|1,0,1]=4 7782 B13R1.17 C#CCCC(=O)C1CCC(CC1)C 1458a_100000692101_200011216234 [0,2,0,0,0,0|1,0,1]=4 7783 B13R1.17 C#CCCC(=O)C1CCC(CC1)O 1458a_100000743365_100000753159 [0,2,0,0,0,0|1,0,1]=4 7784 B13R1.17 C#CCCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000753159 [0,2,0,0,0,0|1,0,1]=4 7785 B13R1.17 C#CCNC(=O)C1CCC(CC1)O 1626a_100000212058_100000743365 [0,2,0,0,0,0|1,0,1]=4 7786 B13R1.17 C#CCNC(=O)C1CCC(CC1)O 240690a_100000212058_100000743365 [0,2,0,0,0,0|1,0,1]=4 7787 B13R1.17 C#CCNC(=O)C1CCC(CC1)O 527a_100000212058_100000743365 [0,2,0,0,0,0|1,0,1]=4 7788 B13R1.17 C#CCNC(=O)[C@H]1CC[C@@H](CC1)C 11a_100000212058_100009815934 [0,2,0,0,0,0|1,0,1]=4 7789 B13R1.17 C#CCNC(=O)[C@H]1CC[C@@H](CC1)C 1626a_100000212058_100009815934 [0,2,0,0,0,0|1,0,1]=4 7790 B13R1.17 C#CCNC(=O)[C@H]1CC[C@@H](CC1)C 240690a_100000212058_100009815934 [0,2,0,0,0,0|1,0,1]=4 7791 B13R1.17 C#CCNC(=O)[C@H]1CC[C@@H](CC1)C 527a_100000212058_100009815934 [0,2,0,0,0,0|1,0,1]=4 7792 B13R1.17 C/C=C/CC(=O)C1CCC(CC1)O 1458a_100000743365_100102629194 [0,2,0,0,0,0|1,0,1]=4 7793 B13R1.17 C/C=C/CC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100102629194 [0,2,0,0,0,0|1,0,1]=4 7794 B13R1.17 C=C1CCC(CC1)C(=O)CCCC 1458a_200000138047_100000210211 [0,2,0,0,0,0|1,0,1]=4 7795 B13R1.17 C=C1CCC(CC1)C(=O)CCCF 1458a_200000138047_100011934791 [0,2,0,0,0,0|1,0,1]=4 7796 B13R1.17 C=C1CCC(CC1)C(=O)CCCO 1458a_200000138047_100011215043 [0,2,0,0,0,0|1,0,1]=4 7797 B13R1.17 C=C1CCC(CC1)C(=O)CCOC 1458a_200000138047_100000233755 [0,2,0,0,0,0|1,0,1]=4 7798 B13R1.17 C=C1CCC(CC1)C(=O)CCSC 1458a_200000138047_100000751147 [0,2,0,0,0,0|1,0,1]=4 7799 B13R1.17 C=C1CCC(CC1)C(=O)NCCC 11a_100020643023_200000138047 [0,2,0,0,0,0|1,0,1]=4 7800 B13R1.17 C=C1CCC(CC1)C(=O)NCCC 1626a_100020643023_200000138047 [0,2,0,0,0,0|1,0,1]=4 7801 B13R1.17 C=C1CCC(CC1)C(=O)NCCC 240690a_100020643023_200000138047 [0,2,0,0,0,0|1,0,1]=4 7802 B13R1.17 C=C1CCC(CC1)C(=O)NCCC 527a_100020643023_200000138047 [0,2,0,0,0,0|1,0,1]=4 7803 B13R1.17 C=C1CCC(CC1)C(=O)NCCF 11a_100000724931_200000138047 [0,2,0,0,0,0|1,0,1]=4 7804 B13R1.17 C=C1CCC(CC1)C(=O)NCCF 1626a_100000724931_200000138047 [0,2,0,0,0,0|1,0,1]=4 7805 B13R1.17 C=C1CCC(CC1)C(=O)NCCF 240690a_100000724931_200000138047 [0,2,0,0,0,0|1,0,1]=4 7806 B13R1.17 C=C1CCC(CC1)C(=O)NCCF 527a_100000724931_200000138047 [0,2,0,0,0,0|1,0,1]=4 7807 B13R1.17 C=C1CCC(CC1)C(=O)NCCO 240690a_100000210304_200000138047 [0,2,0,0,0,0|1,0,1]=4 7808 B13R1.17 C=C1CCC(CC1)C(=O)NCCO 527a_100000210304_200000138047 [0,2,0,0,0,0|1,0,1]=4 7809 B13R1.17 C=C1CCC(CC1)C(=O)NNCC 22a_100000756455_200000138047 [0,2,0,0,0,0|1,0,1]=4 7810 B13R1.17 C=C1CCN(CC1)C(=O)COCC 11a_100000752442_100000211967 [0,2,0,0,0,0|1,0,1]=4 7811 B13R1.17 C=C1CCN(CC1)C(=O)COCC 1626a_100000752442_100000211967 [0,2,0,0,0,0|1,0,1]=4 7812 B13R1.17 C=C1CCN(CC1)C(=O)COCC 240690a_100000752442_100000211967 [0,2,0,0,0,0|1,0,1]=4 7813 B13R1.17 C=C1CCN(CC1)C(=O)COCC 527a_100000752442_100000211967 [0,2,0,0,0,0|1,0,1]=4 7814 B13R1.17 C=CCCC(=O)C1CCC(CC1)C 1458a_100000749702_200011216234 [0,2,0,0,0,0|1,0,1]=4 7815 B13R1.17 C=CCCC(=O)C1CCC(CC1)O 1458a_100000743365_100000754431 [0,2,0,0,0,0|1,0,1]=4 7816 B13R1.17 C=CCCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000754431 [0,2,0,0,0,0|1,0,1]=4 7817 B13R1.17 C=CCNC(=O)C1CCC(CC1)O 1626a_100020586998_100000743365 [0,2,0,0,0,0|1,0,1]=4 7818 B13R1.17 C=CCNC(=O)C1CCC(CC1)O 240690a_100020586998_100000743365 [0,2,0,0,0,0|1,0,1]=4 7819 B13R1.17 C=CCNC(=O)C1CCC(CC1)O 527a_100020586998_100000743365 [0,2,0,0,0,0|1,0,1]=4 7820 B13R1.17 C=CCNC(=O)[C@H]1CC[C@@H](CC1)C 1626a_100020586998_100009815934 [0,2,0,0,0,0|1,0,1]=4 7821 B13R1.17 C=CCNC(=O)[C@H]1CC[C@@H](CC1)C 240690a_100020586998_100009815934 [0,2,0,0,0,0|1,0,1]=4 7822 B13R1.17 C=CCNC(=O)[C@H]1CC[C@@H](CC1)C 527a_100020586998_100009815934 [0,2,0,0,0,0|1,0,1]=4 7823 B13R1.17 CC#CCC(=O)C1CCC(CC1)O 1458a_100000743365_100000748600 [0,2,0,0,0,0|1,0,1]=4 7824 B13R1.17 CC#CCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000748600 [0,2,0,0,0,0|1,0,1]=4 7825 B13R1.17 CC1CCC(CC1)C(=O)C#CCO 1458a_100000049017_200011216234 [0,2,0,0,0,0|1,0,1]=4 7826 B13R1.17 CC1CCC(CC1)C(=O)CCC#N 1458a_100011934036_200011216234 [0,2,0,0,0,0|1,0,1]=4 7827 B13R1.17 CC1CCN(CC1)C(=O)CCS[13CH3] 62a_100011194420_200025704644 [0,2,0,0,0,0|2,0,0]=4 7828 B13R1.17 CC1CCN(CC1)C(=O)CCS[13CH3] 62a_200025704644_100011194420 [0,2,0,0,0,0|2,0,0]=4 7829 B13R1.17 CC1CCN(CC1)C(=O)NCCF 273464a_100000724931_100000188429 [0,2,0,0,0,0|2,0,0]=4 7830 B13R1.17 CC1CCN(CC1)C(=O)NCCO 273464a_100000210304_100000188429 [0,2,0,0,0,0|2,0,0]=4 7831 B13R1.17 CC=CCC(=O)C1CCC(CC1)C 1458a_100121576822_200011216234 [0,2,0,0,0,0|1,0,1]=4 7832 B13R1.17 CC=CCC(=O)C1CCC(CC1)O 1458a_100000743365_100000070051 [0,2,0,0,0,0|1,0,1]=4 7833 B13R1.17 CC=CCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000070051 [0,2,0,0,0,0|1,0,1]=4 7834 B13R1.17 CCC#CC(=O)C1CCC(CC1)C 1458a_100011827653_200011216234 [0,2,0,0,0,0|1,0,0]=3 7835 B13R1.17 CCC=CC(=O)C1CCC(CC1)C 1458a_100000212282_200011216234 [0,2,0,0,0,0|1,0,0]=3 7836 B13R1.17 CCC=CC(=O)N1CCC(CC1)C 240690a_100000188429_100000212282 [0,2,0,0,0,0|2,0,0]=4 7837 B13R1.17 CCC=CC(=O)N1CCC(CC1)F 11a_100015193889_100000212282 [0,2,0,0,0,0|2,0,0]=4 7838 B13R1.17 CCC=CC(=O)N1CCC(CC1)F 1626a_100015193889_100000212282 [0,2,0,0,0,0|2,0,0]=4 7839 B13R1.17 CCC=CC(=O)N1CCC(CC1)F 240690a_100015193889_100000212282 [0,2,0,0,0,0|2,0,0]=4 7840 B13R1.17 CCC=CC(=O)N1CCC(CC1)O 240690a_100025773856_100000212282 [0,2,0,0,0,0|2,0,0]=4 7841 B13R1.17 CCCCC(=O)C1CCC(CC1)C 1458a_100000210183_200011216234 [0,2,0,0,0,0|1,0,0]=3 7842 B13R1.17 CCCCC(=O)C1CCC(CC1)O 1458a_100000743365_100000210211 [0,2,0,0,0,0|1,0,0]=3 7843 B13R1.17 CCCCC(=O)C1CCN(CC1)C 1458a_100000743488_100000210211 [0,2,0,0,0,0|2,0,0]=4 7844 B13R1.17 CCCCC(=O)N1CCC(CC1)C 240690a_100000188429_100000210183 [0,2,0,0,0,0|2,0,0]=4 7845 B13R1.17 CCCCC(=O)N1CCC(CC1)C 527a_100000188429_100000210183 [0,2,0,0,0,0|2,0,0]=4 7846 B13R1.17 CCCCC(=O)N1CCC(CC1)F 11a_100015193889_100000210183 [0,2,0,0,0,0|2,0,0]=4 7847 B13R1.17 CCCCC(=O)N1CCC(CC1)F 1626a_100015193889_100000210183 [0,2,0,0,0,0|2,0,0]=4 7848 B13R1.17 CCCCC(=O)N1CCC(CC1)F 240690a_100015193889_100000210183 [0,2,0,0,0,0|2,0,0]=4 7849 B13R1.17 CCCCC(=O)N1CCC(CC1)F 527a_100015193889_100000210183 [0,2,0,0,0,0|2,0,0]=4 7850 B13R1.17 CCCCC(=O)N1CCC(CC1)O 240690a_100025773856_100000210183 [0,2,0,0,0,0|2,0,0]=4 7851 B13R1.17 CCCCC(=O)N1CCC(CC1)O 527a_100025773856_100000210183 [0,2,0,0,0,0|2,0,0]=4 7852 B13R1.17 CCCCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000210211 [0,2,0,0,0,0|1,0,0]=3 7853 B13R1.17 CCCNC(=O)C1CCC(CC1)O 1626a_100020643023_100000743365 [0,2,0,0,0,0|1,0,0]=3 7854 B13R1.17 CCCNC(=O)C1CCC(CC1)O 240690a_100020643023_100000743365 [0,2,0,0,0,0|1,0,0]=3 7855 B13R1.17 CCCNC(=O)C1CCC(CC1)O 527a_100020643023_100000743365 [0,2,0,0,0,0|1,0,0]=3 7856 B13R1.17 CCCNC(=O)C1CCN(CC1)C 2230a_100000753480_200000210301 [0,2,0,0,0,0|2,0,0]=4 7857 B13R1.17 CCCNC(=O)C1CCN(CC1)C 240690a_100020643023_100000743488 [0,2,0,0,0,0|2,0,0]=4 7858 B13R1.17 CCCNC(=O)C1CCN(CC1)C 269982a_100000753480_200000210301 [0,2,0,0,0,0|2,0,0]=4 7859 B13R1.17 CCCNC(=O)C1CCN(CC1)C 34a_100000753480_200000210301 [0,2,0,0,0,0|2,0,0]=4 7860 B13R1.17 CCCNC(=O)C1CCN(CC1)C 527a_100020643023_100000743488 [0,2,0,0,0,0|2,0,0]=4 7861 B13R1.17 CCCNC(=O)C1CCN(CC1)[13CH3] 2230a_100000753480_200025704644 [0,2,0,0,0,0|2,0,0]=4 7862 B13R1.17 CCCNC(=O)C1CCN(CC1)[13CH3] 269982a_100000753480_200025704644 [0,2,0,0,0,0|2,0,0]=4 7863 B13R1.17 CCCNC(=O)C1CCN(CC1)[13CH3] 34a_100000753480_200025704644 [0,2,0,0,0,0|2,0,0]=4 7864 B13R1.17 CCCNC(=O)N1CCC(CC1)C 2708a_100020643023_100000188429 [0,2,0,0,0,0|2,0,0]=4 7865 B13R1.17 CCCNC(=O)N1CCC(CC1)C 273464a_100020643023_100000188429 [0,2,0,0,0,0|2,0,0]=4 7866 B13R1.17 CCCNC(=O)N1CCC(CC1)F 2708a_100020643023_100015193889 [0,2,0,0,0,0|2,0,0]=4 7867 B13R1.17 CCCNC(=O)N1CCC(CC1)F 273464a_100020643023_100015193889 [0,2,0,0,0,0|2,0,0]=4 7868 B13R1.17 CCCNC(=O)N1CCC(CC1)O 2708a_100020643023_100025773856 [0,2,0,0,0,0|2,0,0]=4 7869 B13R1.17 CCCNC(=O)N1CCC(CC1)O 273464a_100020643023_100025773856 [0,2,0,0,0,0|2,0,0]=4 7870 B13R1.17 CCCNC(=O)[C@H]1CC[C@@H](CC1)C 11a_100020643023_100009815934 [0,2,0,0,0,0|1,0,0]=3 7871 B13R1.17 CCCNC(=O)[C@H]1CC[C@@H](CC1)C 1626a_100020643023_100009815934 [0,2,0,0,0,0|1,0,0]=3 7872 B13R1.17 CCCNC(=O)[C@H]1CC[C@@H](CC1)C 240690a_100020643023_100009815934 [0,2,0,0,0,0|1,0,0]=3 7873 B13R1.17 CCCNC(=O)[C@H]1CC[C@@H](CC1)C 527a_100020643023_100009815934 [0,2,0,0,0,0|1,0,0]=3 7874 B13R1.17 CCNCC(=O)N1CCC(CC1)C 2230a_100015525214_100000182867 [0,2,0,0,0,0|2,0,0]=4 7875 B13R1.17 CCNNC(=O)C1CCC(CC1)O 22a_100000756455_100000743365 [0,2,0,0,0,0|1,0,0]=3 7876 B13R1.17 CCNNC(=O)C1CCN(CC1)C 22a_100000756455_100000743488 [0,2,0,0,0,0|2,0,0]=4 7877 B13R1.17 CCNNC(=O)[C@H]1CC[C@@H](CC1)C 22a_100000756455_100009815934 [0,2,0,0,0,0|1,0,0]=3 7878 B13R1.17 CCOCC(=O)C1CCC(CC1)C 1458a_100000211967_200011216234 [0,2,0,0,0,0|0,0,0]=2 7879 B13R1.17 CCOCC(=O)N1CCC(CC1)C 240690a_100000188429_100000211967 [0,2,0,0,0,0|1,0,0]=3 7880 B13R1.17 CCOCC(=O)N1CCC(CC1)C 34a_100121572206_100000182867 [0,2,0,0,0,0|1,0,0]=3 7881 B13R1.17 CCOCC(=O)N1CCC(CC1)C 527a_100000188429_100000211967 [0,2,0,0,0,0|1,0,0]=3 7882 B13R1.17 CCOCC(=O)N1CCC(CC1)F 11a_100015193889_100000211967 [0,2,0,0,0,0|1,0,0]=3 7883 B13R1.17 CCOCC(=O)N1CCC(CC1)F 1626a_100015193889_100000211967 [0,2,0,0,0,0|1,0,0]=3 7884 B13R1.17 CCOCC(=O)N1CCC(CC1)F 240690a_100015193889_100000211967 [0,2,0,0,0,0|1,0,0]=3 7885 B13R1.17 CCOCC(=O)N1CCC(CC1)F 527a_100015193889_100000211967 [0,2,0,0,0,0|1,0,0]=3 7886 B13R1.17 CCOCC(=O)N1CCC(CC1)O 240690a_100025773856_100000211967 [0,2,0,0,0,0|1,0,0]=3 7887 B13R1.17 CCOCC(=O)N1CCC(CC1)O 527a_100025773856_100000211967 [0,2,0,0,0,0|1,0,0]=3 7888 B13R1.17 CCOCC(=O)N1CCN(CC1)C 11a_100000188432_100000211967 [0,2,0,0,0,0|2,0,0]=4 7889 B13R1.17 CCOCC(=O)N1CCN(CC1)C 240690a_100000188432_100000211967 [0,2,0,0,0,0|2,0,0]=4 7890 B13R1.17 CCOCC(=O)N1CCN(CC1)C 527a_100000188432_100000211967 [0,2,0,0,0,0|2,0,0]=4 7891 B13R1.17 CCOCC(=O)N1CCS(=O)CC1 240690a_100000752083_100000211967 [0,2,0,0,0,0|2,0,0]=4 7892 B13R1.17 CCOCC(=O)N1CCS(=O)CC1 527a_100000752083_100000211967 [0,2,0,0,0,0|2,0,0]=4 7893 B13R1.17 CCOCN(C)[C@H]1CC[C@H](CC1)O 269982a_100020636401_100000739092 [0,2,0,0,0,0|2,0,0]=4 7894 B13R1.17 CCSCC(=O)C1CCC(CC1)C 1458a_100000230394_200011216234 [0,2,0,0,0,0|0,1,0]=3 7895 B13R1.17 CCSCC(=O)N1CCC(CC1)C 240690a_100000188429_100000230394 [0,2,0,0,0,0|1,1,0]=4 7896 B13R1.17 CCSCC(=O)N1CCC(CC1)C 527a_100000188429_100000230394 [0,2,0,0,0,0|1,1,0]=4 7897 B13R1.17 CCSCC(=O)N1CCC(CC1)C 62a_100000182867_100000210202 [0,2,0,0,0,0|1,1,0]=4 7898 B13R1.17 CCSCC(=O)N1CCC(CC1)C 62a_100000210202_100000182867 [0,2,0,0,0,0|1,1,0]=4 7899 B13R1.17 CCSCC(=O)N1CCC(CC1)F 11a_100015193889_100000230394 [0,2,0,0,0,0|1,1,0]=4 7900 B13R1.17 CCSCC(=O)N1CCC(CC1)F 1626a_100015193889_100000230394 [0,2,0,0,0,0|1,1,0]=4 7901 B13R1.17 CCSCC(=O)N1CCC(CC1)F 240690a_100015193889_100000230394 [0,2,0,0,0,0|1,1,0]=4 7902 B13R1.17 CCSCC(=O)N1CCC(CC1)F 527a_100015193889_100000230394 [0,2,0,0,0,0|1,1,0]=4 7903 B13R1.17 CCSCC(=O)N1CCC(CC1)O 240690a_100025773856_100000230394 [0,2,0,0,0,0|1,1,0]=4 7904 B13R1.17 CCSCC(=O)N1CCC(CC1)O 527a_100025773856_100000230394 [0,2,0,0,0,0|1,1,0]=4 7905 B13R1.17 CN1CCC(CC1)C(=O)CCCF 1458a_100000743488_100011934791 [0,2,0,0,0,0|2,0,0]=4 7906 B13R1.17 CN1CCC(CC1)C(=O)CCCO 1458a_100000743488_100011215043 [0,2,0,0,0,0|2,0,0]=4 7907 B13R1.17 CN1CCC(CC1)C(=O)NCCF 240690a_100000724931_100000743488 [0,2,0,0,0,0|2,0,0]=4 7908 B13R1.17 CN1CCC(CC1)C(=O)NCCF 527a_100000724931_100000743488 [0,2,0,0,0,0|2,0,0]=4 7909 B13R1.17 CN1CCC(CC1)C(=O)NCCO 2230a_100025771131_200000210301 [0,2,0,0,0,0|2,0,0]=4 7910 B13R1.17 CN1CCC(CC1)C(=O)NCCO 240690a_100000210304_100000743488 [0,2,0,0,0,0|2,0,0]=4 7911 B13R1.17 CN1CCC(CC1)C(=O)NCCO 269982a_100025771131_200000210301 [0,2,0,0,0,0|2,0,0]=4 7912 B13R1.17 CN1CCC(CC1)C(=O)NCCO 34a_100025771131_200000210301 [0,2,0,0,0,0|2,0,0]=4 7913 B13R1.17 CN1CCC(CC1)C(=O)NCCO 527a_100000210304_100000743488 [0,2,0,0,0,0|2,0,0]=4 7914 B13R1.17 CNCCC(=O)N1CCC(CC1)C 2230a_106832991635_100011194420 [0,2,0,0,0,0|2,0,0]=4 7915 B13R1.17 CNCCC(=O)N1CCC(CC1)C 34a_100102657272_100011194420 [0,2,0,0,0,0|2,0,0]=4 7916 B13R1.17 CNCCC(=O)N1CCC(CC1)C 7a_106832991635_100011194420 [0,2,0,0,0,0|2,0,0]=4 7917 B13R1.17 COC=CC(=O)C1CCC(CC1)C 1458a_100016268678_200011216234 [0,2,0,0,0,0|1,0,1]=4 7918 B13R1.17 COCCC(=O)C1CCC(CC1)C 1458a_100000749529_200011216234 [0,2,0,0,0,0|1,0,0]=3 7919 B13R1.17 COCCC(=O)C1CCC(CC1)O 1458a_100000743365_100000233755 [0,2,0,0,0,0|1,0,0]=3 7920 B13R1.17 COCCC(=O)C1CCN(CC1)C 1458a_100000743488_100000233755 [0,2,0,0,0,0|2,0,0]=4 7921 B13R1.17 COCCC(=O)N1CCC(CC1)C 240690a_100000188429_100000749529 [0,2,0,0,0,0|2,0,0]=4 7922 B13R1.17 COCCC(=O)N1CCC(CC1)C 34a_100138415774_100011194420 [0,2,0,0,0,0|2,0,0]=4 7923 B13R1.17 COCCC(=O)N1CCC(CC1)C 527a_100000188429_100000749529 [0,2,0,0,0,0|2,0,0]=4 7924 B13R1.17 COCCC(=O)N1CCC(CC1)F 11a_100015193889_100000749529 [0,2,0,0,0,0|2,0,0]=4 7925 B13R1.17 COCCC(=O)N1CCC(CC1)F 1626a_100015193889_100000749529 [0,2,0,0,0,0|2,0,0]=4 7926 B13R1.17 COCCC(=O)N1CCC(CC1)F 240690a_100015193889_100000749529 [0,2,0,0,0,0|2,0,0]=4 7927 B13R1.17 COCCC(=O)N1CCC(CC1)F 527a_100015193889_100000749529 [0,2,0,0,0,0|2,0,0]=4 7928 B13R1.17 COCCC(=O)N1CCC(CC1)O 240690a_100025773856_100000749529 [0,2,0,0,0,0|2,0,0]=4 7929 B13R1.17 COCCC(=O)N1CCC(CC1)O 527a_100025773856_100000749529 [0,2,0,0,0,0|2,0,0]=4 7930 B13R1.17 COCCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000233755 [0,2,0,0,0,0|1,0,0]=3 7931 B13R1.17 CSCCC(=O)C1CCC(CC1)C 1458a_100000174002_200011216234 [0,2,0,0,0,0|1,0,0]=3 7932 B13R1.17 CSCCC(=O)C1CCC(CC1)O 1458a_100000743365_100000751147 [0,2,0,0,0,0|1,0,0]=3 7933 B13R1.17 CSCCC(=O)C1CCN(CC1)C 1458a_100000743488_100000751147 [0,2,0,0,0,0|2,0,0]=4 7934 B13R1.17 CSCCC(=O)N1CCC(CC1)C 240690a_100000188429_100000174002 [0,2,0,0,0,0|2,0,0]=4 7935 B13R1.17 CSCCC(=O)N1CCC(CC1)C 527a_100000188429_100000174002 [0,2,0,0,0,0|2,0,0]=4 7936 B13R1.17 CSCCC(=O)N1CCC(CC1)C 62a_100011194420_200000210301 [0,2,0,0,0,0|2,0,0]=4 7937 B13R1.17 CSCCC(=O)N1CCC(CC1)C 62a_200000210301_100011194420 [0,2,0,0,0,0|2,0,0]=4 7938 B13R1.17 CSCCC(=O)N1CCC(CC1)F 11a_100015193889_100000174002 [0,2,0,0,0,0|2,0,0]=4 7939 B13R1.17 CSCCC(=O)N1CCC(CC1)F 1626a_100015193889_100000174002 [0,2,0,0,0,0|2,0,0]=4 7940 B13R1.17 CSCCC(=O)N1CCC(CC1)F 240690a_100015193889_100000174002 [0,2,0,0,0,0|2,0,0]=4 7941 B13R1.17 CSCCC(=O)N1CCC(CC1)F 527a_100015193889_100000174002 [0,2,0,0,0,0|2,0,0]=4 7942 B13R1.17 CSCCC(=O)N1CCC(CC1)O 240690a_100025773856_100000174002 [0,2,0,0,0,0|2,0,0]=4 7943 B13R1.17 CSCCC(=O)N1CCC(CC1)O 527a_100025773856_100000174002 [0,2,0,0,0,0|2,0,0]=4 7944 B13R1.17 CSCCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000751147 [0,2,0,0,0,0|1,0,0]=3 7945 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)CCC#N 1458a_100009815934_100011215226 [0,2,0,0,0,0|1,0,1]=4 7946 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)CCCF 1458a_100009815934_100011934791 [0,2,0,0,0,0|1,0,0]=3 7947 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)CCCO 1458a_100009815934_100011215043 [0,2,0,0,0,0|1,0,0]=3 7948 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)NCC#N 1626a_100000734998_100009815934 [0,2,0,0,0,0|1,0,1]=4 7949 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)NCC#N 527a_100000734998_100009815934 [0,2,0,0,0,0|1,0,1]=4 7950 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)NCCF 11a_100000724931_100009815934 [0,2,0,0,0,0|1,0,0]=3 7951 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)NCCF 1626a_100000724931_100009815934 [0,2,0,0,0,0|1,0,0]=3 7952 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)NCCF 240690a_100000724931_100009815934 [0,2,0,0,0,0|1,0,0]=3 7953 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)NCCF 527a_100000724931_100009815934 [0,2,0,0,0,0|1,0,0]=3 7954 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)NCCO 240690a_100000210304_100009815934 [0,2,0,0,0,0|1,0,0]=3 7955 B13R1.17 C[C@H]1CC[C@@H](CC1)C(=O)NCCO 527a_100000210304_100009815934 [0,2,0,0,0,0|1,0,0]=3 7956 B13R1.17 N#CCCC(=O)C1CCC(CC1)O 1458a_100000743365_100011215226 [0,2,0,0,0,0|1,0,1]=4 7957 B13R1.17 N#CCNC(=O)C1CCC(CC1)O 1626a_100000734998_100000743365 [0,2,0,0,0,0|1,0,1]=4 7958 B13R1.17 N#CCNC(=O)C1CCC(CC1)O 527a_100000734998_100000743365 [0,2,0,0,0,0|1,0,1]=4 7959 B13R1.17 O=C(CCCF)C1CCC(CC1)O 1458a_100000743365_100011934791 [0,2,0,0,0,0|1,0,0]=3 7960 B13R1.17 O=C(CCCO)C1CCC(CC1)O 1458a_100000743365_100011215043 [0,2,0,0,0,0|1,0,0]=3 7961 B13R1.17 O=C(NCCF)C1CCC(CC1)O 1626a_100000724931_100000743365 [0,2,0,0,0,0|1,0,0]=3 7962 B13R1.17 O=C(NCCF)C1CCC(CC1)O 240690a_100000724931_100000743365 [0,2,0,0,0,0|1,0,0]=3 7963 B13R1.17 O=C(NCCF)C1CCC(CC1)O 527a_100000724931_100000743365 [0,2,0,0,0,0|1,0,0]=3 7964 B13R1.17 O=C(NCCF)N1CCC(CC1)F 273464a_100000724931_100015193889 [0,2,0,0,0,0|2,0,0]=4 7965 B13R1.17 O=C(NCCF)N1CCC(CC1)O 273464a_100000724931_100025773856 [0,2,0,0,0,0|2,0,0]=4 7966 B13R1.17 O=C(NCCO)C1CCC(CC1)O 240690a_100000210304_100000743365 [0,2,0,0,0,0|1,0,0]=3 7967 B13R1.17 O=C(NCCO)C1CCC(CC1)O 527a_100000210304_100000743365 [0,2,0,0,0,0|1,0,0]=3 7968 B13R1.17 O=C(NCCO)N1CCC(CC1)F 273464a_100000210304_100015193889 [0,2,0,0,0,0|2,0,0]=4 7969 B13R1.17 O=C(NCCO)N1CCC(CC1)O 273464a_100000210304_100025773856 [0,2,0,0,0,0|2,0,0]=4 7970 B13R1.17 [13CH3]N1CCC(CC1)C(=O)NCCO 2230a_100025771131_200025704644 [0,2,0,0,0,0|2,0,0]=4 7971 B13R1.17 [13CH3]N1CCC(CC1)C(=O)NCCO 269982a_100025771131_200025704644 [0,2,0,0,0,0|2,0,0]=4 7972 B13R1.17 [13CH3]N1CCC(CC1)C(=O)NCCO 34a_100025771131_200025704644 [0,2,0,0,0,0|2,0,0]=4 7973 B13R1.21 C/C=C(\C)/C(=O)C1CCC(CC1)C 1458a_100020587367_200011216234 [0,2,0,0,0,0|1,0,1]=4 7974 B13R1.21 C=C1CCC(CC1)C(=O)C(C)CC 1458a_200000138047_100000758301 [0,2,0,0,0,0|1,0,1]=4 7975 B13R1.21 C=C1CCC(CC1)C(=O)N(C)CC 11a_100000225621_200000138047 [0,2,0,0,0,0|1,0,1]=4 7976 B13R1.21 C=C1CCC(CC1)C(=O)N(C)CC 1626a_100000225621_200000138047 [0,2,0,0,0,0|1,0,1]=4 7977 B13R1.21 C=C1CCC(CC1)C(=O)N(C)CC 240690a_100000225621_200000138047 [0,2,0,0,0,0|1,0,1]=4 7978 B13R1.21 C=C1CCC(CC1)C(=O)N(C)CC 527a_100000225621_200000138047 [0,2,0,0,0,0|1,0,1]=4 7979 B13R1.21 CC1CCC(CC1)C(=O)C(O)CO 1458a_100011215603_200011216234 [0,2,0,0,0,0|2,0,0]=4 7980 B13R1.21 CCC(C)C(=O)C1CCC(CC1)C 1458a_100011192722_200011216234 [0,2,0,0,0,0|1,0,0]=3 7981 B13R1.21 CCC(C)C(=O)C1CCC(CC1)O 1458a_100000743365_100000758301 [0,2,0,0,0,0|1,0,0]=3 7982 B13R1.21 CCC(C)C(=O)C1CCN(CC1)C 1458a_100000743488_100000758301 [0,2,0,0,0,0|2,0,0]=4 7983 B13R1.21 CCC(C)C(=O)N1CCC(CC1)C 240690a_100000188429_100011192722 [0,2,0,0,0,0|2,0,0]=4 7984 B13R1.21 CCC(C)C(=O)N1CCC(CC1)C 527a_100000188429_100011192722 [0,2,0,0,0,0|2,0,0]=4 7985 B13R1.21 CCC(C)C(=O)N1CCC(CC1)F 11a_100015193889_100011192722 [0,2,0,0,0,0|2,0,0]=4 7986 B13R1.21 CCC(C)C(=O)N1CCC(CC1)F 1626a_100015193889_100011192722 [0,2,0,0,0,0|2,0,0]=4 7987 B13R1.21 CCC(C)C(=O)N1CCC(CC1)F 240690a_100015193889_100011192722 [0,2,0,0,0,0|2,0,0]=4 7988 B13R1.21 CCC(C)C(=O)N1CCC(CC1)F 527a_100015193889_100011192722 [0,2,0,0,0,0|2,0,0]=4 7989 B13R1.21 CCC(C)C(=O)N1CCC(CC1)O 240690a_100025773856_100011192722 [0,2,0,0,0,0|2,0,0]=4 7990 B13R1.21 CCC(C)C(=O)N1CCC(CC1)O 527a_100025773856_100011192722 [0,2,0,0,0,0|2,0,0]=4 7991 B13R1.21 CCC(C)C(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000758301 [0,2,0,0,0,0|1,0,0]=3 7992 B13R1.21 CCC(O)C(=O)C1CCC(CC1)C 1458a_100011196387_200011216234 [0,2,0,0,0,0|1,0,0]=3 7993 B13R1.21 CCC(O)C(=O)N1CCC(CC1)C 240690a_100000188429_100011196387 [0,2,0,0,0,0|2,0,0]=4 7994 B13R1.21 CCC(O)C(=O)N1CCC(CC1)F 240690a_100015193889_100011196387 [0,2,0,0,0,0|2,0,0]=4 7995 B13R1.21 CCC(O)C(=O)N1CCC(CC1)O 240690a_100025773856_100011196387 [0,2,0,0,0,0|2,0,0]=4 7996 B13R1.21 CCN(C)C(=O)C1CCC(CC1)O 1626a_100000225621_100000743365 [0,2,0,0,0,0|1,0,0]=3 7997 B13R1.21 CCN(C)C(=O)C1CCC(CC1)O 240690a_100000225621_100000743365 [0,2,0,0,0,0|1,0,0]=3 7998 B13R1.21 CCN(C)C(=O)C1CCC(CC1)O 527a_100000225621_100000743365 [0,2,0,0,0,0|1,0,0]=3 7999 B13R1.21 CCN(C)C(=O)C1CCN(CC1)C 240690a_100000225621_100000743488 [0,2,0,0,0,0|2,0,0]=4 8000 B13R1.21 CCN(C)C(=O)C1CCN(CC1)C 527a_100000225621_100000743488 [0,2,0,0,0,0|2,0,0]=4 8001 B13R1.21 CCN(C)C(=O)[C@H]1CC[C@@H](CC1)C 11a_100000225621_100009815934 [0,2,0,0,0,0|1,0,0]=3 8002 B13R1.21 CCN(C)C(=O)[C@H]1CC[C@@H](CC1)C 1626a_100000225621_100009815934 [0,2,0,0,0,0|1,0,0]=3 8003 B13R1.21 CCN(C)C(=O)[C@H]1CC[C@@H](CC1)C 240690a_100000225621_100009815934 [0,2,0,0,0,0|1,0,0]=3 8004 B13R1.21 CCN(C)C(=O)[C@H]1CC[C@@H](CC1)C 527a_100000225621_100009815934 [0,2,0,0,0,0|1,0,0]=3 8005 B13R1.21 CNC(=O)C(=O)C1CCC(CC1)C 1458a_100011218921_200011216234 [0,2,0,0,0,0|2,0,0]=4 8006 B13R1.21 COC(C)C(=O)C1CCC(CC1)C 1458a_100000743197_200011216234 [0,2,0,0,0,0|2,0,0]=4 8007 B13R1.21 CSC(C)C(=O)C1CCC(CC1)C 1458a_100000149566_200011216234 [0,2,0,0,0,0|2,0,0]=4 8008 B13R1.29 CCOC(C)(C)C1CCC(CC1)C 34a_200011215047_100000210202 [0,2,0,0,0,0|1,0,1]=4 8009 B13R1.29 CCOC(C)(C)C1CCC(CC1)C 7a_200011215047_100000210202 [0,2,0,0,0,0|1,0,1]=4 8010 B13R1.29 CCOC(C)(C)[C@H]1CC[C@@H](CC1)N 34a_100015421777_100000210202 [0,2,0,0,0,0|1,0,1]=4 8011 B13R1.132 C=C(C)CC(=O)C1CCC(CC1)O 1458a_100000743365_100000748629 [0,2,0,0,0,0|1,0,1]=4 8012 B13R1.132 C=C(C)CC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000748629 [0,2,0,0,0,0|1,0,1]=4 8013 B13R1.132 C=C1CCC(CC1)C(=O)CC(C)C 1458a_200000138047_100000210624 [0,2,0,0,0,0|1,0,1]=4 8014 B13R1.132 C=C1CCC(CC1)C(=O)CC(C)O 1458a_200000138047_100011218427 [0,2,0,0,0,0|1,0,1]=4 8015 B13R1.132 C=C1CCC(CC1)C(=O)NC(C)C 11a_100138425928_200000138047 [0,2,0,0,0,0|1,0,1]=4 8016 B13R1.132 C=C1CCC(CC1)C(=O)NC(C)C 1626a_100138425928_200000138047 [0,2,0,0,0,0|1,0,1]=4 8017 B13R1.132 C=C1CCC(CC1)C(=O)NC(C)C 240690a_100138425928_200000138047 [0,2,0,0,0,0|1,0,1]=4 8018 B13R1.132 C=C1CCC(CC1)C(=O)NC(C)C 527a_100138425928_200000138047 [0,2,0,0,0,0|1,0,1]=4 8019 B13R1.132 CC(=CC(=O)C1CCC(CC1)C)C 1458a_100000211388_200011216234 [0,2,0,0,0,0|1,0,1]=4 8020 B13R1.132 CC(=CC(=O)C1CCC(CC1)C)Cl 1458a_200042562850_200011216234 [0,2,0,0,0,0|1,0,1]=4 8021 B13R1.132 CC(=CC(=O)C1CCC(CC1)C)I 1458a_100025716642_200011216234 [0,2,0,0,0,0|1,0,1]=4 8022 B13R1.132 CC(C)CC(=O)C1CCC(CC1)C 1458a_100000210554_200011216234 [0,2,0,0,0,0|1,0,0]=3 8023 B13R1.132 CC(C)CC(=O)C1CCC(CC1)O 1458a_100000743365_100000210624 [0,2,0,0,0,0|1,0,0]=3 8024 B13R1.132 CC(C)CC(=O)C1CCN(CC1)C 1458a_100000743488_100000210624 [0,2,0,0,0,0|2,0,0]=4 8025 B13R1.132 CC(C)CC(=O)N1CCC(CC1)C 240690a_100000188429_100000210554 [0,2,0,0,0,0|2,0,0]=4 8026 B13R1.132 CC(C)CC(=O)N1CCC(CC1)C 527a_100000188429_100000210554 [0,2,0,0,0,0|2,0,0]=4 8027 B13R1.132 CC(C)CC(=O)N1CCC(CC1)F 11a_100015193889_100000210554 [0,2,0,0,0,0|2,0,0]=4 8028 B13R1.132 CC(C)CC(=O)N1CCC(CC1)F 1626a_100015193889_100000210554 [0,2,0,0,0,0|2,0,0]=4 8029 B13R1.132 CC(C)CC(=O)N1CCC(CC1)F 240690a_100015193889_100000210554 [0,2,0,0,0,0|2,0,0]=4 8030 B13R1.132 CC(C)CC(=O)N1CCC(CC1)F 527a_100015193889_100000210554 [0,2,0,0,0,0|2,0,0]=4 8031 B13R1.132 CC(C)CC(=O)N1CCC(CC1)O 240690a_100025773856_100000210554 [0,2,0,0,0,0|2,0,0]=4 8032 B13R1.132 CC(C)CC(=O)N1CCC(CC1)O 527a_100025773856_100000210554 [0,2,0,0,0,0|2,0,0]=4 8033 B13R1.132 CC(C)CC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000210624 [0,2,0,0,0,0|1,0,0]=3 8034 B13R1.132 CC(C)NC(=O)C1CCC(CC1)O 1626a_100138425928_100000743365 [0,2,0,0,0,0|1,0,0]=3 8035 B13R1.132 CC(C)NC(=O)C1CCC(CC1)O 240690a_100138425928_100000743365 [0,2,0,0,0,0|1,0,0]=3 8036 B13R1.132 CC(C)NC(=O)C1CCC(CC1)O 527a_100138425928_100000743365 [0,2,0,0,0,0|1,0,0]=3 8037 B13R1.132 CC(C)NC(=O)C1CCN(CC1)C 240690a_100138425928_100000743488 [0,2,0,0,0,0|2,0,0]=4 8038 B13R1.132 CC(C)NC(=O)C1CCN(CC1)C 527a_100138425928_100000743488 [0,2,0,0,0,0|2,0,0]=4 8039 B13R1.132 CC(C)NC(=O)N1CCC(CC1)F 2708a_100138425928_100015193889 [0,2,0,0,0,0|2,0,0]=4 8040 B13R1.132 CC(C)NC(=O)N1CCC(CC1)F 273464a_100138425928_100015193889 [0,2,0,0,0,0|2,0,0]=4 8041 B13R1.132 CC(C)NC(=O)N1CCC(CC1)O 2708a_100138425928_100025773856 [0,2,0,0,0,0|2,0,0]=4 8042 B13R1.132 CC(C)NC(=O)N1CCC(CC1)O 273464a_100138425928_100025773856 [0,2,0,0,0,0|2,0,0]=4 8043 B13R1.132 CC(C)NC(=O)[C@H]1CC[C@@H](CC1)C 11a_100138425928_100009815934 [0,2,0,0,0,0|1,0,0]=3 8044 B13R1.132 CC(C)NC(=O)[C@H]1CC[C@@H](CC1)C 1626a_100138425928_100009815934 [0,2,0,0,0,0|1,0,0]=3 8045 B13R1.132 CC(C)NC(=O)[C@H]1CC[C@@H](CC1)C 240690a_100138425928_100009815934 [0,2,0,0,0,0|1,0,0]=3 8046 B13R1.132 CC(C)NC(=O)[C@H]1CC[C@@H](CC1)C 527a_100138425928_100009815934 [0,2,0,0,0,0|1,0,0]=3 8047 B13R1.132 CC(C)OC(=O)N1CCN(CC1)C 2230a_200011548458_200000210301 [0,2,0,0,0,0|2,0,0]=4 8048 B13R1.132 CC(C)OC(=O)N1CCN(CC1)C 269982a_200011548458_200000210301 [0,2,0,0,0,0|2,0,0]=4 8049 B13R1.132 CC(C)OC(=O)N1CCN(CC1)[13CH3] 2230a_200011548458_200025704644 [0,2,0,0,0,0|2,0,0]=4 8050 B13R1.132 CC(C)OC(=O)N1CCN(CC1)[13CH3] 269982a_200011548458_200025704644 [0,2,0,0,0,0|2,0,0]=4 8051 B13R1.132 CC(O)CC(=O)C1CCC(CC1)O 1458a_100000743365_100011218427 [0,2,0,0,0,0|1,0,0]=3 8052 B13R1.132 CC(O)CC(=O)C1CCN(CC1)C 1458a_100000743488_100011218427 [0,2,0,0,0,0|2,0,0]=4 8053 B13R1.132 CC(O)CC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100011218427 [0,2,0,0,0,0|1,0,0]=3 8054 B13R1.132 CC1CCC(CC1)C(=O)CN(C)C 1458a_100000750896_200011216234 [0,2,0,0,0,0|2,0,0]=4 8055 B13R1.132 CC1CCC(CC1)C(=O)C[C@@H](C)O 1458a_100011933948_200011216234 [0,2,0,0,0,0|1,0,0]=3 8056 B13R1.132 CC1CCC(CC1)C(=O)C[S+](C)C 1458a_200159257847_200011216234 [0,2,0,0,0,0|2,0,0]=4 8057 B13R1.132 CC1CCN(CC1)C(=O)C[C@@H](C)O 240690a_100000188429_100011933948 [0,2,0,0,0,0|2,0,0]=4 8058 B13R1.132 CC1CCN(CC1)C(=O)NC(C)C 2708a_100138425928_100000188429 [0,2,0,0,0,0|2,0,0]=4 8059 B13R1.132 CC1CCN(CC1)C(=O)NC(C)C 273464a_100138425928_100000188429 [0,2,0,0,0,0|2,0,0]=4 8060 B13R1.132 C[C@@H](O)CC(=O)N1CCC(CC1)F 240690a_100015193889_100011933948 [0,2,0,0,0,0|2,0,0]=4 8061 B13R1.132 C[C@@H](O)CC(=O)N1CCC(CC1)O 240690a_100025773856_100011933948 [0,2,0,0,0,0|2,0,0]=4 8062 B13R1.132 C[C@H]1CC[C@@H](CC1)C(=O)CC(F)F 1458a_100009815934_100011934356 [0,2,0,0,0,0|2,0,0]=4 8063 B13R1.132 O=C(CC(F)F)C1CCC(CC1)O 1458a_100000743365_100011934356 [0,2,0,0,0,0|2,0,0]=4 8064 B13R1.452 C#CC1CCN(CC1)C(=O)CCC 11a_100016991398_100000211992 [0,2,0,0,0,0|2,0,0]=4 8065 B13R1.452 C#CC1CCN(CC1)C(=O)CCC 1626a_100016991398_100000211992 [0,2,0,0,0,0|2,0,0]=4 8066 B13R1.452 C#CC1CCN(CC1)C(=O)CCC 240690a_100016991398_100000211992 [0,2,0,0,0,0|2,0,0]=4 8067 B13R1.452 C#CC1CCN(CC1)C(=O)CCC 527a_100016991398_100000211992 [0,2,0,0,0,0|2,0,0]=4 8068 B13R1.452 C#CC1CCN(CC1)C(=O)NCC 2708a_100015525214_100016991398 [0,2,0,0,0,0|2,0,0]=4 8069 B13R1.452 C#CC1CCN(CC1)C(=O)NCC 273464a_100015525214_100016991398 [0,2,0,0,0,0|2,0,0]=4 8070 B13R1.452 CCCC(=O)C1CCC(CC1)CO 1458a_100011217856_100000210303 [0,2,0,0,0,0|1,0,0]=3 8071 B13R1.452 CCCC(=O)C1CCC(CC1)OC 1458a_100011215563_100000210303 [0,2,0,0,0,0|1,0,0]=3 8072 B13R1.452 CCCC(=O)C1CCN(CC1)CC 1458a_100015186486_100000210303 [0,2,0,0,0,0|2,0,0]=4 8073 B13R1.452 CCCC(=O)N1CCC(CC1)C#N 11a_100000747632_100000211992 [0,2,0,0,0,0|2,0,0]=4 8074 B13R1.452 CCCC(=O)N1CCC(CC1)C#N 1626a_100000747632_100000211992 [0,2,0,0,0,0|2,0,0]=4 8075 B13R1.452 CCCC(=O)N1CCC(CC1)C#N 240690a_100000747632_100000211992 [0,2,0,0,0,0|2,0,0]=4 8076 B13R1.452 CCCC(=O)N1CCC(CC1)C#N 527a_100000747632_100000211992 [0,2,0,0,0,0|2,0,0]=4 8077 B13R1.452 CCCC(=O)N1CCC(CC1)CC 11a_100000754474_100000211992 [0,2,0,0,0,0|2,0,0]=4 8078 B13R1.452 CCCC(=O)N1CCC(CC1)CC 1626a_100000754474_100000211992 [0,2,0,0,0,0|2,0,0]=4 8079 B13R1.452 CCCC(=O)N1CCC(CC1)CC 240690a_100000754474_100000211992 [0,2,0,0,0,0|2,0,0]=4 8080 B13R1.452 CCCC(=O)N1CCC(CC1)CC 527a_100000754474_100000211992 [0,2,0,0,0,0|2,0,0]=4 8081 B13R1.452 CCCC(=O)N1CCC(CC1)CF 11a_100015203933_100000211992 [0,2,0,0,0,0|2,0,0]=4 8082 B13R1.452 CCCC(=O)N1CCC(CC1)CF 1626a_100015203933_100000211992 [0,2,0,0,0,0|2,0,0]=4 8083 B13R1.452 CCCC(=O)N1CCC(CC1)CF 240690a_100015203933_100000211992 [0,2,0,0,0,0|2,0,0]=4 8084 B13R1.452 CCCC(=O)N1CCC(CC1)CF 527a_100015203933_100000211992 [0,2,0,0,0,0|2,0,0]=4 8085 B13R1.452 CCCC(=O)N1CCC(CC1)CO 240690a_100000738675_100000211992 [0,2,0,0,0,0|2,0,0]=4 8086 B13R1.452 CCCC(=O)N1CCC(CC1)CO 527a_100000738675_100000211992 [0,2,0,0,0,0|2,0,0]=4 8087 B13R1.452 CCCC(=O)N1CCC(CC1)NC 270004a_106832991635_100000162424 [0,2,0,0,0,0|2,0,0]=4 8088 B13R1.452 CCCC(=O)N1CCC(CC1)OC 11a_100000234800_100000211992 [0,2,0,0,0,0|2,0,0]=4 8089 B13R1.452 CCCC(=O)N1CCC(CC1)OC 1626a_100000234800_100000211992 [0,2,0,0,0,0|2,0,0]=4 8090 B13R1.452 CCCC(=O)N1CCC(CC1)OC 240690a_100000234800_100000211992 [0,2,0,0,0,0|2,0,0]=4 8091 B13R1.452 CCCC(=O)N1CCC(CC1)OC 527a_100000234800_100000211992 [0,2,0,0,0,0|2,0,0]=4 8092 B13R1.452 CCCC(=O)N1CCC(CC1)SC 11a_100015202541_100000211992 [0,2,0,0,0,0|2,0,0]=4 8093 B13R1.452 CCCC(=O)N1CCC(CC1)SC 1626a_100015202541_100000211992 [0,2,0,0,0,0|2,0,0]=4 8094 B13R1.452 CCCC(=O)N1CCC(CC1)SC 240690a_100015202541_100000211992 [0,2,0,0,0,0|2,0,0]=4 8095 B13R1.452 CCCC(=O)N1CCC(CC1)SC 527a_100015202541_100000211992 [0,2,0,0,0,0|2,0,0]=4 8096 B13R1.452 CCCC(=O)[C@H]1CC[C@@H](CC1)C#N 1458a_100132307125_100000210303 [0,2,0,0,0,0|1,0,0]=3 8097 B13R1.452 CCCC(=O)[C@H]1CC[C@@H](CC1)CC 1458a_100000709782_100000210303 [0,2,0,0,0,0|1,0,0]=3 8098 B13R1.452 CCNC(=O)C1CCC(CC1)CO 240690a_100015525214_100011217856 [0,2,0,0,0,0|1,0,0]=3 8099 B13R1.452 CCNC(=O)C1CCC(CC1)OC 11a_100015525214_100011215563 [0,2,0,0,0,0|1,0,0]=3 8100 B13R1.452 CCNC(=O)C1CCC(CC1)OC 240690a_100015525214_100011215563 [0,2,0,0,0,0|1,0,0]=3 8101 B13R1.452 CCNC(=O)C1CCC(CC1)OC 527a_100015525214_100011215563 [0,2,0,0,0,0|1,0,0]=3 8102 B13R1.452 CCNC(=O)C1CCN(CC1)CC 11a_100015525214_100015186486 [0,2,0,0,0,0|2,0,0]=4 8103 B13R1.452 CCNC(=O)C1CCN(CC1)CC 240690a_100015525214_100015186486 [0,2,0,0,0,0|2,0,0]=4 8104 B13R1.452 CCNC(=O)C1CCN(CC1)CC 527a_100015525214_100015186486 [0,2,0,0,0,0|2,0,0]=4 8105 B13R1.452 CCNC(=O)N1CCC(CC1)C#N 2708a_100015525214_100000747632 [0,2,0,0,0,0|2,0,0]=4 8106 B13R1.452 CCNC(=O)N1CCC(CC1)C#N 273464a_100015525214_100000747632 [0,2,0,0,0,0|2,0,0]=4 8107 B13R1.452 CCNC(=O)N1CCC(CC1)CC 2708a_100015525214_100000754474 [0,2,0,0,0,0|2,0,0]=4 8108 B13R1.452 CCNC(=O)N1CCC(CC1)CC 273464a_100015525214_100000754474 [0,2,0,0,0,0|2,0,0]=4 8109 B13R1.452 CCNC(=O)N1CCC(CC1)CF 2708a_100015525214_100015203933 [0,2,0,0,0,0|2,0,0]=4 8110 B13R1.452 CCNC(=O)N1CCC(CC1)CF 273464a_100015525214_100015203933 [0,2,0,0,0,0|2,0,0]=4 8111 B13R1.452 CCNC(=O)N1CCC(CC1)CO 2708a_100015525214_100000738675 [0,2,0,0,0,0|2,0,0]=4 8112 B13R1.452 CCNC(=O)N1CCC(CC1)CO 273464a_100015525214_100000738675 [0,2,0,0,0,0|2,0,0]=4 8113 B13R1.452 CCNC(=O)N1CCC(CC1)OC 2708a_100015525214_100000234800 [0,2,0,0,0,0|2,0,0]=4 8114 B13R1.452 CCNC(=O)N1CCC(CC1)OC 273464a_100015525214_100000234800 [0,2,0,0,0,0|2,0,0]=4 8115 B13R1.452 CCNC(=O)N1CCC(CC1)SC 2708a_100015525214_100015202541 [0,2,0,0,0,0|2,0,0]=4 8116 B13R1.452 CCNC(=O)N1CCC(CC1)SC 273464a_100015525214_100015202541 [0,2,0,0,0,0|2,0,0]=4 8117 B13R1.452 CCNC(=O)[C@H]1CC[C@@H](CC1)C#N 11a_100015525214_100132307125 [0,2,0,0,0,0|1,0,0]=3 8118 B13R1.452 CCNC(=O)[C@H]1CC[C@@H](CC1)C#N 240690a_100015525214_100132307125 [0,2,0,0,0,0|1,0,0]=3 8119 B13R1.452 CCNC(=O)[C@H]1CC[C@@H](CC1)C#N 527a_100015525214_100132307125 [0,2,0,0,0,0|1,0,0]=3 8120 B13R1.452 CCNC(=O)[C@H]1CC[C@@H](CC1)CC 11a_100015525214_100000709782 [0,2,0,0,0,0|1,0,0]=3 8121 B13R1.452 CCNC(=O)[C@H]1CC[C@@H](CC1)CC 240690a_100015525214_100000709782 [0,2,0,0,0,0|1,0,0]=3 8122 B13R1.452 CCNC(=O)[C@H]1CC[C@@H](CC1)CC 527a_100015525214_100000709782 [0,2,0,0,0,0|1,0,0]=3 8123 B13R1.452 CCOC(=O)C1CCC(CC1)NC 270004a_106832991635_100000033286 [0,2,0,0,0,0|0,0,0]=2 8124 B13R1.452 CCOC(=O)C1CCC(CC1)OC 7a_100011219671_200000210301 [0,2,0,0,0,0|0,0,0]=2 8125 B13R1.452 CCOC(=O)C1CCC(CC1)O[13CH3] 7a_100011219671_200025704644 [0,2,0,0,0,0|0,0,0]=2 8126 B13R1.452 CCOC(=O)C1CCN(CC1)CC 2230a_100000210402_100000210202 [0,2,0,0,0,0|1,0,0]=3 8127 B13R1.452 CCOC(=O)C1CCN(CC1)CC 269982a_100000210402_100000204670 [0,2,0,0,0,0|1,0,0]=3 8128 B13R1.452 CCOC(=O)C1CCN(CC1)CF 269982a_100000210402_100015361967 [0,2,0,0,0,0|1,0,0]=3 8129 B13R1.452 CCOC(=O)N1CCC(CC1)NC 270004a_106832991635_100000162416 [0,2,0,0,0,0|1,0,0]=3 8130 B13R1.452 CCOC(=O)N1CCC(CC1)OC 7a_100000246467_200000210301 [0,2,0,0,0,0|1,0,0]=3 8131 B13R1.452 CCOC(=O)N1CCC(CC1)O[13CH3] 7a_100000246467_200025704644 [0,2,0,0,0,0|1,0,0]=3 8132 B13R1.452 CCOC(=O)N1CCC(CC1)SC 62a_200000210301_100000069185 [0,2,0,0,0,0|1,0,0]=3 8133 B13R1.452 CCOC(=O)N1CCC(CC1)S[13CH3] 62a_200025704644_100000069185 [0,2,0,0,0,0|1,0,0]=3 8134 B13R1.452 CCOC(=O)N1CCN(CC1)CC 2230a_100000210854_100000210202 [0,2,0,0,0,0|2,0,0]=4 8135 B13R1.452 CCOC(=O)N1CCN(CC1)CC 269982a_100000210854_100000204670 [0,2,0,0,0,0|2,0,0]=4 8136 B13R1.452 CCOC(=O)N1CCN(CC1)CF 269982a_100000210854_100015361967 [0,2,0,0,0,0|2,0,0]=4 8137 B13R1.452 CC[C@H]1CC[C@@H](CC1)C(=O)CCF 1458a_100000709782_100011217306 [0,2,0,0,0,0|2,0,0]=4 8138 B13R1.452 CC[C@H]1CC[C@@H](CC1)C(=O)CCO 1458a_100000709782_100000211926 [0,2,0,0,0,0|2,0,0]=4 8139 B13R1.452 CC[C@H]1CC[C@@H](CC1)C(=O)NNC 22a_100016993582_100000709782 [0,2,0,0,0,0|2,0,0]=4 8140 B13R1.452 CNNC(=O)C1CCC(CC1)CO 22a_100016993582_100011217856 [0,2,0,0,0,0|2,0,0]=4 8141 B13R1.452 CNNC(=O)C1CCC(CC1)OC 22a_100016993582_100011215563 [0,2,0,0,0,0|2,0,0]=4 8142 B13R1.452 CNNC(=O)[C@H]1CC[C@@H](CC1)C#N 22a_100016993582_100132307125 [0,2,0,0,0,0|2,0,0]=4 8143 B13R1.452 COC1CCC(CC1)C(=O)CCF 1458a_100011215563_100011217306 [0,2,0,0,0,0|2,0,0]=4 8144 B13R1.452 COC1CCC(CC1)C(=O)CCO 1458a_100011215563_100000211926 [0,2,0,0,0,0|2,0,0]=4 8145 B13R1.452 N#C[C@H]1CC[C@@H](CC1)C(=O)CCF 1458a_100132307125_100011217306 [0,2,0,0,0,0|2,0,0]=4 8146 B13R1.452 N#C[C@H]1CC[C@@H](CC1)C(=O)CCO 1458a_100132307125_100000211926 [0,2,0,0,0,0|2,0,0]=4 8147 B13R1.452 O=C(CCF)C1CCC(CC1)CO 1458a_100011217856_100011217306 [0,2,0,0,0,0|2,0,0]=4 8148 B13R1.452 O=C(CCO)C1CCC(CC1)CO 1458a_100011217856_100000211926 [0,2,0,0,0,0|2,0,0]=4 8149 B13R1.466 CCCC(=O)N1CCC(C(C1)C)O 240690a_100011998114_100000211992 [0,2,0,0,0,0|2,0,0]=4 8150 B13R1.466 CCCC(=O)N1CCC(C(C1)C)O 527a_100011998114_100000211992 [0,2,0,0,0,0|2,0,0]=4 8151 B13R1.466 CCCC(=O)N1CCC(C(C1)O)C 11a_100000696640_100000211992 [0,2,0,0,0,0|2,0,0]=4 8152 B13R1.466 CCCC(=O)N1CCC(C(C1)O)C 240690a_100000696640_100000211992 [0,2,0,0,0,0|2,0,0]=4 8153 B13R1.466 CCCC(=O)N1CCC(C(C1)O)C 527a_100000696640_100000211992 [0,2,0,0,0,0|2,0,0]=4 8154 B13R1.466 CCCC(=O)N1CC[C@H]([C@H](C1)F)O 240690a_200016994291_100000211992 [0,2,0,0,0,0|2,0,0]=4 8155 B13R1.466 CCCC(=O)N1CC[C@H]([C@H](C1)F)O 527a_200016994291_100000211992 [0,2,0,0,0,0|2,0,0]=4 8156 B13R1.466 CCCC(=O)N1CC[C@H]([C@H](C1)O)O 11a_100000690696_100000211992 [0,2,0,0,0,0|2,0,0]=4 8157 B13R1.466 CCCC(=O)N1CC[C@H]([C@H](C1)O)O 240690a_100000690696_100000211992 [0,2,0,0,0,0|2,0,0]=4 8158 B13R1.466 CCCC(=O)N1CC[C@H]([C@H](C1)O)O 527a_100000690696_100000211992 [0,2,0,0,0,0|2,0,0]=4 8159 B13R1.466 CCNC(=O)N1CCC(C(C1)C)O 2708a_100015525214_100011998114 [0,2,0,0,0,0|2,0,0]=4 8160 B13R1.466 CCNC(=O)N1CCC(C(C1)C)O 273464a_100015525214_100011998114 [0,2,0,0,0,0|2,0,0]=4 8161 B13R1.466 CCNC(=O)N1CCC(C(C1)O)C 2708a_100015525214_100000696640 [0,2,0,0,0,0|2,0,0]=4 8162 B13R1.466 CCNC(=O)N1CCC(C(C1)O)C 273464a_100015525214_100000696640 [0,2,0,0,0,0|2,0,0]=4 8163 B13R1.466 CCNC(=O)N1CC[C@H]([C@H](C1)F)O 2708a_100015525214_200016994291 [0,2,0,0,0,0|2,0,0]=4 8164 B13R1.466 CCNC(=O)N1CC[C@H]([C@H](C1)F)O 273464a_100015525214_200016994291 [0,2,0,0,0,0|2,0,0]=4 8165 B13R1.466 CCNC(=O)N1CC[C@H]([C@H](C1)O)O 2708a_100015525214_100000690696 [0,2,0,0,0,0|2,0,0]=4 8166 B13R1.1512 CC#CC(=O)C1CCC(CC1)(F)F 1458a_100000763181_100009865109 [0,2,0,0,0,0|1,0,1]=4 8167 B13R1.1512 CC=CC(=O)C1CCC(CC1)(F)F 1458a_100000210699_100009865109 [0,2,0,0,0,0|1,0,1]=4 8168 B13R1.1512 CCCC(=O)C1CCC(CC1)(F)F 1458a_100000211992_100009865109 [0,2,0,0,0,0|1,0,0]=3 8169 B13R1.1512 CCCC(=O)C1CCC(CC1)(F)F 1458a_100000752077_100000210303 [0,2,0,0,0,0|1,0,0]=3 8170 B13R1.1512 CCCC(=O)C1CCS(=O)(=O)CC1 1458a_100000755231_100000210303 [0,2,0,0,0,0|2,0,0]=4 8171 B13R1.1512 CCCC(=O)N1CCC(CC1)(C)C 11a_100000750138_100000211992 [0,2,0,0,0,0|2,0,0]=4 8172 B13R1.1512 CCCC(=O)N1CCC(CC1)(C)C 1626a_100000750138_100000211992 [0,2,0,0,0,0|2,0,0]=4 8173 B13R1.1512 CCCC(=O)N1CCC(CC1)(C)C 240690a_100000750138_100000211992 [0,2,0,0,0,0|2,0,0]=4 8174 B13R1.1512 CCCC(=O)N1CCC(CC1)(C)C 527a_100000750138_100000211992 [0,2,0,0,0,0|2,0,0]=4 8175 B13R1.1512 CCCC(=O)N1CCC(CC1)(C)O 240690a_100000690209_100000211992 [0,2,0,0,0,0|2,0,0]=4 8176 B13R1.1512 CCCC(=O)N1CCC(CC1)(C)O 527a_100000690209_100000211992 [0,2,0,0,0,0|2,0,0]=4 8177 B13R1.1512 CCCC(=O)N1CCC(CC1)(F)F 11a_100000724815_100000211992 [0,2,0,0,0,0|2,0,0]=4 8178 B13R1.1512 CCCC(=O)N1CCC(CC1)(F)F 240690a_100000724815_100000211992 [0,2,0,0,0,0|2,0,0]=4 8179 B13R1.1512 CCCC(=O)N1CCC(CC1)(F)F 527a_100000724815_100000211992 [0,2,0,0,0,0|2,0,0]=4 8180 B13R1.1512 CCNC(=O)C1CCC(CC1)(F)F 11a_100015525214_100000752077 [0,2,0,0,0,0|1,0,0]=3 8181 B13R1.1512 CCNC(=O)C1CCC(CC1)(F)F 240690a_100015525214_100000752077 [0,2,0,0,0,0|1,0,0]=3 8182 B13R1.1512 CCNC(=O)C1CCC(CC1)(F)F 527a_100015525214_100000752077 [0,2,0,0,0,0|1,0,0]=3 8183 B13R1.1512 CCNC(=O)C1CCS(=O)(=O)CC1 11a_100015525214_100000755231 [0,2,0,0,0,0|2,0,0]=4 8184 B13R1.1512 CCNC(=O)C1CCS(=O)(=O)CC1 240690a_100015525214_100000755231 [0,2,0,0,0,0|2,0,0]=4 8185 B13R1.1512 CCNC(=O)C1CCS(=O)(=O)CC1 527a_100015525214_100000755231 [0,2,0,0,0,0|2,0,0]=4 8186 B13R1.1512 CCNC(=O)N1CCC(CC1)(C)C 2708a_100015525214_100000750138 [0,2,0,0,0,0|2,0,0]=4 8187 B13R1.1512 CCNC(=O)N1CCC(CC1)(C)C 273464a_100015525214_100000750138 [0,2,0,0,0,0|2,0,0]=4 8188 B13R1.1512 CCNC(=O)N1CCC(CC1)(C)O 2708a_100015525214_100000690209 [0,2,0,0,0,0|2,0,0]=4 8189 B13R1.1512 CCNC(=O)N1CCC(CC1)(C)O 273464a_100015525214_100000690209 [0,2,0,0,0,0|2,0,0]=4 8190 B13R1.1512 CCNC(=O)N1CCC(CC1)(F)F 2708a_100015525214_100000724815 [0,2,0,0,0,0|2,0,0]=4 8191 B13R1.1512 CCNC(=O)N1CCC(CC1)(F)F 273464a_100015525214_100000724815 [0,2,0,0,0,0|2,0,0]=4 8192 B13R1.1512 CCNC(=O)N1CCC(CC1)(O)O 2708a_100015525214_100016987284 [0,2,0,0,0,0|2,0,0]=4 8193 B13R1.1512 CCNC(=O)N1CCC(CC1)(O)O 273464a_100015525214_100016987284 [0,2,0,0,0,0|2,0,0]=4 8194 B13R1.1512 CNNC(=O)C1CCC(CC1)(F)F 22a_100016993582_100000752077 [0,2,0,0,0,0|2,0,0]=4 8195 B13R1.1512 COCC(=O)C1CCC(CC1)(F)F 1458a_100000210968_100009865109 [0,2,0,0,0,0|2,0,0]=4 8196 B13R1.1512 CSCC(=O)C1CCC(CC1)(F)F 1458a_100000184570_100009865109 [0,2,0,0,0,0|2,0,0]=4 8197 B13R1.1512 O=C(CCF)C1CCC(CC1)(F)F 1458a_100000752077_100011217306 [0,2,0,0,0,0|2,0,0]=4 8198 B13R1.1512 O=C(CCO)C1CCC(CC1)(F)F 1458a_100000752077_100000211926 [0,2,0,0,0,0|2,0,0]=4 8199 B13R1.1512 O=C(CCO)C1CCC(CC1)(F)F 1458a_100011216618_100009865109 [0,2,0,0,0,0|2,0,0]=4 8200 B13R1.4446 CCCC(=O)C1(CCN(CC1)C)O 1458a_100015186493_100000210303 [0,2,0,0,0,0|2,0,0]=4 8201 B13R1.4446 CCNC(=O)C1(CCN(CC1)C)O 240690a_100015525214_100015186493 [0,2,0,0,0,0|2,0,0]=4 8202 B13R1.4446 CCOC(=O)C1(CCN(CC1)C)C 2230a_100000696230_200000210301 [0,2,0,0,0,0|1,0,0]=3 8203 B13R1.4446 CCOC(=O)C1(CCN(CC1)C)C 269982a_100000696230_200000210301 [0,2,0,0,0,0|1,0,0]=3 8204 B13R1.4446 CCOC(=O)C1(CCN(CC1)C)F 2230a_100016253957_200000210301 [0,2,0,0,0,0|1,0,0]=3 8205 B13R1.4446 CCOC(=O)C1(CCN(CC1)C)F 269982a_100016253957_200000210301 [0,2,0,0,0,0|1,0,0]=3 8206 B13R1.4446 CCOC(=O)C1(CCN(CC1)[13CH3])C 2230a_100000696230_200025704644 [0,2,0,0,0,0|1,0,0]=3 8207 B13R1.4446 CCOC(=O)C1(CCN(CC1)[13CH3])C 269982a_100000696230_200025704644 [0,2,0,0,0,0|1,0,0]=3 8208 B13R1.4446 CCOC(=O)C1(CCN(CC1)[13CH3])F 2230a_100016253957_200025704644 [0,2,0,0,0,0|1,0,0]=3 8209 B13R1.4446 CCOC(=O)C1(CCN(CC1)[13CH3])F 269982a_100016253957_200025704644 [0,2,0,0,0,0|1,0,0]=3 8210 B13R1.18 C#CCCC(=O)C1CCCC(C1)C 1458a_100011215569_100000753159 [0,2,0,0,0,0|1,0,1]=4 8211 B13R1.18 C#CCCC(=O)C1CCCC(C1)O 1458a_100000707227_100000753159 [0,2,0,0,0,0|1,0,1]=4 8212 B13R1.18 C#CCNC(=O)C1CCCC(C1)C 11a_100000212058_100011215569 [0,2,0,0,0,0|1,0,1]=4 8213 B13R1.18 C#CCNC(=O)C1CCCC(C1)C 1626a_100000212058_100011215569 [0,2,0,0,0,0|1,0,1]=4 8214 B13R1.18 C#CCNC(=O)C1CCCC(C1)C 240690a_100000212058_100011215569 [0,2,0,0,0,0|1,0,1]=4 8215 B13R1.18 C#CCNC(=O)C1CCCC(C1)C 527a_100000212058_100011215569 [0,2,0,0,0,0|1,0,1]=4 8216 B13R1.18 C#CCNC(=O)C1CCCC(C1)O 1626a_100000212058_100000707227 [0,2,0,0,0,0|1,0,1]=4 8217 B13R1.18 C#CCNC(=O)C1CCCC(C1)O 240690a_100000212058_100000707227 [0,2,0,0,0,0|1,0,1]=4 8218 B13R1.18 C/C=C/CC(=O)C1CCCC(C1)C 1458a_100011215569_100102629194 [0,2,0,0,0,0|1,0,1]=4 8219 B13R1.18 C/C=C/CC(=O)C1CCCC(C1)O 1458a_100000707227_100102629194 [0,2,0,0,0,0|1,0,1]=4 8220 B13R1.18 C=CCCC(=O)C1CCCC(C1)C 1458a_100011215569_100000754431 [0,2,0,0,0,0|1,0,1]=4 8221 B13R1.18 C=CCCC(=O)C1CCCC(C1)O 1458a_100000707227_100000754431 [0,2,0,0,0,0|1,0,1]=4 8222 B13R1.18 C=CCNC(=O)C1CCCC(C1)C 1626a_100020586998_100011215569 [0,2,0,0,0,0|1,0,1]=4 8223 B13R1.18 C=CCNC(=O)C1CCCC(C1)C 240690a_100020586998_100011215569 [0,2,0,0,0,0|1,0,1]=4 8224 B13R1.18 C=CCNC(=O)C1CCCC(C1)C 527a_100020586998_100011215569 [0,2,0,0,0,0|1,0,1]=4 8225 B13R1.18 C=CCNC(=O)C1CCCC(C1)O 1626a_100020586998_100000707227 [0,2,0,0,0,0|1,0,1]=4 8226 B13R1.18 C=CCNC(=O)C1CCCC(C1)O 240690a_100020586998_100000707227 [0,2,0,0,0,0|1,0,1]=4 8227 B13R1.18 CC#CCC(=O)C1CCCC(C1)C 1458a_100011215569_100000748600 [0,2,0,0,0,0|1,0,1]=4 8228 B13R1.18 CC#CCC(=O)C1CCCC(C1)O 1458a_100000707227_100000748600 [0,2,0,0,0,0|1,0,1]=4 8229 B13R1.18 CC1CCCC(C1)C(=O)CCC#N 1458a_100011215569_100011215226 [0,2,0,0,0,0|1,0,1]=4 8230 B13R1.18 CC1CCCC(C1)C(=O)CCCF 1458a_100011215569_100011934791 [0,2,0,0,0,0|1,0,0]=3 8231 B13R1.18 CC1CCCC(C1)C(=O)CCCO 1458a_100011215569_100011215043 [0,2,0,0,0,0|1,0,0]=3 8232 B13R1.18 CC1CCCC(C1)C(=O)NCC#N 1626a_100000734998_100011215569 [0,2,0,0,0,0|1,0,1]=4 8233 B13R1.18 CC1CCCC(C1)C(=O)NCC#N 527a_100000734998_100011215569 [0,2,0,0,0,0|1,0,1]=4 8234 B13R1.18 CC1CCCC(C1)C(=O)NCCF 11a_100000724931_100011215569 [0,2,0,0,0,0|1,0,0]=3 8235 B13R1.18 CC1CCCC(C1)C(=O)NCCF 1626a_100000724931_100011215569 [0,2,0,0,0,0|1,0,0]=3 8236 B13R1.18 CC1CCCC(C1)C(=O)NCCF 240690a_100000724931_100011215569 [0,2,0,0,0,0|1,0,0]=3 8237 B13R1.18 CC1CCCC(C1)C(=O)NCCF 527a_100000724931_100011215569 [0,2,0,0,0,0|1,0,0]=3 8238 B13R1.18 CC1CCCC(C1)C(=O)NCCO 240690a_100000210304_100011215569 [0,2,0,0,0,0|1,0,0]=3 8239 B13R1.18 CC1CCCC(C1)C(=O)NCCO 527a_100000210304_100011215569 [0,2,0,0,0,0|1,0,0]=3 8240 B13R1.18 CC1CCCN(C1)C(=O)CCS[13CH3] 62a_200011194461_200025704644 [0,2,0,0,0,0|2,0,0]=4 8241 B13R1.18 CC1CCCN(C1)C(=O)CCS[13CH3] 62a_200025704644_200011194461 [0,2,0,0,0,0|2,0,0]=4 8242 B13R1.18 CC=CCC(=O)C1CCCC(C1)C 1458a_100011215569_100000070051 [0,2,0,0,0,0|1,0,1]=4 8243 B13R1.18 CC=CCC(=O)C1CCCC(C1)O 1458a_100000707227_100000070051 [0,2,0,0,0,0|1,0,1]=4 8244 B13R1.18 CCC=CC(=O)N1CCCC(C1)F 11a_100000697950_100000212282 [0,2,0,0,0,0|2,0,0]=4 8245 B13R1.18 CCC=CC(=O)N1CCCC(C1)F 1626a_100000697950_100000212282 [0,2,0,0,0,0|2,0,0]=4 8246 B13R1.18 CCC=CC(=O)N1CCCC(C1)F 240690a_100000697950_100000212282 [0,2,0,0,0,0|2,0,0]=4 8247 B13R1.18 CCC=CC(=O)N1CCCC(C1)O 240690a_100000211013_100000212282 [0,2,0,0,0,0|2,0,0]=4 8248 B13R1.18 CCC=CC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000212282 [0,2,0,0,0,0|2,0,0]=4 8249 B13R1.18 CCC=CC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000212282 [0,2,0,0,0,0|2,0,0]=4 8250 B13R1.18 CCCCC(=O)C1CCCC(C1)C 1458a_100011215569_100000210211 [0,2,0,0,0,0|1,0,0]=3 8251 B13R1.18 CCCCC(=O)C1CCCC(C1)O 1458a_100000707227_100000210211 [0,2,0,0,0,0|1,0,0]=3 8252 B13R1.18 CCCCC(=O)C1CCCN(C1)C 1458a_100015257587_100000210211 [0,2,0,0,0,0|2,0,0]=4 8253 B13R1.18 CCCCC(=O)N1CCCC(C1)F 11a_100000697950_100000210183 [0,2,0,0,0,0|2,0,0]=4 8254 B13R1.18 CCCCC(=O)N1CCCC(C1)F 1626a_100000697950_100000210183 [0,2,0,0,0,0|2,0,0]=4 8255 B13R1.18 CCCCC(=O)N1CCCC(C1)F 240690a_100000697950_100000210183 [0,2,0,0,0,0|2,0,0]=4 8256 B13R1.18 CCCCC(=O)N1CCCC(C1)F 527a_100000697950_100000210183 [0,2,0,0,0,0|2,0,0]=4 8257 B13R1.18 CCCCC(=O)N1CCCC(C1)O 240690a_100000211013_100000210183 [0,2,0,0,0,0|2,0,0]=4 8258 B13R1.18 CCCCC(=O)N1CCCC(C1)O 527a_100000211013_100000210183 [0,2,0,0,0,0|2,0,0]=4 8259 B13R1.18 CCCCC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000210183 [0,2,0,0,0,0|2,0,0]=4 8260 B13R1.18 CCCCC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000210183 [0,2,0,0,0,0|2,0,0]=4 8261 B13R1.18 CCCCC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000210183 [0,2,0,0,0,0|2,0,0]=4 8262 B13R1.18 CCCNC(=O)C1CCCC(C1)C 11a_100020643023_100011215569 [0,2,0,0,0,0|1,0,0]=3 8263 B13R1.18 CCCNC(=O)C1CCCC(C1)C 1626a_100020643023_100011215569 [0,2,0,0,0,0|1,0,0]=3 8264 B13R1.18 CCCNC(=O)C1CCCC(C1)C 240690a_100020643023_100011215569 [0,2,0,0,0,0|1,0,0]=3 8265 B13R1.18 CCCNC(=O)C1CCCC(C1)C 527a_100020643023_100011215569 [0,2,0,0,0,0|1,0,0]=3 8266 B13R1.18 CCCNC(=O)C1CCCC(C1)O 1626a_100020643023_100000707227 [0,2,0,0,0,0|1,0,0]=3 8267 B13R1.18 CCCNC(=O)C1CCCC(C1)O 240690a_100020643023_100000707227 [0,2,0,0,0,0|1,0,0]=3 8268 B13R1.18 CCCNC(=O)C1CCCN(C1)C 11a_100020643023_100015257587 [0,2,0,0,0,0|2,0,0]=4 8269 B13R1.18 CCCNC(=O)C1CCCN(C1)C 240690a_100020643023_100015257587 [0,2,0,0,0,0|2,0,0]=4 8270 B13R1.18 CCCNC(=O)N1CCCC(C1)F 2708a_100020643023_100000697950 [0,2,0,0,0,0|2,0,0]=4 8271 B13R1.18 CCCNC(=O)N1CCCC(C1)F 273464a_100020643023_100000697950 [0,2,0,0,0,0|2,0,0]=4 8272 B13R1.18 CCCNC(=O)N1CCCC(C1)O 2708a_100020643023_100000211013 [0,2,0,0,0,0|2,0,0]=4 8273 B13R1.18 CCCNC(=O)N1CCCC(C1)O 273464a_100020643023_100000211013 [0,2,0,0,0,0|2,0,0]=4 8274 B13R1.18 CCCNC(=O)N1CCC[C@@H](C1)C 2708a_100020643023_100000717927 [0,2,0,0,0,0|2,0,0]=4 8275 B13R1.18 CCCNC(=O)N1CCC[C@@H](C1)C 273464a_100020643023_100000717927 [0,2,0,0,0,0|2,0,0]=4 8276 B13R1.18 CCNCC(=O)N1CCCC(C1)C 2230a_100015525214_100000182890 [0,2,0,0,0,0|2,0,0]=4 8277 B13R1.18 CCNNC(=O)C1CCCC(C1)C 22a_100000756455_100011215569 [0,2,0,0,0,0|1,0,0]=3 8278 B13R1.18 CCNNC(=O)C1CCCC(C1)O 22a_100000756455_100000707227 [0,2,0,0,0,0|1,0,0]=3 8279 B13R1.18 CCNNC(=O)C1CCCN(C1)C 22a_100000756455_100015257587 [0,2,0,0,0,0|2,0,0]=4 8280 B13R1.18 CCOCC(=O)N1CCCC(C1)C 34a_100121572206_100000182890 [0,2,0,0,0,0|1,0,0]=3 8281 B13R1.18 CCOCC(=O)N1CCCC(C1)F 11a_100000697950_100000211967 [0,2,0,0,0,0|1,0,0]=3 8282 B13R1.18 CCOCC(=O)N1CCCC(C1)F 1626a_100000697950_100000211967 [0,2,0,0,0,0|1,0,0]=3 8283 B13R1.18 CCOCC(=O)N1CCCC(C1)F 240690a_100000697950_100000211967 [0,2,0,0,0,0|1,0,0]=3 8284 B13R1.18 CCOCC(=O)N1CCCC(C1)F 527a_100000697950_100000211967 [0,2,0,0,0,0|1,0,0]=3 8285 B13R1.18 CCOCC(=O)N1CCCC(C1)O 240690a_100000211013_100000211967 [0,2,0,0,0,0|1,0,0]=3 8286 B13R1.18 CCOCC(=O)N1CCCC(C1)O 527a_100000211013_100000211967 [0,2,0,0,0,0|1,0,0]=3 8287 B13R1.18 CCOCC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000211967 [0,2,0,0,0,0|1,0,0]=3 8288 B13R1.18 CCOCC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000211967 [0,2,0,0,0,0|1,0,0]=3 8289 B13R1.18 CCOCC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000211967 [0,2,0,0,0,0|1,0,0]=3 8290 B13R1.18 CCOCC(=O)N1CCOC(C1)C 11a_100000729577_100000211967 [0,2,0,0,0,0|2,0,0]=4 8291 B13R1.18 CCOCC(=O)N1CCOC(C1)C 1626a_100000729577_100000211967 [0,2,0,0,0,0|2,0,0]=4 8292 B13R1.18 CCOCC(=O)N1CCOC(C1)C 240690a_100000729577_100000211967 [0,2,0,0,0,0|2,0,0]=4 8293 B13R1.18 CCOCC(=O)N1CCOC(C1)C 527a_100000729577_100000211967 [0,2,0,0,0,0|2,0,0]=4 8294 B13R1.18 CCOCC(=O)N1CCOC(C1)O 11a_100000688207_100000211967 [0,2,0,0,0,0|2,0,0]=4 8295 B13R1.18 CCOCC(=O)N1CCOC(C1)O 240690a_100000688207_100000211967 [0,2,0,0,0,0|2,0,0]=4 8296 B13R1.18 CCOCC(=O)N1CCOC(C1)O 527a_100000688207_100000211967 [0,2,0,0,0,0|2,0,0]=4 8297 B13R1.18 CCSCC(=O)N1CCCC(C1)C 62a_100000182890_100000210202 [0,2,0,0,0,0|1,1,0]=4 8298 B13R1.18 CCSCC(=O)N1CCCC(C1)F 11a_100000697950_100000230394 [0,2,0,0,0,0|1,1,0]=4 8299 B13R1.18 CCSCC(=O)N1CCCC(C1)F 1626a_100000697950_100000230394 [0,2,0,0,0,0|1,1,0]=4 8300 B13R1.18 CCSCC(=O)N1CCCC(C1)F 240690a_100000697950_100000230394 [0,2,0,0,0,0|1,1,0]=4 8301 B13R1.18 CCSCC(=O)N1CCCC(C1)F 527a_100000697950_100000230394 [0,2,0,0,0,0|1,1,0]=4 8302 B13R1.18 CCSCC(=O)N1CCCC(C1)O 240690a_100000211013_100000230394 [0,2,0,0,0,0|1,1,0]=4 8303 B13R1.18 CCSCC(=O)N1CCCC(C1)O 527a_100000211013_100000230394 [0,2,0,0,0,0|1,1,0]=4 8304 B13R1.18 CCSCC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000230394 [0,2,0,0,0,0|1,1,0]=4 8305 B13R1.18 CCSCC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000230394 [0,2,0,0,0,0|1,1,0]=4 8306 B13R1.18 CCSCC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000230394 [0,2,0,0,0,0|1,1,0]=4 8307 B13R1.18 CN1CCCC(C1)C(=O)CCCF 1458a_100015257587_100011934791 [0,2,0,0,0,0|2,0,0]=4 8308 B13R1.18 CN1CCCC(C1)C(=O)CCCO 1458a_100015257587_100011215043 [0,2,0,0,0,0|2,0,0]=4 8309 B13R1.18 CN1CCCC(C1)C(=O)NCCF 11a_100000724931_100015257587 [0,2,0,0,0,0|2,0,0]=4 8310 B13R1.18 CN1CCCC(C1)C(=O)NCCF 240690a_100000724931_100015257587 [0,2,0,0,0,0|2,0,0]=4 8311 B13R1.18 CN1CCCC(C1)C(=O)NCCO 2230a_200011275841_200000210301 [0,2,0,0,0,0|2,0,0]=4 8312 B13R1.18 CN1CCCC(C1)C(=O)NCCO 240690a_100000210304_100015257587 [0,2,0,0,0,0|2,0,0]=4 8313 B13R1.18 CN1CCCC(C1)C(=O)NCCO 269982a_200011275841_200000210301 [0,2,0,0,0,0|2,0,0]=4 8314 B13R1.18 CN1CCCC(C1)C(=O)NCCO 34a_200011275841_200000210301 [0,2,0,0,0,0|2,0,0]=4 8315 B13R1.18 CNCCC(=O)N1CCCC(C1)C 2230a_106832991635_200011194461 [0,2,0,0,0,0|2,0,0]=4 8316 B13R1.18 CNCCC(=O)N1CCCC(C1)C 34a_100102657272_200011194461 [0,2,0,0,0,0|2,0,0]=4 8317 B13R1.18 CNCCC(=O)N1CCCC(C1)C 7a_106832991635_200011194461 [0,2,0,0,0,0|2,0,0]=4 8318 B13R1.18 COCCC(=O)C1CCCC(C1)C 1458a_100011215569_100000233755 [0,2,0,0,0,0|1,0,0]=3 8319 B13R1.18 COCCC(=O)C1CCCC(C1)O 1458a_100000707227_100000233755 [0,2,0,0,0,0|1,0,0]=3 8320 B13R1.18 COCCC(=O)C1CCCN(C1)C 1458a_100015257587_100000233755 [0,2,0,0,0,0|2,0,0]=4 8321 B13R1.18 COCCC(=O)N1CCCC(C1)C 34a_100138415774_200011194461 [0,2,0,0,0,0|2,0,0]=4 8322 B13R1.18 COCCC(=O)N1CCCC(C1)F 11a_100000697950_100000749529 [0,2,0,0,0,0|2,0,0]=4 8323 B13R1.18 COCCC(=O)N1CCCC(C1)F 1626a_100000697950_100000749529 [0,2,0,0,0,0|2,0,0]=4 8324 B13R1.18 COCCC(=O)N1CCCC(C1)F 240690a_100000697950_100000749529 [0,2,0,0,0,0|2,0,0]=4 8325 B13R1.18 COCCC(=O)N1CCCC(C1)F 527a_100000697950_100000749529 [0,2,0,0,0,0|2,0,0]=4 8326 B13R1.18 COCCC(=O)N1CCCC(C1)O 240690a_100000211013_100000749529 [0,2,0,0,0,0|2,0,0]=4 8327 B13R1.18 COCCC(=O)N1CCCC(C1)O 527a_100000211013_100000749529 [0,2,0,0,0,0|2,0,0]=4 8328 B13R1.18 COCCC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000749529 [0,2,0,0,0,0|2,0,0]=4 8329 B13R1.18 COCCC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000749529 [0,2,0,0,0,0|2,0,0]=4 8330 B13R1.18 COCCC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000749529 [0,2,0,0,0,0|2,0,0]=4 8331 B13R1.18 CSCCC(=O)C1CCCC(C1)C 1458a_100011215569_100000751147 [0,2,0,0,0,0|1,0,0]=3 8332 B13R1.18 CSCCC(=O)C1CCCC(C1)O 1458a_100000707227_100000751147 [0,2,0,0,0,0|1,0,0]=3 8333 B13R1.18 CSCCC(=O)C1CCCN(C1)C 1458a_100015257587_100000751147 [0,2,0,0,0,0|2,0,0]=4 8334 B13R1.18 CSCCC(=O)N1CCCC(C1)C 62a_200000210301_200011194461 [0,2,0,0,0,0|2,0,0]=4 8335 B13R1.18 CSCCC(=O)N1CCCC(C1)C 62a_200011194461_200000210301 [0,2,0,0,0,0|2,0,0]=4 8336 B13R1.18 CSCCC(=O)N1CCCC(C1)F 11a_100000697950_100000174002 [0,2,0,0,0,0|2,0,0]=4 8337 B13R1.18 CSCCC(=O)N1CCCC(C1)F 1626a_100000697950_100000174002 [0,2,0,0,0,0|2,0,0]=4 8338 B13R1.18 CSCCC(=O)N1CCCC(C1)F 240690a_100000697950_100000174002 [0,2,0,0,0,0|2,0,0]=4 8339 B13R1.18 CSCCC(=O)N1CCCC(C1)F 527a_100000697950_100000174002 [0,2,0,0,0,0|2,0,0]=4 8340 B13R1.18 CSCCC(=O)N1CCCC(C1)O 240690a_100000211013_100000174002 [0,2,0,0,0,0|2,0,0]=4 8341 B13R1.18 CSCCC(=O)N1CCCC(C1)O 527a_100000211013_100000174002 [0,2,0,0,0,0|2,0,0]=4 8342 B13R1.18 CSCCC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000174002 [0,2,0,0,0,0|2,0,0]=4 8343 B13R1.18 CSCCC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000174002 [0,2,0,0,0,0|2,0,0]=4 8344 B13R1.18 CSCCC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000174002 [0,2,0,0,0,0|2,0,0]=4 8345 B13R1.18 C[C@H]1CCCN(C1)C(=O)NCCF 273464a_100000724931_100000717927 [0,2,0,0,0,0|2,0,0]=4 8346 B13R1.18 C[C@H]1CCCN(C1)C(=O)NCCO 273464a_100000210304_100000717927 [0,2,0,0,0,0|2,0,0]=4 8347 B13R1.18 N#CCCC(=O)C1CCCC(C1)O 1458a_100000707227_100011215226 [0,2,0,0,0,0|1,0,1]=4 8348 B13R1.18 N#CCNC(=O)C1CCCC(C1)O 1626a_100000734998_100000707227 [0,2,0,0,0,0|1,0,1]=4 8349 B13R1.18 O=C(CCCF)C1CCCC(C1)O 1458a_100000707227_100011934791 [0,2,0,0,0,0|1,0,0]=3 8350 B13R1.18 O=C(CCCO)C1CCCC(C1)O 1458a_100000707227_100011215043 [0,2,0,0,0,0|1,0,0]=3 8351 B13R1.18 O=C(NCCF)C1CCCC(C1)O 1626a_100000724931_100000707227 [0,2,0,0,0,0|1,0,0]=3 8352 B13R1.18 O=C(NCCF)C1CCCC(C1)O 240690a_100000724931_100000707227 [0,2,0,0,0,0|1,0,0]=3 8353 B13R1.18 O=C(NCCF)N1CCCC(C1)F 273464a_100000724931_100000697950 [0,2,0,0,0,0|2,0,0]=4 8354 B13R1.18 O=C(NCCF)N1CCCC(C1)O 273464a_100000724931_100000211013 [0,2,0,0,0,0|2,0,0]=4 8355 B13R1.18 O=C(NCCO)C1CCCC(C1)O 240690a_100000210304_100000707227 [0,2,0,0,0,0|1,0,0]=3 8356 B13R1.18 O=C(NCCO)N1CCCC(C1)F 273464a_100000210304_100000697950 [0,2,0,0,0,0|2,0,0]=4 8357 B13R1.18 O=C(NCCO)N1CCCC(C1)O 273464a_100000210304_100000211013 [0,2,0,0,0,0|2,0,0]=4 8358 B13R1.18 [13CH3]N1CCCC(C1)C(=O)NCCO 2230a_200011275841_200025704644 [0,2,0,0,0,0|2,0,0]=4 8359 B13R1.18 [13CH3]N1CCCC(C1)C(=O)NCCO 269982a_200011275841_200025704644 [0,2,0,0,0,0|2,0,0]=4 8360 B13R1.18 [13CH3]N1CCCC(C1)C(=O)NCCO 34a_200011275841_200025704644 [0,2,0,0,0,0|2,0,0]=4 8361 B13R1.22 CCC(C)C(=O)C1CCCC(C1)C 1458a_100011215569_100000758301 [0,2,0,0,0,0|1,0,0]=3 8362 B13R1.22 CCC(C)C(=O)C1CCCC(C1)O 1458a_100000707227_100000758301 [0,2,0,0,0,0|1,0,0]=3 8363 B13R1.22 CCC(C)C(=O)C1CCCN(C1)C 1458a_100015257587_100000758301 [0,2,0,0,0,0|2,0,0]=4 8364 B13R1.22 CCC(C)C(=O)N1CCCC(C1)F 11a_100000697950_100011192722 [0,2,0,0,0,0|2,0,0]=4 8365 B13R1.22 CCC(C)C(=O)N1CCCC(C1)F 1626a_100000697950_100011192722 [0,2,0,0,0,0|2,0,0]=4 8366 B13R1.22 CCC(C)C(=O)N1CCCC(C1)F 240690a_100000697950_100011192722 [0,2,0,0,0,0|2,0,0]=4 8367 B13R1.22 CCC(C)C(=O)N1CCCC(C1)F 527a_100000697950_100011192722 [0,2,0,0,0,0|2,0,0]=4 8368 B13R1.22 CCC(C)C(=O)N1CCCC(C1)O 240690a_100000211013_100011192722 [0,2,0,0,0,0|2,0,0]=4 8369 B13R1.22 CCC(C)C(=O)N1CCCC(C1)O 527a_100000211013_100011192722 [0,2,0,0,0,0|2,0,0]=4 8370 B13R1.22 CCC(C)C(=O)N1CCC[C@@H](C1)C 11a_100000717927_100011192722 [0,2,0,0,0,0|2,0,0]=4 8371 B13R1.22 CCC(C)C(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100011192722 [0,2,0,0,0,0|2,0,0]=4 8372 B13R1.22 CCC(C)C(=O)N1CCC[C@@H](C1)C 527a_100000717927_100011192722 [0,2,0,0,0,0|2,0,0]=4 8373 B13R1.22 CCC(O)C(=O)N1CCCC(C1)F 240690a_100000697950_100011196387 [0,2,0,0,0,0|2,0,0]=4 8374 B13R1.22 CCC(O)C(=O)N1CCCC(C1)O 240690a_100000211013_100011196387 [0,2,0,0,0,0|2,0,0]=4 8375 B13R1.22 CCC(O)C(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100011196387 [0,2,0,0,0,0|2,0,0]=4 8376 B13R1.22 CCN(C)C(=O)C1CCCC(C1)C 11a_100000225621_100011215569 [0,2,0,0,0,0|1,0,0]=3 8377 B13R1.22 CCN(C)C(=O)C1CCCC(C1)C 1626a_100000225621_100011215569 [0,2,0,0,0,0|1,0,0]=3 8378 B13R1.22 CCN(C)C(=O)C1CCCC(C1)C 240690a_100000225621_100011215569 [0,2,0,0,0,0|1,0,0]=3 8379 B13R1.22 CCN(C)C(=O)C1CCCC(C1)C 527a_100000225621_100011215569 [0,2,0,0,0,0|1,0,0]=3 8380 B13R1.22 CCN(C)C(=O)C1CCCC(C1)O 1626a_100000225621_100000707227 [0,2,0,0,0,0|1,0,0]=3 8381 B13R1.22 CCN(C)C(=O)C1CCCC(C1)O 240690a_100000225621_100000707227 [0,2,0,0,0,0|1,0,0]=3 8382 B13R1.22 CCN(C)C(=O)C1CCCN(C1)C 11a_100000225621_100015257587 [0,2,0,0,0,0|2,0,0]=4 8383 B13R1.22 CCN(C)C(=O)C1CCCN(C1)C 240690a_100000225621_100015257587 [0,2,0,0,0,0|2,0,0]=4 8384 B13R1.147 C=C(C)CC(=O)C1CCCC(C1)C 1458a_100011215569_100000748629 [0,2,0,0,0,0|1,0,1]=4 8385 B13R1.147 C=C(C)CC(=O)C1CCCC(C1)O 1458a_100000707227_100000748629 [0,2,0,0,0,0|1,0,1]=4 8386 B13R1.147 CC(C)CC(=O)C1CCCC(C1)C 1458a_100011215569_100000210624 [0,2,0,0,0,0|1,0,0]=3 8387 B13R1.147 CC(C)CC(=O)C1CCCC(C1)O 1458a_100000707227_100000210624 [0,2,0,0,0,0|1,0,0]=3 8388 B13R1.147 CC(C)CC(=O)C1CCCN(C1)C 1458a_100015257587_100000210624 [0,2,0,0,0,0|2,0,0]=4 8389 B13R1.147 CC(C)CC(=O)N1CCCC(C1)F 11a_100000697950_100000210554 [0,2,0,0,0,0|2,0,0]=4 8390 B13R1.147 CC(C)CC(=O)N1CCCC(C1)F 1626a_100000697950_100000210554 [0,2,0,0,0,0|2,0,0]=4 8391 B13R1.147 CC(C)CC(=O)N1CCCC(C1)F 240690a_100000697950_100000210554 [0,2,0,0,0,0|2,0,0]=4 8392 B13R1.147 CC(C)CC(=O)N1CCCC(C1)F 527a_100000697950_100000210554 [0,2,0,0,0,0|2,0,0]=4 8393 B13R1.147 CC(C)CC(=O)N1CCCC(C1)O 240690a_100000211013_100000210554 [0,2,0,0,0,0|2,0,0]=4 8394 B13R1.147 CC(C)CC(=O)N1CCCC(C1)O 527a_100000211013_100000210554 [0,2,0,0,0,0|2,0,0]=4 8395 B13R1.147 CC(C)CC(=O)N1CCC[C@@H](C1)C 11a_100000717927_100000210554 [0,2,0,0,0,0|2,0,0]=4 8396 B13R1.147 CC(C)CC(=O)N1CCC[C@@H](C1)C 240690a_100000717927_100000210554 [0,2,0,0,0,0|2,0,0]=4 8397 B13R1.147 CC(C)CC(=O)N1CCC[C@@H](C1)C 527a_100000717927_100000210554 [0,2,0,0,0,0|2,0,0]=4 8398 B13R1.147 CC(C)NC(=O)C1CCCC(C1)O 1626a_100138425928_100000707227 [0,2,0,0,0,0|1,0,0]=3 8399 B13R1.147 CC(C)NC(=O)C1CCCC(C1)O 240690a_100138425928_100000707227 [0,2,0,0,0,0|1,0,0]=3 8400 B13R1.147 CC(C)NC(=O)C1CCCN(C1)C 11a_100138425928_100015257587 [0,2,0,0,0,0|2,0,0]=4 8401 B13R1.147 CC(C)NC(=O)C1CCCN(C1)C 240690a_100138425928_100015257587 [0,2,0,0,0,0|2,0,0]=4 8402 B13R1.147 CC(C)NC(=O)N1CCCC(C1)F 2708a_100138425928_100000697950 [0,2,0,0,0,0|2,0,0]=4 8403 B13R1.147 CC(C)NC(=O)N1CCCC(C1)F 273464a_100138425928_100000697950 [0,2,0,0,0,0|2,0,0]=4 8404 B13R1.147 CC(C)NC(=O)N1CCCC(C1)O 2708a_100138425928_100000211013 [0,2,0,0,0,0|2,0,0]=4 8405 B13R1.147 CC(C)NC(=O)N1CCCC(C1)O 273464a_100138425928_100000211013 [0,2,0,0,0,0|2,0,0]=4 8406 B13R1.147 CC(C)NC(=O)N1CCC[C@@H](C1)C 2708a_100138425928_100000717927 [0,2,0,0,0,0|2,0,0]=4 8407 B13R1.147 CC(C)NC(=O)N1CCC[C@@H](C1)C 273464a_100138425928_100000717927 [0,2,0,0,0,0|2,0,0]=4 8408 B13R1.147 CC(O)CC(=O)C1CCCC(C1)C 1458a_100011215569_100011218427 [0,2,0,0,0,0|1,0,0]=3 8409 B13R1.147 CC(O)CC(=O)C1CCCC(C1)O 1458a_100000707227_100011218427 [0,2,0,0,0,0|1,0,0]=3 8410 B13R1.147 CC(O)CC(=O)C1CCCN(C1)C 1458a_100015257587_100011218427 [0,2,0,0,0,0|2,0,0]=4 8411 B13R1.147 CC1CCCC(C1)C(=O)CC(F)F 1458a_100011215569_100011934356 [0,2,0,0,0,0|2,0,0]=4 8412 B13R1.147 CC1CCCC(C1)C(=O)NC(C)C 11a_100138425928_100011215569 [0,2,0,0,0,0|1,0,0]=3 8413 B13R1.147 CC1CCCC(C1)C(=O)NC(C)C 1626a_100138425928_100011215569 [0,2,0,0,0,0|1,0,0]=3 8414 B13R1.147 CC1CCCC(C1)C(=O)NC(C)C 240690a_100138425928_100011215569 [0,2,0,0,0,0|1,0,0]=3 8415 B13R1.147 CC1CCCC(C1)C(=O)NC(C)C 527a_100138425928_100011215569 [0,2,0,0,0,0|1,0,0]=3 8416 B13R1.147 C[C@@H](O)CC(=O)N1CCCC(C1)F 240690a_100000697950_100011933948 [0,2,0,0,0,0|2,0,0]=4 8417 B13R1.147 C[C@@H](O)CC(=O)N1CCCC(C1)O 240690a_100000211013_100011933948 [0,2,0,0,0,0|2,0,0]=4 8418 B13R1.147 C[C@H]1CCCN(C1)C(=O)C[C@@H](C)O 240690a_100000717927_100011933948 [0,2,0,0,0,0|2,0,0]=4 8419 B13R1.147 O=C(CC(F)F)C1CCCC(C1)O 1458a_100000707227_100011934356 [0,2,0,0,0,0|2,0,0]=4 8420 B13R1.446 CCOC(=O)[C@@H]1C[C@H](CCN1C)C 2230a_200015568886_200000210301 [0,2,0,0,0,0|1,0,0]=3 8421 B13R1.446 CCOC(=O)[C@@H]1C[C@H](CCN1C)C 269982a_200015568886_200000210301 [0,2,0,0,0,0|1,0,0]=3 8422 B13R1.446 CCOC(=O)[C@@H]1C[C@H](CCN1[13CH3])C 2230a_200015568886_200025704644 [0,2,0,0,0,0|1,0,0]=3 8423 B13R1.446 CCOC(=O)[C@@H]1C[C@H](CCN1[13CH3])C 269982a_200015568886_200025704644 [0,2,0,0,0,0|1,0,0]=3 8424 B13R1.450 CCCC(=O)N1CC(CC(C1)C)C 11a_100000210448_100000211992 [0,2,0,0,0,0|2,0,0]=4 8425 B13R1.450 CCCC(=O)N1CC(CC(C1)C)C 240690a_100000210448_100000211992 [0,2,0,0,0,0|2,0,0]=4 8426 B13R1.450 CCCC(=O)N1CC(CC(C1)C)C 527a_100000210448_100000211992 [0,2,0,0,0,0|2,0,0]=4 8427 B13R1.450 CCNC(=O)N1CC(CC(C1)C)C 2708a_100015525214_100000210448 [0,2,0,0,0,0|2,0,0]=4 8428 B13R1.450 CCNC(=O)N1CC(CC(C1)C)C 273464a_100015525214_100000210448 [0,2,0,0,0,0|2,0,0]=4 8429 B13R1.460 C#CC1CCCN(C1)C(=O)CCC 11a_100015191679_100000211992 [0,2,0,0,0,0|2,0,0]=4 8430 B13R1.460 C#CC1CCCN(C1)C(=O)CCC 1626a_100015191679_100000211992 [0,2,0,0,0,0|2,0,0]=4 8431 B13R1.460 C#CC1CCCN(C1)C(=O)CCC 240690a_100015191679_100000211992 [0,2,0,0,0,0|2,0,0]=4 8432 B13R1.460 C#CC1CCCN(C1)C(=O)CCC 527a_100015191679_100000211992 [0,2,0,0,0,0|2,0,0]=4 8433 B13R1.460 C#CC1CCCN(C1)C(=O)NCC 2708a_100015525214_100015191679 [0,2,0,0,0,0|2,0,0]=4 8434 B13R1.460 C#CC1CCCN(C1)C(=O)NCC 273464a_100015525214_100015191679 [0,2,0,0,0,0|2,0,0]=4 8435 B13R1.460 CCCC(=O)C1CCCC(C1)OC 1458a_100011215561_100000210303 [0,2,0,0,0,0|1,0,0]=3 8436 B13R1.460 CCCC(=O)C1CCCN(C1)CC 1458a_100000743261_100000210303 [0,2,0,0,0,0|2,0,0]=4 8437 B13R1.460 CCCC(=O)N1CCCC(C1)C#N 11a_100016989302_100000211992 [0,2,0,0,0,0|2,0,0]=4 8438 B13R1.460 CCCC(=O)N1CCCC(C1)C#N 1626a_100016989302_100000211992 [0,2,0,0,0,0|2,0,0]=4 8439 B13R1.460 CCCC(=O)N1CCCC(C1)C#N 240690a_100016989302_100000211992 [0,2,0,0,0,0|2,0,0]=4 8440 B13R1.460 CCCC(=O)N1CCCC(C1)C#N 527a_100016989302_100000211992 [0,2,0,0,0,0|2,0,0]=4 8441 B13R1.460 CCCC(=O)N1CCCC(C1)CF 11a_100016992999_100000211992 [0,2,0,0,0,0|2,0,0]=4 8442 B13R1.460 CCCC(=O)N1CCCC(C1)CF 1626a_100016992999_100000211992 [0,2,0,0,0,0|2,0,0]=4 8443 B13R1.460 CCCC(=O)N1CCCC(C1)CF 240690a_100016992999_100000211992 [0,2,0,0,0,0|2,0,0]=4 8444 B13R1.460 CCCC(=O)N1CCCC(C1)CF 527a_100016992999_100000211992 [0,2,0,0,0,0|2,0,0]=4 8445 B13R1.460 CCCC(=O)N1CCCC(C1)CO 240690a_100000211344_100000211992 [0,2,0,0,0,0|2,0,0]=4 8446 B13R1.460 CCCC(=O)N1CCCC(C1)CO 527a_100000211344_100000211992 [0,2,0,0,0,0|2,0,0]=4 8447 B13R1.460 CCCC(=O)N1CCCC(C1)OC 11a_100000695604_100000211992 [0,2,0,0,0,0|2,0,0]=4 8448 B13R1.460 CCCC(=O)N1CCCC(C1)OC 1626a_100000695604_100000211992 [0,2,0,0,0,0|2,0,0]=4 8449 B13R1.460 CCCC(=O)N1CCCC(C1)OC 240690a_100000695604_100000211992 [0,2,0,0,0,0|2,0,0]=4 8450 B13R1.460 CCCC(=O)N1CCCC(C1)OC 527a_100000695604_100000211992 [0,2,0,0,0,0|2,0,0]=4 8451 B13R1.460 CCNC(=O)C1CCCC(C1)OC 11a_100015525214_100011215561 [0,2,0,0,0,0|1,0,0]=3 8452 B13R1.460 CCNC(=O)C1CCCC(C1)OC 240690a_100015525214_100011215561 [0,2,0,0,0,0|1,0,0]=3 8453 B13R1.460 CCNC(=O)C1CCCC(C1)OC 527a_100015525214_100011215561 [0,2,0,0,0,0|1,0,0]=3 8454 B13R1.460 CCNC(=O)C1CCCN(C1)CC 11a_100015525214_100000743261 [0,2,0,0,0,0|2,0,0]=4 8455 B13R1.460 CCNC(=O)C1CCCN(C1)CC 240690a_100015525214_100000743261 [0,2,0,0,0,0|2,0,0]=4 8456 B13R1.460 CCNC(=O)C1CCCN(C1)CC 527a_100015525214_100000743261 [0,2,0,0,0,0|2,0,0]=4 8457 B13R1.460 CCNC(=O)N1CCCC(C1)C#N 2708a_100015525214_100016989302 [0,2,0,0,0,0|2,0,0]=4 8458 B13R1.460 CCNC(=O)N1CCCC(C1)C#N 273464a_100015525214_100016989302 [0,2,0,0,0,0|2,0,0]=4 8459 B13R1.460 CCNC(=O)N1CCCC(C1)CF 2708a_100015525214_100016992999 [0,2,0,0,0,0|2,0,0]=4 8460 B13R1.460 CCNC(=O)N1CCCC(C1)CF 273464a_100015525214_100016992999 [0,2,0,0,0,0|2,0,0]=4 8461 B13R1.460 CCNC(=O)N1CCCC(C1)CO 2708a_100015525214_100000211344 [0,2,0,0,0,0|2,0,0]=4 8462 B13R1.460 CCNC(=O)N1CCCC(C1)CO 273464a_100015525214_100000211344 [0,2,0,0,0,0|2,0,0]=4 8463 B13R1.460 CCNC(=O)N1CCCC(C1)OC 2708a_100015525214_100000695604 [0,2,0,0,0,0|2,0,0]=4 8464 B13R1.460 CCNC(=O)N1CCCC(C1)OC 273464a_100015525214_100000695604 [0,2,0,0,0,0|2,0,0]=4 8465 B13R1.460 CCOC(=O)C1CC(CCO1)NC 270004a_106832991635_100010274582 [0,2,0,0,0,0|1,0,0]=3 8466 B13R1.460 CCOC(=O)C1CCCC(C1)OC 7a_100011934014_200000210301 [0,2,0,0,0,0|0,0,0]=2 8467 B13R1.460 CCOC(=O)C1CCCC(C1)O[13CH3] 7a_100011934014_200025704644 [0,2,0,0,0,0|0,0,0]=2 8468 B13R1.460 CCOC(=O)C1CN(CCO1)CC 2230a_100016995033_100000210202 [0,2,0,0,0,0|2,0,0]=4 8469 B13R1.460 CCOC(=O)C1CN(CCO1)CC 269982a_100016995033_100000204670 [0,2,0,0,0,0|2,0,0]=4 8470 B13R1.460 CCOC(=O)C1CN(CCO1)CF 269982a_100016995033_100015361967 [0,2,0,0,0,0|2,0,0]=4 8471 B13R1.460 CCOC(=O)[C@H]1CCCN(C1)CC 2230a_100000759086_100000210202 [0,2,0,0,0,0|1,0,0]=3 8472 B13R1.460 CCOC(=O)[C@H]1CCCN(C1)CC 269982a_100000759086_100000204670 [0,2,0,0,0,0|1,0,0]=3 8473 B13R1.460 CCOC(=O)[C@H]1CCCN(C1)CF 269982a_100000759086_100015361967 [0,2,0,0,0,0|1,0,0]=3 8474 B13R1.460 CNNC(=O)C1CCCC(C1)OC 22a_100016993582_100011215561 [0,2,0,0,0,0|2,0,0]=4 8475 B13R1.460 COC1CCCC(C1)C(=O)CCF 1458a_100011215561_100011217306 [0,2,0,0,0,0|2,0,0]=4 8476 B13R1.460 COC1CCCC(C1)C(=O)CCO 1458a_100011215561_100000211926 [0,2,0,0,0,0|2,0,0]=4 8477 B13R1.1517 CCCC(=O)C1CCOC(C1)(C)C 1458a_100000211992_100010191092 [0,2,0,0,0,0|2,0,0]=4 8478 B13R1.1517 CCCC(=O)N1CCCC(C1)(C)C 11a_100000716857_100000211992 [0,2,0,0,0,0|2,0,0]=4 8479 B13R1.1517 CCCC(=O)N1CCCC(C1)(C)C 1626a_100000716857_100000211992 [0,2,0,0,0,0|2,0,0]=4 8480 B13R1.1517 CCCC(=O)N1CCCC(C1)(C)C 240690a_100000716857_100000211992 [0,2,0,0,0,0|2,0,0]=4 8481 B13R1.1517 CCCC(=O)N1CCCC(C1)(C)C 527a_100000716857_100000211992 [0,2,0,0,0,0|2,0,0]=4 8482 B13R1.1517 CCCC(=O)N1CCCC(C1)(C)O 11a_100000695535_100000211992 [0,2,0,0,0,0|2,0,0]=4 8483 B13R1.1517 CCCC(=O)N1CCCC(C1)(C)O 240690a_100000695535_100000211992 [0,2,0,0,0,0|2,0,0]=4 8484 B13R1.1517 CCCC(=O)N1CCCC(C1)(C)O 527a_100000695535_100000211992 [0,2,0,0,0,0|2,0,0]=4 8485 B13R1.1517 CCCC(=O)N1CCCC(C1)(F)F 11a_100000732682_100000211992 [0,2,0,0,0,0|2,0,0]=4 8486 B13R1.1517 CCCC(=O)N1CCCC(C1)(F)F 1626a_100000732682_100000211992 [0,2,0,0,0,0|2,0,0]=4 8487 B13R1.1517 CCCC(=O)N1CCCC(C1)(F)F 240690a_100000732682_100000211992 [0,2,0,0,0,0|2,0,0]=4 8488 B13R1.1517 CCCC(=O)N1CCCC(C1)(F)F 527a_100000732682_100000211992 [0,2,0,0,0,0|2,0,0]=4 8489 B13R1.1517 CCCC(=O)[C@@H]1CCCS(=O)(=O)C1 1458a_200009923180_100000210303 [0,2,0,0,0,0|2,0,0]=4 8490 B13R1.1517 CCNC(=O)N1CCCC(C1)(C)C 2708a_100015525214_100000716857 [0,2,0,0,0,0|2,0,0]=4 8491 B13R1.1517 CCNC(=O)N1CCCC(C1)(C)C 273464a_100015525214_100000716857 [0,2,0,0,0,0|2,0,0]=4 8492 B13R1.1517 CCNC(=O)N1CCCC(C1)(C)O 2708a_100015525214_100000695535 [0,2,0,0,0,0|2,0,0]=4 8493 B13R1.1517 CCNC(=O)N1CCCC(C1)(C)O 273464a_100015525214_100000695535 [0,2,0,0,0,0|2,0,0]=4 8494 B13R1.1517 CCNC(=O)N1CCCC(C1)(F)F 2708a_100015525214_100000732682 [0,2,0,0,0,0|2,0,0]=4 8495 B13R1.1517 CCNC(=O)N1CCCC(C1)(F)F 273464a_100015525214_100000732682 [0,2,0,0,0,0|2,0,0]=4 8496 B13R1.1517 CCNC(=O)[C@@H]1CCCS(=O)(=O)C1 11a_100015525214_200009923180 [0,2,0,0,0,0|2,0,0]=4 8497 B13R1.1517 CCNC(=O)[C@@H]1CCCS(=O)(=O)C1 240690a_100015525214_200009923180 [0,2,0,0,0,0|2,0,0]=4 8498 B13R1.4470 CCOC(=O)C1(CCCN(C1)C)C 2230a_100016990316_200000210301 [0,2,0,0,0,0|1,0,0]=3 8499 B13R1.4470 CCOC(=O)C1(CCCN(C1)C)C 269982a_100016990316_200000210301 [0,2,0,0,0,0|1,0,0]=3 8500 B13R1.4470 CCOC(=O)C1(CCCN(C1)[13CH3])C 2230a_100016990316_200025704644 [0,2,0,0,0,0|1,0,0]=3 8501 B13R1.4470 CCOC(=O)C1(CCCN(C1)[13CH3])C 269982a_100016990316_200025704644 [0,2,0,0,0,0|1,0,0]=3 8502 B13R1.11 C#CC(C)NC(=O)C1CCCCC1 11a_100000707721_100000210647 [0,2,0,0,0,0|1,0,0]=3 8503 B13R1.11 C#CC(C)NC(=O)C1CCCCC1 1626a_100000707721_100000210647 [0,2,0,0,0,0|1,0,0]=3 8504 B13R1.11 C#CC(C)NC(=O)C1CCCCC1 240690a_100000707721_100000210647 [0,2,0,0,0,0|1,0,0]=3 8505 B13R1.11 C#CC(C)NC(=O)C1CCCCC1 527a_100000707721_100000210647 [0,2,0,0,0,0|1,0,0]=3 8506 B13R1.11 C#CC(C)NC(=O)C1CCCCO1 11a_100000707721_100000748299 [0,2,0,0,0,0|2,0,0]=4 8507 B13R1.11 C#CC(C)NC(=O)C1CCCCO1 1626a_100000707721_100000748299 [0,2,0,0,0,0|2,0,0]=4 8508 B13R1.11 C#CC(C)NC(=O)C1CCCCO1 240690a_100000707721_100000748299 [0,2,0,0,0,0|2,0,0]=4 8509 B13R1.11 C#CC(C)NC(=O)C1CCCCO1 527a_100000707721_100000748299 [0,2,0,0,0,0|2,0,0]=4 8510 B13R1.11 C#CC(C)NC(=O)C1CCCOC1 11a_100000707721_100000741522 [0,2,0,0,0,0|2,0,0]=4 8511 B13R1.11 C#CC(C)NC(=O)C1CCCOC1 1626a_100000707721_100000741522 [0,2,0,0,0,0|2,0,0]=4 8512 B13R1.11 C#CC(C)NC(=O)C1CCCOC1 240690a_100000707721_100000741522 [0,2,0,0,0,0|2,0,0]=4 8513 B13R1.11 C#CC(C)NC(=O)C1CCCOC1 527a_100000707721_100000741522 [0,2,0,0,0,0|2,0,0]=4 8514 B13R1.11 C#CC(C)NC(=O)C1CCOCC1 11a_100000707721_100000195482 [0,2,0,0,0,0|2,0,0]=4 8515 B13R1.11 C#CC(C)NC(=O)C1CCOCC1 1626a_100000707721_100000195482 [0,2,0,0,0,0|2,0,0]=4 8516 B13R1.11 C#CC(C)NC(=O)C1CCOCC1 240690a_100000707721_100000195482 [0,2,0,0,0,0|2,0,0]=4 8517 B13R1.11 C#CC(C)NC(=O)C1CCOCC1 527a_100000707721_100000195482 [0,2,0,0,0,0|2,0,0]=4 8518 B13R1.11 C#CC(C)NC(=O)C1CCSCC1 11a_100000707721_100000755232 [0,2,0,0,0,0|2,0,0]=4 8519 B13R1.11 C#CC(C)NC(=O)C1CCSCC1 1626a_100000707721_100000755232 [0,2,0,0,0,0|2,0,0]=4 8520 B13R1.11 C#CC(C)NC(=O)C1CCSCC1 240690a_100000707721_100000755232 [0,2,0,0,0,0|2,0,0]=4 8521 B13R1.11 C#CC(C)NC(=O)C1CCSCC1 527a_100000707721_100000755232 [0,2,0,0,0,0|2,0,0]=4 8522 B13R1.11 C#CC(C)OC(C)C1CCCCC1 34a_100011216961_200000035995 [0,2,0,0,0,0|1,0,1]=4 8523 B13R1.11 C=CC(C)CC(=O)C1CCCCC1 1458a_100011934298_100000210327 [0,2,0,0,0,0|1,0,0]=3 8524 B13R1.11 C=CC(C)CC(=O)C1CCCOC1 1458a_100011934298_100000693364 [0,2,0,0,0,0|2,0,0]=4 8525 B13R1.11 C=CC(C)CC(=O)C1CCOCC1 1458a_100011934298_100011324220 [0,2,0,0,0,0|2,0,0]=4 8526 B13R1.11 CC(C#N)NC(=O)C1CCCCC1 11a_100000737613_100000210647 [0,2,0,0,0,0|1,0,0]=3 8527 B13R1.11 CC(C#N)NC(=O)C1CCCCC1 1626a_100000737613_100000210647 [0,2,0,0,0,0|1,0,0]=3 8528 B13R1.11 CC(C#N)NC(=O)C1CCCCC1 527a_100000737613_100000210647 [0,2,0,0,0,0|1,0,0]=3 8529 B13R1.11 CC(C#N)NC(=O)C1CCCCO1 11a_100000737613_100000748299 [0,2,0,0,0,0|2,0,0]=4 8530 B13R1.11 CC(C#N)NC(=O)C1CCCCO1 1626a_100000737613_100000748299 [0,2,0,0,0,0|2,0,0]=4 8531 B13R1.11 CC(C#N)NC(=O)C1CCCCO1 527a_100000737613_100000748299 [0,2,0,0,0,0|2,0,0]=4 8532 B13R1.11 CC(C#N)NC(=O)C1CCCOC1 11a_100000737613_100000741522 [0,2,0,0,0,0|2,0,0]=4 8533 B13R1.11 CC(C#N)NC(=O)C1CCCOC1 1626a_100000737613_100000741522 [0,2,0,0,0,0|2,0,0]=4 8534 B13R1.11 CC(C#N)NC(=O)C1CCCOC1 527a_100000737613_100000741522 [0,2,0,0,0,0|2,0,0]=4 8535 B13R1.11 CC(C#N)NC(=O)C1CCOCC1 11a_100000737613_100000195482 [0,2,0,0,0,0|2,0,0]=4 8536 B13R1.11 CC(C#N)NC(=O)C1CCOCC1 1626a_100000737613_100000195482 [0,2,0,0,0,0|2,0,0]=4 8537 B13R1.11 CC(C#N)NC(=O)C1CCOCC1 527a_100000737613_100000195482 [0,2,0,0,0,0|2,0,0]=4 8538 B13R1.11 CC(C#N)NC(=O)C1CCSCC1 11a_100000737613_100000755232 [0,2,0,0,0,0|2,0,0]=4 8539 B13R1.11 CC(C#N)NC(=O)C1CCSCC1 1626a_100000737613_100000755232 [0,2,0,0,0,0|2,0,0]=4 8540 B13R1.11 CC(C#N)NC(=O)C1CCSCC1 527a_100000737613_100000755232 [0,2,0,0,0,0|2,0,0]=4 8541 B13R1.11 CC(C#N)OC(C)C1CCCCC1 7a_100011216961_100000703298 [0,2,0,0,0,0|1,0,1]=4 8542 B13R1.11 CC(CO)OC(C)C1CCCCC1 34a_100011216961_100012180447 [0,2,0,0,0,0|1,0,1]=4 8543 B13R1.11 CC(CO)OC(C)C1CCCCC1 7a_100011216961_100012180447 [0,2,0,0,0,0|1,0,1]=4 8544 B13R1.11 CCC(=CC(=O)C1CCCCC1)C 1458a_100020758463_100000210327 [0,2,0,0,0,0|1,0,0]=3 8545 B13R1.11 CCC(=CC(=O)C1CCCOC1)C 1458a_100020758463_100000693364 [0,2,0,0,0,0|2,0,0]=4 8546 B13R1.11 CCC(=CC(=O)C1CCOCC1)C 1458a_100020758463_100011324220 [0,2,0,0,0,0|2,0,0]=4 8547 B13R1.11 CCC(=O)CC(=O)C1CCCCC1 1458a_100000210414_100000241979 [0,2,0,0,0,0|1,0,0]=3 8548 B13R1.11 CCC(=O)CC(=O)C1CCCCC1 1458a_100000210647_100000747405 [0,2,0,0,0,0|1,0,0]=3 8549 B13R1.11 CCC(=O)CC(=O)C1CCCCO1 1458a_100000748299_100000747405 [0,2,0,0,0,0|2,0,0]=4 8550 B13R1.11 CCC(=O)CC(=O)C1CCCOC1 1458a_100000741522_100000747405 [0,2,0,0,0,0|2,0,0]=4 8551 B13R1.11 CCC(=O)CC(=O)C1CCOCC1 1458a_100000195482_100000747405 [0,2,0,0,0,0|2,0,0]=4 8552 B13R1.11 CCC(=O)CC(=O)C1CCOCC1 1458a_100000210414_100000689883 [0,2,0,0,0,0|2,0,0]=4 8553 B13R1.11 CCC(=O)CC(=O)C1CCSCC1 1458a_100000755232_100000747405 [0,2,0,0,0,0|2,0,0]=4 8554 B13R1.11 CCC(=O)CC(=O)N1CCCCC1 1458a_100000210414_100000183409 [0,2,0,0,0,0|2,0,0]=4 8555 B13R1.11 CCC(C)CC(=O)C1CCCCC1 1458a_100000210647_100000748023 [0,2,0,0,0,0|1,0,0]=3 8556 B13R1.11 CCC(C)CC(=O)C1CCCCC1 1458a_100000708755_100000210327 [0,2,0,0,0,0|1,0,0]=3 8557 B13R1.11 CCC(C)CC(=O)C1CCCCO1 1458a_100000748299_100000748023 [0,2,0,0,0,0|2,0,0]=4 8558 B13R1.11 CCC(C)CC(=O)C1CCCOC1 1458a_100000708755_100000693364 [0,2,0,0,0,0|2,0,0]=4 8559 B13R1.11 CCC(C)CC(=O)C1CCCOC1 1458a_100000741522_100000748023 [0,2,0,0,0,0|2,0,0]=4 8560 B13R1.11 CCC(C)CC(=O)C1CCOCC1 1458a_100000195482_100000748023 [0,2,0,0,0,0|2,0,0]=4 8561 B13R1.11 CCC(C)CC(=O)C1CCOCC1 1458a_100000708755_100011324220 [0,2,0,0,0,0|2,0,0]=4 8562 B13R1.11 CCC(C)CC(=O)C1CCSCC1 1458a_100000755232_100000748023 [0,2,0,0,0,0|2,0,0]=4 8563 B13R1.11 CCC(C)NC(=O)C1CCCCC1 11a_100000209981_100000210647 [0,2,0,0,0,0|1,0,0]=3 8564 B13R1.11 CCC(C)NC(=O)C1CCCCC1 1626a_100000209981_100000210647 [0,2,0,0,0,0|1,0,0]=3 8565 B13R1.11 CCC(C)NC(=O)C1CCCCC1 240690a_100000209981_100000210647 [0,2,0,0,0,0|1,0,0]=3 8566 B13R1.11 CCC(C)NC(=O)C1CCCCC1 527a_100000209981_100000210647 [0,2,0,0,0,0|1,0,0]=3 8567 B13R1.11 CCC(C)NC(=O)C1CCCCO1 11a_100000209981_100000748299 [0,2,0,0,0,0|2,0,0]=4 8568 B13R1.11 CCC(C)NC(=O)C1CCCCO1 1626a_100000209981_100000748299 [0,2,0,0,0,0|2,0,0]=4 8569 B13R1.11 CCC(C)NC(=O)C1CCCCO1 240690a_100000209981_100000748299 [0,2,0,0,0,0|2,0,0]=4 8570 B13R1.11 CCC(C)NC(=O)C1CCCCO1 527a_100000209981_100000748299 [0,2,0,0,0,0|2,0,0]=4 8571 B13R1.11 CCC(C)NC(=O)C1CCCOC1 11a_100000209981_100000741522 [0,2,0,0,0,0|2,0,0]=4 8572 B13R1.11 CCC(C)NC(=O)C1CCCOC1 1626a_100000209981_100000741522 [0,2,0,0,0,0|2,0,0]=4 8573 B13R1.11 CCC(C)NC(=O)C1CCCOC1 240690a_100000209981_100000741522 [0,2,0,0,0,0|2,0,0]=4 8574 B13R1.11 CCC(C)NC(=O)C1CCCOC1 527a_100000209981_100000741522 [0,2,0,0,0,0|2,0,0]=4 8575 B13R1.11 CCC(C)NC(=O)C1CCOCC1 11a_100000209981_100000195482 [0,2,0,0,0,0|2,0,0]=4 8576 B13R1.11 CCC(C)NC(=O)C1CCOCC1 1626a_100000209981_100000195482 [0,2,0,0,0,0|2,0,0]=4 8577 B13R1.11 CCC(C)NC(=O)C1CCOCC1 240690a_100000209981_100000195482 [0,2,0,0,0,0|2,0,0]=4 8578 B13R1.11 CCC(C)NC(=O)C1CCOCC1 527a_100000209981_100000195482 [0,2,0,0,0,0|2,0,0]=4 8579 B13R1.11 CCC(C)NC(=O)C1CCSCC1 11a_100000209981_100000755232 [0,2,0,0,0,0|2,0,0]=4 8580 B13R1.11 CCC(C)NC(=O)C1CCSCC1 1626a_100000209981_100000755232 [0,2,0,0,0,0|2,0,0]=4 8581 B13R1.11 CCC(C)NC(=O)C1CCSCC1 240690a_100000209981_100000755232 [0,2,0,0,0,0|2,0,0]=4 8582 B13R1.11 CCC(C)NC(=O)C1CCSCC1 527a_100000209981_100000755232 [0,2,0,0,0,0|2,0,0]=4 8583 B13R1.11 CCC(C)OC(C)C1CCCCC1 34a_100011216961_100011215416 [0,2,0,0,0,0|1,0,1]=4 8584 B13R1.11 CCC(C)OC(C)C1CCCCC1 7a_100011216961_100000758301 [0,2,0,0,0,0|1,0,1]=4 8585 B13R1.11 CCC(O)CC(=O)C1CCCCC1 1458a_100000210647_100011218378 [0,2,0,0,0,0|1,0,0]=3 8586 B13R1.11 CCC(O)CC(=O)C1CCCCC1 1458a_100011667805_100000210327 [0,2,0,0,0,0|1,0,0]=3 8587 B13R1.11 CCC(O)CC(=O)C1CCCCO1 1458a_100000748299_100011218378 [0,2,0,0,0,0|2,0,0]=4 8588 B13R1.11 CCC(O)CC(=O)C1CCCOC1 1458a_100000741522_100011218378 [0,2,0,0,0,0|2,0,0]=4 8589 B13R1.11 CCC(O)CC(=O)C1CCCOC1 1458a_100011667805_100000693364 [0,2,0,0,0,0|2,0,0]=4 8590 B13R1.11 CCC(O)CC(=O)C1CCOCC1 1458a_100000195482_100011218378 [0,2,0,0,0,0|2,0,0]=4 8591 B13R1.11 CCC(O)CC(=O)C1CCOCC1 1458a_100011667805_100011324220 [0,2,0,0,0,0|2,0,0]=4 8592 B13R1.11 CCC(O)CC(=O)C1CCSCC1 1458a_100000755232_100011218378 [0,2,0,0,0,0|2,0,0]=4 8593 B13R1.11 CCN(C)CC(=O)C1CCCCC1 1458a_100116209913_100000210327 [0,2,0,0,0,0|1,0,0]=3 8594 B13R1.11 CCN(C)CC(=O)C1CCCCC1 2230a_100000225621_100000241979 [0,2,0,0,0,0|1,0,0]=3 8595 B13R1.11 CCN(C)CC(=O)C1CCCCC1 269982a_100000225621_100000241979 [0,2,0,0,0,0|1,0,0]=3 8596 B13R1.11 CCN(C)CC(=O)C1CCCOC1 1458a_100116209913_100000693364 [0,2,0,0,0,0|2,0,0]=4 8597 B13R1.11 CCN(C)CC(=O)C1CCOCC1 1458a_100116209913_100011324220 [0,2,0,0,0,0|2,0,0]=4 8598 B13R1.11 CCN(C)CC(=O)C1CCOCC1 2230a_100000225621_100000689883 [0,2,0,0,0,0|2,0,0]=4 8599 B13R1.11 CCN(C)CC(=O)C1CCOCC1 269982a_100000225621_100000689883 [0,2,0,0,0,0|2,0,0]=4 8600 B13R1.11 CCN(C)CC(=O)N1CCCCC1 2230a_100000225621_100000183409 [0,2,0,0,0,0|2,0,0]=4 8601 B13R1.11 CCN(C)CC(=O)N1CCCCC1 2230a_200025747655_100000210202 [0,2,0,0,0,0|2,0,0]=4 8602 B13R1.11 CCN(C)CC(=O)N1CCCCC1 269982a_100000225621_100000183409 [0,2,0,0,0,0|2,0,0]=4 8603 B13R1.11 CCN(C)CC(=O)N1CCCCC1 269982a_200025747655_100000204670 [0,2,0,0,0,0|2,0,0]=4 8604 B13R1.11 CC[C@H](C)CC(=O)C1CCCCC1 1458a_100000210647_100009816398 [0,2,0,0,0,0|1,0,0]=3 8605 B13R1.11 CC[C@H](C)CC(=O)C1CCCCO1 1458a_100000748299_100009816398 [0,2,0,0,0,0|2,0,0]=4 8606 B13R1.11 CC[C@H](C)CC(=O)C1CCCOC1 1458a_100000741522_100009816398 [0,2,0,0,0,0|2,0,0]=4 8607 B13R1.11 CC[C@H](C)CC(=O)C1CCOCC1 1458a_100000195482_100009816398 [0,2,0,0,0,0|2,0,0]=4 8608 B13R1.11 CC[C@H](C)CC(=O)C1CCSCC1 1458a_100000755232_100009816398 [0,2,0,0,0,0|2,0,0]=4 8609 B13R1.11 CNC(=O)CC(=O)C1CCCCC1 1458a_100000210647_100000183359 [0,2,0,0,0,0|1,0,1]=4 8610 B13R1.11 COC(=O)CC(=O)C1CCCCC1 1458a_100000210647_100000747449 [0,2,0,0,0,0|1,0,1]=4 8611 B13R1.11 COC(=O)CC(=O)C1CCCCC1 1458a_100000211351_100000210327 [0,2,0,0,0,0|1,0,1]=4 8612 B13R1.11 C[C@@H](CO)CC(=O)C1CCCCC1 1458a_100000210647_100000059175 [0,2,0,0,0,0|1,0,0]=3 8613 B13R1.11 C[C@@H](CO)CC(=O)C1CCCCO1 1458a_100000748299_100000059175 [0,2,0,0,0,0|2,0,0]=4 8614 B13R1.11 C[C@@H](CO)CC(=O)C1CCCOC1 1458a_100000741522_100000059175 [0,2,0,0,0,0|2,0,0]=4 8615 B13R1.11 C[C@@H](CO)CC(=O)C1CCOCC1 1458a_100000195482_100000059175 [0,2,0,0,0,0|2,0,0]=4 8616 B13R1.11 C[C@@H](CO)CC(=O)C1CCSCC1 1458a_100000755232_100000059175 [0,2,0,0,0,0|2,0,0]=4 8617 B13R1.11 C[C@H](CF)NC(=O)C1CCCCC1 11a_100102880703_100000210647 [0,2,0,0,0,0|1,0,0]=3 8618 B13R1.11 C[C@H](CF)NC(=O)C1CCCCC1 1626a_100102880703_100000210647 [0,2,0,0,0,0|1,0,0]=3 8619 B13R1.11 C[C@H](CF)NC(=O)C1CCCCC1 240690a_100102880703_100000210647 [0,2,0,0,0,0|1,0,0]=3 8620 B13R1.11 C[C@H](CF)NC(=O)C1CCCCC1 527a_100102880703_100000210647 [0,2,0,0,0,0|1,0,0]=3 8621 B13R1.11 C[C@H](CF)NC(=O)C1CCCCO1 11a_100102880703_100000748299 [0,2,0,0,0,0|2,0,0]=4 8622 B13R1.11 C[C@H](CF)NC(=O)C1CCCCO1 1626a_100102880703_100000748299 [0,2,0,0,0,0|2,0,0]=4 8623 B13R1.11 C[C@H](CF)NC(=O)C1CCCCO1 240690a_100102880703_100000748299 [0,2,0,0,0,0|2,0,0]=4 8624 B13R1.11 C[C@H](CF)NC(=O)C1CCCCO1 527a_100102880703_100000748299 [0,2,0,0,0,0|2,0,0]=4 8625 B13R1.11 C[C@H](CF)NC(=O)C1CCCOC1 11a_100102880703_100000741522 [0,2,0,0,0,0|2,0,0]=4 8626 B13R1.11 C[C@H](CF)NC(=O)C1CCCOC1 1626a_100102880703_100000741522 [0,2,0,0,0,0|2,0,0]=4 8627 B13R1.11 C[C@H](CF)NC(=O)C1CCCOC1 240690a_100102880703_100000741522 [0,2,0,0,0,0|2,0,0]=4 8628 B13R1.11 C[C@H](CF)NC(=O)C1CCCOC1 527a_100102880703_100000741522 [0,2,0,0,0,0|2,0,0]=4 8629 B13R1.11 C[C@H](CF)NC(=O)C1CCOCC1 11a_100102880703_100000195482 [0,2,0,0,0,0|2,0,0]=4 8630 B13R1.11 C[C@H](CF)NC(=O)C1CCOCC1 1626a_100102880703_100000195482 [0,2,0,0,0,0|2,0,0]=4 8631 B13R1.11 C[C@H](CF)NC(=O)C1CCOCC1 240690a_100102880703_100000195482 [0,2,0,0,0,0|2,0,0]=4 8632 B13R1.11 C[C@H](CF)NC(=O)C1CCOCC1 527a_100102880703_100000195482 [0,2,0,0,0,0|2,0,0]=4 8633 B13R1.11 C[C@H](CF)NC(=O)C1CCSCC1 11a_100102880703_100000755232 [0,2,0,0,0,0|2,0,0]=4 8634 B13R1.11 C[C@H](CF)NC(=O)C1CCSCC1 1626a_100102880703_100000755232 [0,2,0,0,0,0|2,0,0]=4 8635 B13R1.11 C[C@H](CF)NC(=O)C1CCSCC1 240690a_100102880703_100000755232 [0,2,0,0,0,0|2,0,0]=4 8636 B13R1.11 C[C@H](CF)NC(=O)C1CCSCC1 527a_100102880703_100000755232 [0,2,0,0,0,0|2,0,0]=4 8637 B13R1.11 C[C@H](CO)NC(=O)C1CCCCC1 240690a_100000737577_100000210647 [0,2,0,0,0,0|1,0,0]=3 8638 B13R1.11 C[C@H](CO)NC(=O)C1CCCCC1 527a_100000737577_100000210647 [0,2,0,0,0,0|1,0,0]=3 8639 B13R1.11 C[C@H](CO)NC(=O)C1CCCCO1 240690a_100000737577_100000748299 [0,2,0,0,0,0|2,0,0]=4 8640 B13R1.11 C[C@H](CO)NC(=O)C1CCCCO1 527a_100000737577_100000748299 [0,2,0,0,0,0|2,0,0]=4 8641 B13R1.11 C[C@H](CO)NC(=O)C1CCCOC1 240690a_100000737577_100000741522 [0,2,0,0,0,0|2,0,0]=4 8642 B13R1.11 C[C@H](CO)NC(=O)C1CCCOC1 527a_100000737577_100000741522 [0,2,0,0,0,0|2,0,0]=4 8643 B13R1.11 C[C@H](CO)NC(=O)C1CCOCC1 240690a_100000737577_100000195482 [0,2,0,0,0,0|2,0,0]=4 8644 B13R1.11 C[C@H](CO)NC(=O)C1CCOCC1 527a_100000737577_100000195482 [0,2,0,0,0,0|2,0,0]=4 8645 B13R1.11 C[C@H](CO)NC(=O)C1CCSCC1 240690a_100000737577_100000755232 [0,2,0,0,0,0|2,0,0]=4 8646 B13R1.11 C[C@H](CO)NC(=O)C1CCSCC1 527a_100000737577_100000755232 [0,2,0,0,0,0|2,0,0]=4 8647 B13R1.11 O=C(CO)CC(=O)C1CCCCC1 1458a_100000210174_100000241979 [0,2,0,0,0,0|1,0,1]=4 8648 B13R1.24 C#CCCCC(=O)C1CCCCC1 1458a_100000210647_100000731252 [0,2,0,0,0,0|1,0,0]=3 8649 B13R1.24 C#CCCCC(=O)C1CCCCC1 1458a_100000690238_100000210327 [0,2,0,0,0,0|1,0,0]=3 8650 B13R1.24 C#CCCCC(=O)C1CCCCO1 1458a_100000748299_100000731252 [0,2,0,0,0,0|2,0,0]=4 8651 B13R1.24 C#CCCCC(=O)C1CCCOC1 1458a_100000690238_100000693364 [0,2,0,0,0,0|2,0,0]=4 8652 B13R1.24 C#CCCCC(=O)C1CCCOC1 1458a_100000741522_100000731252 [0,2,0,0,0,0|2,0,0]=4 8653 B13R1.24 C#CCCCC(=O)C1CCOCC1 1458a_100000195482_100000731252 [0,2,0,0,0,0|2,0,0]=4 8654 B13R1.24 C#CCCCC(=O)C1CCOCC1 1458a_100000690238_100011324220 [0,2,0,0,0,0|2,0,0]=4 8655 B13R1.24 C#CCCCC(=O)C1CCSCC1 1458a_100000755232_100000731252 [0,2,0,0,0,0|2,0,0]=4 8656 B13R1.24 C#CCCNC(=O)C1CCCCC1 11a_100000755551_100000210647 [0,2,0,0,0,0|1,0,0]=3 8657 B13R1.24 C#CCCNC(=O)C1CCCCC1 1626a_100000755551_100000210647 [0,2,0,0,0,0|1,0,0]=3 8658 B13R1.24 C#CCCNC(=O)C1CCCCC1 240690a_100000755551_100000210647 [0,2,0,0,0,0|1,0,0]=3 8659 B13R1.24 C#CCCNC(=O)C1CCCCC1 527a_100000755551_100000210647 [0,2,0,0,0,0|1,0,0]=3 8660 B13R1.24 C#CCCNC(=O)C1CCCCO1 11a_100000755551_100000748299 [0,2,0,0,0,0|2,0,0]=4 8661 B13R1.24 C#CCCNC(=O)C1CCCCO1 1626a_100000755551_100000748299 [0,2,0,0,0,0|2,0,0]=4 8662 B13R1.24 C#CCCNC(=O)C1CCCCO1 240690a_100000755551_100000748299 [0,2,0,0,0,0|2,0,0]=4 8663 B13R1.24 C#CCCNC(=O)C1CCCCO1 527a_100000755551_100000748299 [0,2,0,0,0,0|2,0,0]=4 8664 B13R1.24 C#CCCNC(=O)C1CCCOC1 11a_100000755551_100000741522 [0,2,0,0,0,0|2,0,0]=4 8665 B13R1.24 C#CCCNC(=O)C1CCCOC1 1626a_100000755551_100000741522 [0,2,0,0,0,0|2,0,0]=4 8666 B13R1.24 C#CCCNC(=O)C1CCCOC1 240690a_100000755551_100000741522 [0,2,0,0,0,0|2,0,0]=4 8667 B13R1.24 C#CCCNC(=O)C1CCCOC1 527a_100000755551_100000741522 [0,2,0,0,0,0|2,0,0]=4 8668 B13R1.24 C#CCCNC(=O)C1CCOCC1 11a_100000755551_100000195482 [0,2,0,0,0,0|2,0,0]=4 8669 B13R1.24 C#CCCNC(=O)C1CCOCC1 1626a_100000755551_100000195482 [0,2,0,0,0,0|2,0,0]=4 8670 B13R1.24 C#CCCNC(=O)C1CCOCC1 240690a_100000755551_100000195482 [0,2,0,0,0,0|2,0,0]=4 8671 B13R1.24 C#CCCNC(=O)C1CCOCC1 527a_100000755551_100000195482 [0,2,0,0,0,0|2,0,0]=4 8672 B13R1.24 C#CCCNC(=O)C1CCSCC1 11a_100000755551_100000755232 [0,2,0,0,0,0|2,0,0]=4 8673 B13R1.24 C#CCCNC(=O)C1CCSCC1 1626a_100000755551_100000755232 [0,2,0,0,0,0|2,0,0]=4 8674 B13R1.24 C#CCCNC(=O)C1CCSCC1 240690a_100000755551_100000755232 [0,2,0,0,0,0|2,0,0]=4 8675 B13R1.24 C#CCCNC(=O)C1CCSCC1 527a_100000755551_100000755232 [0,2,0,0,0,0|2,0,0]=4 8676 B13R1.24 C#CCCOC(C)C1CCCCC1 34a_100011216961_100000688953 [0,2,0,0,0,0|1,0,1]=4 8677 B13R1.24 C#CCCOC(C)C1CCCCC1 7a_100011216961_100000688953 [0,2,0,0,0,0|1,0,1]=4 8678 B13R1.24 C#CCNCC(=O)C1CCCCC1 34a_100000212058_100000241979 [0,2,0,0,0,0|1,0,1]=4 8679 B13R1.24 C#CCOCC(=O)C1CCCCC1 1458a_100011251226_100000210327 [0,2,0,0,0,0|0,0,1]=3 8680 B13R1.24 C#CCOCC(=O)C1CCCCC1 34a_100000210247_100000241979 [0,2,0,0,0,0|0,0,1]=3 8681 B13R1.24 C#CCOCC(=O)C1CCCOC1 1458a_100011251226_100000693364 [0,2,0,0,0,0|1,0,1]=4 8682 B13R1.24 C#CCOCC(=O)C1CCOCC1 1458a_100011251226_100011324220 [0,2,0,0,0,0|1,0,1]=4 8683 B13R1.24 C#CCOCC(=O)C1CCOCC1 34a_100000210247_100000689883 [0,2,0,0,0,0|1,0,1]=4 8684 B13R1.24 C#CCOCC(=O)N1CCCCC1 34a_100000210247_100000183409 [0,2,0,0,0,0|1,0,1]=4 8685 B13R1.24 C#CCOCC(=O)N1CCCCC1 7a_100011315646_100000038162 [0,2,0,0,0,0|1,0,1]=4 8686 B13R1.24 C#CCSCC(=O)C1CCCCC1 62a_100000038162_100000241979 [0,2,0,0,0,0|0,1,1]=4 8687 B13R1.24 C/C=C/C=CC(=O)C1CCCCC1 1458a_100000185730_100000210327 [0,2,0,0,0,0|1,0,1]=4 8688 B13R1.24 C/C=C/COC(C)C1CCCCC1 34a_100011216961_100102629194 [0,2,0,0,0,0|1,0,1]=4 8689 B13R1.24 C/C=C/COC(C)C1CCCCC1 7a_100011216961_100102629194 [0,2,0,0,0,0|1,0,1]=4 8690 B13R1.24 C=CCCCC(=O)C1CCCCC1 1458a_100000210647_100000757094 [0,2,0,0,0,0|1,0,0]=3 8691 B13R1.24 C=CCCCC(=O)C1CCCCC1 1458a_100000766728_100000210327 [0,2,0,0,0,0|1,0,0]=3 8692 B13R1.24 C=CCCCC(=O)C1CCCCO1 1458a_100000748299_100000757094 [0,2,0,0,0,0|2,0,0]=4 8693 B13R1.24 C=CCCCC(=O)C1CCCOC1 1458a_100000741522_100000757094 [0,2,0,0,0,0|2,0,0]=4 8694 B13R1.24 C=CCCCC(=O)C1CCCOC1 1458a_100000766728_100000693364 [0,2,0,0,0,0|2,0,0]=4 8695 B13R1.24 C=CCCCC(=O)C1CCOCC1 1458a_100000195482_100000757094 [0,2,0,0,0,0|2,0,0]=4 8696 B13R1.24 C=CCCCC(=O)C1CCOCC1 1458a_100000766728_100011324220 [0,2,0,0,0,0|2,0,0]=4 8697 B13R1.24 C=CCCCC(=O)C1CCSCC1 1458a_100000755232_100000757094 [0,2,0,0,0,0|2,0,0]=4 8698 B13R1.24 C=CCCNC(=O)C1CCCCC1 11a_100015191253_100000210647 [0,2,0,0,0,0|1,0,0]=3 8699 B13R1.24 C=CCCNC(=O)C1CCCCC1 1626a_100015191253_100000210647 [0,2,0,0,0,0|1,0,0]=3 8700 B13R1.24 C=CCCNC(=O)C1CCCCC1 240690a_100015191253_100000210647 [0,2,0,0,0,0|1,0,0]=3 8701 B13R1.24 C=CCCNC(=O)C1CCCCC1 527a_100015191253_100000210647 [0,2,0,0,0,0|1,0,0]=3 8702 B13R1.24 C=CCCNC(=O)C1CCCCO1 11a_100015191253_100000748299 [0,2,0,0,0,0|2,0,0]=4 8703 B13R1.24 C=CCCNC(=O)C1CCCCO1 1626a_100015191253_100000748299 [0,2,0,0,0,0|2,0,0]=4 8704 B13R1.24 C=CCCNC(=O)C1CCCCO1 240690a_100015191253_100000748299 [0,2,0,0,0,0|2,0,0]=4 8705 B13R1.24 C=CCCNC(=O)C1CCCCO1 527a_100015191253_100000748299 [0,2,0,0,0,0|2,0,0]=4 8706 B13R1.24 C=CCCNC(=O)C1CCCOC1 11a_100015191253_100000741522 [0,2,0,0,0,0|2,0,0]=4 8707 B13R1.24 C=CCCNC(=O)C1CCCOC1 1626a_100015191253_100000741522 [0,2,0,0,0,0|2,0,0]=4 8708 B13R1.24 C=CCCNC(=O)C1CCCOC1 240690a_100015191253_100000741522 [0,2,0,0,0,0|2,0,0]=4 8709 B13R1.24 C=CCCNC(=O)C1CCCOC1 527a_100015191253_100000741522 [0,2,0,0,0,0|2,0,0]=4 8710 B13R1.24 C=CCCNC(=O)C1CCOCC1 11a_100015191253_100000195482 [0,2,0,0,0,0|2,0,0]=4 8711 B13R1.24 C=CCCNC(=O)C1CCOCC1 1626a_100015191253_100000195482 [0,2,0,0,0,0|2,0,0]=4 8712 B13R1.24 C=CCCNC(=O)C1CCOCC1 240690a_100015191253_100000195482 [0,2,0,0,0,0|2,0,0]=4 8713 B13R1.24 C=CCCNC(=O)C1CCOCC1 527a_100015191253_100000195482 [0,2,0,0,0,0|2,0,0]=4 8714 B13R1.24 C=CCCNC(=O)C1CCSCC1 11a_100015191253_100000755232 [0,2,0,0,0,0|2,0,0]=4 8715 B13R1.24 C=CCCNC(=O)C1CCSCC1 1626a_100015191253_100000755232 [0,2,0,0,0,0|2,0,0]=4 8716 B13R1.24 C=CCCNC(=O)C1CCSCC1 240690a_100015191253_100000755232 [0,2,0,0,0,0|2,0,0]=4 8717 B13R1.24 C=CCCNC(=O)C1CCSCC1 527a_100015191253_100000755232 [0,2,0,0,0,0|2,0,0]=4 8718 B13R1.24 C=CCCOC(C)C1CCCCC1 34a_100011216961_100000754431 [0,2,0,0,0,0|1,0,1]=4 8719 B13R1.24 C=CCCOC(C)C1CCCCC1 7a_100011216961_100000754431 [0,2,0,0,0,0|1,0,1]=4 8720 B13R1.24 C=CCNCC(=O)C1CCCCC1 2230a_100020586998_100000241979 [0,2,0,0,0,0|1,0,1]=4 8721 B13R1.24 C=CCNNC(=O)C1CCCCC1 22a_100020588587_100000210647 [0,2,0,0,0,0|1,0,1]=4 8722 B13R1.24 C=CCOCC(=O)C1CCCCC1 34a_200000210373_100000241979 [0,2,0,0,0,0|0,0,1]=3 8723 B13R1.24 C=CCOCC(=O)C1CCOCC1 34a_200000210373_100000689883 [0,2,0,0,0,0|1,0,1]=4 8724 B13R1.24 C=CCOCC(=O)N1CCCCC1 34a_200000210373_100000183409 [0,2,0,0,0,0|1,0,1]=4 8725 B13R1.24 C=CCOCC(=O)N1CCCCC1 7a_100011315646_100015514636 [0,2,0,0,0,0|1,0,1]=4 8726 B13R1.24 C=CCSCC(=O)C1CCCCC1 1458a_100000230395_100000210327 [0,2,0,0,0,0|0,1,1]=4 8727 B13R1.24 C=CCSCC(=O)C1CCCCC1 62a_100000210623_100000241979 [0,2,0,0,0,0|0,1,1]=4 8728 B13R1.24 C=CCSCC(=O)C1CCCCC1 62a_100000241979_100000210623 [0,2,0,0,0,0|0,1,1]=4 8729 B13R1.24 C=COCCC(=O)C1CCCCC1 1458a_100000210647_100000039644 [0,2,0,0,0,0|0,0,2]=4 8730 B13R1.24 CC#CCNC(=O)C1CCCCC1 11a_100000685387_100000210647 [0,2,0,0,0,0|1,0,0]=3 8731 B13R1.24 CC#CCNC(=O)C1CCCCC1 1626a_100000685387_100000210647 [0,2,0,0,0,0|1,0,0]=3 8732 B13R1.24 CC#CCNC(=O)C1CCCCC1 527a_100000685387_100000210647 [0,2,0,0,0,0|1,0,0]=3 8733 B13R1.24 CC#CCNC(=O)C1CCCCO1 11a_100000685387_100000748299 [0,2,0,0,0,0|2,0,0]=4 8734 B13R1.24 CC#CCNC(=O)C1CCCCO1 1626a_100000685387_100000748299 [0,2,0,0,0,0|2,0,0]=4 8735 B13R1.24 CC#CCNC(=O)C1CCCCO1 527a_100000685387_100000748299 [0,2,0,0,0,0|2,0,0]=4 8736 B13R1.24 CC#CCNC(=O)C1CCCOC1 11a_100000685387_100000741522 [0,2,0,0,0,0|2,0,0]=4 8737 B13R1.24 CC#CCNC(=O)C1CCCOC1 1626a_100000685387_100000741522 [0,2,0,0,0,0|2,0,0]=4 8738 B13R1.24 CC#CCNC(=O)C1CCCOC1 527a_100000685387_100000741522 [0,2,0,0,0,0|2,0,0]=4 8739 B13R1.24 CC#CCNC(=O)C1CCOCC1 11a_100000685387_100000195482 [0,2,0,0,0,0|2,0,0]=4 8740 B13R1.24 CC#CCNC(=O)C1CCOCC1 1626a_100000685387_100000195482 [0,2,0,0,0,0|2,0,0]=4 8741 B13R1.24 CC#CCNC(=O)C1CCOCC1 527a_100000685387_100000195482 [0,2,0,0,0,0|2,0,0]=4 8742 B13R1.24 CC#CCNC(=O)C1CCSCC1 11a_100000685387_100000755232 [0,2,0,0,0,0|2,0,0]=4 8743 B13R1.24 CC#CCNC(=O)C1CCSCC1 1626a_100000685387_100000755232 [0,2,0,0,0,0|2,0,0]=4 8744 B13R1.24 CC#CCNC(=O)C1CCSCC1 527a_100000685387_100000755232 [0,2,0,0,0,0|2,0,0]=4 8745 B13R1.24 CC#CCOC(C)C1CCCCC1 34a_100011216961_100000748600 [0,2,0,0,0,0|1,0,1]=4 8746 B13R1.24 CC#CCOC(C)C1CCCCC1 7a_100011216961_100000748600 [0,2,0,0,0,0|1,0,1]=4 8747 B13R1.24 CC(=NNCCO)C1CCCCC1 4a_100000210001_100000210989 [0,2,0,0,0,0|2,0,0]=4 8748 B13R1.24 CC(OCCC#N)C1CCCCC1 7a_100011216961_100000184422 [0,2,0,0,0,0|1,0,1]=4 8749 B13R1.24 CC(OCCCF)C1CCCCC1 34a_100011216961_100011934791 [0,2,0,0,0,0|1,0,1]=4 8750 B13R1.24 CC(OCCCF)C1CCCCC1 7a_100011216961_100011934791 [0,2,0,0,0,0|1,0,1]=4 8751 B13R1.24 CC(OCCCO)C1CCCCC1 34a_100011216961_100000230001 [0,2,0,0,0,0|1,0,1]=4 8752 B13R1.24 CC(OCCCO)C1CCCCC1 7a_100011216961_100011215043 [0,2,0,0,0,0|1,0,1]=4 8753 B13R1.24 CC/C=C/CC(=O)C1CCCCC1 1458a_100016274230_100000210327 [0,2,0,0,0,0|1,0,0]=3 8754 B13R1.24 CC/C=C/CC(=O)C1CCCOC1 1458a_100016274230_100000693364 [0,2,0,0,0,0|2,0,0]=4 8755 B13R1.24 CC/C=C/CC(=O)C1CCOCC1 1458a_100016274230_100011324220 [0,2,0,0,0,0|2,0,0]=4 8756 B13R1.24 CC/C=C\CC(=O)C1CCCCC1 1458a_100000210647_100103147603 [0,2,0,0,0,0|1,0,0]=3 8757 B13R1.24 CC/C=C\CC(=O)C1CCCCO1 1458a_100000748299_100103147603 [0,2,0,0,0,0|2,0,0]=4 8758 B13R1.24 CC/C=C\CC(=O)C1CCCOC1 1458a_100000741522_100103147603 [0,2,0,0,0,0|2,0,0]=4 8759 B13R1.24 CC/C=C\CC(=O)C1CCOCC1 1458a_100000195482_100103147603 [0,2,0,0,0,0|2,0,0]=4 8760 B13R1.24 CC/C=C\CC(=O)C1CCSCC1 1458a_100000755232_100103147603 [0,2,0,0,0,0|2,0,0]=4 8761 B13R1.24 CC=CCOC(C)C1CCCCC1 34a_100011216961_100000070051 [0,2,0,0,0,0|1,0,1]=4 8762 B13R1.24 CC=CCOC(C)C1CCCCC1 7a_100011216961_100000070051 [0,2,0,0,0,0|1,0,1]=4 8763 B13R1.24 CCC#CCC(=O)C1CCCCC1 1458a_100000210647_100009813939 [0,2,0,0,0,0|1,0,0]=3 8764 B13R1.24 CCC#CCC(=O)C1CCCCO1 1458a_100000748299_100009813939 [0,2,0,0,0,0|2,0,0]=4 8765 B13R1.24 CCC#CCC(=O)C1CCCOC1 1458a_100000741522_100009813939 [0,2,0,0,0,0|2,0,0]=4 8766 B13R1.24 CCC#CCC(=O)C1CCOCC1 1458a_100000195482_100009813939 [0,2,0,0,0,0|2,0,0]=4 8767 B13R1.24 CCC#CCC(=O)C1CCSCC1 1458a_100000755232_100009813939 [0,2,0,0,0,0|2,0,0]=4 8768 B13R1.24 CCC=NNC(=O)C1CCCCC1 4a_100000184180_100000210100 [0,2,0,0,0,0|1,0,0]=3 8769 B13R1.24 CCC=NNC(=O)C1CCOCC1 4a_100000193481_100000210100 [0,2,0,0,0,0|2,0,0]=4 8770 B13R1.24 CCCC#CC(=O)C1CCCCC1 1458a_200011218047_100000210327 [0,2,0,0,0,0|1,0,0]=3 8771 B13R1.24 CCCC#CC(=O)C1CCCOC1 1458a_200011218047_100000693364 [0,2,0,0,0,0|2,0,0]=4 8772 B13R1.24 CCCC#CC(=O)C1CCOCC1 1458a_200011218047_100011324220 [0,2,0,0,0,0|2,0,0]=4 8773 B13R1.24 CCCC=CC(=O)C1CCCCC1 1458a_100000212230_100000210327 [0,2,0,0,0,0|1,0,0]=3 8774 B13R1.24 CCCC=CC(=O)C1CCCOC1 1458a_100000212230_100000693364 [0,2,0,0,0,0|2,0,0]=4 8775 B13R1.24 CCCC=CC(=O)C1CCOCC1 1458a_100000212230_100011324220 [0,2,0,0,0,0|2,0,0]=4 8776 B13R1.24 CCCCCC(=O)C1CCCCC1 1458a_100000210647_100000210326 [0,2,0,0,0,0|1,0,0]=3 8777 B13R1.24 CCCCCC(=O)C1CCCCC1 1458a_100000212188_100000210327 [0,2,0,0,0,0|1,0,0]=3 8778 B13R1.24 CCCCCC(=O)C1CCCCO1 1458a_100000748299_100000210326 [0,2,0,0,0,0|2,0,0]=4 8779 B13R1.24 CCCCCC(=O)C1CCCOC1 1458a_100000212188_100000693364 [0,2,0,0,0,0|2,0,0]=4 8780 B13R1.24 CCCCCC(=O)C1CCCOC1 1458a_100000741522_100000210326 [0,2,0,0,0,0|2,0,0]=4 8781 B13R1.24 CCCCCC(=O)C1CCOCC1 1458a_100000195482_100000210326 [0,2,0,0,0,0|2,0,0]=4 8782 B13R1.24 CCCCCC(=O)C1CCOCC1 1458a_100000212188_100011324220 [0,2,0,0,0,0|2,0,0]=4 8783 B13R1.24 CCCCCC(=O)C1CCSCC1 1458a_100000755232_100000210326 [0,2,0,0,0,0|2,0,0]=4 8784 B13R1.24 CCCCNC(=O)C1CCCCC1 11a_100000102301_100000210647 [0,2,0,0,0,0|1,0,0]=3 8785 B13R1.24 CCCCNC(=O)C1CCCCC1 1626a_100000102301_100000210647 [0,2,0,0,0,0|1,0,0]=3 8786 B13R1.24 CCCCNC(=O)C1CCCCC1 240690a_100000102301_100000210647 [0,2,0,0,0,0|1,0,0]=3 8787 B13R1.24 CCCCNC(=O)C1CCCCC1 527a_100000102301_100000210647 [0,2,0,0,0,0|1,0,0]=3 8788 B13R1.24 CCCCNC(=O)C1CCCCO1 11a_100000102301_100000748299 [0,2,0,0,0,0|2,0,0]=4 8789 B13R1.24 CCCCNC(=O)C1CCCCO1 1626a_100000102301_100000748299 [0,2,0,0,0,0|2,0,0]=4 8790 B13R1.24 CCCCNC(=O)C1CCCCO1 240690a_100000102301_100000748299 [0,2,0,0,0,0|2,0,0]=4 8791 B13R1.24 CCCCNC(=O)C1CCCCO1 527a_100000102301_100000748299 [0,2,0,0,0,0|2,0,0]=4 8792 B13R1.24 CCCCNC(=O)C1CCCOC1 11a_100000102301_100000741522 [0,2,0,0,0,0|2,0,0]=4 8793 B13R1.24 CCCCNC(=O)C1CCCOC1 1626a_100000102301_100000741522 [0,2,0,0,0,0|2,0,0]=4 8794 B13R1.24 CCCCNC(=O)C1CCCOC1 240690a_100000102301_100000741522 [0,2,0,0,0,0|2,0,0]=4 8795 B13R1.24 CCCCNC(=O)C1CCCOC1 527a_100000102301_100000741522 [0,2,0,0,0,0|2,0,0]=4 8796 B13R1.24 CCCCNC(=O)C1CCOCC1 11a_100000102301_100000195482 [0,2,0,0,0,0|2,0,0]=4 8797 B13R1.24 CCCCNC(=O)C1CCOCC1 1626a_100000102301_100000195482 [0,2,0,0,0,0|2,0,0]=4 8798 B13R1.24 CCCCNC(=O)C1CCOCC1 240690a_100000102301_100000195482 [0,2,0,0,0,0|2,0,0]=4 8799 B13R1.24 CCCCNC(=O)C1CCOCC1 527a_100000102301_100000195482 [0,2,0,0,0,0|2,0,0]=4 8800 B13R1.24 CCCCNC(=O)C1CCSCC1 11a_100000102301_100000755232 [0,2,0,0,0,0|2,0,0]=4 8801 B13R1.24 CCCCNC(=O)C1CCSCC1 1626a_100000102301_100000755232 [0,2,0,0,0,0|2,0,0]=4 8802 B13R1.24 CCCCNC(=O)C1CCSCC1 240690a_100000102301_100000755232 [0,2,0,0,0,0|2,0,0]=4 8803 B13R1.24 CCCCNC(=O)C1CCSCC1 527a_100000102301_100000755232 [0,2,0,0,0,0|2,0,0]=4 8804 B13R1.24 CCCCOC(C)C1CCCCC1 34a_100011216961_100000210210 [0,2,0,0,0,0|1,0,1]=4 8805 B13R1.24 CCCCOC(C)C1CCCCC1 7a_100011216961_100000210211 [0,2,0,0,0,0|1,0,1]=4 8806 B13R1.24 CCCNCC(=O)N1CCCCC1 2230a_100000751303_100000210303 [0,2,0,0,0,0|2,0,0]=4 8807 B13R1.24 CCCNN=C(C)C1CCCCC1 4a_100000740057_100000210989 [0,2,0,0,0,0|2,0,0]=4 8808 B13R1.24 CCCNNC(=O)C1CCCCC1 22a_100000740057_100000210647 [0,2,0,0,0,0|1,0,0]=3 8809 B13R1.24 CCCNNC(=O)C1CCCCO1 22a_100000740057_100000748299 [0,2,0,0,0,0|2,0,0]=4 8810 B13R1.24 CCCNNC(=O)C1CCCOC1 22a_100000740057_100000741522 [0,2,0,0,0,0|2,0,0]=4 8811 B13R1.24 CCCNNC(=O)C1CCOCC1 22a_100000740057_100000195482 [0,2,0,0,0,0|2,0,0]=4 8812 B13R1.24 CCCNNC(=O)C1CCSCC1 22a_100000740057_100000755232 [0,2,0,0,0,0|2,0,0]=4 8813 B13R1.24 CCCOCC(=O)C1C=CCCC1 1458a_100000745993_100000751183 [0,2,0,0,0,0|0,0,2]=4 8814 B13R1.24 CCCOCC(=O)C1CCCCC1 1458a_100000745993_100000210327 [0,2,0,0,0,0|0,0,0]=2 8815 B13R1.24 CCCOCC(=O)C1CCCCC1 34a_100000210258_100000241979 [0,2,0,0,0,0|0,0,0]=2 8816 B13R1.24 CCCOCC(=O)C1CCCOC1 1458a_100000745993_100000693364 [0,2,0,0,0,0|1,0,0]=3 8817 B13R1.24 CCCOCC(=O)C1CCOCC1 1458a_100000745993_100011324220 [0,2,0,0,0,0|1,0,0]=3 8818 B13R1.24 CCCOCC(=O)C1CCOCC1 34a_100000210258_100000689883 [0,2,0,0,0,0|1,0,0]=3 8819 B13R1.24 CCCOCC(=O)N1CCCCC1 34a_100000210258_100000183409 [0,2,0,0,0,0|1,0,0]=3 8820 B13R1.24 CCCOCC(=O)N1CCCCC1 7a_100011315646_100000210303 [0,2,0,0,0,0|1,0,0]=3 8821 B13R1.24 CCCOCC(=O)N1CCCOC1 11a_100000131196_100000745993 [0,2,0,0,0,0|2,0,0]=4 8822 B13R1.24 CCCOCC(=O)N1CCCOC1 240690a_100000131196_100000745993 [0,2,0,0,0,0|2,0,0]=4 8823 B13R1.24 CCCOCC(=O)N1CCOCC1 11a_100015191051_100000745993 [0,2,0,0,0,0|2,0,0]=4 8824 B13R1.24 CCCOCC(=O)N1CCOCC1 1626a_100015191051_100000745993 [0,2,0,0,0,0|2,0,0]=4 8825 B13R1.24 CCCOCC(=O)N1CCOCC1 240690a_100015191051_100000745993 [0,2,0,0,0,0|2,0,0]=4 8826 B13R1.24 CCCOCC(=O)N1CCOCC1 34a_100000210258_100000183410 [0,2,0,0,0,0|2,0,0]=4 8827 B13R1.24 CCCOCC(=O)N1CCOCC1 527a_100015191051_100000745993 [0,2,0,0,0,0|2,0,0]=4 8828 B13R1.24 CCCOCC(=O)N1CCOCC1 7a_100000752472_100000210303 [0,2,0,0,0,0|2,0,0]=4 8829 B13R1.24 CCCOCC(=O)N1CCSCC1 11a_100000737611_100000745993 [0,2,0,0,0,0|2,0,0]=4 8830 B13R1.24 CCCOCC(=O)N1CCSCC1 240690a_100000737611_100000745993 [0,2,0,0,0,0|2,0,0]=4 8831 B13R1.24 CCCOCC(=O)N1CCSCC1 527a_100000737611_100000745993 [0,2,0,0,0,0|2,0,0]=4 8832 B13R1.24 CCCOC[C@H](N)C1CCCCC1 34a_100009817630_100000210303 [0,2,0,0,0,0|1,0,1]=4 8833 B13R1.24 CCCSCC(=O)C1CCCCC1 1458a_100000217233_100000210327 [0,2,0,0,0,0|0,1,0]=3 8834 B13R1.24 CCCSCC(=O)C1CCCCC1 62a_100000210303_100000241979 [0,2,0,0,0,0|0,1,0]=3 8835 B13R1.24 CCCSCC(=O)C1CCCCC1 62a_100000241979_100000210303 [0,2,0,0,0,0|0,1,0]=3 8836 B13R1.24 CCCSCC(=O)C1CCCOC1 1458a_100000217233_100000693364 [0,2,0,0,0,0|1,1,0]=4 8837 B13R1.24 CCCSCC(=O)C1CCOCC1 1458a_100000217233_100011324220 [0,2,0,0,0,0|1,1,0]=4 8838 B13R1.24 CCCSCC(=O)C1CCOCC1 62a_100000210303_100000689883 [0,2,0,0,0,0|1,1,0]=4 8839 B13R1.24 CCCSCC(=O)C1CCOCC1 62a_100000689883_100000210303 [0,2,0,0,0,0|1,1,0]=4 8840 B13R1.24 CCCSCC(=O)N1CCCCC1 62a_100000183409_100000210303 [0,2,0,0,0,0|1,1,0]=4 8841 B13R1.24 CCCSCC(=O)N1CCCCC1 62a_100000210303_100000183409 [0,2,0,0,0,0|1,1,0]=4 8842 B13R1.24 CCNCCC(=O)N1CCCCC1 2230a_100015525214_100102558178 [0,2,0,0,0,0|2,0,0]=4 8843 B13R1.24 CCNCOC(=O)C1CCCCC1 2230a_100015525214_100009893799 [0,2,0,0,0,0|0,0,0]=2 8844 B13R1.24 CCNCOC(=O)N1CCOCC1 2230a_100015525214_100009898760 [0,2,0,0,0,0|2,0,0]=4 8845 B13R1.24 CCOC=CC(=O)C1C=CCCC1 1458a_100016266692_100000751183 [0,2,0,0,0,0|0,0,2]=4 8846 B13R1.24 CCOC=CC(=O)C1CCCCC1 1458a_100016266692_100000210327 [0,2,0,0,0,0|0,0,0]=2 8847 B13R1.24 CCOC=CC(=O)C1CCCOC1 1458a_100016266692_100000693364 [0,2,0,0,0,0|1,0,0]=3 8848 B13R1.24 CCOC=CC(=O)C1CCOCC1 1458a_100016266692_100011324220 [0,2,0,0,0,0|1,0,0]=3 8849 B13R1.24 CCOC=CC(=O)N1CCCOC1 11a_100000131196_100016266692 [0,2,0,0,0,0|2,0,0]=4 8850 B13R1.24 CCOC=CC(=O)N1CCCOC1 240690a_100000131196_100016266692 [0,2,0,0,0,0|2,0,0]=4 8851 B13R1.24 CCOC=CC(=O)N1CCOCC1 11a_100015191051_100016266692 [0,2,0,0,0,0|2,0,0]=4 8852 B13R1.24 CCOC=CC(=O)N1CCOCC1 1626a_100015191051_100016266692 [0,2,0,0,0,0|2,0,0]=4 8853 B13R1.24 CCOC=CC(=O)N1CCOCC1 240690a_100015191051_100016266692 [0,2,0,0,0,0|2,0,0]=4 8854 B13R1.24 CCOC=CC(=O)N1CCSCC1 11a_100000737611_100016266692 [0,2,0,0,0,0|2,0,0]=4 8855 B13R1.24 CCOC=CC(=O)N1CCSCC1 240690a_100000737611_100016266692 [0,2,0,0,0,0|2,0,0]=4 8856 B13R1.24 CCOCCC(=O)C1=CCCCC1 1458a_100000765259_100011215890 [0,2,0,0,0,0|0,0,2]=4 8857 B13R1.24 CCOCCC(=O)C1C=CCCC1 1458a_100000749530_100000751183 [0,2,0,0,0,0|0,0,2]=4 8858 B13R1.24 CCOCCC(=O)C1CCCCC1 1458a_100000210647_100011215890 [0,2,0,0,0,0|0,0,0]=2 8859 B13R1.24 CCOCCC(=O)C1CCCCC1 1458a_100000749530_100000210327 [0,2,0,0,0,0|0,0,0]=2 8860 B13R1.24 CCOCCC(=O)C1CCCCO1 1458a_100000748299_100011215890 [0,2,0,0,0,0|1,0,0]=3 8861 B13R1.24 CCOCCC(=O)C1CCCOC1 1458a_100000741522_100011215890 [0,2,0,0,0,0|1,0,0]=3 8862 B13R1.24 CCOCCC(=O)C1CCCOC1 1458a_100000749530_100000693364 [0,2,0,0,0,0|1,0,0]=3 8863 B13R1.24 CCOCCC(=O)C1CCOCC1 1458a_100000195482_100011215890 [0,2,0,0,0,0|1,0,0]=3 8864 B13R1.24 CCOCCC(=O)C1CCOCC1 1458a_100000749530_100011324220 [0,2,0,0,0,0|1,0,0]=3 8865 B13R1.24 CCOCCC(=O)C1CCSCC1 1458a_100000755232_100011215890 [0,2,0,0,0,0|1,0,0]=3 8866 B13R1.24 CCOCCC(=O)C1COCCO1 1458a_100000045528_100011215890 [0,2,0,0,0,0|2,0,0]=4 8867 B13R1.24 CCOCCC(=O)C1SCCCS1 1458a_100000028545_100011215890 [0,2,0,0,0,0|2,0,0]=4 8868 B13R1.24 CCOCCC(=O)N1CCCCC1 34a_100121572206_100102558178 [0,2,0,0,0,0|1,0,0]=3 8869 B13R1.24 CCOCCC(=O)N1CCCOC1 11a_100000131196_100000749530 [0,2,0,0,0,0|2,0,0]=4 8870 B13R1.24 CCOCCC(=O)N1CCCOC1 240690a_100000131196_100000749530 [0,2,0,0,0,0|2,0,0]=4 8871 B13R1.24 CCOCCC(=O)N1CCOCC1 11a_100015191051_100000749530 [0,2,0,0,0,0|2,0,0]=4 8872 B13R1.24 CCOCCC(=O)N1CCOCC1 1626a_100015191051_100000749530 [0,2,0,0,0,0|2,0,0]=4 8873 B13R1.24 CCOCCC(=O)N1CCOCC1 240690a_100015191051_100000749530 [0,2,0,0,0,0|2,0,0]=4 8874 B13R1.24 CCOCCC(=O)N1CCOCC1 527a_100015191051_100000749530 [0,2,0,0,0,0|2,0,0]=4 8875 B13R1.24 CCOCCC(=O)N1CCSCC1 11a_100000737611_100000749530 [0,2,0,0,0,0|2,0,0]=4 8876 B13R1.24 CCOCCC(=O)N1CCSCC1 240690a_100000737611_100000749530 [0,2,0,0,0,0|2,0,0]=4 8877 B13R1.24 CCOCCC(=O)N1CCSCC1 527a_100000737611_100000749530 [0,2,0,0,0,0|2,0,0]=4 8878 B13R1.24 CCOCCC(=O)[C@H]1CC=CCC1 1458a_100009820709_100011215890 [0,2,0,0,0,0|0,0,2]=4 8879 B13R1.24 CCOCCC(N)C1CCCCC1 34a_200020622111_100000210202 [0,2,0,0,0,0|1,0,1]=4 8880 B13R1.24 CCOCCN(C)C1CCCCC1 2230a_100000207522_100011215890 [0,2,0,0,0,0|2,0,0]=4 8881 B13R1.24 CCOCCN(C)C1CCCCC1 269982a_100000207522_100011215890 [0,2,0,0,0,0|2,0,0]=4 8882 B13R1.24 CCOCCN(C)C1CCCCC1 34a_100000207522_100000210147 [0,2,0,0,0,0|2,0,0]=4 8883 B13R1.24 CCOCOC(=O)C1CCCCC1 34a_100121572206_100009893799 [0,2,0,0,0,0|0,0,0]=2 8884 B13R1.24 CCSCCC(=O)C1CCCCC1 1458a_100000210647_100000757381 [0,2,0,0,0,0|0,1,0]=3 8885 B13R1.24 CCSCCC(=O)C1CCCCC1 1458a_100000230768_100000210327 [0,2,0,0,0,0|0,1,0]=3 8886 B13R1.24 CCSCCC(=O)C1CCCCO1 1458a_100000748299_100000757381 [0,2,0,0,0,0|1,1,0]=4 8887 B13R1.24 CCSCCC(=O)C1CCCOC1 1458a_100000230768_100000693364 [0,2,0,0,0,0|1,1,0]=4 8888 B13R1.24 CCSCCC(=O)C1CCCOC1 1458a_100000741522_100000757381 [0,2,0,0,0,0|1,1,0]=4 8889 B13R1.24 CCSCCC(=O)C1CCOCC1 1458a_100000195482_100000757381 [0,2,0,0,0,0|1,1,0]=4 8890 B13R1.24 CCSCCC(=O)C1CCOCC1 1458a_100000230768_100011324220 [0,2,0,0,0,0|1,1,0]=4 8891 B13R1.24 CCSCCC(=O)C1CCSCC1 1458a_100000755232_100000757381 [0,2,0,0,0,0|1,1,0]=4 8892 B13R1.24 CCSCCC(=O)N1CCCCC1 62a_100000210202_100102558178 [0,2,0,0,0,0|1,1,0]=4 8893 B13R1.24 CCSCCC(=O)N1CCCCC1 62a_100102558178_100000210202 [0,2,0,0,0,0|1,1,0]=4 8894 B13R1.24 CCSCOC(=O)C1CCCCC1 62a_100000210202_100009893799 [0,2,0,0,0,0|0,0,0]=2 8895 B13R1.24 CCSCOC(=O)C1CCCCC1 62a_100009893799_100000210202 [0,2,0,0,0,0|0,0,0]=2 8896 B13R1.24 CCSCOC(=O)N1CCOCC1 62a_100000210202_100009898760 [0,2,0,0,0,0|2,0,0]=4 8897 B13R1.24 CCSCOC(=O)N1CCOCC1 62a_100009898760_100000210202 [0,2,0,0,0,0|2,0,0]=4 8898 B13R1.24 COCC=CC(=O)C1CCCCC1 1458a_100016285016_100000210327 [0,2,0,0,0,0|1,0,0]=3 8899 B13R1.24 COCC=CC(=O)C1CCCOC1 1458a_100016285016_100000693364 [0,2,0,0,0,0|2,0,0]=4 8900 B13R1.24 COCC=CC(=O)C1CCOCC1 1458a_100016285016_100011324220 [0,2,0,0,0,0|2,0,0]=4 8901 B13R1.24 COCCCC(=O)C1CCCCC1 1458a_100000210647_100000740836 [0,2,0,0,0,0|1,0,0]=3 8902 B13R1.24 COCCCC(=O)C1CCCCC1 1458a_100000741012_100000210327 [0,2,0,0,0,0|1,0,0]=3 8903 B13R1.24 COCCCC(=O)C1CCCCO1 1458a_100000748299_100000740836 [0,2,0,0,0,0|2,0,0]=4 8904 B13R1.24 COCCCC(=O)C1CCCOC1 1458a_100000741012_100000693364 [0,2,0,0,0,0|2,0,0]=4 8905 B13R1.24 COCCCC(=O)C1CCCOC1 1458a_100000741522_100000740836 [0,2,0,0,0,0|2,0,0]=4 8906 B13R1.24 COCCCC(=O)C1CCOCC1 1458a_100000195482_100000740836 [0,2,0,0,0,0|2,0,0]=4 8907 B13R1.24 COCCCC(=O)C1CCOCC1 1458a_100000741012_100011324220 [0,2,0,0,0,0|2,0,0]=4 8908 B13R1.24 COCCCC(=O)C1CCSCC1 1458a_100000755232_100000740836 [0,2,0,0,0,0|2,0,0]=4 8909 B13R1.24 COCCNC(=O)C1CCCCC1 1626a_100000209980_100000210647 [0,2,0,0,0,0|1,0,0]=3 8910 B13R1.24 COCCNC(=O)C1CCCCC1 240690a_100000209980_100000210647 [0,2,0,0,0,0|1,0,0]=3 8911 B13R1.24 COCCNC(=O)C1CCCCC1 527a_100000209980_100000210647 [0,2,0,0,0,0|1,0,0]=3 8912 B13R1.24 COCCNC(=O)C1CCCCO1 1626a_100000209980_100000748299 [0,2,0,0,0,0|2,0,0]=4 8913 B13R1.24 COCCNC(=O)C1CCCCO1 240690a_100000209980_100000748299 [0,2,0,0,0,0|2,0,0]=4 8914 B13R1.24 COCCNC(=O)C1CCCCO1 527a_100000209980_100000748299 [0,2,0,0,0,0|2,0,0]=4 8915 B13R1.24 COCCNC(=O)C1CCCNC1 34a_200011275841_200000210301 [0,2,0,0,0,0|2,0,0]=4 8916 B13R1.24 COCCNC(=O)C1CCCOC1 1626a_100000209980_100000741522 [0,2,0,0,0,0|2,0,0]=4 8917 B13R1.24 COCCNC(=O)C1CCCOC1 240690a_100000209980_100000741522 [0,2,0,0,0,0|2,0,0]=4 8918 B13R1.24 COCCNC(=O)C1CCCOC1 527a_100000209980_100000741522 [0,2,0,0,0,0|2,0,0]=4 8919 B13R1.24 COCCNC(=O)C1CCNCC1 34a_100025771131_200000210301 [0,2,0,0,0,0|2,0,0]=4 8920 B13R1.24 COCCNC(=O)C1CCOCC1 1626a_100000209980_100000195482 [0,2,0,0,0,0|2,0,0]=4 8921 B13R1.24 COCCNC(=O)C1CCOCC1 240690a_100000209980_100000195482 [0,2,0,0,0,0|2,0,0]=4 8922 B13R1.24 COCCNC(=O)C1CCOCC1 527a_100000209980_100000195482 [0,2,0,0,0,0|2,0,0]=4 8923 B13R1.24 COCCNC(=O)C1CCSCC1 1626a_100000209980_100000755232 [0,2,0,0,0,0|2,0,0]=4 8924 B13R1.24 COCCNC(=O)C1CCSCC1 240690a_100000209980_100000755232 [0,2,0,0,0,0|2,0,0]=4 8925 B13R1.24 COCCNC(=O)C1CCSCC1 527a_100000209980_100000755232 [0,2,0,0,0,0|2,0,0]=4 8926 B13R1.24 COCCOC(C)C1CCCCC1 34a_100011216961_100011201679 [0,2,0,0,0,0|1,0,1]=4 8927 B13R1.24 COCCOC(C)C1CCCCC1 7a_100011216961_100000233755 [0,2,0,0,0,0|1,0,1]=4 8928 B13R1.24 COCNCC(=O)N1CCCCC1 2230a_100000751303_100000766300 [0,2,0,0,0,0|2,0,0]=4 8929 B13R1.24 COCSCC(=O)C1CCCCC1 62a_100000241979_100000766300 [0,2,0,0,0,0|0,1,0]=3 8930 B13R1.24 COCSCC(=O)C1CCCCC1 62a_100000766300_100000241979 [0,2,0,0,0,0|0,1,0]=3 8931 B13R1.24 COCSCC(=O)C1CCOCC1 62a_100000689883_100000766300 [0,2,0,0,0,0|1,1,0]=4 8932 B13R1.24 COCSCC(=O)C1CCOCC1 62a_100000766300_100000689883 [0,2,0,0,0,0|1,1,0]=4 8933 B13R1.24 COCSCC(=O)N1CCCCC1 62a_100000183409_100000766300 [0,2,0,0,0,0|1,1,0]=4 8934 B13R1.24 COCSCC(=O)N1CCCCC1 62a_100000766300_100000183409 [0,2,0,0,0,0|1,1,0]=4 8935 B13R1.24 CSCCCC(=O)C1CCCCC1 1458a_100000173376_100000210327 [0,2,0,0,0,0|1,0,0]=3 8936 B13R1.24 CSCCCC(=O)C1CCCOC1 1458a_100000173376_100000693364 [0,2,0,0,0,0|2,0,0]=4 8937 B13R1.24 CSCCCC(=O)C1CCOCC1 1458a_100000173376_100011324220 [0,2,0,0,0,0|2,0,0]=4 8938 B13R1.24 CSCCNC(=O)C1CCCCC1 11a_100020590264_100000210647 [0,2,0,0,0,0|1,0,0]=3 8939 B13R1.24 CSCCNC(=O)C1CCCCC1 1626a_100020590264_100000210647 [0,2,0,0,0,0|1,0,0]=3 8940 B13R1.24 CSCCNC(=O)C1CCCCC1 240690a_100020590264_100000210647 [0,2,0,0,0,0|1,0,0]=3 8941 B13R1.24 CSCCNC(=O)C1CCCCC1 527a_100020590264_100000210647 [0,2,0,0,0,0|1,0,0]=3 8942 B13R1.24 CSCCNC(=O)C1CCCCO1 11a_100020590264_100000748299 [0,2,0,0,0,0|2,0,0]=4 8943 B13R1.24 CSCCNC(=O)C1CCCCO1 1626a_100020590264_100000748299 [0,2,0,0,0,0|2,0,0]=4 8944 B13R1.24 CSCCNC(=O)C1CCCCO1 240690a_100020590264_100000748299 [0,2,0,0,0,0|2,0,0]=4 8945 B13R1.24 CSCCNC(=O)C1CCCCO1 527a_100020590264_100000748299 [0,2,0,0,0,0|2,0,0]=4 8946 B13R1.24 CSCCNC(=O)C1CCCOC1 11a_100020590264_100000741522 [0,2,0,0,0,0|2,0,0]=4 8947 B13R1.24 CSCCNC(=O)C1CCCOC1 1626a_100020590264_100000741522 [0,2,0,0,0,0|2,0,0]=4 8948 B13R1.24 CSCCNC(=O)C1CCCOC1 240690a_100020590264_100000741522 [0,2,0,0,0,0|2,0,0]=4 8949 B13R1.24 CSCCNC(=O)C1CCCOC1 527a_100020590264_100000741522 [0,2,0,0,0,0|2,0,0]=4 8950 B13R1.24 CSCCNC(=O)C1CCOCC1 11a_100020590264_100000195482 [0,2,0,0,0,0|2,0,0]=4 8951 B13R1.24 CSCCNC(=O)C1CCOCC1 1626a_100020590264_100000195482 [0,2,0,0,0,0|2,0,0]=4 8952 B13R1.24 CSCCNC(=O)C1CCOCC1 240690a_100020590264_100000195482 [0,2,0,0,0,0|2,0,0]=4 8953 B13R1.24 CSCCNC(=O)C1CCOCC1 527a_100020590264_100000195482 [0,2,0,0,0,0|2,0,0]=4 8954 B13R1.24 CSCCNC(=O)C1CCSCC1 11a_100020590264_100000755232 [0,2,0,0,0,0|2,0,0]=4 8955 B13R1.24 CSCCNC(=O)C1CCSCC1 1626a_100020590264_100000755232 [0,2,0,0,0,0|2,0,0]=4 8956 B13R1.24 CSCCNC(=O)C1CCSCC1 240690a_100020590264_100000755232 [0,2,0,0,0,0|2,0,0]=4 8957 B13R1.24 CSCCNC(=O)C1CCSCC1 527a_100020590264_100000755232 [0,2,0,0,0,0|2,0,0]=4 8958 B13R1.24 CSCCOC(C)C1CCCCC1 34a_100011216961_100000212216 [0,2,0,0,0,0|1,0,1]=4 8959 B13R1.24 CSCCOC(C)C1CCCCC1 7a_100011216961_100000212216 [0,2,0,0,0,0|1,0,1]=4 8960 B13R1.24 CSCNCC(=O)N1CCCCC1 2230a_100000751303_100011218213 [0,2,0,0,0,0|2,0,0]=4 8961 B13R1.24 CSCOC[C@H](N)C1CCCCC1 34a_100009817630_100011218213 [0,2,0,0,0,0|1,0,1]=4 8962 B13R1.24 CSCSCC(=O)C1CCCCC1 62a_100000241979_100011218213 [0,2,0,0,0,0|0,1,0]=3 8963 B13R1.24 CSCSCC(=O)C1CCCCC1 62a_100011218213_100000241979 [0,2,0,0,0,0|0,1,0]=3 8964 B13R1.24 CSCSCC(=O)C1CCOCC1 62a_100000689883_100011218213 [0,2,0,0,0,0|1,1,0]=4 8965 B13R1.24 CSCSCC(=O)C1CCOCC1 62a_100011218213_100000689883 [0,2,0,0,0,0|1,1,0]=4 8966 B13R1.24 CSCSCC(=O)N1CCCCC1 62a_100000183409_100011218213 [0,2,0,0,0,0|1,1,0]=4 8967 B13R1.24 CSCSCC(=O)N1CCCCC1 62a_100011218213_100000183409 [0,2,0,0,0,0|1,1,0]=4 8968 B13R1.24 N#CCCCC(=O)C1CCCCC1 1458a_100000075515_100000210327 [0,2,0,0,0,0|1,0,0]=3 8969 B13R1.24 N#CCCCC(=O)C1CCCCC1 1458a_100000210647_100000211468 [0,2,0,0,0,0|1,0,0]=3 8970 B13R1.24 N#CCCCC(=O)C1CCCCO1 1458a_100000748299_100000211468 [0,2,0,0,0,0|2,0,0]=4 8971 B13R1.24 N#CCCCC(=O)C1CCCOC1 1458a_100000075515_100000693364 [0,2,0,0,0,0|2,0,0]=4 8972 B13R1.24 N#CCCCC(=O)C1CCCOC1 1458a_100000741522_100000211468 [0,2,0,0,0,0|2,0,0]=4 8973 B13R1.24 N#CCCCC(=O)C1CCOCC1 1458a_100000075515_100011324220 [0,2,0,0,0,0|2,0,0]=4 8974 B13R1.24 N#CCCCC(=O)C1CCOCC1 1458a_100000195482_100000211468 [0,2,0,0,0,0|2,0,0]=4 8975 B13R1.24 N#CCCCC(=O)C1CCSCC1 1458a_100000755232_100000211468 [0,2,0,0,0,0|2,0,0]=4 8976 B13R1.24 N#CCCNC(=O)C1CCCCC1 11a_100000720768_100000210647 [0,2,0,0,0,0|1,0,0]=3 8977 B13R1.24 N#CCCNC(=O)C1CCCCC1 1626a_100000720768_100000210647 [0,2,0,0,0,0|1,0,0]=3 8978 B13R1.24 N#CCCNC(=O)C1CCCCC1 240690a_100000720768_100000210647 [0,2,0,0,0,0|1,0,0]=3 8979 B13R1.24 N#CCCNC(=O)C1CCCCC1 527a_100000720768_100000210647 [0,2,0,0,0,0|1,0,0]=3 8980 B13R1.24 N#CCCNC(=O)C1CCCCO1 11a_100000720768_100000748299 [0,2,0,0,0,0|2,0,0]=4 8981 B13R1.24 N#CCCNC(=O)C1CCCCO1 1626a_100000720768_100000748299 [0,2,0,0,0,0|2,0,0]=4 8982 B13R1.24 N#CCCNC(=O)C1CCCCO1 240690a_100000720768_100000748299 [0,2,0,0,0,0|2,0,0]=4 8983 B13R1.24 N#CCCNC(=O)C1CCCCO1 527a_100000720768_100000748299 [0,2,0,0,0,0|2,0,0]=4 8984 B13R1.24 N#CCCNC(=O)C1CCCOC1 11a_100000720768_100000741522 [0,2,0,0,0,0|2,0,0]=4 8985 B13R1.24 N#CCCNC(=O)C1CCCOC1 1626a_100000720768_100000741522 [0,2,0,0,0,0|2,0,0]=4 8986 B13R1.24 N#CCCNC(=O)C1CCCOC1 240690a_100000720768_100000741522 [0,2,0,0,0,0|2,0,0]=4 8987 B13R1.24 N#CCCNC(=O)C1CCCOC1 527a_100000720768_100000741522 [0,2,0,0,0,0|2,0,0]=4 8988 B13R1.24 N#CCCNC(=O)C1CCOCC1 11a_100000720768_100000195482 [0,2,0,0,0,0|2,0,0]=4 8989 B13R1.24 N#CCCNC(=O)C1CCOCC1 1626a_100000720768_100000195482 [0,2,0,0,0,0|2,0,0]=4 8990 B13R1.24 N#CCCNC(=O)C1CCOCC1 240690a_100000720768_100000195482 [0,2,0,0,0,0|2,0,0]=4 8991 B13R1.24 N#CCCNC(=O)C1CCOCC1 527a_100000720768_100000195482 [0,2,0,0,0,0|2,0,0]=4 8992 B13R1.24 N#CCCNC(=O)C1CCSCC1 11a_100000720768_100000755232 [0,2,0,0,0,0|2,0,0]=4 8993 B13R1.24 N#CCCNC(=O)C1CCSCC1 1626a_100000720768_100000755232 [0,2,0,0,0,0|2,0,0]=4 8994 B13R1.24 N#CCCNC(=O)C1CCSCC1 240690a_100000720768_100000755232 [0,2,0,0,0,0|2,0,0]=4 8995 B13R1.24 N#CCCNC(=O)C1CCSCC1 527a_100000720768_100000755232 [0,2,0,0,0,0|2,0,0]=4 8996 B13R1.24 N#CCOCC(=O)N1CCCCC1 7a_100011315646_100011215382 [0,2,0,0,0,0|1,0,1]=4 8997 B13R1.24 N#CCSCC(=O)C1CCCCC1 1458a_100000150266_100000210327 [0,2,0,0,0,0|0,1,1]=4 8998 B13R1.24 N#CCSCC(=O)C1CCCCC1 62a_100000241979_100011215382 [0,2,0,0,0,0|0,1,1]=4 8999 B13R1.24 N#CCSCC(=O)C1CCCCC1 62a_100011215382_100000241979 [0,2,0,0,0,0|0,1,1]=4 9000 B13R1.24 NCCOCC(=O)C1CCCCC1 34a_100000210304_100000241979 [0,2,0,0,0,0|0,0,0]=2 9001 B13R1.24 NCCOCC(=O)C1CCOCC1 34a_100000210304_100000689883 [0,2,0,0,0,0|1,0,0]=3 9002 B13R1.24 NCCOCC(=O)N1CCCCC1 34a_100000210304_100000183409 [0,2,0,0,0,0|1,0,0]=3 9003 B13R1.24 NCCOCC(=O)N1CCOCC1 34a_100000210304_100000183410 [0,2,0,0,0,0|2,0,0]=4 9004 B13R1.24 N[C@@H](COCCF)C1CCCCC1 34a_100009817630_100011217306 [0,2,0,0,0,0|1,0,1]=4 9005 B13R1.24 N[C@@H](COCCO)C1CCCCC1 34a_100009817630_100000211926 [0,2,0,0,0,0|1,0,1]=4 9006 B13R1.24 O=C(CC#CCO)C1CCCCC1 1458a_100000210647_200000047223 [0,2,0,0,0,0|1,0,1]=4 9007 B13R1.24 O=C(CCCCF)C1CCCCC1 1458a_100000210647_100000729493 [0,2,0,0,0,0|1,0,0]=3 9008 B13R1.24 O=C(CCCCF)C1CCCCO1 1458a_100000748299_100000729493 [0,2,0,0,0,0|2,0,0]=4 9009 B13R1.24 O=C(CCCCF)C1CCCOC1 1458a_100000741522_100000729493 [0,2,0,0,0,0|2,0,0]=4 9010 B13R1.24 O=C(CCCCF)C1CCOCC1 1458a_100000195482_100000729493 [0,2,0,0,0,0|2,0,0]=4 9011 B13R1.24 O=C(CCCCF)C1CCSCC1 1458a_100000755232_100000729493 [0,2,0,0,0,0|2,0,0]=4 9012 B13R1.24 O=C(CCCCO)C1CCCCC1 1458a_100000210647_100000210776 [0,2,0,0,0,0|1,0,0]=3 9013 B13R1.24 O=C(CCCCO)C1CCCCC1 1458a_100000695505_100000210327 [0,2,0,0,0,0|1,0,0]=3 9014 B13R1.24 O=C(CCCCO)C1CCCCO1 1458a_100000748299_100000210776 [0,2,0,0,0,0|2,0,0]=4 9015 B13R1.24 O=C(CCCCO)C1CCCOC1 1458a_100000695505_100000693364 [0,2,0,0,0,0|2,0,0]=4 9016 B13R1.24 O=C(CCCCO)C1CCCOC1 1458a_100000741522_100000210776 [0,2,0,0,0,0|2,0,0]=4 9017 B13R1.24 O=C(CCCCO)C1CCOCC1 1458a_100000195482_100000210776 [0,2,0,0,0,0|2,0,0]=4 9018 B13R1.24 O=C(CCCCO)C1CCOCC1 1458a_100000695505_100011324220 [0,2,0,0,0,0|2,0,0]=4 9019 B13R1.24 O=C(CCCCO)C1CCSCC1 1458a_100000755232_100000210776 [0,2,0,0,0,0|2,0,0]=4 9020 B13R1.24 O=C(CCSCF)N1CCCCC1 62a_100015361967_100102558178 [0,2,0,0,0,0|2,0,0]=4 9021 B13R1.24 O=C(CCSCF)N1CCCCC1 62a_100102558178_100015361967 [0,2,0,0,0,0|2,0,0]=4 9022 B13R1.24 O=C(CNCCF)C1CCCCC1 34a_100000724931_100000241979 [0,2,0,0,0,0|1,0,0]=3 9023 B13R1.24 O=C(CNCCF)C1CCOCC1 34a_100000724931_100000689883 [0,2,0,0,0,0|2,0,0]=4 9024 B13R1.24 O=C(CNCCF)N1CCCCC1 2230a_100000751303_100011217306 [0,2,0,0,0,0|2,0,0]=4 9025 B13R1.24 O=C(CNCCF)N1CCCCC1 34a_100000724931_100000183409 [0,2,0,0,0,0|2,0,0]=4 9026 B13R1.24 O=C(CNCCO)C1CCCCC1 2230a_100016997473_100000241979 [0,2,0,0,0,0|1,0,0]=3 9027 B13R1.24 O=C(CNCCO)C1CCCCC1 34a_100016990907_100000241979 [0,2,0,0,0,0|1,0,0]=3 9028 B13R1.24 O=C(CNCCO)C1CCOCC1 2230a_100016997473_100000689883 [0,2,0,0,0,0|2,0,0]=4 9029 B13R1.24 O=C(CNCCO)C1CCOCC1 34a_100016990907_100000689883 [0,2,0,0,0,0|2,0,0]=4 9030 B13R1.24 O=C(CNCCO)N1CCCCC1 2230a_100000751303_100000211926 [0,2,0,0,0,0|2,0,0]=4 9031 B13R1.24 O=C(CNCCO)N1CCCCC1 2230a_100016997473_100000183409 [0,2,0,0,0,0|2,0,0]=4 9032 B13R1.24 O=C(CNCCO)N1CCCCC1 34a_100016990907_100000183409 [0,2,0,0,0,0|2,0,0]=4 9033 B13R1.24 O=C(COCCBr)C1CCCCC1 34a_100000211926_100000241979 [0,2,0,0,0,0|0,0,0]=2 9034 B13R1.24 O=C(COCCBr)C1CCOCC1 34a_100000211926_100000689883 [0,2,0,0,0,0|1,0,0]=3 9035 B13R1.24 O=C(COCCBr)N1CCCCC1 34a_100000211926_100000183409 [0,2,0,0,0,0|1,0,0]=3 9036 B13R1.24 O=C(COCCBr)N1CCOCC1 34a_100000211926_100000183410 [0,2,0,0,0,0|2,0,0]=4 9037 B13R1.24 O=C(COCCF)N1CCCCC1 7a_100011315646_100011217306 [0,2,0,0,0,0|1,0,0]=3 9038 B13R1.24 O=C(COCCF)N1CCOCC1 7a_100000752472_100011217306 [0,2,0,0,0,0|2,0,0]=4 9039 B13R1.24 O=C(COCCO)C1C=CCCC1 1458a_100000708028_100000751183 [0,2,0,0,0,0|0,0,2]=4 9040 B13R1.24 O=C(COCCO)C1CCCCC1 1458a_100000708028_100000210327 [0,2,0,0,0,0|0,0,0]=2 9041 B13R1.24 O=C(COCCO)C1CCCOC1 1458a_100000708028_100000693364 [0,2,0,0,0,0|1,0,0]=3 9042 B13R1.24 O=C(COCCO)C1CCOCC1 1458a_100000708028_100011324220 [0,2,0,0,0,0|1,0,0]=3 9043 B13R1.24 O=C(COCCO)N1CCCCC1 7a_100011315646_100000211926 [0,2,0,0,0,0|1,0,0]=3 9044 B13R1.24 O=C(COCCO)N1CCCOC1 240690a_100000131196_100000708028 [0,2,0,0,0,0|2,0,0]=4 9045 B13R1.24 O=C(COCCO)N1CCOCC1 1626a_100015191051_100000708028 [0,2,0,0,0,0|2,0,0]=4 9046 B13R1.24 O=C(COCCO)N1CCOCC1 240690a_100015191051_100000708028 [0,2,0,0,0,0|2,0,0]=4 9047 B13R1.24 O=C(COCCO)N1CCOCC1 7a_100000752472_100000211926 [0,2,0,0,0,0|2,0,0]=4 9048 B13R1.24 O=C(COCCO)N1CCSCC1 240690a_100000737611_100000708028 [0,2,0,0,0,0|2,0,0]=4 9049 B13R1.24 O=C(CSCCF)C1CCCCC1 62a_100000241979_100011217306 [0,2,0,0,0,0|0,1,0]=3 9050 B13R1.24 O=C(CSCCF)C1CCCCC1 62a_100011217306_100000241979 [0,2,0,0,0,0|0,1,0]=3 9051 B13R1.24 O=C(CSCCF)C1CCOCC1 62a_100000689883_100011217306 [0,2,0,0,0,0|1,1,0]=4 9052 B13R1.24 O=C(CSCCF)C1CCOCC1 62a_100011217306_100000689883 [0,2,0,0,0,0|1,1,0]=4 9053 B13R1.24 O=C(CSCCF)N1CCCCC1 62a_100000183409_100011217306 [0,2,0,0,0,0|1,1,0]=4 9054 B13R1.24 O=C(CSCCF)N1CCCCC1 62a_100011217306_100000183409 [0,2,0,0,0,0|1,1,0]=4 9055 B13R1.24 O=C(CSCCO)C1CCCCC1 62a_100000211926_100000241979 [0,2,0,0,0,0|0,1,0]=3 9056 B13R1.24 O=C(CSCCO)C1CCCCC1 62a_100000241979_100000211926 [0,2,0,0,0,0|0,1,0]=3 9057 B13R1.24 O=C(CSCCO)C1CCOCC1 62a_100000211926_100000689883 [0,2,0,0,0,0|1,1,0]=4 9058 B13R1.24 O=C(CSCCO)C1CCOCC1 62a_100000689883_100000211926 [0,2,0,0,0,0|1,1,0]=4 9059 B13R1.24 O=C(CSCCO)N1CCCCC1 62a_100000183409_100000211926 [0,2,0,0,0,0|1,1,0]=4 9060 B13R1.24 O=C(CSCCO)N1CCCCC1 62a_100000211926_100000183409 [0,2,0,0,0,0|1,1,0]=4 9061 B13R1.24 O=C(NCCCF)C1CCCCC1 11a_100015189416_100000210647 [0,2,0,0,0,0|1,0,0]=3 9062 B13R1.24 O=C(NCCCF)C1CCCCC1 1626a_100015189416_100000210647 [0,2,0,0,0,0|1,0,0]=3 9063 B13R1.24 O=C(NCCCF)C1CCCCC1 240690a_100015189416_100000210647 [0,2,0,0,0,0|1,0,0]=3 9064 B13R1.24 O=C(NCCCF)C1CCCCC1 527a_100015189416_100000210647 [0,2,0,0,0,0|1,0,0]=3 9065 B13R1.24 O=C(NCCCF)C1CCCCO1 11a_100015189416_100000748299 [0,2,0,0,0,0|2,0,0]=4 9066 B13R1.24 O=C(NCCCF)C1CCCCO1 1626a_100015189416_100000748299 [0,2,0,0,0,0|2,0,0]=4 9067 B13R1.24 O=C(NCCCF)C1CCCCO1 240690a_100015189416_100000748299 [0,2,0,0,0,0|2,0,0]=4 9068 B13R1.24 O=C(NCCCF)C1CCCCO1 527a_100015189416_100000748299 [0,2,0,0,0,0|2,0,0]=4 9069 B13R1.24 O=C(NCCCF)C1CCCOC1 11a_100015189416_100000741522 [0,2,0,0,0,0|2,0,0]=4 9070 B13R1.24 O=C(NCCCF)C1CCCOC1 1626a_100015189416_100000741522 [0,2,0,0,0,0|2,0,0]=4 9071 B13R1.24 O=C(NCCCF)C1CCCOC1 240690a_100015189416_100000741522 [0,2,0,0,0,0|2,0,0]=4 9072 B13R1.24 O=C(NCCCF)C1CCCOC1 527a_100015189416_100000741522 [0,2,0,0,0,0|2,0,0]=4 9073 B13R1.24 O=C(NCCCF)C1CCOCC1 11a_100015189416_100000195482 [0,2,0,0,0,0|2,0,0]=4 9074 B13R1.24 O=C(NCCCF)C1CCOCC1 1626a_100015189416_100000195482 [0,2,0,0,0,0|2,0,0]=4 9075 B13R1.24 O=C(NCCCF)C1CCOCC1 240690a_100015189416_100000195482 [0,2,0,0,0,0|2,0,0]=4 9076 B13R1.24 O=C(NCCCF)C1CCOCC1 527a_100015189416_100000195482 [0,2,0,0,0,0|2,0,0]=4 9077 B13R1.24 O=C(NCCCF)C1CCSCC1 11a_100015189416_100000755232 [0,2,0,0,0,0|2,0,0]=4 9078 B13R1.24 O=C(NCCCF)C1CCSCC1 1626a_100015189416_100000755232 [0,2,0,0,0,0|2,0,0]=4 9079 B13R1.24 O=C(NCCCF)C1CCSCC1 240690a_100015189416_100000755232 [0,2,0,0,0,0|2,0,0]=4 9080 B13R1.24 O=C(NCCCF)C1CCSCC1 527a_100015189416_100000755232 [0,2,0,0,0,0|2,0,0]=4 9081 B13R1.24 O=C(NCCCO)C1CCCCC1 240690a_100000182051_100000210647 [0,2,0,0,0,0|1,0,0]=3 9082 B13R1.24 O=C(NCCCO)C1CCCCC1 527a_100000182051_100000210647 [0,2,0,0,0,0|1,0,0]=3 9083 B13R1.24 O=C(NCCCO)C1CCCCO1 240690a_100000182051_100000748299 [0,2,0,0,0,0|2,0,0]=4 9084 B13R1.24 O=C(NCCCO)C1CCCCO1 527a_100000182051_100000748299 [0,2,0,0,0,0|2,0,0]=4 9085 B13R1.24 O=C(NCCCO)C1CCCOC1 240690a_100000182051_100000741522 [0,2,0,0,0,0|2,0,0]=4 9086 B13R1.24 O=C(NCCCO)C1CCCOC1 527a_100000182051_100000741522 [0,2,0,0,0,0|2,0,0]=4 9087 B13R1.24 O=C(NCCCO)C1CCOCC1 240690a_100000182051_100000195482 [0,2,0,0,0,0|2,0,0]=4 9088 B13R1.24 O=C(NCCCO)C1CCOCC1 527a_100000182051_100000195482 [0,2,0,0,0,0|2,0,0]=4 9089 B13R1.24 O=C(NCCCO)C1CCSCC1 240690a_100000182051_100000755232 [0,2,0,0,0,0|2,0,0]=4 9090 B13R1.24 O=C(NCCCO)C1CCSCC1 527a_100000182051_100000755232 [0,2,0,0,0,0|2,0,0]=4 9091 B13R1.24 O=C(NNCCO)C1CCCCC1 22a_100000210001_100000210647 [0,2,0,0,0,0|1,0,0]=3 9092 B13R1.24 O=C(NNCCO)C1CCCCO1 22a_100000210001_100000748299 [0,2,0,0,0,0|2,0,0]=4 9093 B13R1.24 O=C(NNCCO)C1CCCOC1 22a_100000210001_100000741522 [0,2,0,0,0,0|2,0,0]=4 9094 B13R1.24 O=C(NNCCO)C1CCOCC1 22a_100000210001_100000195482 [0,2,0,0,0,0|2,0,0]=4 9095 B13R1.24 O=C(NNCCO)C1CCSCC1 22a_100000210001_100000755232 [0,2,0,0,0,0|2,0,0]=4 9096 B13R1.24 O=C(OCSCF)C1CCCCC1 62a_100009893799_100015361967 [0,2,0,0,0,0|0,0,0]=2 9097 B13R1.24 O=C(OCSCF)C1CCCCC1 62a_100015361967_100009893799 [0,2,0,0,0,0|0,0,0]=2 9098 B13R1.24 O=C(OCSCF)N1CCOCC1 62a_100009898760_100015361967 [0,2,0,0,0,0|2,0,0]=4 9099 B13R1.24 O=C(OCSCF)N1CCOCC1 62a_100015361967_100009898760 [0,2,0,0,0,0|2,0,0]=4 9100 B13R1.24 O=CCOCC(=O)N1CCCCC1 7a_100011315646_200015260668 [0,2,0,0,0,0|1,0,1]=4 9101 B13R1.24 O=CCSCC(=O)C1CCCCC1 62a_100000241979_200015260668 [0,2,0,0,0,0|0,1,1]=4 9102 B13R1.24 O=CCSCC(=O)C1CCCCC1 62a_200015260668_100000241979 [0,2,0,0,0,0|0,1,1]=4 9103 B13R1.24 [13CH3]OCCNC(=O)C1CCCNC1 34a_200011275841_200025704644 [0,2,0,0,0,0|2,0,0]=4 9104 B13R1.24 [13CH3]OCCNC(=O)C1CCNCC1 34a_100025771131_200025704644 [0,2,0,0,0,0|2,0,0]=4 9105 B13R1.24 [N-]=[N+]=NCCC(=O)C1CCCCC1 1458a_100000688302_100000210327 [0,2,0,0,0,0|2,0,0]=4 9106 B13R1.45 C=C(C)CCC(=O)C1CCCCC1 1458a_100000210647_100000730704 [0,2,0,0,0,0|1,0,0]=3 9107 B13R1.45 C=C(C)CCC(=O)C1CCCCC1 1458a_200000688413_100000210327 [0,2,0,0,0,0|1,0,0]=3 9108 B13R1.45 C=C(C)CCC(=O)C1CCCCO1 1458a_100000748299_100000730704 [0,2,0,0,0,0|2,0,0]=4 9109 B13R1.45 C=C(C)CCC(=O)C1CCCOC1 1458a_100000741522_100000730704 [0,2,0,0,0,0|2,0,0]=4 9110 B13R1.45 C=C(C)CCC(=O)C1CCCOC1 1458a_200000688413_100000693364 [0,2,0,0,0,0|2,0,0]=4 9111 B13R1.45 C=C(C)CCC(=O)C1CCOCC1 1458a_100000195482_100000730704 [0,2,0,0,0,0|2,0,0]=4 9112 B13R1.45 C=C(C)CCC(=O)C1CCOCC1 1458a_200000688413_100011324220 [0,2,0,0,0,0|2,0,0]=4 9113 B13R1.45 C=C(C)CCC(=O)C1CCSCC1 1458a_100000755232_100000730704 [0,2,0,0,0,0|2,0,0]=4 9114 B13R1.45 C=C(C)CNC(=O)C1CCCCC1 11a_100000765925_100000210647 [0,2,0,0,0,0|1,0,0]=3 9115 B13R1.45 C=C(C)CNC(=O)C1CCCCC1 1626a_100000765925_100000210647 [0,2,0,0,0,0|1,0,0]=3 9116 B13R1.45 C=C(C)CNC(=O)C1CCCCC1 240690a_100000765925_100000210647 [0,2,0,0,0,0|1,0,0]=3 9117 B13R1.45 C=C(C)CNC(=O)C1CCCCC1 527a_100000765925_100000210647 [0,2,0,0,0,0|1,0,0]=3 9118 B13R1.45 C=C(C)CNC(=O)C1CCCCO1 11a_100000765925_100000748299 [0,2,0,0,0,0|2,0,0]=4 9119 B13R1.45 C=C(C)CNC(=O)C1CCCCO1 1626a_100000765925_100000748299 [0,2,0,0,0,0|2,0,0]=4 9120 B13R1.45 C=C(C)CNC(=O)C1CCCCO1 240690a_100000765925_100000748299 [0,2,0,0,0,0|2,0,0]=4 9121 B13R1.45 C=C(C)CNC(=O)C1CCCCO1 527a_100000765925_100000748299 [0,2,0,0,0,0|2,0,0]=4 9122 B13R1.45 C=C(C)CNC(=O)C1CCCOC1 11a_100000765925_100000741522 [0,2,0,0,0,0|2,0,0]=4 9123 B13R1.45 C=C(C)CNC(=O)C1CCCOC1 1626a_100000765925_100000741522 [0,2,0,0,0,0|2,0,0]=4 9124 B13R1.45 C=C(C)CNC(=O)C1CCCOC1 240690a_100000765925_100000741522 [0,2,0,0,0,0|2,0,0]=4 9125 B13R1.45 C=C(C)CNC(=O)C1CCCOC1 527a_100000765925_100000741522 [0,2,0,0,0,0|2,0,0]=4 9126 B13R1.45 C=C(C)CNC(=O)C1CCOCC1 11a_100000765925_100000195482 [0,2,0,0,0,0|2,0,0]=4 9127 B13R1.45 C=C(C)CNC(=O)C1CCOCC1 1626a_100000765925_100000195482 [0,2,0,0,0,0|2,0,0]=4 9128 B13R1.45 C=C(C)CNC(=O)C1CCOCC1 240690a_100000765925_100000195482 [0,2,0,0,0,0|2,0,0]=4 9129 B13R1.45 C=C(C)CNC(=O)C1CCOCC1 527a_100000765925_100000195482 [0,2,0,0,0,0|2,0,0]=4 9130 B13R1.45 C=C(C)CNC(=O)C1CCSCC1 11a_100000765925_100000755232 [0,2,0,0,0,0|2,0,0]=4 9131 B13R1.45 C=C(C)CNC(=O)C1CCSCC1 1626a_100000765925_100000755232 [0,2,0,0,0,0|2,0,0]=4 9132 B13R1.45 C=C(C)CNC(=O)C1CCSCC1 240690a_100000765925_100000755232 [0,2,0,0,0,0|2,0,0]=4 9133 B13R1.45 C=C(C)CNC(=O)C1CCSCC1 527a_100000765925_100000755232 [0,2,0,0,0,0|2,0,0]=4 9134 B13R1.45 C=C(C)COC(C)C1CCCCC1 34a_100011216961_100000748629 [0,2,0,0,0,0|1,0,1]=4 9135 B13R1.45 C=C(C)COC(C)C1CCCCC1 7a_100011216961_100000748629 [0,2,0,0,0,0|1,0,1]=4 9136 B13R1.45 CC(=CCC(=O)C1CCCCC1)C 1458a_100000210647_100000761012 [0,2,0,0,0,0|1,0,1]=4 9137 B13R1.45 CC(=CCC(=O)C1CCCCC1)C 1458a_100011220947_100000210327 [0,2,0,0,0,0|1,0,1]=4 9138 B13R1.45 CC(=NNC(C)C)C1CCCCC1 4a_100000741168_100000210989 [0,2,0,0,0,0|2,0,0]=4 9139 B13R1.45 CC(=O)CCC(=O)N1CCCCC1 1458a_100000070787_100102558178 [0,2,0,0,0,0|2,0,0]=4 9140 B13R1.45 CC(=O)CCC(=O)N1CCCCC1 1458a_200000243808_200000210301 [0,2,0,0,0,0|2,0,0]=4 9141 B13R1.45 CC(=O)CNC(=O)C1CCCCC1 1458a_100000183267_200000210301 [0,2,0,0,0,0|1,0,0]=3 9142 B13R1.45 CC(=O)CNC(=O)C1CCOCC1 1458a_200000754379_200000210301 [0,2,0,0,0,0|2,0,0]=4 9143 B13R1.45 CC(=O)COC(=O)C1CCCCC1 1458a_100000070787_100009893799 [0,2,0,0,0,0|0,0,0]=2 9144 B13R1.45 CC(=O)COC(=O)N1CCOCC1 1458a_100000070787_100009898760 [0,2,0,0,0,0|2,0,0]=4 9145 B13R1.45 CC(=O)NCC(=O)C1CCCCC1 1458a_100000194580_100000210327 [0,2,0,0,0,0|1,0,1]=4 9146 B13R1.45 CC(=O)NNC(=O)C1CCCCC1 22a_100000184180_100000070787 [0,2,0,0,0,0|1,0,1]=4 9147 B13R1.45 CC(=O)NNC(=O)C1CCCCC1 22a_100000189765_100000210647 [0,2,0,0,0,0|1,0,1]=4 9148 B13R1.45 CC(=O)OCC(=O)C1CCCCC1 1458a_100000183556_100000210327 [0,2,0,0,0,0|0,0,1]=3 9149 B13R1.45 CC(=O)OCC(=O)C1CCCOC1 1458a_100000183556_100000693364 [0,2,0,0,0,0|1,0,1]=4 9150 B13R1.45 CC(=O)OCC(=O)C1CCOCC1 1458a_100000183556_100011324220 [0,2,0,0,0,0|1,0,1]=4 9151 B13R1.45 CC(=O)SCC(=O)C1CCCCC1 1458a_100000049016_100000210327 [0,2,0,0,0,0|0,1,1]=4 9152 B13R1.45 CC(C)C=CC(=O)C1CCCCC1 1458a_100016268746_100000210327 [0,2,0,0,0,0|1,0,0]=3 9153 B13R1.45 CC(C)C=CC(=O)C1CCCOC1 1458a_100016268746_100000693364 [0,2,0,0,0,0|2,0,0]=4 9154 B13R1.45 CC(C)C=CC(=O)C1CCOCC1 1458a_100016268746_100011324220 [0,2,0,0,0,0|2,0,0]=4 9155 B13R1.45 CC(C)CCC(=O)C1CCCCC1 1458a_100000181311_100000210327 [0,2,0,0,0,0|1,0,0]=3 9156 B13R1.45 CC(C)CCC(=O)C1CCCCC1 1458a_100000210647_100000210312 [0,2,0,0,0,0|1,0,0]=3 9157 B13R1.45 CC(C)CCC(=O)C1CCCCO1 1458a_100000748299_100000210312 [0,2,0,0,0,0|2,0,0]=4 9158 B13R1.45 CC(C)CCC(=O)C1CCCOC1 1458a_100000181311_100000693364 [0,2,0,0,0,0|2,0,0]=4 9159 B13R1.45 CC(C)CCC(=O)C1CCCOC1 1458a_100000741522_100000210312 [0,2,0,0,0,0|2,0,0]=4 9160 B13R1.45 CC(C)CCC(=O)C1CCOCC1 1458a_100000181311_100011324220 [0,2,0,0,0,0|2,0,0]=4 9161 B13R1.45 CC(C)CCC(=O)C1CCOCC1 1458a_100000195482_100000210312 [0,2,0,0,0,0|2,0,0]=4 9162 B13R1.45 CC(C)CCC(=O)C1CCSCC1 1458a_100000755232_100000210312 [0,2,0,0,0,0|2,0,0]=4 9163 B13R1.45 CC(C)CNC(=O)C1CCCCC1 11a_100000210953_100000210647 [0,2,0,0,0,0|1,0,0]=3 9164 B13R1.45 CC(C)CNC(=O)C1CCCCC1 1626a_100000210953_100000210647 [0,2,0,0,0,0|1,0,0]=3 9165 B13R1.45 CC(C)CNC(=O)C1CCCCC1 240690a_100000210953_100000210647 [0,2,0,0,0,0|1,0,0]=3 9166 B13R1.45 CC(C)CNC(=O)C1CCCCC1 527a_100000210953_100000210647 [0,2,0,0,0,0|1,0,0]=3 9167 B13R1.45 CC(C)CNC(=O)C1CCCCO1 11a_100000210953_100000748299 [0,2,0,0,0,0|2,0,0]=4 9168 B13R1.45 CC(C)CNC(=O)C1CCCCO1 1626a_100000210953_100000748299 [0,2,0,0,0,0|2,0,0]=4 9169 B13R1.45 CC(C)CNC(=O)C1CCCCO1 240690a_100000210953_100000748299 [0,2,0,0,0,0|2,0,0]=4 9170 B13R1.45 CC(C)CNC(=O)C1CCCCO1 527a_100000210953_100000748299 [0,2,0,0,0,0|2,0,0]=4 9171 B13R1.45 CC(C)CNC(=O)C1CCCOC1 11a_100000210953_100000741522 [0,2,0,0,0,0|2,0,0]=4 9172 B13R1.45 CC(C)CNC(=O)C1CCCOC1 1626a_100000210953_100000741522 [0,2,0,0,0,0|2,0,0]=4 9173 B13R1.45 CC(C)CNC(=O)C1CCCOC1 240690a_100000210953_100000741522 [0,2,0,0,0,0|2,0,0]=4 9174 B13R1.45 CC(C)CNC(=O)C1CCCOC1 527a_100000210953_100000741522 [0,2,0,0,0,0|2,0,0]=4 9175 B13R1.45 CC(C)CNC(=O)C1CCOCC1 11a_100000210953_100000195482 [0,2,0,0,0,0|2,0,0]=4 9176 B13R1.45 CC(C)CNC(=O)C1CCOCC1 1626a_100000210953_100000195482 [0,2,0,0,0,0|2,0,0]=4 9177 B13R1.45 CC(C)CNC(=O)C1CCOCC1 240690a_100000210953_100000195482 [0,2,0,0,0,0|2,0,0]=4 9178 B13R1.45 CC(C)CNC(=O)C1CCOCC1 527a_100000210953_100000195482 [0,2,0,0,0,0|2,0,0]=4 9179 B13R1.45 CC(C)CNC(=O)C1CCSCC1 11a_100000210953_100000755232 [0,2,0,0,0,0|2,0,0]=4 9180 B13R1.45 CC(C)CNC(=O)C1CCSCC1 1626a_100000210953_100000755232 [0,2,0,0,0,0|2,0,0]=4 9181 B13R1.45 CC(C)CNC(=O)C1CCSCC1 240690a_100000210953_100000755232 [0,2,0,0,0,0|2,0,0]=4 9182 B13R1.45 CC(C)CNC(=O)C1CCSCC1 527a_100000210953_100000755232 [0,2,0,0,0,0|2,0,0]=4 9183 B13R1.45 CC(C)COC(C)C1CCCCC1 34a_100011216961_100000210624 [0,2,0,0,0,0|1,0,1]=4 9184 B13R1.45 CC(C)COC(C)C1CCCCC1 7a_100011216961_100000210760 [0,2,0,0,0,0|1,0,1]=4 9185 B13R1.45 CC(C)NCC(=O)C1CCCCC1 2230a_100138425928_100000241979 [0,2,0,0,0,0|1,0,0]=3 9186 B13R1.45 CC(C)NCC(=O)C1CCCCC1 34a_100138425928_100000241979 [0,2,0,0,0,0|1,0,0]=3 9187 B13R1.45 CC(C)NCC(=O)C1CCOCC1 2230a_100138425928_100000689883 [0,2,0,0,0,0|2,0,0]=4 9188 B13R1.45 CC(C)NCC(=O)C1CCOCC1 34a_100138425928_100000689883 [0,2,0,0,0,0|2,0,0]=4 9189 B13R1.45 CC(C)NCC(=O)N1CCCCC1 2230a_100000751303_100000210206 [0,2,0,0,0,0|2,0,0]=4 9190 B13R1.45 CC(C)NCC(=O)N1CCCCC1 2230a_100138425928_100000183409 [0,2,0,0,0,0|2,0,0]=4 9191 B13R1.45 CC(C)NCC(=O)N1CCCCC1 34a_100138425928_100000183409 [0,2,0,0,0,0|2,0,0]=4 9192 B13R1.45 CC(C)NNC(=O)C1CCCCC1 22a_100000741168_100000210647 [0,2,0,0,0,0|1,0,0]=3 9193 B13R1.45 CC(C)NNC(=O)C1CCCCO1 22a_100000741168_100000748299 [0,2,0,0,0,0|2,0,0]=4 9194 B13R1.45 CC(C)NNC(=O)C1CCCOC1 22a_100000741168_100000741522 [0,2,0,0,0,0|2,0,0]=4 9195 B13R1.45 CC(C)NNC(=O)C1CCOCC1 22a_100000741168_100000195482 [0,2,0,0,0,0|2,0,0]=4 9196 B13R1.45 CC(C)NNC(=O)C1CCSCC1 22a_100000741168_100000755232 [0,2,0,0,0,0|2,0,0]=4 9197 B13R1.45 CC(C)OCC(=O)C1C=CCCC1 1458a_100000745533_100000751183 [0,2,0,0,0,0|0,0,2]=4 9198 B13R1.45 CC(C)OCC(=O)C1CCCCC1 1458a_100000745533_100000210327 [0,2,0,0,0,0|0,0,0]=2 9199 B13R1.45 CC(C)OCC(=O)C1CCCCC1 34a_100000212225_100000241979 [0,2,0,0,0,0|0,0,0]=2 9200 B13R1.45 CC(C)OCC(=O)C1CCCOC1 1458a_100000745533_100000693364 [0,2,0,0,0,0|1,0,0]=3 9201 B13R1.45 CC(C)OCC(=O)C1CCOCC1 1458a_100000745533_100011324220 [0,2,0,0,0,0|1,0,0]=3 9202 B13R1.45 CC(C)OCC(=O)C1CCOCC1 34a_100000212225_100000689883 [0,2,0,0,0,0|1,0,0]=3 9203 B13R1.45 CC(C)OCC(=O)N1CCCCC1 34a_100000212225_100000183409 [0,2,0,0,0,0|1,0,0]=3 9204 B13R1.45 CC(C)OCC(=O)N1CCCCC1 7a_100011315646_100000210206 [0,2,0,0,0,0|1,0,0]=3 9205 B13R1.45 CC(C)OCC(=O)N1CCCOC1 11a_100000131196_100000745533 [0,2,0,0,0,0|2,0,0]=4 9206 B13R1.45 CC(C)OCC(=O)N1CCCOC1 240690a_100000131196_100000745533 [0,2,0,0,0,0|2,0,0]=4 9207 B13R1.45 CC(C)OCC(=O)N1CCOCC1 11a_100015191051_100000745533 [0,2,0,0,0,0|2,0,0]=4 9208 B13R1.45 CC(C)OCC(=O)N1CCOCC1 1626a_100015191051_100000745533 [0,2,0,0,0,0|2,0,0]=4 9209 B13R1.45 CC(C)OCC(=O)N1CCOCC1 240690a_100015191051_100000745533 [0,2,0,0,0,0|2,0,0]=4 9210 B13R1.45 CC(C)OCC(=O)N1CCOCC1 34a_100000212225_100000183410 [0,2,0,0,0,0|2,0,0]=4 9211 B13R1.45 CC(C)OCC(=O)N1CCOCC1 527a_100015191051_100000745533 [0,2,0,0,0,0|2,0,0]=4 9212 B13R1.45 CC(C)OCC(=O)N1CCOCC1 7a_100000752472_100000210206 [0,2,0,0,0,0|2,0,0]=4 9213 B13R1.45 CC(C)OCC(=O)N1CCSCC1 11a_100000737611_100000745533 [0,2,0,0,0,0|2,0,0]=4 9214 B13R1.45 CC(C)OCC(=O)N1CCSCC1 240690a_100000737611_100000745533 [0,2,0,0,0,0|2,0,0]=4 9215 B13R1.45 CC(C)OCC(=O)N1CCSCC1 527a_100000737611_100000745533 [0,2,0,0,0,0|2,0,0]=4 9216 B13R1.45 CC(C)OCN(C)C1CCCCC1 2230a_100000207522_100000709892 [0,2,0,0,0,0|2,0,0]=4 9217 B13R1.45 CC(C)OCN(C)C1CCCCC1 269982a_100000207522_100000709892 [0,2,0,0,0,0|2,0,0]=4 9218 B13R1.45 CC(C)OCN(C)C1CCCCC1 34a_100000207522_100000709892 [0,2,0,0,0,0|2,0,0]=4 9219 B13R1.45 CC(C)OC[C@H](N)C1CCCCC1 34a_100009817630_100000210206 [0,2,0,0,0,0|1,0,1]=4 9220 B13R1.45 CC(C)SCC(=O)C1CCCCC1 1458a_100000241585_100000210327 [0,2,0,0,0,0|0,1,0]=3 9221 B13R1.45 CC(C)SCC(=O)C1CCCCC1 62a_100000210206_100000241979 [0,2,0,0,0,0|0,1,0]=3 9222 B13R1.45 CC(C)SCC(=O)C1CCCCC1 62a_100000241979_100000210206 [0,2,0,0,0,0|0,1,0]=3 9223 B13R1.45 CC(C)SCC(=O)C1CCCOC1 1458a_100000241585_100000693364 [0,2,0,0,0,0|1,1,0]=4 9224 B13R1.45 CC(C)SCC(=O)C1CCOCC1 1458a_100000241585_100011324220 [0,2,0,0,0,0|1,1,0]=4 9225 B13R1.45 CC(C)SCC(=O)C1CCOCC1 62a_100000210206_100000689883 [0,2,0,0,0,0|1,1,0]=4 9226 B13R1.45 CC(C)SCC(=O)C1CCOCC1 62a_100000689883_100000210206 [0,2,0,0,0,0|1,1,0]=4 9227 B13R1.45 CC(C)SCC(=O)N1CCCCC1 62a_100000183409_100000210206 [0,2,0,0,0,0|1,1,0]=4 9228 B13R1.45 CC(C)SCC(=O)N1CCCCC1 62a_100000210206_100000183409 [0,2,0,0,0,0|1,1,0]=4 9229 B13R1.45 CC(O)CCC(=O)C1CCCCC1 1458a_100000210647_100012276601 [0,2,0,0,0,0|1,0,0]=3 9230 B13R1.45 CC(O)CCC(=O)C1CCCCO1 1458a_100000748299_100012276601 [0,2,0,0,0,0|2,0,0]=4 9231 B13R1.45 CC(O)CCC(=O)C1CCCOC1 1458a_100000741522_100012276601 [0,2,0,0,0,0|2,0,0]=4 9232 B13R1.45 CC(O)CCC(=O)C1CCOCC1 1458a_100000195482_100012276601 [0,2,0,0,0,0|2,0,0]=4 9233 B13R1.45 CC(O)CCC(=O)C1CCSCC1 1458a_100000755232_100012276601 [0,2,0,0,0,0|2,0,0]=4 9234 B13R1.45 CC(O)CNC(=O)C1CCCCC1 11a_100000210904_100000210647 [0,2,0,0,0,0|1,0,0]=3 9235 B13R1.45 CC(O)CNC(=O)C1CCCCC1 240690a_100000210904_100000210647 [0,2,0,0,0,0|1,0,0]=3 9236 B13R1.45 CC(O)CNC(=O)C1CCCCC1 527a_100000210904_100000210647 [0,2,0,0,0,0|1,0,0]=3 9237 B13R1.45 CC(O)CNC(=O)C1CCCCO1 11a_100000210904_100000748299 [0,2,0,0,0,0|2,0,0]=4 9238 B13R1.45 CC(O)CNC(=O)C1CCCCO1 240690a_100000210904_100000748299 [0,2,0,0,0,0|2,0,0]=4 9239 B13R1.45 CC(O)CNC(=O)C1CCCCO1 527a_100000210904_100000748299 [0,2,0,0,0,0|2,0,0]=4 9240 B13R1.45 CC(O)CNC(=O)C1CCCOC1 11a_100000210904_100000741522 [0,2,0,0,0,0|2,0,0]=4 9241 B13R1.45 CC(O)CNC(=O)C1CCCOC1 240690a_100000210904_100000741522 [0,2,0,0,0,0|2,0,0]=4 9242 B13R1.45 CC(O)CNC(=O)C1CCCOC1 527a_100000210904_100000741522 [0,2,0,0,0,0|2,0,0]=4 9243 B13R1.45 CC(O)CNC(=O)C1CCOCC1 11a_100000210904_100000195482 [0,2,0,0,0,0|2,0,0]=4 9244 B13R1.45 CC(O)CNC(=O)C1CCOCC1 240690a_100000210904_100000195482 [0,2,0,0,0,0|2,0,0]=4 9245 B13R1.45 CC(O)CNC(=O)C1CCOCC1 527a_100000210904_100000195482 [0,2,0,0,0,0|2,0,0]=4 9246 B13R1.45 CC(O)CNC(=O)C1CCSCC1 11a_100000210904_100000755232 [0,2,0,0,0,0|2,0,0]=4 9247 B13R1.45 CC(O)CNC(=O)C1CCSCC1 240690a_100000210904_100000755232 [0,2,0,0,0,0|2,0,0]=4 9248 B13R1.45 CC(O)CNC(=O)C1CCSCC1 527a_100000210904_100000755232 [0,2,0,0,0,0|2,0,0]=4 9249 B13R1.45 CC(O)COC(C)C1CCCCC1 34a_100011216961_100011218427 [0,2,0,0,0,0|1,0,1]=4 9250 B13R1.45 CC(O)COC(C)C1CCCCC1 7a_100011216961_100011218427 [0,2,0,0,0,0|1,0,1]=4 9251 B13R1.45 CC(OCC(F)F)C1CCCCC1 34a_100011216961_100011934356 [0,2,0,0,0,0|1,0,1]=4 9252 B13R1.45 CC(OCC(F)F)C1CCCCC1 7a_100011216961_100011934356 [0,2,0,0,0,0|1,0,1]=4 9253 B13R1.45 CC(OC[C@@H](C)O)C1CCCCC1 34a_100011216961_100009817552 [0,2,0,0,0,0|1,0,1]=4 9254 B13R1.45 CC(OC[C@@H](C)O)C1CCCCC1 7a_100011216961_100009817552 [0,2,0,0,0,0|1,0,1]=4 9255 B13R1.45 CN(C)CCC(=O)N1CCCCC1 2230a_100102631434_100102558178 [0,2,0,0,0,0|2,0,0]=4 9256 B13R1.45 CN(C)CCC(=O)N1CCCCC1 269982a_100102631434_100102558178 [0,2,0,0,0,0|2,0,0]=4 9257 B13R1.45 CN(C)COC(=O)C1CCCCC1 2230a_100102631434_100009893799 [0,2,0,0,0,0|0,0,0]=2 9258 B13R1.45 CN(C)COC(=O)C1CCCCC1 269982a_100102631434_100009893799 [0,2,0,0,0,0|0,0,0]=2 9259 B13R1.45 CN(C)COC(=O)N1CCOCC1 2230a_100102631434_100009898760 [0,2,0,0,0,0|2,0,0]=4 9260 B13R1.45 CN(C)COC(=O)N1CCOCC1 269982a_100102631434_100009898760 [0,2,0,0,0,0|2,0,0]=4 9261 B13R1.45 C[S+](C)CCC(=O)C1CCCCC1 1458a_100009452791_100000210327 [0,2,0,0,0,0|1,0,0]=3 9262 B13R1.45 C[S+](C)CCC(=O)C1CCCOC1 1458a_100009452791_100000693364 [0,2,0,0,0,0|2,0,0]=4 9263 B13R1.45 C[S+](C)CCC(=O)C1CCOCC1 1458a_100009452791_100011324220 [0,2,0,0,0,0|2,0,0]=4 9264 B13R1.45 NC(=O)CCC(=O)C1CCCCC1 1458a_100011215257_100000210327 [0,2,0,0,0,0|1,0,1]=4 9265 B13R1.45 NC(=O)CNC(=O)C1CCCCC1 11a_100000711301_100000210647 [0,2,0,0,0,0|1,0,1]=4 9266 B13R1.45 NC(=O)CNC(=O)C1CCCCC1 240690a_100000711301_100000210647 [0,2,0,0,0,0|1,0,1]=4 9267 B13R1.45 NC(=O)CNC(=O)C1CCCCC1 527a_100000711301_100000210647 [0,2,0,0,0,0|1,0,1]=4 9268 B13R1.45 O=C(CC[N+](=O)[O-])C1CCCCC1 1458a_200000064761_100000210327 [0,2,0,0,0,0|2,0,0]=4 9269 B13R1.45 O=C(COC(F)F)C1CCCCC1 1458a_200000719455_100000210327 [0,2,0,0,0,0|1,0,0]=3 9270 B13R1.45 O=C(COC(F)F)C1CCCOC1 1458a_200000719455_100000693364 [0,2,0,0,0,0|2,0,0]=4 9271 B13R1.45 O=C(COC(F)F)C1CCOCC1 1458a_200000719455_100011324220 [0,2,0,0,0,0|2,0,0]=4 9272 B13R1.45 O=C(CSC(F)F)C1CCCCC1 1458a_114828291038_100000210327 [0,2,0,0,0,0|1,1,0]=4 9273 B13R1.45 O=C(NCC(F)F)C1CCCCC1 11a_100000765723_100000210647 [0,2,0,0,0,0|1,0,0]=3 9274 B13R1.45 O=C(NCC(F)F)C1CCCCC1 1626a_100000765723_100000210647 [0,2,0,0,0,0|1,0,0]=3 9275 B13R1.45 O=C(NCC(F)F)C1CCCCC1 240690a_100000765723_100000210647 [0,2,0,0,0,0|1,0,0]=3 9276 B13R1.45 O=C(NCC(F)F)C1CCCCC1 527a_100000765723_100000210647 [0,2,0,0,0,0|1,0,0]=3 9277 B13R1.45 O=C(NCC(F)F)C1CCCCO1 11a_100000765723_100000748299 [0,2,0,0,0,0|2,0,0]=4 9278 B13R1.45 O=C(NCC(F)F)C1CCCCO1 1626a_100000765723_100000748299 [0,2,0,0,0,0|2,0,0]=4 9279 B13R1.45 O=C(NCC(F)F)C1CCCCO1 240690a_100000765723_100000748299 [0,2,0,0,0,0|2,0,0]=4 9280 B13R1.45 O=C(NCC(F)F)C1CCCCO1 527a_100000765723_100000748299 [0,2,0,0,0,0|2,0,0]=4 9281 B13R1.45 O=C(NCC(F)F)C1CCCOC1 11a_100000765723_100000741522 [0,2,0,0,0,0|2,0,0]=4 9282 B13R1.45 O=C(NCC(F)F)C1CCCOC1 1626a_100000765723_100000741522 [0,2,0,0,0,0|2,0,0]=4 9283 B13R1.45 O=C(NCC(F)F)C1CCCOC1 240690a_100000765723_100000741522 [0,2,0,0,0,0|2,0,0]=4 9284 B13R1.45 O=C(NCC(F)F)C1CCCOC1 527a_100000765723_100000741522 [0,2,0,0,0,0|2,0,0]=4 9285 B13R1.45 O=C(NCC(F)F)C1CCOCC1 11a_100000765723_100000195482 [0,2,0,0,0,0|2,0,0]=4 9286 B13R1.45 O=C(NCC(F)F)C1CCOCC1 1626a_100000765723_100000195482 [0,2,0,0,0,0|2,0,0]=4 9287 B13R1.45 O=C(NCC(F)F)C1CCOCC1 240690a_100000765723_100000195482 [0,2,0,0,0,0|2,0,0]=4 9288 B13R1.45 O=C(NCC(F)F)C1CCOCC1 527a_100000765723_100000195482 [0,2,0,0,0,0|2,0,0]=4 9289 B13R1.45 O=C(NCC(F)F)C1CCSCC1 11a_100000765723_100000755232 [0,2,0,0,0,0|2,0,0]=4 9290 B13R1.45 O=C(NCC(F)F)C1CCSCC1 1626a_100000765723_100000755232 [0,2,0,0,0,0|2,0,0]=4 9291 B13R1.45 O=C(NCC(F)F)C1CCSCC1 240690a_100000765723_100000755232 [0,2,0,0,0,0|2,0,0]=4 9292 B13R1.45 O=C(NCC(F)F)C1CCSCC1 527a_100000765723_100000755232 [0,2,0,0,0,0|2,0,0]=4 9293 B13R1.45 [13CH3]C(=O)CCC(=O)N1CCCCC1 1458a_200000243808_200025704644 [0,2,0,0,0,0|2,0,0]=4 9294 B13R1.45 [13CH3]C(=O)CNC(=O)C1CCCCC1 1458a_100000183267_200025704644 [0,2,0,0,0,0|1,0,0]=3 9295 B13R1.45 [13CH3]C(=O)CNC(=O)C1CCOCC1 1458a_200000754379_200025704644 [0,2,0,0,0,0|2,0,0]=4 9296 B13R1.122 CCCNS(=O)(=O)C1CCCCC1 270084a_100020643023_100011219266 [0,2,0,0,0,0|2,0,0]=4 9297 B13R1.122 CCCNS(=O)(=O)C1CCCCC1 274078a_100020643023_100011219266 [0,2,0,0,0,0|2,0,0]=4 9298 B13R1.122 O=S(=O)(NCCF)C1CCCCC1 270084a_100000724931_100011219266 [0,2,0,0,0,0|2,0,0]=4 9299 B13R1.122 O=S(=O)(NCCF)C1CCCCC1 274078a_100000724931_100011219266 [0,2,0,0,0,0|2,0,0]=4 9300 B13R1.122 O=S(=O)(NCCO)C1CCCCC1 270084a_100000210304_100011219266 [0,2,0,0,0,0|2,0,0]=4 9301 B13R1.122 O=S(=O)(NCCO)C1CCCCC1 274078a_100000210304_100011219266 [0,2,0,0,0,0|2,0,0]=4 9302 B13R1.674 C#CCCC(=O)C1CCCCC1C 1458a_100011215568_100000753159 [0,2,0,0,0,0|1,0,1]=4 9303 B13R1.674 C#CCCC(=O)C1CCCCC1O 1458a_100011803323_100000753159 [0,2,0,0,0,0|1,0,1]=4 9304 B13R1.674 C#CCNC(=O)C1CCCCC1C 11a_100000212058_100011215568 [0,2,0,0,0,0|1,0,1]=4 9305 B13R1.674 C#CCNC(=O)C1CCCCC1C 1626a_100000212058_100011215568 [0,2,0,0,0,0|1,0,1]=4 9306 B13R1.674 C#CCNC(=O)C1CCCCC1C 240690a_100000212058_100011215568 [0,2,0,0,0,0|1,0,1]=4 9307 B13R1.674 C#CCNC(=O)C1CCCCC1C 527a_100000212058_100011215568 [0,2,0,0,0,0|1,0,1]=4 9308 B13R1.674 C/C=C/CC(=O)C1CCCCC1C 1458a_100011215568_100102629194 [0,2,0,0,0,0|1,0,1]=4 9309 B13R1.674 C/C=C/CC(=O)C1CCCCC1O 1458a_100011803323_100102629194 [0,2,0,0,0,0|1,0,1]=4 9310 B13R1.674 C=CCCC(=O)C1CCCCC1C 1458a_100011215568_100000754431 [0,2,0,0,0,0|1,0,1]=4 9311 B13R1.674 C=CCCC(=O)C1CCCCC1O 1458a_100011803323_100000754431 [0,2,0,0,0,0|1,0,1]=4 9312 B13R1.674 C=CCNC(=O)C1CCCCC1C 1626a_100020586998_100011215568 [0,2,0,0,0,0|1,0,1]=4 9313 B13R1.674 C=CCNC(=O)C1CCCCC1C 240690a_100020586998_100011215568 [0,2,0,0,0,0|1,0,1]=4 9314 B13R1.674 C=CCNC(=O)C1CCCCC1C 527a_100020586998_100011215568 [0,2,0,0,0,0|1,0,1]=4 9315 B13R1.674 CC#CCC(=O)C1CCCCC1C 1458a_100011215568_100000748600 [0,2,0,0,0,0|1,0,1]=4 9316 B13R1.674 CC#CCC(=O)C1CCCCC1O 1458a_100011803323_100000748600 [0,2,0,0,0,0|1,0,1]=4 9317 B13R1.674 CC1CCCCC1C(=O)CCC#N 1458a_100011215568_100011215226 [0,2,0,0,0,0|1,0,1]=4 9318 B13R1.674 CC1CCCCC1C(=O)CCCF 1458a_100011215568_100011934791 [0,2,0,0,0,0|1,0,0]=3 9319 B13R1.674 CC1CCCCC1C(=O)CCCO 1458a_100011215568_100011215043 [0,2,0,0,0,0|1,0,0]=3 9320 B13R1.674 CC1CCCCC1C(=O)NCC#N 1626a_100000734998_100011215568 [0,2,0,0,0,0|1,0,1]=4 9321 B13R1.674 CC1CCCCC1C(=O)NCC#N 527a_100000734998_100011215568 [0,2,0,0,0,0|1,0,1]=4 9322 B13R1.674 CC1CCCCC1C(=O)NCCF 11a_100000724931_100011215568 [0,2,0,0,0,0|1,0,0]=3 9323 B13R1.674 CC1CCCCC1C(=O)NCCF 1626a_100000724931_100011215568 [0,2,0,0,0,0|1,0,0]=3 9324 B13R1.674 CC1CCCCC1C(=O)NCCF 240690a_100000724931_100011215568 [0,2,0,0,0,0|1,0,0]=3 9325 B13R1.674 CC1CCCCC1C(=O)NCCF 527a_100000724931_100011215568 [0,2,0,0,0,0|1,0,0]=3 9326 B13R1.674 CC1CCCCC1C(=O)NCCO 240690a_100000210304_100011215568 [0,2,0,0,0,0|1,0,0]=3 9327 B13R1.674 CC1CCCCC1C(=O)NCCO 527a_100000210304_100011215568 [0,2,0,0,0,0|1,0,0]=3 9328 B13R1.674 CC1CCCCN1C(=O)CCN[13CH3] 34a_100025749213_200025704644 [0,2,0,0,0,0|2,0,0]=4 9329 B13R1.674 CC1CCCCN1C(=O)NCCF 273464a_100000724931_100000211376 [0,2,0,0,0,0|2,0,0]=4 9330 B13R1.674 CC1CCCCN1C(=O)NCCO 273464a_100000210304_100000211376 [0,2,0,0,0,0|2,0,0]=4 9331 B13R1.674 CC=CCC(=O)C1CCCCC1C 1458a_100011215568_100000070051 [0,2,0,0,0,0|1,0,1]=4 9332 B13R1.674 CC=CCC(=O)C1CCCCC1O 1458a_100011803323_100000070051 [0,2,0,0,0,0|1,0,1]=4 9333 B13R1.674 CCC#CC(=O)C1CCCCC1=O 1458a_100011827653_100000204591 [0,2,0,0,0,0|1,0,1]=4 9334 B13R1.674 CCC=CC(=O)C1CCCCC1=O 1458a_100000212282_100000204591 [0,2,0,0,0,0|1,0,1]=4 9335 B13R1.674 CCC=CC(=O)N1CCCCC1C 11a_100000211376_100000212282 [0,2,0,0,0,0|2,0,0]=4 9336 B13R1.674 CCC=CC(=O)N1CCCCC1C 1626a_100000211376_100000212282 [0,2,0,0,0,0|2,0,0]=4 9337 B13R1.674 CCC=CC(=O)N1CCCCC1C 240690a_100000211376_100000212282 [0,2,0,0,0,0|2,0,0]=4 9338 B13R1.674 CCCCC(=O)C1CCCCC1=O 1458a_100000210183_100000204591 [0,2,0,0,0,0|1,0,1]=4 9339 B13R1.674 CCCCC(=O)C1CCCCC1C 1458a_100011215568_100000210211 [0,2,0,0,0,0|1,0,0]=3 9340 B13R1.674 CCCCC(=O)C1CCCCC1O 1458a_100011803323_100000210211 [0,2,0,0,0,0|1,0,0]=3 9341 B13R1.674 CCCCC(=O)N1CCCCC1C 11a_100000211376_100000210183 [0,2,0,0,0,0|2,0,0]=4 9342 B13R1.674 CCCCC(=O)N1CCCCC1C 1626a_100000211376_100000210183 [0,2,0,0,0,0|2,0,0]=4 9343 B13R1.674 CCCCC(=O)N1CCCCC1C 240690a_100000211376_100000210183 [0,2,0,0,0,0|2,0,0]=4 9344 B13R1.674 CCCCC(=O)N1CCCCC1C 527a_100000211376_100000210183 [0,2,0,0,0,0|2,0,0]=4 9345 B13R1.674 CCCCC(=O)[C@H]1CCCCN1C 1458a_100000767060_100000210211 [0,2,0,0,0,0|2,0,0]=4 9346 B13R1.674 CCCNC(=O)C1CCCCC1C 11a_100020643023_100011215568 [0,2,0,0,0,0|1,0,0]=3 9347 B13R1.674 CCCNC(=O)C1CCCCC1C 1626a_100020643023_100011215568 [0,2,0,0,0,0|1,0,0]=3 9348 B13R1.674 CCCNC(=O)C1CCCCC1C 240690a_100020643023_100011215568 [0,2,0,0,0,0|1,0,0]=3 9349 B13R1.674 CCCNC(=O)C1CCCCC1C 527a_100020643023_100011215568 [0,2,0,0,0,0|1,0,0]=3 9350 B13R1.674 CCCNC(=O)N1CCCCC1C 2708a_100020643023_100000211376 [0,2,0,0,0,0|2,0,0]=4 9351 B13R1.674 CCCNC(=O)N1CCCCC1C 273464a_100020643023_100000211376 [0,2,0,0,0,0|2,0,0]=4 9352 B13R1.674 CCCNC(=O)[C@H]1CCCCN1C 11a_100020643023_100000767060 [0,2,0,0,0,0|2,0,0]=4 9353 B13R1.674 CCCNC(=O)[C@H]1CCCCN1C 1626a_100020643023_100000767060 [0,2,0,0,0,0|2,0,0]=4 9354 B13R1.674 CCCNC(=O)[C@H]1CCCCN1C 240690a_100020643023_100000767060 [0,2,0,0,0,0|2,0,0]=4 9355 B13R1.674 CCCNC(=O)[C@H]1CCCCN1C 527a_100020643023_100000767060 [0,2,0,0,0,0|2,0,0]=4 9356 B13R1.674 CCNCC(=O)N1CCCCC1C 2230a_100015525214_100000182743 [0,2,0,0,0,0|2,0,0]=4 9357 B13R1.674 CCNNC(=O)C1CCCCC1C 22a_100000756455_100011215568 [0,2,0,0,0,0|1,0,0]=3 9358 B13R1.674 CCNNC(=O)C1CCCCC1O 22a_100000756455_100011803323 [0,2,0,0,0,0|1,0,0]=3 9359 B13R1.674 CCNNC(=O)[C@H]1CCCCN1C 22a_100000756455_100000767060 [0,2,0,0,0,0|2,0,0]=4 9360 B13R1.674 CCOCC(=O)C1CCCCC1=O 1458a_100000211967_100000204591 [0,2,0,0,0,0|0,0,1]=3 9361 B13R1.674 CCOCC(=O)C1CCCNC1=O 1458a_100000211967_100000687798 [0,2,0,0,0,0|1,0,1]=4 9362 B13R1.674 CCOCC(=O)C1COCCC1=O 1458a_100000211967_100012180262 [0,2,0,0,0,0|1,0,1]=4 9363 B13R1.674 CCOCC(=O)N1CCCCC1C 11a_100000211376_100000211967 [0,2,0,0,0,0|1,0,0]=3 9364 B13R1.674 CCOCC(=O)N1CCCCC1C 1626a_100000211376_100000211967 [0,2,0,0,0,0|1,0,0]=3 9365 B13R1.674 CCOCC(=O)N1CCCCC1C 240690a_100000211376_100000211967 [0,2,0,0,0,0|1,0,0]=3 9366 B13R1.674 CCOCC(=O)N1CCCCC1C 34a_100121572206_100000182743 [0,2,0,0,0,0|1,0,0]=3 9367 B13R1.674 CCOCC(=O)N1CCCCC1C 527a_100000211376_100000211967 [0,2,0,0,0,0|1,0,0]=3 9368 B13R1.674 CCOCC(=O)N1CCOC[C@@H]1C 11a_100009815349_100000211967 [0,2,0,0,0,0|2,0,0]=4 9369 B13R1.674 CCOCC(=O)N1CCOC[C@@H]1C 240690a_100009815349_100000211967 [0,2,0,0,0,0|2,0,0]=4 9370 B13R1.674 CCOCC(=O)N1CCOC[C@@H]1C 527a_100009815349_100000211967 [0,2,0,0,0,0|2,0,0]=4 9371 B13R1.674 CCOCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000739092 [0,2,0,0,0,0|2,0,0]=4 9372 B13R1.674 CCSCC(=O)C1CCCCC1=O 1458a_100000230394_100000204591 [0,2,0,0,0,0|0,1,1]=4 9373 B13R1.674 CCSCC(=O)N1CCCCC1C 11a_100000211376_100000230394 [0,2,0,0,0,0|1,1,0]=4 9374 B13R1.674 CCSCC(=O)N1CCCCC1C 1626a_100000211376_100000230394 [0,2,0,0,0,0|1,1,0]=4 9375 B13R1.674 CCSCC(=O)N1CCCCC1C 240690a_100000211376_100000230394 [0,2,0,0,0,0|1,1,0]=4 9376 B13R1.674 CCSCC(=O)N1CCCCC1C 527a_100000211376_100000230394 [0,2,0,0,0,0|1,1,0]=4 9377 B13R1.674 CCSCC(=O)N1CCCCC1C 62a_100000182743_100000210202 [0,2,0,0,0,0|1,1,0]=4 9378 B13R1.674 CCSCC(=O)N1CCCCC1C 62a_100000210202_100000182743 [0,2,0,0,0,0|1,1,0]=4 9379 B13R1.674 CN1CCCC[C@@H]1C(=O)CCCF 1458a_100000767060_100011934791 [0,2,0,0,0,0|2,0,0]=4 9380 B13R1.674 CN1CCCC[C@@H]1C(=O)CCCO 1458a_100000767060_100011215043 [0,2,0,0,0,0|2,0,0]=4 9381 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCF 11a_100000724931_100000767060 [0,2,0,0,0,0|2,0,0]=4 9382 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCF 1626a_100000724931_100000767060 [0,2,0,0,0,0|2,0,0]=4 9383 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCF 240690a_100000724931_100000767060 [0,2,0,0,0,0|2,0,0]=4 9384 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCF 527a_100000724931_100000767060 [0,2,0,0,0,0|2,0,0]=4 9385 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCO 240690a_100000210304_100000767060 [0,2,0,0,0,0|2,0,0]=4 9386 B13R1.674 CN1CCCC[C@@H]1C(=O)NCCO 527a_100000210304_100000767060 [0,2,0,0,0,0|2,0,0]=4 9387 B13R1.674 CNCCC(=O)N1CCCCC1C 34a_100025749213_200000210301 [0,2,0,0,0,0|2,0,0]=4 9388 B13R1.674 COCCC(=O)C1CCCCC1=O 1458a_100000749529_100000204591 [0,2,0,0,0,0|1,0,1]=4 9389 B13R1.674 COCCC(=O)C1CCCCC1C 1458a_100011215568_100000233755 [0,2,0,0,0,0|1,0,0]=3 9390 B13R1.674 COCCC(=O)C1CCCCC1O 1458a_100011803323_100000233755 [0,2,0,0,0,0|1,0,0]=3 9391 B13R1.674 COCCC(=O)N1CCCCC1C 11a_100000211376_100000749529 [0,2,0,0,0,0|2,0,0]=4 9392 B13R1.674 COCCC(=O)N1CCCCC1C 1626a_100000211376_100000749529 [0,2,0,0,0,0|2,0,0]=4 9393 B13R1.674 COCCC(=O)N1CCCCC1C 240690a_100000211376_100000749529 [0,2,0,0,0,0|2,0,0]=4 9394 B13R1.674 COCCC(=O)N1CCCCC1C 527a_100000211376_100000749529 [0,2,0,0,0,0|2,0,0]=4 9395 B13R1.674 COCCC(=O)[C@H]1CCCCN1C 1458a_100000767060_100000233755 [0,2,0,0,0,0|2,0,0]=4 9396 B13R1.674 CSCCC(=O)C1CCCCC1=O 1458a_100000174002_100000204591 [0,2,0,0,0,0|1,0,1]=4 9397 B13R1.674 CSCCC(=O)C1CCCCC1C 1458a_100011215568_100000751147 [0,2,0,0,0,0|1,0,0]=3 9398 B13R1.674 CSCCC(=O)C1CCCCC1O 1458a_100011803323_100000751147 [0,2,0,0,0,0|1,0,0]=3 9399 B13R1.674 CSCCC(=O)N1CCCCC1C 11a_100000211376_100000174002 [0,2,0,0,0,0|2,0,0]=4 9400 B13R1.674 CSCCC(=O)N1CCCCC1C 1626a_100000211376_100000174002 [0,2,0,0,0,0|2,0,0]=4 9401 B13R1.674 CSCCC(=O)N1CCCCC1C 240690a_100000211376_100000174002 [0,2,0,0,0,0|2,0,0]=4 9402 B13R1.674 CSCCC(=O)N1CCCCC1C 527a_100000211376_100000174002 [0,2,0,0,0,0|2,0,0]=4 9403 B13R1.674 CSCCC(=O)[C@H]1CCCCN1C 1458a_100000767060_100000751147 [0,2,0,0,0,0|2,0,0]=4 9404 B13R1.674 N#CCCC(=O)C1CCCCC1O 1458a_100011803323_100011215226 [0,2,0,0,0,0|1,0,1]=4 9405 B13R1.674 O=C(CCCF)C1CCCCC1O 1458a_100011803323_100011934791 [0,2,0,0,0,0|1,0,0]=3 9406 B13R1.674 O=C(CCCO)C1CCCCC1O 1458a_100011803323_100011215043 [0,2,0,0,0,0|1,0,0]=3 9407 B13R1.2522 C#CCCC(=O)C1(CCCCC1)C 1458a_100000762840_100000753159 [0,2,0,0,0,0|1,0,1]=4 9408 B13R1.2522 C#CCCC(=O)C1(CCCCC1)F 1458a_100000069003_100000753159 [0,2,0,0,0,0|1,0,1]=4 9409 B13R1.2522 C#CCCC(=O)C1(CCCCC1)O 1458a_100000242742_100000753159 [0,2,0,0,0,0|1,0,1]=4 9410 B13R1.2522 C#CCNC(=O)C1(CCCCC1)C 11a_100000212058_100000762840 [0,2,0,0,0,0|1,0,1]=4 9411 B13R1.2522 C#CCNC(=O)C1(CCCCC1)C 1626a_100000212058_100000762840 [0,2,0,0,0,0|1,0,1]=4 9412 B13R1.2522 C#CCNC(=O)C1(CCCCC1)C 240690a_100000212058_100000762840 [0,2,0,0,0,0|1,0,1]=4 9413 B13R1.2522 C#CCNC(=O)C1(CCCCC1)C 527a_100000212058_100000762840 [0,2,0,0,0,0|1,0,1]=4 9414 B13R1.2522 C#CCNC(=O)C1(CCCCC1)F 11a_100000212058_100000069003 [0,2,0,0,0,0|1,0,1]=4 9415 B13R1.2522 C#CCNC(=O)C1(CCCCC1)F 1626a_100000212058_100000069003 [0,2,0,0,0,0|1,0,1]=4 9416 B13R1.2522 C#CCNC(=O)C1(CCCCC1)F 240690a_100000212058_100000069003 [0,2,0,0,0,0|1,0,1]=4 9417 B13R1.2522 C#CCNC(=O)C1(CCCCC1)F 527a_100000212058_100000069003 [0,2,0,0,0,0|1,0,1]=4 9418 B13R1.2522 C#CCNC(=O)C1(CCCCC1)O 240690a_100000212058_100000242742 [0,2,0,0,0,0|1,0,1]=4 9419 B13R1.2522 C/C=C/CC(=O)C1(CCCCC1)C 1458a_100000762840_100102629194 [0,2,0,0,0,0|1,0,1]=4 9420 B13R1.2522 C/C=C/CC(=O)C1(CCCCC1)F 1458a_100000069003_100102629194 [0,2,0,0,0,0|1,0,1]=4 9421 B13R1.2522 C/C=C/CC(=O)C1(CCCCC1)O 1458a_100000242742_100102629194 [0,2,0,0,0,0|1,0,1]=4 9422 B13R1.2522 C=CCCC(=O)C1(CCCCC1)C 1458a_100000762840_100000754431 [0,2,0,0,0,0|1,0,1]=4 9423 B13R1.2522 C=CCCC(=O)C1(CCCCC1)F 1458a_100000069003_100000754431 [0,2,0,0,0,0|1,0,1]=4 9424 B13R1.2522 C=CCCC(=O)C1(CCCCC1)O 1458a_100000242742_100000754431 [0,2,0,0,0,0|1,0,1]=4 9425 B13R1.2522 C=CCNC(=O)C1(CCCCC1)C 1626a_100020586998_100000762840 [0,2,0,0,0,0|1,0,1]=4 9426 B13R1.2522 C=CCNC(=O)C1(CCCCC1)C 240690a_100020586998_100000762840 [0,2,0,0,0,0|1,0,1]=4 9427 B13R1.2522 C=CCNC(=O)C1(CCCCC1)C 527a_100020586998_100000762840 [0,2,0,0,0,0|1,0,1]=4 9428 B13R1.2522 C=CCNC(=O)C1(CCCCC1)F 1626a_100020586998_100000069003 [0,2,0,0,0,0|1,0,1]=4 9429 B13R1.2522 C=CCNC(=O)C1(CCCCC1)F 240690a_100020586998_100000069003 [0,2,0,0,0,0|1,0,1]=4 9430 B13R1.2522 C=CCNC(=O)C1(CCCCC1)F 527a_100020586998_100000069003 [0,2,0,0,0,0|1,0,1]=4 9431 B13R1.2522 C=CCNC(=O)C1(CCCCC1)O 240690a_100020586998_100000242742 [0,2,0,0,0,0|1,0,1]=4 9432 B13R1.2522 CC#CCC(=O)C1(CCCCC1)C 1458a_100000762840_100000748600 [0,2,0,0,0,0|1,0,1]=4 9433 B13R1.2522 CC#CCC(=O)C1(CCCCC1)F 1458a_100000069003_100000748600 [0,2,0,0,0,0|1,0,1]=4 9434 B13R1.2522 CC#CCC(=O)C1(CCCCC1)O 1458a_100000242742_100000748600 [0,2,0,0,0,0|1,0,1]=4 9435 B13R1.2522 CC1(CCCCC1)C(=O)CCC#N 1458a_100000762840_100011215226 [0,2,0,0,0,0|1,0,1]=4 9436 B13R1.2522 CC1(CCCCC1)C(=O)CCCF 1458a_100000762840_100011934791 [0,2,0,0,0,0|1,0,0]=3 9437 B13R1.2522 CC1(CCCCC1)C(=O)CCCO 1458a_100000762840_100011215043 [0,2,0,0,0,0|1,0,0]=3 9438 B13R1.2522 CC1(CCCCC1)C(=O)NCC#N 1626a_100000734998_100000762840 [0,2,0,0,0,0|1,0,1]=4 9439 B13R1.2522 CC1(CCCCC1)C(=O)NCC#N 527a_100000734998_100000762840 [0,2,0,0,0,0|1,0,1]=4 9440 B13R1.2522 CC1(CCCCC1)C(=O)NCCF 11a_100000724931_100000762840 [0,2,0,0,0,0|1,0,0]=3 9441 B13R1.2522 CC1(CCCCC1)C(=O)NCCF 1626a_100000724931_100000762840 [0,2,0,0,0,0|1,0,0]=3 9442 B13R1.2522 CC1(CCCCC1)C(=O)NCCF 240690a_100000724931_100000762840 [0,2,0,0,0,0|1,0,0]=3 9443 B13R1.2522 CC1(CCCCC1)C(=O)NCCF 527a_100000724931_100000762840 [0,2,0,0,0,0|1,0,0]=3 9444 B13R1.2522 CC1(CCCCC1)C(=O)NCCO 240690a_100000210304_100000762840 [0,2,0,0,0,0|1,0,0]=3 9445 B13R1.2522 CC1(CCCCC1)C(=O)NCCO 527a_100000210304_100000762840 [0,2,0,0,0,0|1,0,0]=3 9446 B13R1.2522 CC1(CCOCC1)C(=O)CCCF 1458a_100000749465_100011934791 [0,2,0,0,0,0|2,0,0]=4 9447 B13R1.2522 CC1(CCOCC1)C(=O)CCCO 1458a_100000749465_100011215043 [0,2,0,0,0,0|2,0,0]=4 9448 B13R1.2522 CC1(CCOCC1)C(=O)NCCF 11a_100000724931_100000749465 [0,2,0,0,0,0|2,0,0]=4 9449 B13R1.2522 CC1(CCOCC1)C(=O)NCCF 1626a_100000724931_100000749465 [0,2,0,0,0,0|2,0,0]=4 9450 B13R1.2522 CC1(CCOCC1)C(=O)NCCF 240690a_100000724931_100000749465 [0,2,0,0,0,0|2,0,0]=4 9451 B13R1.2522 CC1(CCOCC1)C(=O)NCCF 527a_100000724931_100000749465 [0,2,0,0,0,0|2,0,0]=4 9452 B13R1.2522 CC1(CCOCC1)C(=O)NCCO 240690a_100000210304_100000749465 [0,2,0,0,0,0|2,0,0]=4 9453 B13R1.2522 CC1(CCOCC1)C(=O)NCCO 527a_100000210304_100000749465 [0,2,0,0,0,0|2,0,0]=4 9454 B13R1.2522 CC=CCC(=O)C1(CCCCC1)C 1458a_100000762840_100000070051 [0,2,0,0,0,0|1,0,1]=4 9455 B13R1.2522 CC=CCC(=O)C1(CCCCC1)F 1458a_100000069003_100000070051 [0,2,0,0,0,0|1,0,1]=4 9456 B13R1.2522 CC=CCC(=O)C1(CCCCC1)O 1458a_100000242742_100000070051 [0,2,0,0,0,0|1,0,1]=4 9457 B13R1.2522 CCCCC(=O)C1(CCCCC1)C 1458a_100000762840_100000210211 [0,2,0,0,0,0|1,0,0]=3 9458 B13R1.2522 CCCCC(=O)C1(CCCCC1)F 1458a_100000069003_100000210211 [0,2,0,0,0,0|1,0,0]=3 9459 B13R1.2522 CCCCC(=O)C1(CCCCC1)O 1458a_100000242742_100000210211 [0,2,0,0,0,0|1,0,0]=3 9460 B13R1.2522 CCCCC(=O)C1(CCOCC1)C 1458a_100000749465_100000210211 [0,2,0,0,0,0|2,0,0]=4 9461 B13R1.2522 CCCCC(=O)C1(CCOCC1)F 1458a_100009845733_100000210211 [0,2,0,0,0,0|2,0,0]=4 9462 B13R1.2522 CCCCC(=O)C1(CCOCC1)O 1458a_100000751969_100000210211 [0,2,0,0,0,0|2,0,0]=4 9463 B13R1.2522 CCCNC(=O)C1(CCCCC1)C 11a_100020643023_100000762840 [0,2,0,0,0,0|1,0,0]=3 9464 B13R1.2522 CCCNC(=O)C1(CCCCC1)C 1626a_100020643023_100000762840 [0,2,0,0,0,0|1,0,0]=3 9465 B13R1.2522 CCCNC(=O)C1(CCCCC1)C 240690a_100020643023_100000762840 [0,2,0,0,0,0|1,0,0]=3 9466 B13R1.2522 CCCNC(=O)C1(CCCCC1)C 527a_100020643023_100000762840 [0,2,0,0,0,0|1,0,0]=3 9467 B13R1.2522 CCCNC(=O)C1(CCCCC1)F 11a_100020643023_100000069003 [0,2,0,0,0,0|1,0,0]=3 9468 B13R1.2522 CCCNC(=O)C1(CCCCC1)F 1626a_100020643023_100000069003 [0,2,0,0,0,0|1,0,0]=3 9469 B13R1.2522 CCCNC(=O)C1(CCCCC1)F 240690a_100020643023_100000069003 [0,2,0,0,0,0|1,0,0]=3 9470 B13R1.2522 CCCNC(=O)C1(CCCCC1)F 527a_100020643023_100000069003 [0,2,0,0,0,0|1,0,0]=3 9471 B13R1.2522 CCCNC(=O)C1(CCCCC1)O 240690a_100020643023_100000242742 [0,2,0,0,0,0|1,0,0]=3 9472 B13R1.2522 CCCNC(=O)C1(CCOCC1)C 11a_100020643023_100000749465 [0,2,0,0,0,0|2,0,0]=4 9473 B13R1.2522 CCCNC(=O)C1(CCOCC1)C 1626a_100020643023_100000749465 [0,2,0,0,0,0|2,0,0]=4 9474 B13R1.2522 CCCNC(=O)C1(CCOCC1)C 240690a_100020643023_100000749465 [0,2,0,0,0,0|2,0,0]=4 9475 B13R1.2522 CCCNC(=O)C1(CCOCC1)C 527a_100020643023_100000749465 [0,2,0,0,0,0|2,0,0]=4 9476 B13R1.2522 CCCNC(=O)C1(CCOCC1)F 11a_100020643023_100009845733 [0,2,0,0,0,0|2,0,0]=4 9477 B13R1.2522 CCCNC(=O)C1(CCOCC1)F 1626a_100020643023_100009845733 [0,2,0,0,0,0|2,0,0]=4 9478 B13R1.2522 CCCNC(=O)C1(CCOCC1)F 240690a_100020643023_100009845733 [0,2,0,0,0,0|2,0,0]=4 9479 B13R1.2522 CCCNC(=O)C1(CCOCC1)F 527a_100020643023_100009845733 [0,2,0,0,0,0|2,0,0]=4 9480 B13R1.2522 CCCNC(=O)C1(CCOCC1)O 240690a_100020643023_100000751969 [0,2,0,0,0,0|2,0,0]=4 9481 B13R1.2522 CCNNC(=O)C1(CCCCC1)C 22a_100000756455_100000762840 [0,2,0,0,0,0|1,0,0]=3 9482 B13R1.2522 CCNNC(=O)C1(CCCCC1)F 22a_100000756455_100000069003 [0,2,0,0,0,0|1,0,0]=3 9483 B13R1.2522 CCNNC(=O)C1(CCCCC1)O 22a_100000756455_100000242742 [0,2,0,0,0,0|1,0,0]=3 9484 B13R1.2522 CCNNC(=O)C1(CCOCC1)C 22a_100000756455_100000749465 [0,2,0,0,0,0|2,0,0]=4 9485 B13R1.2522 CCNNC(=O)C1(CCOCC1)F 22a_100000756455_100009845733 [0,2,0,0,0,0|2,0,0]=4 9486 B13R1.2522 CCNNC(=O)C1(CCOCC1)O 22a_100000756455_100000751969 [0,2,0,0,0,0|2,0,0]=4 9487 B13R1.2522 COCCC(=O)C1(CCCCC1)C 1458a_100000762840_100000233755 [0,2,0,0,0,0|1,0,0]=3 9488 B13R1.2522 COCCC(=O)C1(CCCCC1)F 1458a_100000069003_100000233755 [0,2,0,0,0,0|1,0,0]=3 9489 B13R1.2522 COCCC(=O)C1(CCCCC1)O 1458a_100000242742_100000233755 [0,2,0,0,0,0|1,0,0]=3 9490 B13R1.2522 COCCC(=O)C1(CCOCC1)C 1458a_100000749465_100000233755 [0,2,0,0,0,0|2,0,0]=4 9491 B13R1.2522 COCCC(=O)C1(CCOCC1)F 1458a_100009845733_100000233755 [0,2,0,0,0,0|2,0,0]=4 9492 B13R1.2522 COCCC(=O)C1(CCOCC1)O 1458a_100000751969_100000233755 [0,2,0,0,0,0|2,0,0]=4 9493 B13R1.2522 CSCCC(=O)C1(CCCCC1)C 1458a_100000762840_100000751147 [0,2,0,0,0,0|1,0,0]=3 9494 B13R1.2522 CSCCC(=O)C1(CCCCC1)F 1458a_100000069003_100000751147 [0,2,0,0,0,0|1,0,0]=3 9495 B13R1.2522 CSCCC(=O)C1(CCCCC1)O 1458a_100000242742_100000751147 [0,2,0,0,0,0|1,0,0]=3 9496 B13R1.2522 CSCCC(=O)C1(CCOCC1)C 1458a_100000749465_100000751147 [0,2,0,0,0,0|2,0,0]=4 9497 B13R1.2522 CSCCC(=O)C1(CCOCC1)F 1458a_100009845733_100000751147 [0,2,0,0,0,0|2,0,0]=4 9498 B13R1.2522 CSCCC(=O)C1(CCOCC1)O 1458a_100000751969_100000751147 [0,2,0,0,0,0|2,0,0]=4 9499 B13R1.2522 N#CCCC(=O)C1(CCCCC1)F 1458a_100000069003_100011215226 [0,2,0,0,0,0|1,0,1]=4 9500 B13R1.2522 N#CCCC(=O)C1(CCCCC1)O 1458a_100000242742_100011215226 [0,2,0,0,0,0|1,0,1]=4 9501 B13R1.2522 N#CCNC(=O)C1(CCCCC1)F 1626a_100000734998_100000069003 [0,2,0,0,0,0|1,0,1]=4 9502 B13R1.2522 N#CCNC(=O)C1(CCCCC1)F 527a_100000734998_100000069003 [0,2,0,0,0,0|1,0,1]=4 9503 B13R1.2522 O=C(CCCF)C1(CCCCC1)F 1458a_100000069003_100011934791 [0,2,0,0,0,0|1,0,0]=3 9504 B13R1.2522 O=C(CCCF)C1(CCCCC1)O 1458a_100000242742_100011934791 [0,2,0,0,0,0|1,0,0]=3 9505 B13R1.2522 O=C(CCCF)C1(CCOCC1)F 1458a_100009845733_100011934791 [0,2,0,0,0,0|2,0,0]=4 9506 B13R1.2522 O=C(CCCF)C1(CCOCC1)O 1458a_100000751969_100011934791 [0,2,0,0,0,0|2,0,0]=4 9507 B13R1.2522 O=C(CCCO)C1(CCCCC1)F 1458a_100000069003_100011215043 [0,2,0,0,0,0|1,0,0]=3 9508 B13R1.2522 O=C(CCCO)C1(CCCCC1)O 1458a_100000242742_100011215043 [0,2,0,0,0,0|1,0,0]=3 9509 B13R1.2522 O=C(CCCO)C1(CCOCC1)F 1458a_100009845733_100011215043 [0,2,0,0,0,0|2,0,0]=4 9510 B13R1.2522 O=C(CCCO)C1(CCOCC1)O 1458a_100000751969_100011215043 [0,2,0,0,0,0|2,0,0]=4 9511 B13R1.2522 O=C(NCCF)C1(CCCCC1)F 11a_100000724931_100000069003 [0,2,0,0,0,0|1,0,0]=3 9512 B13R1.2522 O=C(NCCF)C1(CCCCC1)F 1626a_100000724931_100000069003 [0,2,0,0,0,0|1,0,0]=3 9513 B13R1.2522 O=C(NCCF)C1(CCCCC1)F 240690a_100000724931_100000069003 [0,2,0,0,0,0|1,0,0]=3 9514 B13R1.2522 O=C(NCCF)C1(CCCCC1)F 527a_100000724931_100000069003 [0,2,0,0,0,0|1,0,0]=3 9515 B13R1.2522 O=C(NCCF)C1(CCCCC1)O 240690a_100000724931_100000242742 [0,2,0,0,0,0|1,0,0]=3 9516 B13R1.2522 O=C(NCCF)C1(CCOCC1)F 11a_100000724931_100009845733 [0,2,0,0,0,0|2,0,0]=4 9517 B13R1.2522 O=C(NCCF)C1(CCOCC1)F 1626a_100000724931_100009845733 [0,2,0,0,0,0|2,0,0]=4 9518 B13R1.2522 O=C(NCCF)C1(CCOCC1)F 240690a_100000724931_100009845733 [0,2,0,0,0,0|2,0,0]=4 9519 B13R1.2522 O=C(NCCF)C1(CCOCC1)F 527a_100000724931_100009845733 [0,2,0,0,0,0|2,0,0]=4 9520 B13R1.2522 O=C(NCCF)C1(CCOCC1)O 240690a_100000724931_100000751969 [0,2,0,0,0,0|2,0,0]=4 9521 B13R1.2522 O=C(NCCO)C1(CCCCC1)F 240690a_100000210304_100000069003 [0,2,0,0,0,0|1,0,0]=3 9522 B13R1.2522 O=C(NCCO)C1(CCCCC1)F 527a_100000210304_100000069003 [0,2,0,0,0,0|1,0,0]=3 9523 B13R1.2522 O=C(NCCO)C1(CCCCC1)O 240690a_100000210304_100000242742 [0,2,0,0,0,0|1,0,0]=3 9524 B13R1.2522 O=C(NCCO)C1(CCOCC1)F 240690a_100000210304_100009845733 [0,2,0,0,0,0|2,0,0]=4 9525 B13R1.2522 O=C(NCCO)C1(CCOCC1)F 527a_100000210304_100009845733 [0,2,0,0,0,0|2,0,0]=4 9526 B13R1.2522 O=C(NCCO)C1(CCOCC1)O 240690a_100000210304_100000751969 [0,2,0,0,0,0|2,0,0]=4 9527 B13R1.86 CCC(CC)C(=O)C1CCCCC1 1458a_100000210647_100000210505 [0,2,0,0,0,0|1,0,0]=3 9528 B13R1.86 CCC(CC)C(=O)C1CCCCC1 1458a_100000211163_100000210327 [0,2,0,0,0,0|1,0,0]=3 9529 B13R1.86 CCC(CC)C(=O)C1CCCCO1 1458a_100000748299_100000210505 [0,2,0,0,0,0|2,0,0]=4 9530 B13R1.86 CCC(CC)C(=O)C1CCCOC1 1458a_100000211163_100000693364 [0,2,0,0,0,0|2,0,0]=4 9531 B13R1.86 CCC(CC)C(=O)C1CCCOC1 1458a_100000741522_100000210505 [0,2,0,0,0,0|2,0,0]=4 9532 B13R1.86 CCC(CC)C(=O)C1CCOCC1 1458a_100000195482_100000210505 [0,2,0,0,0,0|2,0,0]=4 9533 B13R1.86 CCC(CC)C(=O)C1CCOCC1 1458a_100000211163_100011324220 [0,2,0,0,0,0|2,0,0]=4 9534 B13R1.86 CCC(CC)C(=O)C1CCSCC1 1458a_100000755232_100000210505 [0,2,0,0,0,0|2,0,0]=4 9535 B13R1.86 CCC(NC)C(=O)N1CCCCC1 2230a_106832991635_200011763366 [0,2,0,0,0,0|2,0,0]=4 9536 B13R1.86 CCC(NC)C(=O)N1CCCCC1 34a_100102657272_200011763366 [0,2,0,0,0,0|2,0,0]=4 9537 B13R1.86 CCC(NC)C(=O)N1CCCCC1 7a_106832991635_200011763366 [0,2,0,0,0,0|2,0,0]=4 9538 B13R1.86 CCC(OC)C(=O)C1CCCCC1 1458a_100000747056_100000210327 [0,2,0,0,0,0|1,0,0]=3 9539 B13R1.86 CCC(OC)C(=O)C1CCCOC1 1458a_100000747056_100000693364 [0,2,0,0,0,0|2,0,0]=4 9540 B13R1.86 CCC(OC)C(=O)C1CCOCC1 1458a_100000747056_100011324220 [0,2,0,0,0,0|2,0,0]=4 9541 B13R1.86 CCC(OC)C(=O)N1CCCCC1 34a_100138415774_200011763366 [0,2,0,0,0,0|2,0,0]=4 9542 B13R1.86 CCC(SC)C(=O)N1CCCCC1 62a_200000210301_200011763366 [0,2,0,0,0,0|2,0,0]=4 9543 B13R1.86 CCC(SC)C(=O)N1CCCCC1 62a_200011763366_200000210301 [0,2,0,0,0,0|2,0,0]=4 9544 B13R1.86 CCC(S[13CH3])C(=O)N1CCCCC1 62a_200011763366_200025704644 [0,2,0,0,0,0|2,0,0]=4 9545 B13R1.86 CCC(S[13CH3])C(=O)N1CCCCC1 62a_200025704644_200011763366 [0,2,0,0,0,0|2,0,0]=4 9546 B13R1.86 CCN(CC)C(=O)C1CCCCC1 11a_100000724800_100000210647 [0,2,0,0,0,0|1,0,0]=3 9547 B13R1.86 CCN(CC)C(=O)C1CCCCC1 1626a_100000724800_100000210647 [0,2,0,0,0,0|1,0,0]=3 9548 B13R1.86 CCN(CC)C(=O)C1CCCCC1 240690a_100000724800_100000210647 [0,2,0,0,0,0|1,0,0]=3 9549 B13R1.86 CCN(CC)C(=O)C1CCCCC1 527a_100000724800_100000210647 [0,2,0,0,0,0|1,0,0]=3 9550 B13R1.86 CCN(CC)C(=O)C1CCCCO1 11a_100000724800_100000748299 [0,2,0,0,0,0|2,0,0]=4 9551 B13R1.86 CCN(CC)C(=O)C1CCCCO1 1626a_100000724800_100000748299 [0,2,0,0,0,0|2,0,0]=4 9552 B13R1.86 CCN(CC)C(=O)C1CCCCO1 240690a_100000724800_100000748299 [0,2,0,0,0,0|2,0,0]=4 9553 B13R1.86 CCN(CC)C(=O)C1CCCCO1 527a_100000724800_100000748299 [0,2,0,0,0,0|2,0,0]=4 9554 B13R1.86 CCN(CC)C(=O)C1CCCOC1 11a_100000724800_100000741522 [0,2,0,0,0,0|2,0,0]=4 9555 B13R1.86 CCN(CC)C(=O)C1CCCOC1 1626a_100000724800_100000741522 [0,2,0,0,0,0|2,0,0]=4 9556 B13R1.86 CCN(CC)C(=O)C1CCCOC1 240690a_100000724800_100000741522 [0,2,0,0,0,0|2,0,0]=4 9557 B13R1.86 CCN(CC)C(=O)C1CCCOC1 527a_100000724800_100000741522 [0,2,0,0,0,0|2,0,0]=4 9558 B13R1.86 CCN(CC)C(=O)C1CCOCC1 11a_100000724800_100000195482 [0,2,0,0,0,0|2,0,0]=4 9559 B13R1.86 CCN(CC)C(=O)C1CCOCC1 1626a_100000724800_100000195482 [0,2,0,0,0,0|2,0,0]=4 9560 B13R1.86 CCN(CC)C(=O)C1CCOCC1 240690a_100000724800_100000195482 [0,2,0,0,0,0|2,0,0]=4 9561 B13R1.86 CCN(CC)C(=O)C1CCOCC1 527a_100000724800_100000195482 [0,2,0,0,0,0|2,0,0]=4 9562 B13R1.86 CCN(CC)C(=O)C1CCSCC1 11a_100000724800_100000755232 [0,2,0,0,0,0|2,0,0]=4 9563 B13R1.86 CCN(CC)C(=O)C1CCSCC1 1626a_100000724800_100000755232 [0,2,0,0,0,0|2,0,0]=4 9564 B13R1.86 CCN(CC)C(=O)C1CCSCC1 240690a_100000724800_100000755232 [0,2,0,0,0,0|2,0,0]=4 9565 B13R1.86 CCN(CC)C(=O)C1CCSCC1 527a_100000724800_100000755232 [0,2,0,0,0,0|2,0,0]=4 9566 B13R1.86 COC(OC)C(=O)C1CCCCC1 1458a_100000046285_100000210327 [0,2,0,0,0,0|2,0,0]=4 9567 B13R1.152 CC(=O)C(C)C(=O)C1CCCCC1 1458a_100000210647_100000179758 [0,2,0,0,0,0|1,0,1]=4 9568 B13R1.152 CC(C)C(=O)C(=O)N1CCCCC1 1458a_200011297168_100000210206 [0,2,0,0,0,0|2,0,0]=4 9569 B13R1.152 CC(C)C(C)C(=O)C1CCCCC1 1458a_100000755409_100000210327 [0,2,0,0,0,0|1,0,0]=3 9570 B13R1.152 CC(C)C(C)C(=O)C1CCCOC1 1458a_100000755409_100000693364 [0,2,0,0,0,0|2,0,0]=4 9571 B13R1.152 CC(C)C(C)C(=O)C1CCOCC1 1458a_100000755409_100011324220 [0,2,0,0,0,0|2,0,0]=4 9572 B13R1.152 CC(C)N(C)C(=O)C1CCCCC1 11a_200000211004_100000210647 [0,2,0,0,0,0|1,0,0]=3 9573 B13R1.152 CC(C)N(C)C(=O)C1CCCCC1 1626a_200000211004_100000210647 [0,2,0,0,0,0|1,0,0]=3 9574 B13R1.152 CC(C)N(C)C(=O)C1CCCCC1 240690a_200000211004_100000210647 [0,2,0,0,0,0|1,0,0]=3 9575 B13R1.152 CC(C)N(C)C(=O)C1CCCCC1 527a_200000211004_100000210647 [0,2,0,0,0,0|1,0,0]=3 9576 B13R1.152 CC(C)N(C)C(=O)C1CCCCO1 11a_200000211004_100000748299 [0,2,0,0,0,0|2,0,0]=4 9577 B13R1.152 CC(C)N(C)C(=O)C1CCCCO1 1626a_200000211004_100000748299 [0,2,0,0,0,0|2,0,0]=4 9578 B13R1.152 CC(C)N(C)C(=O)C1CCCCO1 240690a_200000211004_100000748299 [0,2,0,0,0,0|2,0,0]=4 9579 B13R1.152 CC(C)N(C)C(=O)C1CCCCO1 527a_200000211004_100000748299 [0,2,0,0,0,0|2,0,0]=4 9580 B13R1.152 CC(C)N(C)C(=O)C1CCCOC1 11a_200000211004_100000741522 [0,2,0,0,0,0|2,0,0]=4 9581 B13R1.152 CC(C)N(C)C(=O)C1CCCOC1 1626a_200000211004_100000741522 [0,2,0,0,0,0|2,0,0]=4 9582 B13R1.152 CC(C)N(C)C(=O)C1CCCOC1 240690a_200000211004_100000741522 [0,2,0,0,0,0|2,0,0]=4 9583 B13R1.152 CC(C)N(C)C(=O)C1CCCOC1 527a_200000211004_100000741522 [0,2,0,0,0,0|2,0,0]=4 9584 B13R1.152 CC(C)N(C)C(=O)C1CCOCC1 11a_200000211004_100000195482 [0,2,0,0,0,0|2,0,0]=4 9585 B13R1.152 CC(C)N(C)C(=O)C1CCOCC1 1626a_200000211004_100000195482 [0,2,0,0,0,0|2,0,0]=4 9586 B13R1.152 CC(C)N(C)C(=O)C1CCOCC1 240690a_200000211004_100000195482 [0,2,0,0,0,0|2,0,0]=4 9587 B13R1.152 CC(C)N(C)C(=O)C1CCOCC1 527a_200000211004_100000195482 [0,2,0,0,0,0|2,0,0]=4 9588 B13R1.152 CC(C)N(C)C(=O)C1CCSCC1 11a_200000211004_100000755232 [0,2,0,0,0,0|2,0,0]=4 9589 B13R1.152 CC(C)N(C)C(=O)C1CCSCC1 1626a_200000211004_100000755232 [0,2,0,0,0,0|2,0,0]=4 9590 B13R1.152 CC(C)N(C)C(=O)C1CCSCC1 240690a_200000211004_100000755232 [0,2,0,0,0,0|2,0,0]=4 9591 B13R1.152 CC(C)N(C)C(=O)C1CCSCC1 527a_200000211004_100000755232 [0,2,0,0,0,0|2,0,0]=4 9592 B13R1.152 CC(C)[C@@H](O)C(=O)C1CCCCC1 1458a_100000691806_100000210327 [0,2,0,0,0,0|1,0,0]=3 9593 B13R1.152 CC(C)[C@@H](O)C(=O)C1CCCOC1 1458a_100000691806_100000693364 [0,2,0,0,0,0|2,0,0]=4 9594 B13R1.152 CC(C)[C@@H](O)C(=O)C1CCOCC1 1458a_100000691806_100011324220 [0,2,0,0,0,0|2,0,0]=4 9595 B13R1.152 CN(C)C(=O)C(=O)C1CCCCC1 1458a_100011218876_100000210327 [0,2,0,0,0,0|2,0,0]=4 9596 B13R1.152 C[C@@H](C(=O)C1CCCCC1)N(C)C 1458a_100009822176_100000210327 [0,2,0,0,0,0|2,0,0]=4 9597 B13R1.263 CC(C)(CF)C(=O)C1CCCCC1 1458a_100000138116_100000210327 [0,2,0,0,0,0|2,0,0]=4 9598 B13R1.263 CC(C)(CO)C(=O)C1CCCCC1 1458a_100000749806_100000210327 [0,2,0,0,0,0|2,0,0]=4 9599 B13R1.263 CCC(C)(C)C(=O)C1CCCCC1 1458a_100000749717_100000210327 [0,2,0,0,0,0|1,0,0]=3 9600 B13R1.263 CCC(C)(C)C(=O)C1CCCOC1 1458a_100000749717_100000693364 [0,2,0,0,0,0|2,0,0]=4 9601 B13R1.263 CCC(C)(C)C(=O)C1CCOCC1 1458a_100000749717_100011324220 [0,2,0,0,0,0|2,0,0]=4 9602 B13R1.263 CCC(C)(O)C(=O)C1CCCCC1 1458a_100011219770_100000210327 [0,2,0,0,0,0|1,0,0]=3 9603 B13R1.263 CCC(C)(O)C(=O)C1CCCOC1 1458a_100011219770_100000693364 [0,2,0,0,0,0|2,0,0]=4 9604 B13R1.263 CCC(C)(O)C(=O)C1CCOCC1 1458a_100011219770_100011324220 [0,2,0,0,0,0|2,0,0]=4 9605 B13R1.263 CCC(F)(F)C(=O)C1CCCCC1 1458a_100000061896_100000210327 [0,2,0,0,0,0|1,0,0]=3 9606 B13R1.263 CCC(F)(F)C(=O)C1CCCOC1 1458a_100000061896_100000693364 [0,2,0,0,0,0|2,0,0]=4 9607 B13R1.263 CCC(F)(F)C(=O)C1CCOCC1 1458a_100000061896_100011324220 [0,2,0,0,0,0|2,0,0]=4 9608 B13R1.263 COC(C)(C)C(=O)C1CCCCC1 1458a_100000753492_100000210327 [0,2,0,0,0,0|2,0,0]=4 9609 B13R1.696 CCC(C)C(=O)C1CCCCC1=O 1458a_100011192722_100000204591 [0,2,0,0,0,0|1,0,1]=4 9610 B13R1.696 CCC(C)C(=O)C1CCCCC1C 1458a_100011215568_100000758301 [0,2,0,0,0,0|1,0,0]=3 9611 B13R1.696 CCC(C)C(=O)C1CCCCC1O 1458a_100011803323_100000758301 [0,2,0,0,0,0|1,0,0]=3 9612 B13R1.696 CCC(C)C(=O)N1CCCCC1C 11a_100000211376_100011192722 [0,2,0,0,0,0|2,0,0]=4 9613 B13R1.696 CCC(C)C(=O)N1CCCCC1C 1626a_100000211376_100011192722 [0,2,0,0,0,0|2,0,0]=4 9614 B13R1.696 CCC(C)C(=O)N1CCCCC1C 240690a_100000211376_100011192722 [0,2,0,0,0,0|2,0,0]=4 9615 B13R1.696 CCC(C)C(=O)N1CCCCC1C 527a_100000211376_100011192722 [0,2,0,0,0,0|2,0,0]=4 9616 B13R1.696 CCC(C)C(=O)[C@H]1CCCCN1C 1458a_100000767060_100000758301 [0,2,0,0,0,0|2,0,0]=4 9617 B13R1.696 CCC(O)C(=O)C1CCCCC1=O 1458a_100011196387_100000204591 [0,2,0,0,0,0|1,0,1]=4 9618 B13R1.696 CCC(O)C(=O)N1CCCCC1C 240690a_100000211376_100011196387 [0,2,0,0,0,0|2,0,0]=4 9619 B13R1.696 CCN(C)C(=O)C1CCCCC1C 11a_100000225621_100011215568 [0,2,0,0,0,0|1,0,0]=3 9620 B13R1.696 CCN(C)C(=O)C1CCCCC1C 1626a_100000225621_100011215568 [0,2,0,0,0,0|1,0,0]=3 9621 B13R1.696 CCN(C)C(=O)C1CCCCC1C 240690a_100000225621_100011215568 [0,2,0,0,0,0|1,0,0]=3 9622 B13R1.696 CCN(C)C(=O)C1CCCCC1C 527a_100000225621_100011215568 [0,2,0,0,0,0|1,0,0]=3 9623 B13R1.696 CCN(C)C(=O)[C@H]1CCCCN1C 11a_100000225621_100000767060 [0,2,0,0,0,0|2,0,0]=4 9624 B13R1.696 CCN(C)C(=O)[C@H]1CCCCN1C 1626a_100000225621_100000767060 [0,2,0,0,0,0|2,0,0]=4 9625 B13R1.696 CCN(C)C(=O)[C@H]1CCCCN1C 240690a_100000225621_100000767060 [0,2,0,0,0,0|2,0,0]=4 9626 B13R1.696 CCN(C)C(=O)[C@H]1CCCCN1C 527a_100000225621_100000767060 [0,2,0,0,0,0|2,0,0]=4 9627 B13R1.708 CCN(C)S(=O)(=O)C1CCCCC1 270084a_100000225621_100011219266 [0,2,0,0,0,0|2,0,0]=4 9628 B13R1.708 CCN(C)S(=O)(=O)C1CCCCC1 274078a_100000225621_100011219266 [0,2,0,0,0,0|2,0,0]=4 9629 B13R1.2650 CCC(C)C(=O)C1(CCCCC1)C 1458a_100000762840_100000758301 [0,2,0,0,0,0|1,0,0]=3 9630 B13R1.2650 CCC(C)C(=O)C1(CCCCC1)F 1458a_100000069003_100000758301 [0,2,0,0,0,0|1,0,0]=3 9631 B13R1.2650 CCC(C)C(=O)C1(CCCCC1)O 1458a_100000242742_100000758301 [0,2,0,0,0,0|1,0,0]=3 9632 B13R1.2650 CCC(C)C(=O)C1(CCOCC1)C 1458a_100000749465_100000758301 [0,2,0,0,0,0|2,0,0]=4 9633 B13R1.2650 CCC(C)C(=O)C1(CCOCC1)F 1458a_100009845733_100000758301 [0,2,0,0,0,0|2,0,0]=4 9634 B13R1.2650 CCC(C)C(=O)C1(CCOCC1)O 1458a_100000751969_100000758301 [0,2,0,0,0,0|2,0,0]=4 9635 B13R1.2650 CCN(C)C(=O)C1(CCCCC1)C 11a_100000225621_100000762840 [0,2,0,0,0,0|1,0,0]=3 9636 B13R1.2650 CCN(C)C(=O)C1(CCCCC1)C 1626a_100000225621_100000762840 [0,2,0,0,0,0|1,0,0]=3 9637 B13R1.2650 CCN(C)C(=O)C1(CCCCC1)C 240690a_100000225621_100000762840 [0,2,0,0,0,0|1,0,0]=3 9638 B13R1.2650 CCN(C)C(=O)C1(CCCCC1)C 527a_100000225621_100000762840 [0,2,0,0,0,0|1,0,0]=3 9639 B13R1.2650 CCN(C)C(=O)C1(CCCCC1)F 11a_100000225621_100000069003 [0,2,0,0,0,0|1,0,0]=3 9640 B13R1.2650 CCN(C)C(=O)C1(CCCCC1)F 1626a_100000225621_100000069003 [0,2,0,0,0,0|1,0,0]=3 9641 B13R1.2650 CCN(C)C(=O)C1(CCCCC1)F 240690a_100000225621_100000069003 [0,2,0,0,0,0|1,0,0]=3 9642 B13R1.2650 CCN(C)C(=O)C1(CCCCC1)F 527a_100000225621_100000069003 [0,2,0,0,0,0|1,0,0]=3 9643 B13R1.2650 CCN(C)C(=O)C1(CCCCC1)O 240690a_100000225621_100000242742 [0,2,0,0,0,0|1,0,0]=3 9644 B13R1.2650 CCN(C)C(=O)C1(CCOCC1)C 11a_100000225621_100000749465 [0,2,0,0,0,0|2,0,0]=4 9645 B13R1.2650 CCN(C)C(=O)C1(CCOCC1)C 1626a_100000225621_100000749465 [0,2,0,0,0,0|2,0,0]=4 9646 B13R1.2650 CCN(C)C(=O)C1(CCOCC1)C 240690a_100000225621_100000749465 [0,2,0,0,0,0|2,0,0]=4 9647 B13R1.2650 CCN(C)C(=O)C1(CCOCC1)C 527a_100000225621_100000749465 [0,2,0,0,0,0|2,0,0]=4 9648 B13R1.2650 CCN(C)C(=O)C1(CCOCC1)F 11a_100000225621_100009845733 [0,2,0,0,0,0|2,0,0]=4 9649 B13R1.2650 CCN(C)C(=O)C1(CCOCC1)F 1626a_100000225621_100009845733 [0,2,0,0,0,0|2,0,0]=4 9650 B13R1.2650 CCN(C)C(=O)C1(CCOCC1)F 240690a_100000225621_100009845733 [0,2,0,0,0,0|2,0,0]=4 9651 B13R1.2650 CCN(C)C(=O)C1(CCOCC1)F 527a_100000225621_100009845733 [0,2,0,0,0,0|2,0,0]=4 9652 B13R1.2650 CCN(C)C(=O)C1(CCOCC1)O 240690a_100000225621_100000751969 [0,2,0,0,0,0|2,0,0]=4 9653 B13R1.347 CC(C)NS(=O)(=O)C1CCCCC1 270084a_100138425928_100011219266 [0,2,0,0,0,0|2,0,0]=4 9654 B13R1.347 CC(C)NS(=O)(=O)C1CCCCC1 274078a_100138425928_100011219266 [0,2,0,0,0,0|2,0,0]=4 9655 B13R1.201 C=C(C)CC(=O)C1CCCCC1C 1458a_100011215568_100000748629 [0,2,0,0,0,0|1,0,1]=4 9656 B13R1.201 C=C(C)CC(=O)C1CCCCC1O 1458a_100011803323_100000748629 [0,2,0,0,0,0|1,0,1]=4 9657 B13R1.201 CC(C)CC(=O)C1CCCCC1=O 1458a_100000210554_100000204591 [0,2,0,0,0,0|1,0,1]=4 9658 B13R1.201 CC(C)CC(=O)C1CCCCC1C 1458a_100011215568_100000210624 [0,2,0,0,0,0|1,0,0]=3 9659 B13R1.201 CC(C)CC(=O)C1CCCCC1O 1458a_100011803323_100000210624 [0,2,0,0,0,0|1,0,0]=3 9660 B13R1.201 CC(C)CC(=O)N1CCCCC1C 11a_100000211376_100000210554 [0,2,0,0,0,0|2,0,0]=4 9661 B13R1.201 CC(C)CC(=O)N1CCCCC1C 1626a_100000211376_100000210554 [0,2,0,0,0,0|2,0,0]=4 9662 B13R1.201 CC(C)CC(=O)N1CCCCC1C 240690a_100000211376_100000210554 [0,2,0,0,0,0|2,0,0]=4 9663 B13R1.201 CC(C)CC(=O)N1CCCCC1C 527a_100000211376_100000210554 [0,2,0,0,0,0|2,0,0]=4 9664 B13R1.201 CC(C)CC(=O)[C@H]1CCCCN1C 1458a_100000767060_100000210624 [0,2,0,0,0,0|2,0,0]=4 9665 B13R1.201 CC(C)NC(=O)C1CCCCC1C 11a_100138425928_100011215568 [0,2,0,0,0,0|1,0,0]=3 9666 B13R1.201 CC(C)NC(=O)C1CCCCC1C 1626a_100138425928_100011215568 [0,2,0,0,0,0|1,0,0]=3 9667 B13R1.201 CC(C)NC(=O)C1CCCCC1C 240690a_100138425928_100011215568 [0,2,0,0,0,0|1,0,0]=3 9668 B13R1.201 CC(C)NC(=O)C1CCCCC1C 527a_100138425928_100011215568 [0,2,0,0,0,0|1,0,0]=3 9669 B13R1.201 CC(C)NC(=O)N1CCCCC1C 2708a_100138425928_100000211376 [0,2,0,0,0,0|2,0,0]=4 9670 B13R1.201 CC(C)NC(=O)N1CCCCC1C 273464a_100138425928_100000211376 [0,2,0,0,0,0|2,0,0]=4 9671 B13R1.201 CC(C)NC(=O)[C@H]1CCCCN1C 11a_100138425928_100000767060 [0,2,0,0,0,0|2,0,0]=4 9672 B13R1.201 CC(C)NC(=O)[C@H]1CCCCN1C 1626a_100138425928_100000767060 [0,2,0,0,0,0|2,0,0]=4 9673 B13R1.201 CC(C)NC(=O)[C@H]1CCCCN1C 240690a_100138425928_100000767060 [0,2,0,0,0,0|2,0,0]=4 9674 B13R1.201 CC(C)NC(=O)[C@H]1CCCCN1C 527a_100138425928_100000767060 [0,2,0,0,0,0|2,0,0]=4 9675 B13R1.201 CC(O)CC(=O)C1CCCCC1C 1458a_100011215568_100011218427 [0,2,0,0,0,0|1,0,0]=3 9676 B13R1.201 CC(O)CC(=O)C1CCCCC1O 1458a_100011803323_100011218427 [0,2,0,0,0,0|1,0,0]=3 9677 B13R1.201 CC(O)CC(=O)[C@H]1CCCCN1C 1458a_100000767060_100011218427 [0,2,0,0,0,0|2,0,0]=4 9678 B13R1.201 CC1CCCCC1C(=O)CC(F)F 1458a_100011215568_100011934356 [0,2,0,0,0,0|2,0,0]=4 9679 B13R1.201 CC1CCCCN1C(=O)C[C@@H](C)O 240690a_100000211376_100011933948 [0,2,0,0,0,0|2,0,0]=4 9680 B13R1.201 C[C@@H](O)CC(=O)C1CCCCC1=O 1458a_100011933948_100000204591 [0,2,0,0,0,0|1,0,1]=4 9681 B13R1.201 O=C(CC(F)F)C1CCCCC1O 1458a_100011803323_100011934356 [0,2,0,0,0,0|2,0,0]=4 9682 B13R1.352 CC(C)(C)CC(=O)C1CCCCC1 1458a_100000211214_100000210327 [0,2,0,0,0,0|1,0,0]=3 9683 B13R1.352 CC(C)(C)CC(=O)C1CCCOC1 1458a_100000211214_100000693364 [0,2,0,0,0,0|2,0,0]=4 9684 B13R1.352 CC(C)(C)CC(=O)C1CCOCC1 1458a_100000211214_100011324220 [0,2,0,0,0,0|2,0,0]=4 9685 B13R1.352 CC(C)(C)NC(=O)C1CCCCC1 11a_100000715429_100000210647 [0,2,0,0,0,0|1,0,0]=3 9686 B13R1.352 CC(C)(C)NC(=O)C1CCCCC1 1626a_100000715429_100000210647 [0,2,0,0,0,0|1,0,0]=3 9687 B13R1.352 CC(C)(C)NC(=O)C1CCCCC1 240690a_100000715429_100000210647 [0,2,0,0,0,0|1,0,0]=3 9688 B13R1.352 CC(C)(C)NC(=O)C1CCCCC1 527a_100000715429_100000210647 [0,2,0,0,0,0|1,0,0]=3 9689 B13R1.352 CC(C)(C)NC(=O)C1CCCCO1 11a_100000715429_100000748299 [0,2,0,0,0,0|2,0,0]=4 9690 B13R1.352 CC(C)(C)NC(=O)C1CCCCO1 1626a_100000715429_100000748299 [0,2,0,0,0,0|2,0,0]=4 9691 B13R1.352 CC(C)(C)NC(=O)C1CCCCO1 240690a_100000715429_100000748299 [0,2,0,0,0,0|2,0,0]=4 9692 B13R1.352 CC(C)(C)NC(=O)C1CCCCO1 527a_100000715429_100000748299 [0,2,0,0,0,0|2,0,0]=4 9693 B13R1.352 CC(C)(C)NC(=O)C1CCCOC1 11a_100000715429_100000741522 [0,2,0,0,0,0|2,0,0]=4 9694 B13R1.352 CC(C)(C)NC(=O)C1CCCOC1 1626a_100000715429_100000741522 [0,2,0,0,0,0|2,0,0]=4 9695 B13R1.352 CC(C)(C)NC(=O)C1CCCOC1 240690a_100000715429_100000741522 [0,2,0,0,0,0|2,0,0]=4 9696 B13R1.352 CC(C)(C)NC(=O)C1CCCOC1 527a_100000715429_100000741522 [0,2,0,0,0,0|2,0,0]=4 9697 B13R1.352 CC(C)(C)NC(=O)C1CCOCC1 11a_100000715429_100000195482 [0,2,0,0,0,0|2,0,0]=4 9698 B13R1.352 CC(C)(C)NC(=O)C1CCOCC1 1626a_100000715429_100000195482 [0,2,0,0,0,0|2,0,0]=4 9699 B13R1.352 CC(C)(C)NC(=O)C1CCOCC1 240690a_100000715429_100000195482 [0,2,0,0,0,0|2,0,0]=4 9700 B13R1.352 CC(C)(C)NC(=O)C1CCOCC1 527a_100000715429_100000195482 [0,2,0,0,0,0|2,0,0]=4 9701 B13R1.352 CC(C)(C)NC(=O)C1CCSCC1 11a_100000715429_100000755232 [0,2,0,0,0,0|2,0,0]=4 9702 B13R1.352 CC(C)(C)NC(=O)C1CCSCC1 1626a_100000715429_100000755232 [0,2,0,0,0,0|2,0,0]=4 9703 B13R1.352 CC(C)(C)NC(=O)C1CCSCC1 240690a_100000715429_100000755232 [0,2,0,0,0,0|2,0,0]=4 9704 B13R1.352 CC(C)(C)NC(=O)C1CCSCC1 527a_100000715429_100000755232 [0,2,0,0,0,0|2,0,0]=4 9705 B13R1.352 CC(C)(O)CC(=O)C1CCCCC1 1458a_100000693243_100000210327 [0,2,0,0,0,0|1,0,0]=3 9706 B13R1.352 CC(C)(O)CC(=O)C1CCCOC1 1458a_100000693243_100000693364 [0,2,0,0,0,0|2,0,0]=4 9707 B13R1.352 CC(C)(O)CC(=O)C1CCOCC1 1458a_100000693243_100011324220 [0,2,0,0,0,0|2,0,0]=4 9708 B13R1.352 CC(OC(C)(C)C)C1CCCCC1 34a_100011216961_100000210625 [0,2,0,0,0,0|1,0,1]=4 9709 B13R1.352 CS(=O)(=O)CC(=O)C1CCCCC1 1458a_100000744497_100000210327 [0,2,0,0,0,0|2,0,0]=4 9710 B13R1.352 CS(=O)(=O)NC(=O)C1CCCCC1 2740a_100000171171_100000210647 [0,2,0,0,0,0|2,0,0]=4 9711 B13R1.352 C[N+](C)(C)CC(=O)C1CCCCC1 1458a_100000033712_100000210327 [0,2,0,0,0,0|2,0,0]=4 9712 B13R1.352 C[Si](C)(C)CC(=O)C1CCCCC1 1458a_100000210647_100000233785 [0,2,0,0,0,0|1,1,0]=4 9713 B13R1.352 C[Si](C)(C)CC(=O)C1CCCCC1 1458a_100011218504_100000210327 [0,2,0,0,0,0|1,1,0]=4 9714 B13R1.352 O=C(CC(F)(F)F)C1CCCCC1 1458a_100000245130_100000210327 [0,2,0,0,0,0|2,0,0]=4 9715 B13R1.7467 C=C(C)CC(=O)C1(CCCCC1)C 1458a_100000762840_100000748629 [0,2,0,0,0,0|1,0,1]=4 9716 B13R1.7467 C=C(C)CC(=O)C1(CCCCC1)F 1458a_100000069003_100000748629 [0,2,0,0,0,0|1,0,1]=4 9717 B13R1.7467 C=C(C)CC(=O)C1(CCCCC1)O 1458a_100000242742_100000748629 [0,2,0,0,0,0|1,0,1]=4 9718 B13R1.7467 CC(C)CC(=O)C1(CCCCC1)C 1458a_100000762840_100000210624 [0,2,0,0,0,0|1,0,0]=3 9719 B13R1.7467 CC(C)CC(=O)C1(CCCCC1)F 1458a_100000069003_100000210624 [0,2,0,0,0,0|1,0,0]=3 9720 B13R1.7467 CC(C)CC(=O)C1(CCCCC1)O 1458a_100000242742_100000210624 [0,2,0,0,0,0|1,0,0]=3 9721 B13R1.7467 CC(C)CC(=O)C1(CCOCC1)C 1458a_100000749465_100000210624 [0,2,0,0,0,0|2,0,0]=4 9722 B13R1.7467 CC(C)CC(=O)C1(CCOCC1)F 1458a_100009845733_100000210624 [0,2,0,0,0,0|2,0,0]=4 9723 B13R1.7467 CC(C)CC(=O)C1(CCOCC1)O 1458a_100000751969_100000210624 [0,2,0,0,0,0|2,0,0]=4 9724 B13R1.7467 CC(C)NC(=O)C1(CCCCC1)C 11a_100138425928_100000762840 [0,2,0,0,0,0|1,0,0]=3 9725 B13R1.7467 CC(C)NC(=O)C1(CCCCC1)C 1626a_100138425928_100000762840 [0,2,0,0,0,0|1,0,0]=3 9726 B13R1.7467 CC(C)NC(=O)C1(CCCCC1)C 240690a_100138425928_100000762840 [0,2,0,0,0,0|1,0,0]=3 9727 B13R1.7467 CC(C)NC(=O)C1(CCCCC1)C 527a_100138425928_100000762840 [0,2,0,0,0,0|1,0,0]=3 9728 B13R1.7467 CC(C)NC(=O)C1(CCCCC1)F 11a_100138425928_100000069003 [0,2,0,0,0,0|1,0,0]=3 9729 B13R1.7467 CC(C)NC(=O)C1(CCCCC1)F 1626a_100138425928_100000069003 [0,2,0,0,0,0|1,0,0]=3 9730 B13R1.7467 CC(C)NC(=O)C1(CCCCC1)F 240690a_100138425928_100000069003 [0,2,0,0,0,0|1,0,0]=3 9731 B13R1.7467 CC(C)NC(=O)C1(CCCCC1)F 527a_100138425928_100000069003 [0,2,0,0,0,0|1,0,0]=3 9732 B13R1.7467 CC(C)NC(=O)C1(CCCCC1)O 240690a_100138425928_100000242742 [0,2,0,0,0,0|1,0,0]=3 9733 B13R1.7467 CC(C)NC(=O)C1(CCOCC1)C 11a_100138425928_100000749465 [0,2,0,0,0,0|2,0,0]=4 9734 B13R1.7467 CC(C)NC(=O)C1(CCOCC1)C 1626a_100138425928_100000749465 [0,2,0,0,0,0|2,0,0]=4 9735 B13R1.7467 CC(C)NC(=O)C1(CCOCC1)C 240690a_100138425928_100000749465 [0,2,0,0,0,0|2,0,0]=4 9736 B13R1.7467 CC(C)NC(=O)C1(CCOCC1)C 527a_100138425928_100000749465 [0,2,0,0,0,0|2,0,0]=4 9737 B13R1.7467 CC(C)NC(=O)C1(CCOCC1)F 11a_100138425928_100009845733 [0,2,0,0,0,0|2,0,0]=4 9738 B13R1.7467 CC(C)NC(=O)C1(CCOCC1)F 1626a_100138425928_100009845733 [0,2,0,0,0,0|2,0,0]=4 9739 B13R1.7467 CC(C)NC(=O)C1(CCOCC1)F 240690a_100138425928_100009845733 [0,2,0,0,0,0|2,0,0]=4 9740 B13R1.7467 CC(C)NC(=O)C1(CCOCC1)F 527a_100138425928_100009845733 [0,2,0,0,0,0|2,0,0]=4 9741 B13R1.7467 CC(C)NC(=O)C1(CCOCC1)O 240690a_100138425928_100000751969 [0,2,0,0,0,0|2,0,0]=4 9742 B13R1.7467 CC(O)CC(=O)C1(CCCCC1)C 1458a_100000762840_100011218427 [0,2,0,0,0,0|1,0,0]=3 9743 B13R1.7467 CC(O)CC(=O)C1(CCCCC1)F 1458a_100000069003_100011218427 [0,2,0,0,0,0|1,0,0]=3 9744 B13R1.7467 CC(O)CC(=O)C1(CCCCC1)O 1458a_100000242742_100011218427 [0,2,0,0,0,0|1,0,0]=3 9745 B13R1.7467 CC(O)CC(=O)C1(CCOCC1)C 1458a_100000749465_100011218427 [0,2,0,0,0,0|2,0,0]=4 9746 B13R1.7467 CC(O)CC(=O)C1(CCOCC1)F 1458a_100009845733_100011218427 [0,2,0,0,0,0|2,0,0]=4 9747 B13R1.7467 CC(O)CC(=O)C1(CCOCC1)O 1458a_100000751969_100011218427 [0,2,0,0,0,0|2,0,0]=4 9748 B13R1.7467 CC1(CCCCC1)C(=O)CC(F)F 1458a_100000762840_100011934356 [0,2,0,0,0,0|2,0,0]=4 9749 B13R1.7467 O=C(CC(F)F)C1(CCCCC1)F 1458a_100000069003_100011934356 [0,2,0,0,0,0|2,0,0]=4 9750 B13R1.7467 O=C(CC(F)F)C1(CCCCC1)O 1458a_100000242742_100011934356 [0,2,0,0,0,0|2,0,0]=4 9751 B13R1.464 C#CC1CCCCN1C(=O)CCC 11a_200020621307_100000211992 [0,2,0,0,0,0|2,0,0]=4 9752 B13R1.464 C#CC1CCCCN1C(=O)CCC 1626a_200020621307_100000211992 [0,2,0,0,0,0|2,0,0]=4 9753 B13R1.464 C#CC1CCCCN1C(=O)CCC 240690a_200020621307_100000211992 [0,2,0,0,0,0|2,0,0]=4 9754 B13R1.464 C#CC1CCCCN1C(=O)CCC 527a_200020621307_100000211992 [0,2,0,0,0,0|2,0,0]=4 9755 B13R1.464 C#CC1CCCCN1C(=O)NCC 2708a_100015525214_200020621307 [0,2,0,0,0,0|2,0,0]=4 9756 B13R1.464 C#CC1CCCCN1C(=O)NCC 273464a_100015525214_200020621307 [0,2,0,0,0,0|2,0,0]=4 9757 B13R1.464 CCCC(=O)C1CCCCN1CC 1458a_100000743832_100000210303 [0,2,0,0,0,0|2,0,0]=4 9758 B13R1.464 CCCC(=O)N1CCCCC1C#N 11a_100016989756_100000211992 [0,2,0,0,0,0|2,0,0]=4 9759 B13R1.464 CCCC(=O)N1CCCCC1C#N 1626a_100016989756_100000211992 [0,2,0,0,0,0|2,0,0]=4 9760 B13R1.464 CCCC(=O)N1CCCCC1C#N 240690a_100016989756_100000211992 [0,2,0,0,0,0|2,0,0]=4 9761 B13R1.464 CCCC(=O)N1CCCCC1CC 11a_100000210034_100000211992 [0,2,0,0,0,0|2,0,0]=4 9762 B13R1.464 CCCC(=O)N1CCCCC1CC 1626a_100000210034_100000211992 [0,2,0,0,0,0|2,0,0]=4 9763 B13R1.464 CCCC(=O)N1CCCCC1CC 240690a_100000210034_100000211992 [0,2,0,0,0,0|2,0,0]=4 9764 B13R1.464 CCCC(=O)N1CCCCC1CC 527a_100000210034_100000211992 [0,2,0,0,0,0|2,0,0]=4 9765 B13R1.464 CCCC(=O)N1CCCCC1CO 240690a_100000210821_100000211992 [0,2,0,0,0,0|2,0,0]=4 9766 B13R1.464 CCNC(=O)C1CCCCN1CC 11a_100015525214_100000743832 [0,2,0,0,0,0|2,0,0]=4 9767 B13R1.464 CCNC(=O)C1CCCCN1CC 240690a_100015525214_100000743832 [0,2,0,0,0,0|2,0,0]=4 9768 B13R1.464 CCNC(=O)C1CCCCN1CC 527a_100015525214_100000743832 [0,2,0,0,0,0|2,0,0]=4 9769 B13R1.464 CCNC(=O)N1CCCCC1C#N 273464a_100015525214_100016989756 [0,2,0,0,0,0|2,0,0]=4 9770 B13R1.464 CCNC(=O)N1CCCCC1CC 2708a_100015525214_100000210034 [0,2,0,0,0,0|2,0,0]=4 9771 B13R1.464 CCNC(=O)N1CCCCC1CC 273464a_100015525214_100000210034 [0,2,0,0,0,0|2,0,0]=4 9772 B13R1.464 CCNC(=O)N1CCCCC1CO 2708a_100015525214_100000210821 [0,2,0,0,0,0|2,0,0]=4 9773 B13R1.464 CCNC(=O)N1CCCCC1CO 273464a_100015525214_100000210821 [0,2,0,0,0,0|2,0,0]=4 9774 B13R1.464 CCOC(=O)C1CCCCC1OC 7a_100000038711_200000210301 [0,2,0,0,0,0|0,0,0]=2 9775 B13R1.464 CCOC(=O)C1CCCCC1O[13CH3] 7a_100000038711_200025704644 [0,2,0,0,0,0|0,0,0]=2 9776 B13R1.464 CCOC(=O)C1CCCCN1CC 2230a_100016990872_100000210202 [0,2,0,0,0,0|1,0,0]=3 9777 B13R1.464 CCOC(=O)C1CCCCN1CC 269982a_100016990872_100000204670 [0,2,0,0,0,0|1,0,0]=3 9778 B13R1.464 CCOC(=O)C1CCCCN1CF 269982a_100016990872_100015361967 [0,2,0,0,0,0|1,0,0]=3 9779 B13R1.464 CCOC(=O)C1CSCCN1CC 2230a_100000735462_100000210202 [0,2,0,0,0,0|2,0,0]=4 9780 B13R1.464 CCOC(=O)C1CSCCN1CC 269982a_100000735462_100000204670 [0,2,0,0,0,0|2,0,0]=4 9781 B13R1.464 CCOC(=O)C1CSCCN1CF 269982a_100000735462_100015361967 [0,2,0,0,0,0|2,0,0]=4 9782 B13R1.464 CCOC(=O)[C@@H]1COCCN1CC 2230a_100015229691_100000210202 [0,2,0,0,0,0|2,0,0]=4 9783 B13R1.464 CCOC(=O)[C@@H]1COCCN1CC 269982a_100015229691_100000204670 [0,2,0,0,0,0|2,0,0]=4 9784 B13R1.464 CCOC(=O)[C@@H]1COCCN1CF 269982a_100015229691_100015361967 [0,2,0,0,0,0|2,0,0]=4 9785 B13R1.4453 CCCC(=O)N1C(CCCC1C)C 11a_100000210447_100000211992 [0,2,0,0,0,0|2,0,0]=4 9786 B13R1.4453 CCCC(=O)N1C(CCCC1C)C 240690a_100000210447_100000211992 [0,2,0,0,0,0|2,0,0]=4 9787 B13R1.4453 CCNC(=O)N1C(CCCC1C)C 2708a_100015525214_100000210447 [0,2,0,0,0,0|2,0,0]=4 9788 B13R1.4453 CCNC(=O)N1C(CCCC1C)C 273464a_100015525214_100000210447 [0,2,0,0,0,0|2,0,0]=4 9789 B13R1.4472 CCCC(=O)C1(CCCCC1)C#N 1458a_100000745063_100000210303 [0,2,0,0,0,0|1,0,0]=3 9790 B13R1.4472 CCCC(=O)C1(CCOCC1)C#N 1458a_100000754344_100000210303 [0,2,0,0,0,0|2,0,0]=4 9791 B13R1.4472 CCCC(=O)C1(CCOCC1)CO 1458a_100012175746_100000210303 [0,2,0,0,0,0|2,0,0]=4 9792 B13R1.4472 CCNC(=O)C1(CCCCC1)C#N 11a_100015525214_100000745063 [0,2,0,0,0,0|1,0,0]=3 9793 B13R1.4472 CCNC(=O)C1(CCCCC1)C#N 240690a_100015525214_100000745063 [0,2,0,0,0,0|1,0,0]=3 9794 B13R1.4472 CCNC(=O)C1(CCCCC1)C#N 527a_100015525214_100000745063 [0,2,0,0,0,0|1,0,0]=3 9795 B13R1.4472 CCNC(=O)C1(CCOCC1)C#N 240690a_100015525214_100000754344 [0,2,0,0,0,0|2,0,0]=4 9796 B13R1.4472 CCNC(=O)C1(CCOCC1)C#N 527a_100015525214_100000754344 [0,2,0,0,0,0|2,0,0]=4 9797 B13R1.4472 CCNC(=O)C1(CCOCC1)CO 240690a_100015525214_100012175746 [0,2,0,0,0,0|2,0,0]=4 9798 B13R1.4472 CCOC(=O)C1(CCCCC1)OC 34a_200011213212_200000210301 [0,2,0,0,0,0|0,0,0]=2 9799 B13R1.4472 CCOC(=O)C1(CCCCC1)OC 7a_200011213212_200000210301 [0,2,0,0,0,0|0,0,0]=2 9800 B13R1.4472 CCOC(=O)C1(CCCCC1)O[13CH3] 34a_200011213212_200025704644 [0,2,0,0,0,0|0,0,0]=2 9801 B13R1.4472 CCOC(=O)C1(CCCCC1)O[13CH3] 7a_200011213212_200025704644 [0,2,0,0,0,0|0,0,0]=2 9802 B13R1.4472 CNNC(=O)C1(CCCCC1)C#N 22a_100016993582_100000745063 [0,2,0,0,0,0|2,0,0]=4 9803 B13R1.4472 N#CC1(CCCCC1)C(=O)CCF 1458a_100000745063_100011217306 [0,2,0,0,0,0|2,0,0]=4 9804 B13R1.4472 N#CC1(CCCCC1)C(=O)CCO 1458a_100000745063_100000211926 [0,2,0,0,0,0|2,0,0]=4 9805 B11R1.30 CC#CC(=O)CC1CCCC1 1458a_100000763181_100000740388 [0,0,1,1,0,0|1,0,1]=4 9806 B11R1.30 CC=CC(=O)CC1CCCC1 1458a_100000210699_100000740388 [0,0,1,1,0,0|1,0,1]=4 9807 B11R1.30 CCCC(=O)CC1CCCC1 1458a_100000210891_100000210303 [0,0,1,1,0,0|1,0,0]=3 9808 B11R1.30 CCCC(=O)CC1CCCC1 1458a_100000211992_100000740388 [0,0,1,1,0,0|1,0,0]=3 9809 B11R1.30 CCCC(=O)CC1CCCO1 1458a_100000211992_100000203698 [0,0,1,1,0,0|2,0,0]=4 9810 B11R1.30 CCCC(=O)CC1CCOC1 1458a_100000211992_100000702531 [0,0,1,1,0,0|2,0,0]=4 9811 B11R1.30 CCCC(=O)CC1CCOC1 1458a_100011218419_100000210303 [0,0,1,1,0,0|2,0,0]=4 9812 B11R1.30 CCCC(=O)CN1CCCC1 1458a_100000740243_100000210303 [0,0,1,1,0,0|2,0,0]=4 9813 B11R1.30 CCCC(=O)CN1CCCC1 2230a_100000188435_100000747444 [0,0,1,1,0,0|2,0,0]=4 9814 B11R1.30 CCCC(=O)CN1CCCC1 269982a_100000188435_100000747444 [0,0,1,1,0,0|2,0,0]=4 9815 B11R1.30 CCCC(=O)NC1CCCC1 11a_100000211070_100000211992 [0,0,1,1,0,0|2,0,0]=4 9816 B11R1.30 CCCC(=O)NC1CCCC1 1626a_100000211070_100000211992 [0,0,1,1,0,0|2,0,0]=4 9817 B11R1.30 CCCC(=O)NC1CCCC1 240690a_100000211070_100000211992 [0,0,1,1,0,0|2,0,0]=4 9818 B11R1.30 CCCC(=O)NC1CCCC1 527a_100000211070_100000211992 [0,0,1,1,0,0|2,0,0]=4 9819 B11R1.30 CCNC(=O)CC1CCCC1 11a_100015525214_100000210891 [0,0,1,1,0,0|1,0,0]=3 9820 B11R1.30 CCNC(=O)CC1CCCC1 240690a_100015525214_100000210891 [0,0,1,1,0,0|1,0,0]=3 9821 B11R1.30 CCNC(=O)CC1CCCC1 527a_100015525214_100000210891 [0,0,1,1,0,0|1,0,0]=3 9822 B11R1.30 CCNC(=O)CC1CCOC1 11a_100015525214_100011218419 [0,0,1,1,0,0|2,0,0]=4 9823 B11R1.30 CCNC(=O)CC1CCOC1 240690a_100015525214_100011218419 [0,0,1,1,0,0|2,0,0]=4 9824 B11R1.30 CCNC(=O)CC1CCOC1 527a_100015525214_100011218419 [0,0,1,1,0,0|2,0,0]=4 9825 B11R1.30 CCNC(=O)CN1CCCC1 2230a_100000188435_100000183381 [0,0,1,1,0,0|2,0,0]=4 9826 B11R1.30 CCNC(=O)CN1CCCC1 240690a_100015525214_100000740243 [0,0,1,1,0,0|2,0,0]=4 9827 B11R1.30 CCNC(=O)CN1CCCC1 269982a_100000188435_100000183381 [0,0,1,1,0,0|2,0,0]=4 9828 B11R1.30 CCNC(=O)CN1CCCC1 527a_100015525214_100000740243 [0,0,1,1,0,0|2,0,0]=4 9829 B11R1.30 CCNC(=O)NC1CCCC1 2708a_100000211070_100015525214 [0,0,1,1,0,0|2,0,0]=4 9830 B11R1.30 CCNC(=O)NC1CCCC1 2708a_100015525214_100000211070 [0,0,1,1,0,0|2,0,0]=4 9831 B11R1.30 CCNC(=O)NC1CCCC1 273464a_100000211070_100015525214 [0,0,1,1,0,0|2,0,0]=4 9832 B11R1.30 CCNC(=O)NC1CCCC1 273464a_100015525214_100000211070 [0,0,1,1,0,0|2,0,0]=4 9833 B11R1.30 CCNC(=O)NC1CCCC1 512a_100000211070_100015525214 [0,0,1,1,0,0|2,0,0]=4 9834 B11R1.30 CCNC(=O)NC1CCCC1 512a_100015525214_100000211070 [0,0,1,1,0,0|2,0,0]=4 9835 B11R1.30 CCOC(=O)CN1CCCC1 2230a_100000188435_100000188475 [0,0,1,1,0,0|1,0,0]=3 9836 B11R1.30 CCOC(=O)CN1CCCC1 269982a_100000188435_100000188475 [0,0,1,1,0,0|1,0,0]=3 9837 B11R1.30 CCOC(=O)CN1CCSC1 2230a_100011215254_100000188475 [0,0,1,1,0,0|2,0,0]=4 9838 B11R1.30 CCOC(=O)CN1CCSC1 269982a_100011215254_100000188475 [0,0,1,1,0,0|2,0,0]=4 9839 B11R1.30 CNNC(=O)CC1CCCC1 22a_100016993582_100000210891 [0,0,1,1,0,0|2,0,0]=4 9840 B11R1.30 COCC(=O)CC1CCCC1 1458a_100000210968_100000740388 [0,0,1,1,0,0|2,0,0]=4 9841 B11R1.30 CSCC(=O)CC1CCCC1 1458a_100000184570_100000740388 [0,0,1,1,0,0|2,0,0]=4 9842 B11R1.30 O=C(CCF)CC1CCCC1 1458a_100000210891_100011217306 [0,0,1,1,0,0|2,0,0]=4 9843 B11R1.30 O=C(CCO)CC1CCCC1 1458a_100000210891_100000211926 [0,0,1,1,0,0|2,0,0]=4 9844 B11R1.30 O=C(CCO)CC1CCCC1 1458a_100011216618_100000740388 [0,0,1,1,0,0|2,0,0]=4 9845 B11R1.117 CCOC1CCCCCCC1 34a_100000210054_100000210202 [0,0,1,1,0,0|1,0,1]=4 9846 B11R1.117 CCOC1CCCCCCC1 7a_100000210054_100000210202 [0,0,1,1,0,0|1,0,1]=4 9847 B11R1.135 CCCN1CCNC(=O)CC1 2230a_100000698595_100000210303 [0,0,1,1,0,0|2,0,0]=4 9848 B11R1.135 CCCN1CCNC(=O)CC1 269982a_100000698595_100000210303 [0,0,1,1,0,0|2,0,0]=4 9849 B11R1.180 CCCCNC1CCCC1=O 2230a_100000102301_100000211823 [0,0,1,1,0,0|2,0,0]=4 9850 B11R1.180 CCCCNC1CCCC1=O 7a_106832991798_100000211823 [0,0,1,1,0,0|2,0,0]=4 9851 B11R1.180 CCCCNC1CCNC1=O 2230a_100016995588_100000210211 [0,0,1,1,0,0|2,0,0]=4 9852 B11R1.180 CCCCNC1CCNC1=O 34a_100016995588_100000210210 [0,0,1,1,0,0|2,0,0]=4 9853 B11R1.180 CCCCNC1CCOC1=O 2230a_100000102301_100000211211 [0,0,1,1,0,0|1,0,0]=3 9854 B11R1.180 CCCCNC1CCOC1=O 7a_106832991798_100000211211 [0,0,1,1,0,0|1,0,0]=3 9855 B11R1.180 CCCCOC1CCCC1=O 34a_100000210227_100000709159 [0,0,1,1,0,0|2,0,0]=4 9856 B11R1.180 CCCCOC1CCCC1=O 34a_200000719330_100000210210 [0,0,1,1,0,0|2,0,0]=4 9857 B11R1.180 CCCCOC1CCCC1=O 7a_100000210227_100000211823 [0,0,1,1,0,0|2,0,0]=4 9858 B11R1.180 CCCCOC1CCOC1=O 34a_100000210227_100000211211 [0,0,1,1,0,0|1,0,0]=3 9859 B11R1.180 CCCCOC1CCOC1=O 7a_100000210227_100000211211 [0,0,1,1,0,0|1,0,0]=3 9860 B11R1.180 CCCCO[C@H]1CCNC1=O 34a_100000688343_100000210210 [0,0,1,1,0,0|2,0,0]=4 9861 B11R1.180 CCCCSC1CCCC1=O 62a_100000210211_100000211823 [0,0,1,1,0,0|2,0,0]=4 9862 B11R1.180 CCCCSC1CCCC1=O 62a_100000211823_100000210210 [0,0,1,1,0,0|2,0,0]=4 9863 B11R1.180 CCCCSC1CCOC1=O 62a_100000210211_100000211211 [0,0,1,1,0,0|1,0,0]=3 9864 B11R1.180 CCCCSC1CCOC1=O 62a_100000211211_100000210210 [0,0,1,1,0,0|1,0,0]=3 9865 B11R1.180 CCCOCC1CCNC1=O 34a_100000133458_100000210303 [0,0,1,1,0,0|2,0,0]=4 9866 B11R1.180 CCOCSC1CCOC1=O 62a_100000211211_100000739092 [0,0,1,1,0,0|2,0,0]=4 9867 B11R1.180 CCOCSC1CCOC1=O 62a_100000739092_100000211211 [0,0,1,1,0,0|2,0,0]=4 9868 B11R1.180 COCCNC1CCOC1=O 2230a_100000209980_100000211211 [0,0,1,1,0,0|2,0,0]=4 9869 B11R1.180 COCCOC1CCOC1=O 34a_100000210237_100000211211 [0,0,1,1,0,0|2,0,0]=4 9870 B11R1.180 COCCSC1CCOC1=O 62a_100000211211_100000233755 [0,0,1,1,0,0|2,0,0]=4 9871 B11R1.180 COCCSC1CCOC1=O 62a_100000233755_100000211211 [0,0,1,1,0,0|2,0,0]=4 9872 B11R1.180 CSCCNC1CCOC1=O 2230a_100020590264_100000211211 [0,0,1,1,0,0|2,0,0]=4 9873 B11R1.180 CSCCOC1CCOC1=O 34a_100000230434_100000211211 [0,0,1,1,0,0|2,0,0]=4 9874 B11R1.180 CSCCOC1CCOC1=O 7a_100000230434_100000211211 [0,0,1,1,0,0|2,0,0]=4 9875 B11R1.180 CSCCSC1CCOC1=O 62a_100000211211_100000751147 [0,0,1,1,0,0|2,0,0]=4 9876 B11R1.180 CSCCSC1CCOC1=O 62a_100000212216_100000211211 [0,0,1,1,0,0|2,0,0]=4 9877 B11R1.180 NCCCOC1CCOC1=O 34a_100000182051_100000211211 [0,0,1,1,0,0|2,0,0]=4 9878 B11R1.180 O=C1OCCC1NCCCF 2230a_100015189416_100000211211 [0,0,1,1,0,0|2,0,0]=4 9879 B11R1.180 O=C1OCCC1NCCCF 34a_100015189416_100000211211 [0,0,1,1,0,0|2,0,0]=4 9880 B11R1.180 O=C1OCCC1OCCCBr 34a_100011217188_100000211211 [0,0,1,1,0,0|2,0,0]=4 9881 B11R1.180 O=C1OCCC1OCCCCl 34a_100000230001_100000211211 [0,0,1,1,0,0|2,0,0]=4 9882 B11R1.180 O=C1OCCC1OCCCF 34a_100000759539_100000211211 [0,0,1,1,0,0|2,0,0]=4 9883 B11R1.180 O=C1OCCC1SCCCF 62a_100000211211_100011934791 [0,0,1,1,0,0|2,0,0]=4 9884 B11R1.180 O=C1OCCC1SCCCF 62a_100011934791_100000211211 [0,0,1,1,0,0|2,0,0]=4 9885 B11R1.180 O=C1OCCC1SCCCO 62a_100000211211_100011215043 [0,0,1,1,0,0|2,0,0]=4 9886 B11R1.180 O=C1OCCC1SCCCO 62a_100011215043_100000211211 [0,0,1,1,0,0|2,0,0]=4 9887 B11R1.189 CCOC1CCCC(C1)CC 7a_100011985506_100000210202 [0,0,1,1,0,0|1,0,1]=4 9888 B11R1.288 CCOC(=O)CN[C@@H]1C[C@@H]1F 2230a_100015190264_100000188475 [0,0,1,1,0,0|2,0,0]=4 9889 B11R1.288 CCOC(=O)CN[C@@H]1C[C@H]1F 2230a_100025746932_100000188475 [0,0,1,1,0,0|2,0,0]=4 9890 B11R1.288 CCOC(=O)CN[C@@H]1C[C@H]1F 34a_100025746932_100000188475 [0,0,1,1,0,0|2,0,0]=4 9891 B11R1.289 CCCC(=O)CNC1CCC1 2230a_100000749019_100000747444 [0,0,1,1,0,0|2,0,0]=4 9892 B11R1.289 CCCC(=O)CSC1CCC1 62a_100000747444_100000749161 [0,0,1,1,0,0|2,0,0]=4 9893 B11R1.289 CCCC(=O)NCC1CCC1 11a_100000738700_100000211992 [0,0,1,1,0,0|2,0,0]=4 9894 B11R1.289 CCCC(=O)NCC1CCC1 1626a_100000738700_100000211992 [0,0,1,1,0,0|2,0,0]=4 9895 B11R1.289 CCCC(=O)NCC1CCC1 240690a_100000738700_100000211992 [0,0,1,1,0,0|2,0,0]=4 9896 B11R1.289 CCCC(=O)NCC1CCC1 527a_100000738700_100000211992 [0,0,1,1,0,0|2,0,0]=4 9897 B11R1.289 CCNC(=O)CCN1CCC1 269982a_100000754969_100000737597 [0,0,1,1,0,0|2,0,0]=4 9898 B11R1.289 CCNC(=O)CNC1CCC1 2230a_100000749019_100000183381 [0,0,1,1,0,0|2,0,0]=4 9899 B11R1.289 CCNC(=O)CNC1CCC1 270004a_100016988866_100000241760 [0,0,1,1,0,0|2,0,0]=4 9900 B11R1.289 CCNC(=O)CNC1CCC1 34a_100000749019_100000183381 [0,0,1,1,0,0|2,0,0]=4 9901 B11R1.289 CCNC(=O)COC1CCC1 34a_100000748187_100000183381 [0,0,1,1,0,0|2,0,0]=4 9902 B11R1.289 CCNC(=O)CSC1CCC1 62a_100000183381_100000749161 [0,0,1,1,0,0|2,0,0]=4 9903 B11R1.289 CCNC(=O)NCC1CCC1 2708a_100000738700_100015525214 [0,0,1,1,0,0|2,0,0]=4 9904 B11R1.289 CCNC(=O)NCC1CCC1 2708a_100015525214_100000738700 [0,0,1,1,0,0|2,0,0]=4 9905 B11R1.289 CCNC(=O)NCC1CCC1 273464a_100000738700_100015525214 [0,0,1,1,0,0|2,0,0]=4 9906 B11R1.289 CCNC(=O)NCC1CCC1 273464a_100015525214_100000738700 [0,0,1,1,0,0|2,0,0]=4 9907 B11R1.289 CCNC(=O)NCC1CCC1 512a_100000738700_100015525214 [0,0,1,1,0,0|2,0,0]=4 9908 B11R1.289 CCNC(=O)NCC1CCC1 512a_100015525214_100000738700 [0,0,1,1,0,0|2,0,0]=4 9909 B11R1.289 CCOC(=O)CCN1CCC1 269982a_100000754969_100011206558 [0,0,1,1,0,0|1,0,0]=3 9910 B11R1.289 CCOC(=O)CNC1CCC1 2230a_100000749019_100000188475 [0,0,1,1,0,0|1,0,0]=3 9911 B11R1.289 CCOC(=O)CNC1CCC1 34a_100000749019_100000188475 [0,0,1,1,0,0|1,0,0]=3 9912 B11R1.289 CCOC(=O)CNC1COC1 2230a_100016991112_100000188475 [0,0,1,1,0,0|2,0,0]=4 9913 B11R1.289 CCOC(=O)COC1CCC1 34a_100000748187_100000188475 [0,0,1,1,0,0|1,0,0]=3 9914 B11R1.289 CCOC(=O)COC1CSC1 7a_100000072292_100000188475 [0,0,1,1,0,0|2,0,0]=4 9915 B11R1.289 CCOC(=O)CSC1CCC1 62a_100000188475_100000749161 [0,0,1,1,0,0|1,0,0]=3 9916 B11R1.289 CCOC(=O)CSC1COC1 62a_100000188475_100009818527 [0,0,1,1,0,0|2,0,0]=4 9917 B11R1.290 CCCC(=O)CCCC1CO1 1458a_100000211992_100000733510 [0,0,1,1,0,0|2,0,0]=4 9918 B11R1.290 CCCC(=O)CNCC1CC1 2230a_100000735609_100000747444 [0,0,1,1,0,0|2,0,0]=4 9919 B11R1.290 CCCC(=O)CSCC1CC1 1458a_200011316215_100000210303 [0,0,1,1,0,0|2,0,0]=4 9920 B11R1.290 CCCC(=O)CSCC1CC1 62a_100000747444_100000742324 [0,0,1,1,0,0|2,0,0]=4 9921 B11R1.290 CCCC(=O)CSCC1CC1 62a_100000756562_100000747444 [0,0,1,1,0,0|2,0,0]=4 9922 B11R1.290 CCCC(=O)NCCC1CC1 1626a_100000764129_100000211992 [0,0,1,1,0,0|2,0,0]=4 9923 B11R1.290 CCCC(=O)NCCC1CC1 240690a_100000764129_100000211992 [0,0,1,1,0,0|2,0,0]=4 9924 B11R1.290 CCCC(=O)NCCC1CC1 527a_100000764129_100000211992 [0,0,1,1,0,0|2,0,0]=4 9925 B11R1.290 CCNC(=O)CCNC1CC1 34a_100025743525_100000211595 [0,0,1,1,0,0|2,0,0]=4 9926 B11R1.290 CCNC(=O)CCSC1CC1 62a_100000737597_100000211595 [0,0,1,1,0,0|2,0,0]=4 9927 B11R1.290 CCNC(=O)CNCC1CC1 2230a_100000735609_100000183381 [0,0,1,1,0,0|2,0,0]=4 9928 B11R1.290 CCNC(=O)CNCC1CC1 2230a_100016988866_100000742324 [0,0,1,1,0,0|2,0,0]=4 9929 B11R1.290 CCNC(=O)CNCC1CC1 34a_100000735609_100000183381 [0,0,1,1,0,0|2,0,0]=4 9930 B11R1.290 CCNC(=O)COCC1CC1 34a_100000211283_100000183381 [0,0,1,1,0,0|2,0,0]=4 9931 B11R1.290 CCNC(=O)CSCC1CC1 11a_100015525214_200011316215 [0,0,1,1,0,0|2,0,0]=4 9932 B11R1.290 CCNC(=O)CSCC1CC1 240690a_100015525214_200011316215 [0,0,1,1,0,0|2,0,0]=4 9933 B11R1.290 CCNC(=O)CSCC1CC1 527a_100015525214_200011316215 [0,0,1,1,0,0|2,0,0]=4 9934 B11R1.290 CCNC(=O)CSCC1CC1 62a_100000183381_100000742324 [0,0,1,1,0,0|2,0,0]=4 9935 B11R1.290 CCNC(=O)CSCC1CC1 62a_100000756562_100000183381 [0,0,1,1,0,0|2,0,0]=4 9936 B11R1.290 CCNC(=O)NCCC1CC1 2708a_100000764129_100015525214 [0,0,1,1,0,0|2,0,0]=4 9937 B11R1.290 CCNC(=O)NCCC1CC1 2708a_100015525214_100000764129 [0,0,1,1,0,0|2,0,0]=4 9938 B11R1.290 CCNC(=O)NCCC1CC1 273464a_100000764129_100015525214 [0,0,1,1,0,0|2,0,0]=4 9939 B11R1.290 CCNC(=O)NCCC1CC1 273464a_100015525214_100000764129 [0,0,1,1,0,0|2,0,0]=4 9940 B11R1.290 CCNC(=O)NCCC1CC1 512a_100000764129_100015525214 [0,0,1,1,0,0|2,0,0]=4 9941 B11R1.290 CCNC(=O)NCCC1CC1 512a_100015525214_100000764129 [0,0,1,1,0,0|2,0,0]=4 9942 B11R1.290 CCOC(=O)CCNC1CC1 34a_100000212008_100000765890 [0,0,1,1,0,0|1,0,0]=3 9943 B11R1.290 CCOC(=O)CCSC1CC1 62a_100000765890_100000211595 [0,0,1,1,0,0|1,0,0]=3 9944 B11R1.290 CCOC(=O)CNCC1CC1 2230a_100000735609_100000188475 [0,0,1,1,0,0|1,0,0]=3 9945 B11R1.290 CCOC(=O)CNCC1CC1 34a_100000735609_100000188475 [0,0,1,1,0,0|1,0,0]=3 9946 B11R1.290 CCOC(=O)COCC1CC1 34a_100000211283_100000188475 [0,0,1,1,0,0|1,0,0]=3 9947 B11R1.290 CCOC(=O)COC[C@@H]1CO1 34a_100000757423_100000188475 [0,0,1,1,0,0|2,0,0]=4 9948 B11R1.290 CCOC(=O)CSCC1CC1 62a_100000188475_100000742324 [0,0,1,1,0,0|1,0,0]=3 9949 B11R1.290 CCOC(=O)CSCC1CC1 62a_100000756562_100000188475 [0,0,1,1,0,0|1,0,0]=3 9950 B11R1.290 CCOC(=O)CSCC1CO1 62a_100000188475_102125554688 [0,0,1,1,0,0|2,0,0]=4 9951 B11R1.290 CCOC(=O)CSCC1CO1 62a_102125554688_100000188475 [0,0,1,1,0,0|2,0,0]=4 9952 B11R1.290 CCOC(=O)CSCC1CS1 62a_100000031435_100000188475 [0,0,1,1,0,0|2,0,0]=4 9953 B11R1.290 CCOC(=O)CSCC1CS1 62a_100000188475_100000031435 [0,0,1,1,0,0|2,0,0]=4 9954 B11R1.290 CCOC(=O)CSC[C@@H]1CO1 62a_100000188475_100000745022 [0,0,1,1,0,0|2,0,0]=4 9955 B11R1.290 CCOC(=O)CSC[C@@H]1CO1 62a_100000745022_100000188475 [0,0,1,1,0,0|2,0,0]=4 9956 B11R1.291 CCCC(=O)CN1CCC1C 269982a_100000755817_100000747444 [0,0,1,1,0,0|2,0,0]=4 9957 B11R1.291 CCNC(=O)CN1CCC1C 269982a_100000755817_100000183381 [0,0,1,1,0,0|2,0,0]=4 9958 B11R1.291 CCNC(=O)CN1CCC1C 34a_100000755817_100000183381 [0,0,1,1,0,0|2,0,0]=4 9959 B11R1.291 CCOC(=O)CN1CCC1C 269982a_100000755817_100000188475 [0,0,1,1,0,0|1,0,0]=3 9960 B11R1.291 CCOC(=O)CN1CCC1C 34a_100000755817_100000188475 [0,0,1,1,0,0|1,0,0]=3 9961 B11R1.356 CCCCCCC(=O)C1CC1 1458a_100000210395_100000210757 [0,0,1,1,0,0|1,0,0]=3 9962 B11R1.356 CCCCCCC(=O)C1CO1 1458a_100000701028_100000210757 [0,0,1,1,0,0|2,0,0]=4 9963 B11R1.356 CCCCCNC(=O)C1CC1 11a_100000209983_100000210395 [0,0,1,1,0,0|2,0,0]=4 9964 B11R1.356 CCCCCNC(=O)C1CC1 1626a_100000209983_100000210395 [0,0,1,1,0,0|2,0,0]=4 9965 B11R1.356 CCCCCNC(=O)C1CC1 240690a_100000209983_100000210395 [0,0,1,1,0,0|2,0,0]=4 9966 B11R1.356 CCCCCNC(=O)C1CC1 527a_100000209983_100000210395 [0,0,1,1,0,0|2,0,0]=4 9967 B11R1.356 CCCCNCC(=O)C1CC1 2230a_100000102301_100000746382 [0,0,1,1,0,0|2,0,0]=4 9968 B11R1.356 CCCCNCC(=O)C1CC1 7a_106832991798_100000746382 [0,0,1,1,0,0|2,0,0]=4 9969 B11R1.356 CCCCOCC(=O)C1CC1 1458a_100000210395_100011995733 [0,0,1,1,0,0|2,0,0]=4 9970 B11R1.356 CCCCOCC(=O)C1CC1 34a_100000210227_100000746382 [0,0,1,1,0,0|2,0,0]=4 9971 B11R1.356 CCCCOCC(=O)C1CC1 34a_100000686663_100000210210 [0,0,1,1,0,0|2,0,0]=4 9972 B11R1.356 CCCCOCC(=O)C1CC1 7a_100000210227_100000746382 [0,0,1,1,0,0|2,0,0]=4 9973 B11R1.356 CCCCSCC(=O)C1CC1 62a_100000210211_100000746382 [0,0,1,1,0,0|2,0,0]=4 9974 B11R1.356 CCCCSCC(=O)C1CC1 62a_100000746382_100000210210 [0,0,1,1,0,0|2,0,0]=4 9975 B11R1.356 CCCOCCC(=O)C1CC1 1458a_100000210395_100011215938 [0,0,1,1,0,0|2,0,0]=4 9976 B11R1.356 CCOCCCC(=O)C1CC1 1458a_100000210395_100012232248 [0,0,1,1,0,0|2,0,0]=4 9977 B11R1.356 COCCCCC(=O)C1CC1 1458a_100000210395_100000755781 [0,0,1,1,0,0|2,0,0]=4 9978 B11R1.356 O=C(CCCCCF)C1CC1 1458a_100000210395_100000729378 [0,0,1,1,0,0|2,0,0]=4 9979 B11R1.356 O=C(CCCCCO)C1CC1 1458a_100000210395_100000746330 [0,0,1,1,0,0|2,0,0]=4 9980 B11R1.779 CCOC1(CCCCCC1)C 34a_100000708895_100000210202 [0,0,1,1,0,0|1,0,1]=4 9981 B11R1.779 CCOC1(CCCCCC1)C 7a_100000708895_100000210202 [0,0,1,1,0,0|1,0,1]=4 9982 B11R1.13 CCCN1CCNC(=O)C1C 2230a_100000750721_100000210303 [0,0,1,1,0,0|2,0,0]=4 9983 B11R1.13 CCCN1CCNC(=O)C1C 269982a_100000750721_100000210303 [0,0,1,1,0,0|2,0,0]=4 9984 B11R1.13 CCCN1CCNC(=O)C1C 34a_100000750721_100000210303 [0,0,1,1,0,0|2,0,0]=4 9985 B11R1.182 CCOC1CC(CCC1C)C 34a_100011217446_100000210202 [0,0,1,1,0,0|1,0,1]=4 9986 B11R1.182 CCOC1CC(CCC1C)C 7a_100011217446_100000210202 [0,0,1,1,0,0|1,0,1]=4 9987 B11R1.349 CCCC(=O)N(C)C1CCC1 11a_100000758072_100000211992 [0,0,1,1,0,0|2,0,0]=4 9988 B11R1.349 CCCC(=O)N(C)C1CCC1 1626a_100000758072_100000211992 [0,0,1,1,0,0|2,0,0]=4 9989 B11R1.349 CCCC(=O)N(C)C1CCC1 240690a_100000758072_100000211992 [0,0,1,1,0,0|2,0,0]=4 9990 B11R1.349 CCCC(=O)N(C)C1CCC1 527a_100000758072_100000211992 [0,0,1,1,0,0|2,0,0]=4 9991 B11R1.349 CCNC(=O)C(C)N1CCC1 269982a_100000754969_100000230173 [0,0,1,1,0,0|2,0,0]=4 9992 B11R1.349 CCNC(=O)N(C)C1CCC1 2708a_100015525214_100000758072 [0,0,1,1,0,0|2,0,0]=4 9993 B11R1.349 CCNC(=O)N(C)C1CCC1 273464a_100015525214_100000758072 [0,0,1,1,0,0|2,0,0]=4 9994 B11R1.349 CCOC(=O)C(C)N1CCC1 269982a_100000754969_100011216346 [0,0,1,1,0,0|1,0,0]=3 9995 B11R1.349 CCOC(=O)C(F)N1CCC1 269982a_100000754969_100000760018 [0,0,1,1,0,0|2,0,0]=4 9996 B11R1.351 CCCC(=O)N(C)CC1CC1 11a_100000741881_100000211992 [0,0,1,1,0,0|2,0,0]=4 9997 B11R1.351 CCCC(=O)N(C)CC1CC1 1626a_100000741881_100000211992 [0,0,1,1,0,0|2,0,0]=4 9998 B11R1.351 CCCC(=O)N(C)CC1CC1 240690a_100000741881_100000211992 [0,0,1,1,0,0|2,0,0]=4 9999 B11R1.351 CCCC(=O)N(C)CC1CC1 527a_100000741881_100000211992 [0,0,1,1,0,0|2,0,0]=4 10000 B11R1.351 CCNC(=O)C(C)NC1CC1 34a_100000212008_100000230173 [0,0,1,1,0,0|2,0,0]=4 10001 B11R1.351 CCNC(=O)C(C)NC1CC1 34a_100000736553_100000211595 [0,0,1,1,0,0|2,0,0]=4 10002 B11R1.351 CCNC(=O)C(C)SC1CC1 62a_100000230173_100000211595 [0,0,1,1,0,0|2,0,0]=4 10003 B11R1.351 CCNC(=O)N(C)CC1CC1 2708a_100015525214_100000741881 [0,0,1,1,0,0|2,0,0]=4 10004 B11R1.351 CCNC(=O)N(C)CC1CC1 273464a_100015525214_100000741881 [0,0,1,1,0,0|2,0,0]=4 10005 B11R1.351 CCOC(=O)C(C)NC1CC1 34a_100000212008_100011216346 [0,0,1,1,0,0|1,0,0]=3 10006 B11R1.351 CCOC(=O)C(C)SC1CC1 62a_100011216346_100000211595 [0,0,1,1,0,0|1,0,0]=3 10007 B11R1.351 CCOC(=O)C(F)NC1CC1 34a_100000212008_100000760018 [0,0,1,1,0,0|2,0,0]=4 10008 B11R1.351 CCOC(=O)C(F)SC1CC1 62a_100000760018_100000211595 [0,0,1,1,0,0|2,0,0]=4 10009 B11R1.526 CCCCC(C)C(=O)C1CC1 1458a_100000210395_200011215066 [0,0,1,1,0,0|1,0,0]=3 10010 B11R1.526 CCCCC(C)C(=O)C1CO1 1458a_100000701028_200011215066 [0,0,1,1,0,0|2,0,0]=4 10011 B11R1.526 CCCCN(C)C(=O)C1CC1 11a_100000207549_100000210395 [0,0,1,1,0,0|2,0,0]=4 10012 B11R1.526 CCCCN(C)C(=O)C1CC1 1626a_100000207549_100000210395 [0,0,1,1,0,0|2,0,0]=4 10013 B11R1.526 CCCCN(C)C(=O)C1CC1 240690a_100000207549_100000210395 [0,0,1,1,0,0|2,0,0]=4 10014 B11R1.526 CCCCN(C)C(=O)C1CC1 527a_100000207549_100000210395 [0,0,1,1,0,0|2,0,0]=4 10015 B11R1.822 CCCC(=O)C1CC(C1)CO 1458a_206645079618_100000210303 [0,0,1,1,0,0|2,0,0]=4 10016 B11R1.822 CCCC(=O)C1CC(C1)OC 1458a_100011999411_100000210303 [0,0,1,1,0,0|2,0,0]=4 10017 B11R1.822 CCCC(=O)N1CC(C1)CC 11a_100015205115_100000211992 [0,0,1,1,0,0|2,0,0]=4 10018 B11R1.822 CCCC(=O)N1CC(C1)CC 1626a_100015205115_100000211992 [0,0,1,1,0,0|2,0,0]=4 10019 B11R1.822 CCCC(=O)N1CC(C1)CC 240690a_100015205115_100000211992 [0,0,1,1,0,0|2,0,0]=4 10020 B11R1.822 CCCC(=O)N1CC(C1)CC 527a_100015205115_100000211992 [0,0,1,1,0,0|2,0,0]=4 10021 B11R1.822 CCNC(=O)C1CC(C1)OC 11a_100015525214_100011999411 [0,0,1,1,0,0|2,0,0]=4 10022 B11R1.822 CCNC(=O)C1CC(C1)OC 240690a_100015525214_100011999411 [0,0,1,1,0,0|2,0,0]=4 10023 B11R1.822 CCNC(=O)C1CC(C1)OC 527a_100015525214_100011999411 [0,0,1,1,0,0|2,0,0]=4 10024 B11R1.822 CCNC(=O)N1CC(C1)CC 2708a_100015525214_100015205115 [0,0,1,1,0,0|2,0,0]=4 10025 B11R1.822 CCNC(=O)N1CC(C1)CC 273464a_100015525214_100015205115 [0,0,1,1,0,0|2,0,0]=4 10026 B11R1.822 CCOC(=O)C1CC(C1)OC 7a_100000093532_200000210301 [0,0,1,1,0,0|1,0,0]=3 10027 B11R1.822 CCOC(=O)C1CC(C1)O[13CH3] 7a_100000093532_200025704644 [0,0,1,1,0,0|1,0,0]=3 10028 B11R1.822 CCOC(=O)C1CN(C1)CC 269982a_100015188541_100000204670 [0,0,1,1,0,0|1,0,0]=3 10029 B11R1.822 CCOC(=O)C1CN(C1)CF 269982a_100015188541_100015361967 [0,0,1,1,0,0|2,0,0]=4 10030 B11R1.41 CCOC1CCCCC1CC 34a_100000210738_100000210202 [0,0,1,1,0,0|1,0,1]=4 10031 B11R1.41 CCOC1CCCCC1CC 7a_100000210738_100000210202 [0,0,1,1,0,0|1,0,1]=4 10032 B11R1.605 CCCC1C(=O)NCCN1C 2230a_200000695202_200000210301 [0,0,1,1,0,0|2,0,0]=4 10033 B11R1.605 CCCC1C(=O)NCCN1C 269982a_200000695202_200000210301 [0,0,1,1,0,0|2,0,0]=4 10034 B11R1.605 CCCC1C(=O)NCCN1C 34a_200000695202_200000210301 [0,0,1,1,0,0|2,0,0]=4 10035 B11R1.605 CCCC1C(=O)NCCN1[13CH3] 2230a_200000695202_200025704644 [0,0,1,1,0,0|2,0,0]=4 10036 B11R1.605 CCCC1C(=O)NCCN1[13CH3] 269982a_200000695202_200025704644 [0,0,1,1,0,0|2,0,0]=4 10037 B11R1.605 CCCC1C(=O)NCCN1[13CH3] 34a_200000695202_200025704644 [0,0,1,1,0,0|2,0,0]=4 10038 B11R1.763 CCCC(CC)C(=O)C1CC1 1458a_100000210395_100011219200 [0,0,1,1,0,0|1,0,0]=3 10039 B11R1.763 CCCC(CC)C(=O)C1CO1 1458a_100000701028_100011219200 [0,0,1,1,0,0|2,0,0]=4 10040 B11R1.763 CCCN(CC)C(=O)C1CC1 11a_100000226822_100000210395 [0,0,1,1,0,0|2,0,0]=4 10041 B11R1.763 CCCN(CC)C(=O)C1CC1 1626a_100000226822_100000210395 [0,0,1,1,0,0|2,0,0]=4 10042 B11R1.763 CCCN(CC)C(=O)C1CC1 240690a_100000226822_100000210395 [0,0,1,1,0,0|2,0,0]=4 10043 B11R1.763 CCCN(CC)C(=O)C1CC1 527a_100000226822_100000210395 [0,0,1,1,0,0|2,0,0]=4 10044 B11R1.823 CCCC(=O)N(CC)C1CC1 11a_100000738653_100000211992 [0,0,1,1,0,0|2,0,0]=4 10045 B11R1.823 CCCC(=O)N(CC)C1CC1 1626a_100000738653_100000211992 [0,0,1,1,0,0|2,0,0]=4 10046 B11R1.823 CCCC(=O)N(CC)C1CC1 240690a_100000738653_100000211992 [0,0,1,1,0,0|2,0,0]=4 10047 B11R1.823 CCCC(=O)N(CC)C1CC1 527a_100000738653_100000211992 [0,0,1,1,0,0|2,0,0]=4 10048 B11R1.823 CCNC(=O)N(CC)C1CC1 2708a_100015525214_100000738653 [0,0,1,1,0,0|2,0,0]=4 10049 B11R1.823 CCNC(=O)N(CC)C1CC1 273464a_100015525214_100000738653 [0,0,1,1,0,0|2,0,0]=4 10050 B11R1.823 CCOC(=O)C(NC)C1CC1 2230a_106832991635_100010073418 [0,0,1,1,0,0|1,0,0]=3 10051 B11R1.823 CCOC(=O)C(NC)C1CC1 34a_100102657272_100010073418 [0,0,1,1,0,0|1,0,0]=3 10052 B11R1.823 CCOC(=O)C(NC)C1CC1 7a_106832991635_100010073418 [0,0,1,1,0,0|1,0,0]=3 10053 B11R1.823 CCOC(=O)C(OC)C1CC1 34a_100138415774_100010073418 [0,0,1,1,0,0|1,0,0]=3 10054 B11R1.823 CCOC(=O)C(SC)C1CC1 62a_100010073418_200000210301 [0,0,1,1,0,0|1,0,0]=3 10055 B11R1.823 CCOC(=O)C(SC)C1CC1 62a_200000210301_100010073418 [0,0,1,1,0,0|1,0,0]=3 10056 B11R1.823 CCOC(=O)C(S[13CH3])C1CC1 62a_100010073418_200025704644 [0,0,1,1,0,0|1,0,0]=3 10057 B11R1.823 CCOC(=O)C(S[13CH3])C1CC1 62a_200025704644_100010073418 [0,0,1,1,0,0|1,0,0]=3 10058 B11R1.831 CCC1(CCC1)C(=O)CCF 1458a_100000685558_100011217306 [0,0,1,1,0,0|2,0,0]=4 10059 B11R1.831 CCC1(CCC1)C(=O)CCO 1458a_100000685558_100000211926 [0,0,1,1,0,0|2,0,0]=4 10060 B11R1.831 CCC1(CCC1)C(=O)NNC 22a_100016993582_100000685558 [0,0,1,1,0,0|2,0,0]=4 10061 B11R1.831 CCCC(=O)C1(CCC1)CC 1458a_100000685558_100000210303 [0,0,1,1,0,0|1,0,0]=3 10062 B11R1.831 CCCC(=O)C1(COC1)CC 1458a_100000139254_100000210303 [0,0,1,1,0,0|2,0,0]=4 10063 B11R1.831 CCNC(=O)C1(CCC1)CC 11a_100015525214_100000685558 [0,0,1,1,0,0|1,0,0]=3 10064 B11R1.831 CCNC(=O)C1(CCC1)CC 240690a_100015525214_100000685558 [0,0,1,1,0,0|1,0,0]=3 10065 B11R1.831 CCNC(=O)C1(CCC1)CC 527a_100015525214_100000685558 [0,0,1,1,0,0|1,0,0]=3 10066 B11R1.831 CCNC(=O)C1(COC1)CC 11a_100015525214_100000139254 [0,0,1,1,0,0|2,0,0]=4 10067 B11R1.831 CCNC(=O)C1(COC1)CC 240690a_100015525214_100000139254 [0,0,1,1,0,0|2,0,0]=4 10068 B11R1.831 CCNC(=O)C1(COC1)CC 527a_100015525214_100000139254 [0,0,1,1,0,0|2,0,0]=4 10069 B11R1.831 CCOC(=O)C1(CCC1)NC 34a_100102657272_100009814009 [0,0,1,1,0,0|1,0,0]=3 10070 B11R1.831 CCOC(=O)C1(CCC1)NC 7a_106832991635_100009814009 [0,0,1,1,0,0|1,0,0]=3 10071 B11R1.831 CCOC(=O)C1(CCC1)OC 34a_100138415774_100009814009 [0,0,1,1,0,0|1,0,0]=3 10072 B11R1.831 CCOC(=O)C1(CCC1)SC 62a_100009814009_200000210301 [0,0,1,1,0,0|1,0,0]=3 10073 B11R1.831 CCOC(=O)C1(CCC1)SC 62a_200000210301_100009814009 [0,0,1,1,0,0|1,0,0]=3 10074 B11R1.831 CCOC(=O)C1(CCC1)S[13CH3] 62a_100009814009_200025704644 [0,0,1,1,0,0|1,0,0]=3 10075 B11R1.831 CCOC(=O)C1(CCC1)S[13CH3] 62a_200025704644_100009814009 [0,0,1,1,0,0|1,0,0]=3 10076 B11R1.838 CCCC(=O)C1(CC1)OCC 1458a_100011094191_100000210303 [0,0,1,1,0,0|2,0,0]=4 10077 B11R1.838 CCNC(=O)C1(CC1)OCC 11a_100015525214_100011094191 [0,0,1,1,0,0|2,0,0]=4 10078 B11R1.838 CCNC(=O)C1(CC1)OCC 240690a_100015525214_100011094191 [0,0,1,1,0,0|2,0,0]=4 10079 B11R1.838 CCNC(=O)C1(CC1)OCC 527a_100015525214_100011094191 [0,0,1,1,0,0|2,0,0]=4 10080 B11R1.838 CCOC(=O)C1(CC1)CNC 2230a_106832991635_100010983122 [0,0,1,1,0,0|1,0,0]=3 10081 B11R1.838 CCOC(=O)C1(CC1)CNC 34a_100102657272_100010983122 [0,0,1,1,0,0|1,0,0]=3 10082 B11R1.838 CCOC(=O)C1(CC1)CNC 7a_106832991635_100010983122 [0,0,1,1,0,0|1,0,0]=3 10083 B11R1.838 CCOC(=O)C1(CC1)COC 34a_100138415774_100010983122 [0,0,1,1,0,0|1,0,0]=3 10084 B11R1.838 CCOC(=O)C1(CC1)COC 7a_100000093544_200000210301 [0,0,1,1,0,0|1,0,0]=3 10085 B11R1.838 CCOC(=O)C1(CC1)CO[13CH3] 7a_100000093544_200025704644 [0,0,1,1,0,0|1,0,0]=3 10086 B11R1.838 CCOC(=O)C1(CC1)CSC 62a_100010983122_200000210301 [0,0,1,1,0,0|1,0,0]=3 10087 B11R1.838 CCOC(=O)C1(CC1)CSC 62a_200000210301_100010983122 [0,0,1,1,0,0|1,0,0]=3 10088 B11R1.838 CCOC(=O)C1(CC1)CS[13CH3] 62a_100010983122_200025704644 [0,0,1,1,0,0|1,0,0]=3 10089 B11R1.838 CCOC(=O)C1(CC1)CS[13CH3] 62a_200025704644_100010983122 [0,0,1,1,0,0|1,0,0]=3 10090 B11R1.838 CCOC(=O)C1(CC1)OCC 34a_100121572206_100009861064 [0,0,1,1,0,0|1,0,0]=3 10091 B11R1.838 CCOC(=O)C1(CC1)OCC 7a_200011934196_100000210202 [0,0,1,1,0,0|1,0,0]=3 10092 B11R1.838 CCOC(=O)C1(CC1)OCF 7a_200011934196_100015361967 [0,0,1,1,0,0|2,0,0]=4 10093 B11R1.838 CCOC(=O)C1(CC1)SCC 62a_100000210202_100009861064 [0,0,1,1,0,0|1,0,0]=3 10094 B11R1.838 CCOC(=O)C1(CC1)SCC 62a_100009861064_100000210202 [0,0,1,1,0,0|1,0,0]=3 10095 B11R1.838 CCOC(=O)C1(CC1)SCF 62a_100009861064_100015361967 [0,0,1,1,0,0|2,0,0]=4 10096 B11R1.838 CCOC(=O)C1(CC1)SCF 62a_100015361967_100009861064 [0,0,1,1,0,0|2,0,0]=4 10097 B11R2.164 CCN1CC2CCC1CC2 2230a_100000750499_100000210202 [1,0,0,1,0,0|2,0,0]=4 10098 B11R2.164 CCN1CC2CCC1CC2 269982a_100000750499_100000204670 [1,0,0,1,0,0|2,0,0]=4 10099 B11R2.164 CCN1CC2CCC1CC2 34a_100000750499_100000210202 [1,0,0,1,0,0|2,0,0]=4 10100 B11R2.239 C1CCC(CC1)N2CCC2 269982a_100000754969_100000210327 [1,0,0,1,0,0|2,0,0]=4 10101 B11R2.905 CCC(=O)C1C2C1COC2 1458a_100000138910_100000210202 [1,0,0,1,0,0|1,0,0]=3 10102 B11R2.905 CNC(=O)C1C2C1COC2 11a_106832991635_100000138910 [1,0,0,1,0,0|2,0,0]=4 10103 B11R2.905 CNC(=O)C1C2C1COC2 1626a_100102657272_100000138910 [1,0,0,1,0,0|2,0,0]=4 10104 B11R2.905 CNC(=O)C1C2C1COC2 240690a_100102657272_100000138910 [1,0,0,1,0,0|2,0,0]=4 10105 B11R2.905 CNC(=O)C1C2C1COC2 527a_100102657272_100000138910 [1,0,0,1,0,0|2,0,0]=4 10106 B11R2.905 O=C(CF)C1C2C1COC2 1458a_100000138910_100015361967 [1,0,0,1,0,0|2,0,0]=4 10107 B11R2.914 CCC(=O)N1CC2CC2C1 11a_100000741873_100000210414 [1,0,0,1,0,0|1,0,0]=3 10108 B11R2.914 CCC(=O)N1CC2CC2C1 1626a_100000741873_100000210414 [1,0,0,1,0,0|1,0,0]=3 10109 B11R2.914 CCC(=O)N1CC2CC2C1 240690a_100000741873_100000210414 [1,0,0,1,0,0|1,0,0]=3 10110 B11R2.914 CCC(=O)N1CC2CC2C1 527a_100000741873_100000210414 [1,0,0,1,0,0|1,0,0]=3 10111 B11R2.914 CNC(=O)N1CC2CC2C1 2708a_100102657272_100000741873 [1,0,0,1,0,0|2,0,0]=4 10112 B11R2.914 CNC(=O)N1CC2CC2C1 273464a_100102657272_100000741873 [1,0,0,1,0,0|2,0,0]=4 10113 B11R2.914 O=C(CO)N1CC2CC2C1 240690a_100000741873_100000210174 [1,0,0,1,0,0|2,0,0]=4 10114 B11R2.914 O=C(CO)N1CC2CC2C1 527a_100000741873_100000210174 [1,0,0,1,0,0|2,0,0]=4 10115 B11R2.76 CCCN1C2CCC1CC2 2230a_100000735658_100000210303 [1,0,0,1,0,0|2,0,0]=4 10116 B11R2.76 CCCN1C2CCC1CC2 269982a_100000735658_100000210303 [1,0,0,1,0,0|2,0,0]=4 10117 B11R2.76 CCCN1C2CCC1CC2 34a_100000735658_100000210303 [1,0,0,1,0,0|2,0,0]=4 10118 B11R2.76 CCOC1C2CCC1CC2 34a_100121572206_100009813300 [1,0,0,1,0,0|0,0,1]=3 10119 B11R2.76 CCSC1C2CCC1CC2 62a_100000210202_100009813300 [1,0,0,1,0,0|0,1,1]=4 10120 B11R2.76 CCSC1C2CCC1CC2 62a_100009813300_100000210202 [1,0,0,1,0,0|0,1,1]=4 10121 B11R2.157 CCCNC1CC2CC2C1 270004a_100020643023_100010340937 [1,0,0,1,0,0|2,0,0]=4 10122 B11R2.157 CCOCN1CC2CC2C1 269982a_100000741873_100000739092 [1,0,0,1,0,0|1,0,1]=4 10123 B11R2.238 C1CCC(CC1)NC2CC2 34a_100000182618_100000211595 [1,0,0,1,0,0|2,0,0]=4 10124 B11R2.238 C1CCC(CC1)NC2CC2 34a_100000212008_100000210327 [1,0,0,1,0,0|2,0,0]=4 10125 B11R2.238 C1CCC(CC1)OC2CC2 34a_100000210231_100000211595 [1,0,0,1,0,0|2,0,0]=4 10126 B11R2.238 C1CCC(CC1)SC2CC2 62a_100000210327_100000211595 [1,0,0,1,0,0|2,0,0]=4 10127 B11R2.258 CCOCC1C2C1CNC2 34a_100000045132_100000210202 [1,0,0,1,0,0|1,0,1]=4 10128 B11R2.927 CCCNC1CCC2C1C2 269862a_100020643023_100000692480 [1,0,0,1,0,0|2,0,0]=4 10129 B11R2.927 CCCNC1CCC2C1C2 270004a_100020643023_100000692480 [1,0,0,1,0,0|2,0,0]=4 10130 B11R2.927 CCCOC1CCC2C1C2 34a_200012295571_100000210303 [1,0,0,1,0,0|2,0,0]=4 10131 B11R2.28 CSC1C(=O)[C@H]2CC[C@@H]1C2 62a_200000210301_200015607011 [0,0,0,1,1,0|2,0,0]=4 10132 B11R2.28 CSC1C(=O)[C@H]2CC[C@@H]1C2 62a_200015607011_200000210301 [0,0,0,1,1,0|2,0,0]=4 10133 B11R2.28 [13CH3]SC1C(=O)[C@H]2CC[C@@H]1C2 62a_200015607011_200025704644 [0,0,0,1,1,0|2,0,0]=4 10134 B11R2.28 [13CH3]SC1C(=O)[C@H]2CC[C@@H]1C2 62a_200025704644_200015607011 [0,0,0,1,1,0|2,0,0]=4 10135 B11R2.248 CCOC1CC2CCC1C2 34a_100000211339_100000210202 [0,0,0,1,1,0|1,0,1]=4 10136 B11R2.248 CCOC1CC2CCC1C2 34a_100121572206_100000727232 [0,0,0,1,1,0|1,0,1]=4 10137 B11R2.1031 O=C(C1CC1)C2CCOC2 1458a_100000210395_100000690089 [0,0,0,1,1,0|2,0,0]=4 10138 B11R2.1031 O=C(C1CC1)N2CCCC2 240690a_100000188435_100000210395 [0,0,0,1,1,0|2,0,0]=4 10139 B11R2.1031 O=C(C1CC1)N2CCCC2 527a_100000188435_100000210395 [0,0,0,1,1,0|2,0,0]=4 10140 B11R2.1031 O=C(C1CCCC1)C2CC2 1458a_100000210395_100000179811 [0,0,0,1,1,0|1,0,0]=3 10141 B11R2.1031 O=C(C1CCCC1)C2CO2 1458a_100000701028_100000179811 [0,0,0,1,1,0|2,0,0]=4 10142 B13R2.15 O=C1OCCC1N2CCCOC2 2230a_100000131196_100000211211 [0,0,0,1,0,1|2,0,0]=4 10143 B13R2.15 O=C1OCCC1N2CCCOC2 269982a_100000131196_100000211211 [0,0,0,1,0,1|2,0,0]=4 10144 B13R2.15 O=C1OCCC1N2CCCOC2 34a_100000131196_100000211211 [0,0,0,1,0,1|2,0,0]=4 10145 B13R2.15 O=C1OCCC1N2CCOCC2 2230a_100015191051_100000211211 [0,0,0,1,0,1|2,0,0]=4 10146 B13R2.15 O=C1OCCC1N2CCOCC2 269982a_100015191051_100000211211 [0,0,0,1,0,1|2,0,0]=4 10147 B13R2.15 O=C1OCCC1N2CCOCC2 34a_100015191051_100000211211 [0,0,0,1,0,1|2,0,0]=4 10148 B13R2.15 O=C1OCCC1N2CCSCC2 2230a_100000737611_100000211211 [0,0,0,1,0,1|2,0,0]=4 10149 B13R2.15 O=C1OCCC1N2CCSCC2 269982a_100000737611_100000211211 [0,0,0,1,0,1|2,0,0]=4 10150 B13R2.64 C1CCC(CC1)OC2CCCO2 34a_100000085407_100000210327 [0,0,0,1,0,1|1,0,1]=4 10151 B13R2.444 O=C(CC1CCCCC1)C2CC2 1458a_100000210395_100000211423 [0,0,0,1,0,1|1,0,0]=3 10152 B13R2.444 O=C(CC1CCCCC1)C2CO2 1458a_100000701028_100000211423 [0,0,0,1,0,1|2,0,0]=4 10153 B13R2.444 O=C(CC1CCCCO1)C2CC2 1458a_100000210395_100000211543 [0,0,0,1,0,1|2,0,0]=4 10154 B13R2.444 O=C(CC1CCCOC1)C2CC2 1458a_100000210395_100000741521 [0,0,0,1,0,1|2,0,0]=4 10155 B13R2.444 O=C(CC1CCOCC1)C2CC2 1458a_100000210395_100000754603 [0,0,0,1,0,1|2,0,0]=4 10156 B13R2.444 O=C(NC1CCCCC1)C2CC2 11a_100000182618_100000210395 [0,0,0,1,0,1|1,0,0]=3 10157 B13R2.444 O=C(NC1CCCCC1)C2CC2 1626a_100000182618_100000210395 [0,0,0,1,0,1|1,0,0]=3 10158 B13R2.444 O=C(NC1CCCCC1)C2CC2 240690a_100000182618_100000210395 [0,0,0,1,0,1|1,0,0]=3 10159 B13R2.444 O=C(NC1CCCCC1)C2CC2 527a_100000182618_100000210395 [0,0,0,1,0,1|1,0,0]=3 10160 B13R2.444 O=C(NC1CCCCC1)C2CO2 11a_100000182618_100000701028 [0,0,0,1,0,1|2,0,0]=4 10161 B13R2.444 O=C(NC1CCCCC1)C2CO2 1626a_100000182618_100000701028 [0,0,0,1,0,1|2,0,0]=4 10162 B13R2.444 O=C(NC1CCCCC1)C2CO2 240690a_100000182618_100000701028 [0,0,0,1,0,1|2,0,0]=4 10163 B13R2.444 O=C(NC1CCCCC1)C2CO2 527a_100000182618_100000701028 [0,0,0,1,0,1|2,0,0]=4 10164 B13R2.444 O=C(NC1CCCOC1)C2CC2 11a_100000719290_100000210395 [0,0,0,1,0,1|2,0,0]=4 10165 B13R2.444 O=C(NC1CCCOC1)C2CC2 1626a_100000719290_100000210395 [0,0,0,1,0,1|2,0,0]=4 10166 B13R2.444 O=C(NC1CCCOC1)C2CC2 240690a_100000719290_100000210395 [0,0,0,1,0,1|2,0,0]=4 10167 B13R2.444 O=C(NC1CCCOC1)C2CC2 527a_100000719290_100000210395 [0,0,0,1,0,1|2,0,0]=4 10168 B13R2.444 O=C(NC1CCOCC1)C2CC2 11a_100000741149_100000210395 [0,0,0,1,0,1|2,0,0]=4 10169 B13R2.444 O=C(NC1CCOCC1)C2CC2 1626a_100000741149_100000210395 [0,0,0,1,0,1|2,0,0]=4 10170 B13R2.444 O=C(NC1CCOCC1)C2CC2 240690a_100000741149_100000210395 [0,0,0,1,0,1|2,0,0]=4 10171 B13R2.444 O=C(NC1CCOCC1)C2CC2 527a_100000741149_100000210395 [0,0,0,1,0,1|2,0,0]=4 10172 B13R2.444 O=C(NC1CCSCC1)C2CC2 11a_100000748639_100000210395 [0,0,0,1,0,1|2,0,0]=4 10173 B13R2.444 O=C(NC1CCSCC1)C2CC2 1626a_100000748639_100000210395 [0,0,0,1,0,1|2,0,0]=4 10174 B13R2.444 O=C(NC1CCSCC1)C2CC2 240690a_100000748639_100000210395 [0,0,0,1,0,1|2,0,0]=4 10175 B13R2.444 O=C(NC1CCSCC1)C2CC2 527a_100000748639_100000210395 [0,0,0,1,0,1|2,0,0]=4 10176 B13R2.820 CC=CC(=O)N1C2CCC1CC2 11a_100000735658_100000210699 [0,0,0,1,0,1|1,0,1]=4 10177 B13R2.820 CC=CC(=O)N1C2CCC1CC2 1626a_100000735658_100000210699 [0,0,0,1,0,1|1,0,1]=4 10178 B13R2.820 CC=CC(=O)N1C2CCC1CC2 240690a_100000735658_100000210699 [0,0,0,1,0,1|1,0,1]=4 10179 B13R2.820 CCCC(=O)N1C2CCC1CC2 11a_100000735658_100000211992 [0,0,0,1,0,1|1,0,0]=3 10180 B13R2.820 CCCC(=O)N1C2CCC1CC2 1626a_100000735658_100000211992 [0,0,0,1,0,1|1,0,0]=3 10181 B13R2.820 CCCC(=O)N1C2CCC1CC2 240690a_100000735658_100000211992 [0,0,0,1,0,1|1,0,0]=3 10182 B13R2.820 CCCC(=O)N1C2CCC1CC2 527a_100000735658_100000211992 [0,0,0,1,0,1|1,0,0]=3 10183 B13R2.820 CCNC(=O)N1C2CCC1CC2 2708a_100015525214_100000735658 [0,0,0,1,0,1|1,0,0]=3 10184 B13R2.820 CCNC(=O)N1C2CCC1CC2 273464a_100015525214_100000735658 [0,0,0,1,0,1|1,0,0]=3 10185 B13R2.820 COCC(=O)N1C2CCC1CC2 11a_100000735658_100000210968 [0,0,0,1,0,1|2,0,0]=4 10186 B13R2.820 COCC(=O)N1C2CCC1CC2 1626a_100000735658_100000210968 [0,0,0,1,0,1|2,0,0]=4 10187 B13R2.820 COCC(=O)N1C2CCC1CC2 240690a_100000735658_100000210968 [0,0,0,1,0,1|2,0,0]=4 10188 B13R2.820 COCC(=O)N1C2CCC1CC2 527a_100000735658_100000210968 [0,0,0,1,0,1|2,0,0]=4 10189 B13R2.820 CSCC(=O)N1C2CCC1CC2 11a_100000735658_100000184570 [0,0,0,1,0,1|2,0,0]=4 10190 B13R2.820 CSCC(=O)N1C2CCC1CC2 1626a_100000735658_100000184570 [0,0,0,1,0,1|2,0,0]=4 10191 B13R2.820 CSCC(=O)N1C2CCC1CC2 240690a_100000735658_100000184570 [0,0,0,1,0,1|2,0,0]=4 10192 B13R2.820 CSCC(=O)N1C2CCC1CC2 527a_100000735658_100000184570 [0,0,0,1,0,1|2,0,0]=4 10193 B13R2.820 O=C(CCO)N1C2CCC1CC2 240690a_100000735658_100011216618 [0,0,0,1,0,1|2,0,0]=4 10194 B13R2.882 CCCC(=O)NC1C2C1COC2 11a_100000702821_100000211992 [0,0,0,1,0,1|2,0,0]=4 10195 B13R2.882 CCCC(=O)NC1C2C1COC2 240690a_100000702821_100000211992 [0,0,0,1,0,1|2,0,0]=4 10196 B13R2.882 CCCC(=O)NC1C2C1COC2 527a_100000702821_100000211992 [0,0,0,1,0,1|2,0,0]=4 10197 B13R2.882 CCNC(=O)NC1C2C1COC2 2708a_100000702821_100015525214 [0,0,0,1,0,1|2,0,0]=4 10198 B13R2.882 CCNC(=O)NC1C2C1COC2 2708a_100015525214_100000702821 [0,0,0,1,0,1|2,0,0]=4 10199 B13R2.882 CCNC(=O)NC1C2C1COC2 273464a_100000702821_100015525214 [0,0,0,1,0,1|2,0,0]=4 10200 B13R2.882 CCNC(=O)NC1C2C1COC2 273464a_100015525214_100000702821 [0,0,0,1,0,1|2,0,0]=4 10201 B13R2.882 CCNC(=O)NC1C2C1COC2 512a_100000702821_100015525214 [0,0,0,1,0,1|2,0,0]=4 10202 B13R2.882 CCNC(=O)NC1C2C1COC2 512a_100015525214_100000702821 [0,0,0,1,0,1|2,0,0]=4 10203 B13R2.2232 CCCC(=O)CN1CC2CC2C1 2230a_100000741873_100000747444 [0,0,0,1,0,1|2,0,0]=4 10204 B13R2.2232 CCCC(=O)CN1CC2CC2C1 269982a_100000741873_100000747444 [0,0,0,1,0,1|2,0,0]=4 10205 B13R2.2232 CCNC(=O)CN1CC2CC2C1 2230a_100000741873_100000183381 [0,0,0,1,0,1|2,0,0]=4 10206 B13R2.2232 CCNC(=O)CN1CC2CC2C1 269982a_100000741873_100000183381 [0,0,0,1,0,1|2,0,0]=4 10207 B13R2.2232 CCNC(=O)CN1CC2CC2C1 34a_100000741873_100000183381 [0,0,0,1,0,1|2,0,0]=4 10208 B13R2.2232 CCOC(=O)CN1CC2CC2C1 2230a_100000741873_100000188475 [0,0,0,1,0,1|1,0,0]=3 10209 B13R2.2232 CCOC(=O)CN1CC2CC2C1 269982a_100000741873_100000188475 [0,0,0,1,0,1|1,0,0]=3 10210 B13R2.2232 CCOC(=O)CN1CC2CC2C1 34a_100000741873_100000188475 [0,0,0,1,0,1|1,0,0]=3 10211 B13R2.4014 CN1CC(=O)NC12CCCCC2 2230a_200015869604_200000210301 [0,0,0,1,0,1|2,0,0]=4 10212 B13R2.4014 CN1CC(=O)NC12CCCCC2 34a_200015869604_200000210301 [0,0,0,1,0,1|2,0,0]=4 10213 B13R2.4014 [13CH3]N1CC(=O)NC12CCCCC2 2230a_200015869604_200025704644 [0,0,0,1,0,1|2,0,0]=4 10214 B13R2.4014 [13CH3]N1CC(=O)NC12CCCCC2 34a_200015869604_200025704644 [0,0,0,1,0,1|2,0,0]=4 10215 B13R2.14823 CCCC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 1458a_100153394716_100000210303 [0,0,0,1,0,1|1,0,0]=3 10216 B13R2.14823 CCNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 11a_100015525214_100153394716 [0,0,0,1,0,1|1,0,0]=3 10217 B13R2.14823 CCNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 240690a_100015525214_100153394716 [0,0,0,1,0,1|1,0,0]=3 10218 B13R2.14823 CCNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 527a_100015525214_100153394716 [0,0,0,1,0,1|1,0,0]=3 10219 B13R2.14823 CNNC(=O)[C@H]1[C@H]2[C@@H]1CCCC2 22a_100016993582_100153394716 [0,0,0,1,0,1|2,0,0]=4 10220 B13R2.14823 O=C(CCF)[C@H]1[C@H]2[C@@H]1CCCC2 1458a_100153394716_100011217306 [0,0,0,1,0,1|2,0,0]=4 10221 B13R2.14823 O=C(CCO)[C@H]1[C@H]2[C@@H]1CCCC2 1458a_100153394716_100000211926 [0,0,0,1,0,1|2,0,0]=4 10222 B13R2.2283 O=C(C1CC1)N2CCCCCC2 11a_100000185865_100000210395 [0,0,0,1,0,1|2,0,0]=4 10223 B13R2.2283 O=C(C1CC1)N2CCCCCC2 1626a_100000185865_100000210395 [0,0,0,1,0,1|2,0,0]=4 10224 B13R2.2283 O=C(C1CC1)N2CCCCCC2 240690a_100000185865_100000210395 [0,0,0,1,0,1|2,0,0]=4 10225 B13R2.2283 O=C(C1CC1)N2CCCCCC2 527a_100000185865_100000210395 [0,0,0,1,0,1|2,0,0]=4 10226 B13R2.2283 O=C(C1CC1)N2CCCOCC2 11a_100000685342_100000210395 [0,0,0,1,0,1|2,0,0]=4 10227 B13R2.2283 O=C(C1CC1)N2CCCOCC2 1626a_100000685342_100000210395 [0,0,0,1,0,1|2,0,0]=4 10228 B13R2.2283 O=C(C1CC1)N2CCCOCC2 240690a_100000685342_100000210395 [0,0,0,1,0,1|2,0,0]=4 10229 B13R2.2283 O=C(C1CC1)N2CCCOCC2 527a_100000685342_100000210395 [0,0,0,1,0,1|2,0,0]=4 10230 B13R2.2283 O=C(C1CCCCCC1)C2CC2 1458a_100000210395_100011217769 [0,0,0,1,0,1|1,0,0]=3 10231 B13R2.2283 O=C(C1CCCCCC1)C2CO2 1458a_100000701028_100011217769 [0,0,0,1,0,1|2,0,0]=4 10232 B13R2.3 C1CCC(CC1)N2CCCOC2 269982a_100000131196_100000210327 [0,1,0,1,0,0|2,0,0]=4 10233 B13R2.3 C1CCC(CC1)N2CCCOC2 270004a_100000131196_100000210434 [0,1,0,1,0,0|2,0,0]=4 10234 B13R2.3 C1CCC(CC1)N2CCCOC2 34a_100000131196_100000210327 [0,1,0,1,0,0|2,0,0]=4 10235 B13R2.10 Cc1nc(no1)C2CCCCC2 270196a_100000241002_100000070787 [0,1,0,1,0,0|1,0,1]=4 10236 B13R2.10 Cc1noc(n1)C2CCCCC2 270196a_100000212224_100000210647 [0,1,0,1,0,0|1,0,1]=4 10237 B13R2.520 CC1CCC(CC1)C(=O)C2CC2 1458a_100000210395_200011216234 [0,1,0,1,0,0|1,0,0]=3 10238 B13R2.520 CC1CCC(CC1)C(=O)C2CO2 1458a_100000701028_200011216234 [0,1,0,1,0,0|2,0,0]=4 10239 B13R2.520 CC1CCN(CC1)C(=O)C2CC2 240690a_100000188429_100000210395 [0,1,0,1,0,0|2,0,0]=4 10240 B13R2.520 CC1CCN(CC1)C(=O)C2CC2 527a_100000188429_100000210395 [0,1,0,1,0,0|2,0,0]=4 10241 B13R2.520 O=C(C1CC1)N2CCC(CC2)F 11a_100015193889_100000210395 [0,1,0,1,0,0|2,0,0]=4 10242 B13R2.520 O=C(C1CC1)N2CCC(CC2)F 1626a_100015193889_100000210395 [0,1,0,1,0,0|2,0,0]=4 10243 B13R2.520 O=C(C1CC1)N2CCC(CC2)F 240690a_100015193889_100000210395 [0,1,0,1,0,0|2,0,0]=4 10244 B13R2.520 O=C(C1CC1)N2CCC(CC2)F 527a_100015193889_100000210395 [0,1,0,1,0,0|2,0,0]=4 10245 B13R2.520 O=C(C1CC1)N2CCC(CC2)O 240690a_100025773856_100000210395 [0,1,0,1,0,0|2,0,0]=4 10246 B13R2.520 O=C(C1CC1)N2CCC(CC2)O 527a_100025773856_100000210395 [0,1,0,1,0,0|2,0,0]=4 10247 B13R2.821 CCOC(=O)[C@H]1[C@H]2[C@@H]1CN(C2)C 2230a_100102947547_200000210301 [0,1,0,1,0,0|1,0,0]=3 10248 B13R2.821 CCOC(=O)[C@H]1[C@H]2[C@@H]1CN(C2)C 269982a_100102947547_200000210301 [0,1,0,1,0,0|1,0,0]=3 10249 B13R2.821 CCOC(=O)[C@H]1[C@H]2[C@@H]1CN(C2)[13CH3] 2230a_100102947547_200025704644 [0,1,0,1,0,0|1,0,0]=3 10250 B13R2.821 CCOC(=O)[C@H]1[C@H]2[C@@H]1CN(C2)[13CH3] 269982a_100102947547_200025704644 [0,1,0,1,0,0|1,0,0]=3 10251 B13R2.5102 CN1CCC2(CCNC2=O)CC1 2230a_100015190449_200000210301 [0,1,0,1,0,0|2,0,0]=4 10252 B13R2.5102 CN1CCC2(CCNC2=O)CC1 269982a_100015190449_200000210301 [0,1,0,1,0,0|2,0,0]=4 10253 B13R2.5102 CN1CCC2(CCNC2=O)CC1 34a_100015190449_200000210301 [0,1,0,1,0,0|2,0,0]=4 10254 B13R2.5102 [13CH3]N1CCC2(CCNC2=O)CC1 2230a_100015190449_200025704644 [0,1,0,1,0,0|2,0,0]=4 10255 B13R2.5102 [13CH3]N1CCC2(CCNC2=O)CC1 269982a_100015190449_200025704644 [0,1,0,1,0,0|2,0,0]=4 10256 B13R2.5102 [13CH3]N1CCC2(CCNC2=O)CC1 34a_100015190449_200025704644 [0,1,0,1,0,0|2,0,0]=4 10257 B13R2.856 CC#CC(=O)C1CC2CCC1C2 1458a_100000763181_100000727232 [0,1,0,1,0,0|1,0,1]=4 10258 B13R2.856 CC=CC(=O)C1CC2CCC1C2 1458a_100000210699_100000727232 [0,1,0,1,0,0|1,0,1]=4 10259 B13R2.856 CCCC(=O)C1CC2CCC1C2 1458a_100000181847_100000210303 [0,1,0,1,0,0|1,0,0]=3 10260 B13R2.856 CCCC(=O)C1CC2CCC1C2 1458a_100000211992_100000727232 [0,1,0,1,0,0|1,0,0]=3 10261 B13R2.856 CCCC(=O)N1CC2CCC1C2 11a_100000743476_100000211992 [0,1,0,1,0,0|2,0,0]=4 10262 B13R2.856 CCCC(=O)N1CC2CCC1C2 1626a_100000743476_100000211992 [0,1,0,1,0,0|2,0,0]=4 10263 B13R2.856 CCCC(=O)N1CC2CCC1C2 240690a_100000743476_100000211992 [0,1,0,1,0,0|2,0,0]=4 10264 B13R2.856 CCCC(=O)N1CC2CCC1C2 527a_100000743476_100000211992 [0,1,0,1,0,0|2,0,0]=4 10265 B13R2.856 CCNC(=O)C1CC2CCC1C2 11a_100015525214_100000181847 [0,1,0,1,0,0|1,0,0]=3 10266 B13R2.856 CCNC(=O)C1CC2CCC1C2 240690a_100015525214_100000181847 [0,1,0,1,0,0|1,0,0]=3 10267 B13R2.856 CCNC(=O)C1CC2CCC1C2 527a_100015525214_100000181847 [0,1,0,1,0,0|1,0,0]=3 10268 B13R2.856 CCNC(=O)N1CC2CCC1C2 2708a_100015525214_100000743476 [0,1,0,1,0,0|2,0,0]=4 10269 B13R2.856 CCNC(=O)N1CC2CCC1C2 273464a_100015525214_100000743476 [0,1,0,1,0,0|2,0,0]=4 10270 B13R2.856 CNNC(=O)C1CC2CCC1C2 22a_100016993582_100000181847 [0,1,0,1,0,0|2,0,0]=4 10271 B13R2.856 COCC(=O)C1CC2CCC1C2 1458a_100000210968_100000727232 [0,1,0,1,0,0|2,0,0]=4 10272 B13R2.856 CSCC(=O)C1CC2CCC1C2 1458a_100000184570_100000727232 [0,1,0,1,0,0|2,0,0]=4 10273 B13R2.856 O=C(CCF)C1CC2CCC1C2 1458a_100000181847_100011217306 [0,1,0,1,0,0|2,0,0]=4 10274 B13R2.856 O=C(CCO)C1CC2CCC1C2 1458a_100000181847_100000211926 [0,1,0,1,0,0|2,0,0]=4 10275 B13R2.856 O=C(CCO)C1CC2CCC1C2 1458a_100011216618_100000727232 [0,1,0,1,0,0|2,0,0]=4 10276 B13R2.3473 CN1CCCC2(C1)CCNC2=O 2230a_100015190446_200000210301 [0,1,0,1,0,0|2,0,0]=4 10277 B13R2.3473 CN1CCCC2(C1)CCNC2=O 269982a_100015190446_200000210301 [0,1,0,1,0,0|2,0,0]=4 10278 B13R2.3473 CN1CCCC2(C1)CCNC2=O 34a_100015190446_200000210301 [0,1,0,1,0,0|2,0,0]=4 10279 B13R2.3473 [13CH3]N1CCCC2(C1)CCNC2=O 2230a_100015190446_200025704644 [0,1,0,1,0,0|2,0,0]=4 10280 B13R2.3473 [13CH3]N1CCCC2(C1)CCNC2=O 269982a_100015190446_200025704644 [0,1,0,1,0,0|2,0,0]=4 10281 B13R2.3473 [13CH3]N1CCCC2(C1)CCNC2=O 34a_100015190446_200025704644 [0,1,0,1,0,0|2,0,0]=4 10282 B13R2.5324 C[C@H]1CCCN(C1)C(=O)C2CC2 11a_100000717927_100000210395 [0,1,0,1,0,0|2,0,0]=4 10283 B13R2.5324 C[C@H]1CCCN(C1)C(=O)C2CC2 240690a_100000717927_100000210395 [0,1,0,1,0,0|2,0,0]=4 10284 B13R2.5324 C[C@H]1CCCN(C1)C(=O)C2CC2 527a_100000717927_100000210395 [0,1,0,1,0,0|2,0,0]=4 10285 B13R2.5324 O=C(C1CC1)N2CCCC(C2)F 11a_100000697950_100000210395 [0,1,0,1,0,0|2,0,0]=4 10286 B13R2.5324 O=C(C1CC1)N2CCCC(C2)F 1626a_100000697950_100000210395 [0,1,0,1,0,0|2,0,0]=4 10287 B13R2.5324 O=C(C1CC1)N2CCCC(C2)F 240690a_100000697950_100000210395 [0,1,0,1,0,0|2,0,0]=4 10288 B13R2.5324 O=C(C1CC1)N2CCCC(C2)F 527a_100000697950_100000210395 [0,1,0,1,0,0|2,0,0]=4 10289 B13R2.5324 O=C(C1CC1)N2CCCC(C2)O 240690a_100000211013_100000210395 [0,1,0,1,0,0|2,0,0]=4 10290 B13R2.5324 O=C(C1CC1)N2CCCC(C2)O 527a_100000211013_100000210395 [0,1,0,1,0,0|2,0,0]=4 10291 B13R2.382 CC1CC1C(=O)C2CCCCC2 1458a_100000211227_100000210327 [0,1,0,1,0,0|1,0,0]=3 10292 B13R2.382 CC1CC1C(=O)C2CCCOC2 1458a_100000211227_100000693364 [0,1,0,1,0,0|2,0,0]=4 10293 B13R2.382 CC1CC1C(=O)C2CCOCC2 1458a_100000211227_100011324220 [0,1,0,1,0,0|2,0,0]=4 10294 B13R2.382 O=C(C1CCCCC1)[C@@H]2C[C@@H]2F 1458a_100015396687_100000210327 [0,1,0,1,0,0|1,0,0]=3 10295 B13R2.382 O=C(C1CCCOC1)[C@@H]2C[C@@H]2F 1458a_100015396687_100000693364 [0,1,0,1,0,0|2,0,0]=4 10296 B13R2.382 O=C(C1CCOCC1)[C@@H]2C[C@@H]2F 1458a_100015396687_100011324220 [0,1,0,1,0,0|2,0,0]=4 10297 B13R2.510 CCOCN1CC2CCC1CC2 269982a_100000750499_100000739092 [0,1,0,1,0,0|2,0,0]=4 10298 B13R2.690 CC(OC1CC1)C2CCCCC2 34a_100011216961_100000211595 [0,1,0,1,0,0|1,0,1]=4 10299 B13R2.690 O=C(CC1CC1)C2CCCCC2 1458a_100000210647_100000742324 [0,1,0,1,0,0|1,0,0]=3 10300 B13R2.690 O=C(CC1CC1)C2CCCCC2 1458a_100000738066_100000210327 [0,1,0,1,0,0|1,0,0]=3 10301 B13R2.690 O=C(CC1CC1)C2CCCCO2 1458a_100000748299_100000742324 [0,1,0,1,0,0|2,0,0]=4 10302 B13R2.690 O=C(CC1CC1)C2CCCOC2 1458a_100000738066_100000693364 [0,1,0,1,0,0|2,0,0]=4 10303 B13R2.690 O=C(CC1CC1)C2CCCOC2 1458a_100000741522_100000742324 [0,1,0,1,0,0|2,0,0]=4 10304 B13R2.690 O=C(CC1CC1)C2CCOCC2 1458a_100000195482_100000742324 [0,1,0,1,0,0|2,0,0]=4 10305 B13R2.690 O=C(CC1CC1)C2CCOCC2 1458a_100000738066_100011324220 [0,1,0,1,0,0|2,0,0]=4 10306 B13R2.690 O=C(CC1CC1)C2CCSCC2 1458a_100000755232_100000742324 [0,1,0,1,0,0|2,0,0]=4 10307 B13R2.690 O=C(CC1CO1)C2CCCCC2 1458a_100000210647_100011216344 [0,1,0,1,0,0|1,0,0]=3 10308 B13R2.690 O=C(CC1CO1)C2CCCCO2 1458a_100000748299_100011216344 [0,1,0,1,0,0|2,0,0]=4 10309 B13R2.690 O=C(CC1CO1)C2CCCOC2 1458a_100000741522_100011216344 [0,1,0,1,0,0|2,0,0]=4 10310 B13R2.690 O=C(CC1CO1)C2CCOCC2 1458a_100000195482_100011216344 [0,1,0,1,0,0|2,0,0]=4 10311 B13R2.690 O=C(CC1CO1)C2CCSCC2 1458a_100000755232_100011216344 [0,1,0,1,0,0|2,0,0]=4 10312 B13R2.690 O=C(CC1CS1)C2CCCCC2 1458a_100000210647_100000031435 [0,1,0,1,0,0|1,0,0]=3 10313 B13R2.690 O=C(CC1CS1)C2CCCCO2 1458a_100000748299_100000031435 [0,1,0,1,0,0|2,0,0]=4 10314 B13R2.690 O=C(CC1CS1)C2CCCOC2 1458a_100000741522_100000031435 [0,1,0,1,0,0|2,0,0]=4 10315 B13R2.690 O=C(CC1CS1)C2CCOCC2 1458a_100000195482_100000031435 [0,1,0,1,0,0|2,0,0]=4 10316 B13R2.690 O=C(CC1CS1)C2CCSCC2 1458a_100000755232_100000031435 [0,1,0,1,0,0|2,0,0]=4 10317 B13R2.690 O=C(C[C@@H]1CO1)C2CCCCC2 1458a_100000210647_100000745022 [0,1,0,1,0,0|1,0,0]=3 10318 B13R2.690 O=C(C[C@@H]1CO1)C2CCCCO2 1458a_100000748299_100000745022 [0,1,0,1,0,0|2,0,0]=4 10319 B13R2.690 O=C(C[C@@H]1CO1)C2CCCOC2 1458a_100000741522_100000745022 [0,1,0,1,0,0|2,0,0]=4 10320 B13R2.690 O=C(C[C@@H]1CO1)C2CCOCC2 1458a_100000195482_100000745022 [0,1,0,1,0,0|2,0,0]=4 10321 B13R2.690 O=C(C[C@@H]1CO1)C2CCSCC2 1458a_100000755232_100000745022 [0,1,0,1,0,0|2,0,0]=4 10322 B13R2.690 O=C(NC1CC1)C2CCCCC2 1626a_100000212008_100000210647 [0,1,0,1,0,0|1,0,0]=3 10323 B13R2.690 O=C(NC1CC1)C2CCCCC2 240690a_100000212008_100000210647 [0,1,0,1,0,0|1,0,0]=3 10324 B13R2.690 O=C(NC1CC1)C2CCCCC2 527a_100000212008_100000210647 [0,1,0,1,0,0|1,0,0]=3 10325 B13R2.690 O=C(NC1CC1)C2CCCCO2 1626a_100000212008_100000748299 [0,1,0,1,0,0|2,0,0]=4 10326 B13R2.690 O=C(NC1CC1)C2CCCCO2 240690a_100000212008_100000748299 [0,1,0,1,0,0|2,0,0]=4 10327 B13R2.690 O=C(NC1CC1)C2CCCCO2 527a_100000212008_100000748299 [0,1,0,1,0,0|2,0,0]=4 10328 B13R2.690 O=C(NC1CC1)C2CCCOC2 1626a_100000212008_100000741522 [0,1,0,1,0,0|2,0,0]=4 10329 B13R2.690 O=C(NC1CC1)C2CCCOC2 240690a_100000212008_100000741522 [0,1,0,1,0,0|2,0,0]=4 10330 B13R2.690 O=C(NC1CC1)C2CCCOC2 527a_100000212008_100000741522 [0,1,0,1,0,0|2,0,0]=4 10331 B13R2.690 O=C(NC1CC1)C2CCOCC2 1626a_100000212008_100000195482 [0,1,0,1,0,0|2,0,0]=4 10332 B13R2.690 O=C(NC1CC1)C2CCOCC2 240690a_100000212008_100000195482 [0,1,0,1,0,0|2,0,0]=4 10333 B13R2.690 O=C(NC1CC1)C2CCOCC2 527a_100000212008_100000195482 [0,1,0,1,0,0|2,0,0]=4 10334 B13R2.690 O=C(NC1CC1)C2CCSCC2 1626a_100000212008_100000755232 [0,1,0,1,0,0|2,0,0]=4 10335 B13R2.690 O=C(NC1CC1)C2CCSCC2 240690a_100000212008_100000755232 [0,1,0,1,0,0|2,0,0]=4 10336 B13R2.690 O=C(NC1CC1)C2CCSCC2 527a_100000212008_100000755232 [0,1,0,1,0,0|2,0,0]=4 10337 B13R2.2205 CCCCC(=O)C1C2C1COC2 1458a_100000138910_100000210211 [0,1,0,1,0,0|2,0,0]=4 10338 B13R2.2205 CCCNC(=O)C1C2C1COC2 11a_100020643023_100000138910 [0,1,0,1,0,0|2,0,0]=4 10339 B13R2.2205 CCCNC(=O)C1C2C1COC2 1626a_100020643023_100000138910 [0,1,0,1,0,0|2,0,0]=4 10340 B13R2.2205 CCCNC(=O)C1C2C1COC2 240690a_100020643023_100000138910 [0,1,0,1,0,0|2,0,0]=4 10341 B13R2.2205 CCCNC(=O)C1C2C1COC2 527a_100020643023_100000138910 [0,1,0,1,0,0|2,0,0]=4 10342 B13R2.2205 CCNNC(=O)C1C2C1COC2 22a_100000756455_100000138910 [0,1,0,1,0,0|2,0,0]=4 10343 B13R2.2205 COCCC(=O)C1C2C1COC2 1458a_100000138910_100000233755 [0,1,0,1,0,0|2,0,0]=4 10344 B13R2.2205 CSCCC(=O)C1C2C1COC2 1458a_100000138910_100000751147 [0,1,0,1,0,0|2,0,0]=4 10345 B13R2.2205 O=C(CCCF)C1C2C1COC2 1458a_100000138910_100011934791 [0,1,0,1,0,0|2,0,0]=4 10346 B13R2.2205 O=C(CCCO)C1C2C1COC2 1458a_100000138910_100011215043 [0,1,0,1,0,0|2,0,0]=4 10347 B13R2.2205 O=C(NCCF)C1C2C1COC2 11a_100000724931_100000138910 [0,1,0,1,0,0|2,0,0]=4 10348 B13R2.2205 O=C(NCCF)C1C2C1COC2 1626a_100000724931_100000138910 [0,1,0,1,0,0|2,0,0]=4 10349 B13R2.2205 O=C(NCCF)C1C2C1COC2 240690a_100000724931_100000138910 [0,1,0,1,0,0|2,0,0]=4 10350 B13R2.2205 O=C(NCCF)C1C2C1COC2 527a_100000724931_100000138910 [0,1,0,1,0,0|2,0,0]=4 10351 B13R2.2205 O=C(NCCO)C1C2C1COC2 240690a_100000210304_100000138910 [0,1,0,1,0,0|2,0,0]=4 10352 B13R2.2205 O=C(NCCO)C1C2C1COC2 527a_100000210304_100000138910 [0,1,0,1,0,0|2,0,0]=4 10353 B13R2.2214 CCC=CC(=O)N1CC2CC2C1 11a_100000741873_100000212282 [0,1,0,1,0,0|2,0,0]=4 10354 B13R2.2214 CCC=CC(=O)N1CC2CC2C1 1626a_100000741873_100000212282 [0,1,0,1,0,0|2,0,0]=4 10355 B13R2.2214 CCC=CC(=O)N1CC2CC2C1 240690a_100000741873_100000212282 [0,1,0,1,0,0|2,0,0]=4 10356 B13R2.2214 CCCCC(=O)N1CC2CC2C1 11a_100000741873_100000210183 [0,1,0,1,0,0|2,0,0]=4 10357 B13R2.2214 CCCCC(=O)N1CC2CC2C1 1626a_100000741873_100000210183 [0,1,0,1,0,0|2,0,0]=4 10358 B13R2.2214 CCCCC(=O)N1CC2CC2C1 240690a_100000741873_100000210183 [0,1,0,1,0,0|2,0,0]=4 10359 B13R2.2214 CCCCC(=O)N1CC2CC2C1 527a_100000741873_100000210183 [0,1,0,1,0,0|2,0,0]=4 10360 B13R2.2214 CCCNC(=O)N1CC2CC2C1 2708a_100020643023_100000741873 [0,1,0,1,0,0|2,0,0]=4 10361 B13R2.2214 CCCNC(=O)N1CC2CC2C1 273464a_100020643023_100000741873 [0,1,0,1,0,0|2,0,0]=4 10362 B13R2.2214 CCOCC(=O)N1CC2CC2C1 11a_100000741873_100000211967 [0,1,0,1,0,0|1,0,0]=3 10363 B13R2.2214 CCOCC(=O)N1CC2CC2C1 1626a_100000741873_100000211967 [0,1,0,1,0,0|1,0,0]=3 10364 B13R2.2214 CCOCC(=O)N1CC2CC2C1 240690a_100000741873_100000211967 [0,1,0,1,0,0|1,0,0]=3 10365 B13R2.2214 CCOCC(=O)N1CC2CC2C1 527a_100000741873_100000211967 [0,1,0,1,0,0|1,0,0]=3 10366 B13R2.2214 CCSCC(=O)N1CC2CC2C1 11a_100000741873_100000230394 [0,1,0,1,0,0|1,1,0]=4 10367 B13R2.2214 CCSCC(=O)N1CC2CC2C1 1626a_100000741873_100000230394 [0,1,0,1,0,0|1,1,0]=4 10368 B13R2.2214 CCSCC(=O)N1CC2CC2C1 240690a_100000741873_100000230394 [0,1,0,1,0,0|1,1,0]=4 10369 B13R2.2214 CCSCC(=O)N1CC2CC2C1 527a_100000741873_100000230394 [0,1,0,1,0,0|1,1,0]=4 10370 B13R2.2214 COCCC(=O)N1CC2CC2C1 11a_100000741873_100000749529 [0,1,0,1,0,0|2,0,0]=4 10371 B13R2.2214 COCCC(=O)N1CC2CC2C1 1626a_100000741873_100000749529 [0,1,0,1,0,0|2,0,0]=4 10372 B13R2.2214 COCCC(=O)N1CC2CC2C1 240690a_100000741873_100000749529 [0,1,0,1,0,0|2,0,0]=4 10373 B13R2.2214 COCCC(=O)N1CC2CC2C1 527a_100000741873_100000749529 [0,1,0,1,0,0|2,0,0]=4 10374 B13R2.2214 CSCCC(=O)N1CC2CC2C1 11a_100000741873_100000174002 [0,1,0,1,0,0|2,0,0]=4 10375 B13R2.2214 CSCCC(=O)N1CC2CC2C1 1626a_100000741873_100000174002 [0,1,0,1,0,0|2,0,0]=4 10376 B13R2.2214 CSCCC(=O)N1CC2CC2C1 240690a_100000741873_100000174002 [0,1,0,1,0,0|2,0,0]=4 10377 B13R2.2214 CSCCC(=O)N1CC2CC2C1 527a_100000741873_100000174002 [0,1,0,1,0,0|2,0,0]=4 10378 B13R2.2214 O=C(NCCF)N1CC2CC2C1 273464a_100000724931_100000741873 [0,1,0,1,0,0|2,0,0]=4 10379 B13R2.2214 O=C(NCCO)N1CC2CC2C1 273464a_100000210304_100000741873 [0,1,0,1,0,0|2,0,0]=4 10380 B13R2.8137 O=C(C1C=CCCC1)C2CCO2 1458a_100000089072_100000751183 [0,1,0,1,0,0|0,0,2]=4 10381 B13R2.8137 O=C(C1CCC1)C2CCCCO2 1458a_100000748299_100000749161 [0,1,0,1,0,0|2,0,0]=4 10382 B13R2.8137 O=C(C1CCC1)C2CCCOC2 1458a_100000209988_100000693364 [0,1,0,1,0,0|2,0,0]=4 10383 B13R2.8137 O=C(C1CCC1)C2CCCOC2 1458a_100000741522_100000749161 [0,1,0,1,0,0|2,0,0]=4 10384 B13R2.8137 O=C(C1CCC1)C2CCOCC2 1458a_100000195482_100000749161 [0,1,0,1,0,0|2,0,0]=4 10385 B13R2.8137 O=C(C1CCC1)C2CCOCC2 1458a_100000209988_100011324220 [0,1,0,1,0,0|2,0,0]=4 10386 B13R2.8137 O=C(C1CCC1)C2CCSCC2 1458a_100000755232_100000749161 [0,1,0,1,0,0|2,0,0]=4 10387 B13R2.8137 O=C(C1CCCCC1)C2CCC2 1458a_100000209988_100000210327 [0,1,0,1,0,0|1,0,0]=3 10388 B13R2.8137 O=C(C1CCCCC1)C2CCC2 1458a_100000210647_100000749161 [0,1,0,1,0,0|1,0,0]=3 10389 B13R2.8137 O=C(C1CCCCC1)C2CCO2 1458a_100000089072_100000210327 [0,1,0,1,0,0|0,0,0]=2 10390 B13R2.8137 O=C(C1CCCCC1)C2COC2 1458a_100000210647_100000687716 [0,1,0,1,0,0|1,0,0]=3 10391 B13R2.8137 O=C(C1CCCCC1)C2COC2 1458a_100000758290_100000210327 [0,1,0,1,0,0|1,0,0]=3 10392 B13R2.8137 O=C(C1CCCCC1)N2CCC2 11a_100000754969_100000210647 [0,1,0,1,0,0|1,0,0]=3 10393 B13R2.8137 O=C(C1CCCCC1)N2CCC2 240690a_100000754969_100000210647 [0,1,0,1,0,0|1,0,0]=3 10394 B13R2.8137 O=C(C1CCCCC1)N2CCC2 527a_100000754969_100000210647 [0,1,0,1,0,0|1,0,0]=3 10395 B13R2.8137 O=C(C1CCCCO1)N2CCC2 11a_100000754969_100000748299 [0,1,0,1,0,0|2,0,0]=4 10396 B13R2.8137 O=C(C1CCCCO1)N2CCC2 240690a_100000754969_100000748299 [0,1,0,1,0,0|2,0,0]=4 10397 B13R2.8137 O=C(C1CCCCO1)N2CCC2 527a_100000754969_100000748299 [0,1,0,1,0,0|2,0,0]=4 10398 B13R2.8137 O=C(C1CCCOC1)C2CCO2 1458a_100000089072_100000693364 [0,1,0,1,0,0|1,0,0]=3 10399 B13R2.8137 O=C(C1CCCOC1)C2COC2 1458a_100000741522_100000687716 [0,1,0,1,0,0|2,0,0]=4 10400 B13R2.8137 O=C(C1CCCOC1)C2COC2 1458a_100000758290_100000693364 [0,1,0,1,0,0|2,0,0]=4 10401 B13R2.8137 O=C(C1CCCOC1)N2CCC2 11a_100000754969_100000741522 [0,1,0,1,0,0|2,0,0]=4 10402 B13R2.8137 O=C(C1CCCOC1)N2CCC2 240690a_100000754969_100000741522 [0,1,0,1,0,0|2,0,0]=4 10403 B13R2.8137 O=C(C1CCCOC1)N2CCC2 527a_100000754969_100000741522 [0,1,0,1,0,0|2,0,0]=4 10404 B13R2.8137 O=C(C1CCO1)N2CCCOC2 11a_100000131196_100000089072 [0,1,0,1,0,0|2,0,0]=4 10405 B13R2.8137 O=C(C1CCO1)N2CCCOC2 240690a_100000131196_100000089072 [0,1,0,1,0,0|2,0,0]=4 10406 B13R2.8137 O=C(C1CCO1)N2CCOCC2 11a_100015191051_100000089072 [0,1,0,1,0,0|2,0,0]=4 10407 B13R2.8137 O=C(C1CCO1)N2CCOCC2 1626a_100015191051_100000089072 [0,1,0,1,0,0|2,0,0]=4 10408 B13R2.8137 O=C(C1CCO1)N2CCOCC2 240690a_100015191051_100000089072 [0,1,0,1,0,0|2,0,0]=4 10409 B13R2.8137 O=C(C1CCO1)N2CCOCC2 527a_100015191051_100000089072 [0,1,0,1,0,0|2,0,0]=4 10410 B13R2.8137 O=C(C1CCO1)N2CCSCC2 11a_100000737611_100000089072 [0,1,0,1,0,0|2,0,0]=4 10411 B13R2.8137 O=C(C1CCO1)N2CCSCC2 240690a_100000737611_100000089072 [0,1,0,1,0,0|2,0,0]=4 10412 B13R2.8137 O=C(C1CCO1)N2CCSCC2 527a_100000737611_100000089072 [0,1,0,1,0,0|2,0,0]=4 10413 B13R2.8137 O=C(C1CCOCC1)C2CCO2 1458a_100000089072_100011324220 [0,1,0,1,0,0|1,0,0]=3 10414 B13R2.8137 O=C(C1CCOCC1)C2COC2 1458a_100000195482_100000687716 [0,1,0,1,0,0|2,0,0]=4 10415 B13R2.8137 O=C(C1CCOCC1)C2COC2 1458a_100000758290_100011324220 [0,1,0,1,0,0|2,0,0]=4 10416 B13R2.8137 O=C(C1CCOCC1)N2CCC2 11a_100000754969_100000195482 [0,1,0,1,0,0|2,0,0]=4 10417 B13R2.8137 O=C(C1CCOCC1)N2CCC2 240690a_100000754969_100000195482 [0,1,0,1,0,0|2,0,0]=4 10418 B13R2.8137 O=C(C1CCOCC1)N2CCC2 527a_100000754969_100000195482 [0,1,0,1,0,0|2,0,0]=4 10419 B13R2.8137 O=C(C1CCSCC1)C2COC2 1458a_100000755232_100000687716 [0,1,0,1,0,0|2,0,0]=4 10420 B13R2.8137 O=C(C1CCSCC1)N2CCC2 11a_100000754969_100000755232 [0,1,0,1,0,0|2,0,0]=4 10421 B13R2.8137 O=C(C1CCSCC1)N2CCC2 240690a_100000754969_100000755232 [0,1,0,1,0,0|2,0,0]=4 10422 B13R2.8137 O=C(C1CCSCC1)N2CCC2 527a_100000754969_100000755232 [0,1,0,1,0,0|2,0,0]=4 10423 B13R2.8137 O=C(C1COC1)C2CCCCO2 1458a_100000748299_100000687716 [0,1,0,1,0,0|2,0,0]=4 10424 B13R2.2250 CCC(C)C(=O)C1C2C1COC2 1458a_100000138910_100000758301 [0,1,0,1,0,0|2,0,0]=4 10425 B13R2.2250 CCN(C)C(=O)C1C2C1COC2 11a_100000225621_100000138910 [0,1,0,1,0,0|2,0,0]=4 10426 B13R2.2250 CCN(C)C(=O)C1C2C1COC2 1626a_100000225621_100000138910 [0,1,0,1,0,0|2,0,0]=4 10427 B13R2.2250 CCN(C)C(=O)C1C2C1COC2 240690a_100000225621_100000138910 [0,1,0,1,0,0|2,0,0]=4 10428 B13R2.2250 CCN(C)C(=O)C1C2C1COC2 527a_100000225621_100000138910 [0,1,0,1,0,0|2,0,0]=4 10429 B13R2.2259 CCC(C)C(=O)N1CC2CC2C1 11a_100000741873_100011192722 [0,1,0,1,0,0|2,0,0]=4 10430 B13R2.2259 CCC(C)C(=O)N1CC2CC2C1 1626a_100000741873_100011192722 [0,1,0,1,0,0|2,0,0]=4 10431 B13R2.2259 CCC(C)C(=O)N1CC2CC2C1 240690a_100000741873_100011192722 [0,1,0,1,0,0|2,0,0]=4 10432 B13R2.2259 CCC(C)C(=O)N1CC2CC2C1 527a_100000741873_100011192722 [0,1,0,1,0,0|2,0,0]=4 10433 B13R2.2259 CCC(O)C(=O)N1CC2CC2C1 240690a_100000741873_100011196387 [0,1,0,1,0,0|2,0,0]=4 10434 B13R2.8138 CC1(CC1)C(=O)C2CCCCC2 1458a_100000756474_100000210327 [0,1,0,1,0,0|1,0,0]=3 10435 B13R2.8138 CC1(CC1)C(=O)C2CCCOC2 1458a_100000756474_100000693364 [0,1,0,1,0,0|2,0,0]=4 10436 B13R2.8138 CC1(CC1)C(=O)C2CCOCC2 1458a_100000756474_100011324220 [0,1,0,1,0,0|2,0,0]=4 10437 B13R2.8138 O=C(C1CCCCC1)C2(CC2)F 1458a_100000055089_100000210327 [0,1,0,1,0,0|1,0,0]=3 10438 B13R2.8138 O=C(C1CCCCC1)C2(CC2)O 1458a_100000241761_100000210327 [0,1,0,1,0,0|1,0,0]=3 10439 B13R2.8138 O=C(C1CCCOC1)C2(CC2)F 1458a_100000055089_100000693364 [0,1,0,1,0,0|2,0,0]=4 10440 B13R2.8138 O=C(C1CCCOC1)C2(CC2)O 1458a_100000241761_100000693364 [0,1,0,1,0,0|2,0,0]=4 10441 B13R2.8138 O=C(C1CCOCC1)C2(CC2)F 1458a_100000055089_100011324220 [0,1,0,1,0,0|2,0,0]=4 10442 B13R2.8138 O=C(C1CCOCC1)C2(CC2)O 1458a_100000241761_100011324220 [0,1,0,1,0,0|2,0,0]=4 10443 B13R2.10115 CC(C)CC(=O)C1C2C1COC2 1458a_100000138910_100000210624 [0,1,0,1,0,0|2,0,0]=4 10444 B13R2.10115 CC(C)NC(=O)C1C2C1COC2 11a_100138425928_100000138910 [0,1,0,1,0,0|2,0,0]=4 10445 B13R2.10115 CC(C)NC(=O)C1C2C1COC2 1626a_100138425928_100000138910 [0,1,0,1,0,0|2,0,0]=4 10446 B13R2.10115 CC(C)NC(=O)C1C2C1COC2 240690a_100138425928_100000138910 [0,1,0,1,0,0|2,0,0]=4 10447 B13R2.10115 CC(C)NC(=O)C1C2C1COC2 527a_100138425928_100000138910 [0,1,0,1,0,0|2,0,0]=4 10448 B13R2.10115 CC(O)CC(=O)C1C2C1COC2 1458a_100000138910_100011218427 [0,1,0,1,0,0|2,0,0]=4 10449 B13R2.10121 CC(C)CC(=O)N1CC2CC2C1 11a_100000741873_100000210554 [0,1,0,1,0,0|2,0,0]=4 10450 B13R2.10121 CC(C)CC(=O)N1CC2CC2C1 1626a_100000741873_100000210554 [0,1,0,1,0,0|2,0,0]=4 10451 B13R2.10121 CC(C)CC(=O)N1CC2CC2C1 240690a_100000741873_100000210554 [0,1,0,1,0,0|2,0,0]=4 10452 B13R2.10121 CC(C)CC(=O)N1CC2CC2C1 527a_100000741873_100000210554 [0,1,0,1,0,0|2,0,0]=4 10453 B13R2.10121 CC(C)NC(=O)N1CC2CC2C1 2708a_100138425928_100000741873 [0,1,0,1,0,0|2,0,0]=4 10454 B13R2.10121 CC(C)NC(=O)N1CC2CC2C1 273464a_100138425928_100000741873 [0,1,0,1,0,0|2,0,0]=4 10455 B13R2.10121 C[C@@H](O)CC(=O)N1CC2CC2C1 240690a_100000741873_100011933948 [0,1,0,1,0,0|2,0,0]=4 10456 B13R2.3097 CC1CCCCN1C(=O)C2CC2 11a_100000211376_100000210395 [0,1,0,1,0,0|2,0,0]=4 10457 B13R2.3097 CC1CCCCN1C(=O)C2CC2 1626a_100000211376_100000210395 [0,1,0,1,0,0|2,0,0]=4 10458 B13R2.3097 CC1CCCCN1C(=O)C2CC2 240690a_100000211376_100000210395 [0,1,0,1,0,0|2,0,0]=4 10459 B13R2.3097 CC1CCCCN1C(=O)C2CC2 527a_100000211376_100000210395 [0,1,0,1,0,0|2,0,0]=4 10460 B13R2.3097 O=C1CCCCC1C(=O)C2CC2 1458a_100000210395_100000204591 [0,1,0,1,0,0|1,0,1]=4 10461 B13R3.1883 O=C(C1CC1)N2CC3CC3C2 11a_100000741873_100000210395 [0,0,0,2,0,0|2,0,0]=4 10462 B13R3.1883 O=C(C1CC1)N2CC3CC3C2 1626a_100000741873_100000210395 [0,0,0,2,0,0|2,0,0]=4 10463 B13R3.1883 O=C(C1CC1)N2CC3CC3C2 240690a_100000741873_100000210395 [0,0,0,2,0,0|2,0,0]=4 10464 B13R3.1883 O=C(C1CC1)N2CC3CC3C2 527a_100000741873_100000210395 [0,0,0,2,0,0|2,0,0]=4 10465 B9R1.11 C#CC(=O)C1CCCC1 1458a_100000211873_100000179811 [1,0,0,0,1,0|0,0,2]=4 10466 B9R1.11 C=CC(=O)C1CCCC1 1458a_100000185746_100000179811 [1,0,0,0,1,0|0,0,2]=4 10467 B9R1.11 CC(O[13CH3])C1CCCC1 34a_100011216366_200025704644 [1,0,0,0,1,0|1,0,1]=4 10468 B9R1.11 CC(O[13CH3])C1CCCC1 7a_100011216366_200025704644 [1,0,0,0,1,0|1,0,1]=4 10469 B9R1.11 CCC(=O)C1=CCCC1 1458a_100000038896_100000210202 [1,0,0,0,1,0|0,0,2]=4 10470 B9R1.11 CCC(=O)C1CC=CC1 1458a_100000759439_100000210202 [1,0,0,0,1,0|0,0,2]=4 10471 B9R1.11 CCC(=O)C1CCCC1 1458a_100000210414_100000179811 [1,0,0,0,1,0|0,0,0]=2 10472 B9R1.11 CCC(=O)C1CCCC1 1458a_100000210718_100000210202 [1,0,0,0,1,0|0,0,0]=2 10473 B9R1.11 CCC(=O)C1CCCS1 1458a_100012002731_100000210202 [1,0,0,0,1,0|1,0,0]=3 10474 B9R1.11 CCC(=O)C1CCOC1 1458a_100000210414_100000690089 [1,0,0,0,1,0|1,0,0]=3 10475 B9R1.11 CCC(=O)C1CCOC1 1458a_100011219752_100000210202 [1,0,0,0,1,0|1,0,0]=3 10476 B9R1.11 CCC(=O)N1CCCC1 240690a_100000188435_100000210414 [1,0,0,0,1,0|1,0,0]=3 10477 B9R1.11 CCC(=O)N1CCCC1 527a_100000188435_100000210414 [1,0,0,0,1,0|1,0,0]=3 10478 B9R1.11 CCC(=O)N1CCSC1 11a_100011215254_100000210414 [1,0,0,0,1,0|2,0,0]=4 10479 B9R1.11 CCC(=O)N1CCSC1 240690a_100011215254_100000210414 [1,0,0,0,1,0|2,0,0]=4 10480 B9R1.11 CCC(=O)N1CCSC1 527a_100011215254_100000210414 [1,0,0,0,1,0|2,0,0]=4 10481 B9R1.11 CCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210202 [1,0,0,0,1,0|1,0,0]=3 10482 B9R1.11 CCN(C)C1CCCC1 2230a_100000207505_100000210202 [1,0,0,0,1,0|2,0,0]=4 10483 B9R1.11 CCN(C)C1CCCC1 2230a_100000225621_100000179811 [1,0,0,0,1,0|2,0,0]=4 10484 B9R1.11 CCN(C)C1CCCC1 269982a_100000207505_100000204670 [1,0,0,0,1,0|2,0,0]=4 10485 B9R1.11 CCN(C)C1CCCC1 269982a_100000225621_100000179811 [1,0,0,0,1,0|2,0,0]=4 10486 B9R1.11 CCN(C)C1CCCC1 34a_100000207505_100000210202 [1,0,0,0,1,0|2,0,0]=4 10487 B9R1.11 CNC(=O)C1CCCC1 11a_106832991635_100000210718 [1,0,0,0,1,0|1,0,0]=3 10488 B9R1.11 CNC(=O)C1CCCC1 1626a_100102657272_100000210718 [1,0,0,0,1,0|1,0,0]=3 10489 B9R1.11 CNC(=O)C1CCCC1 240690a_100102657272_100000210718 [1,0,0,0,1,0|1,0,0]=3 10490 B9R1.11 CNC(=O)C1CCCC1 527a_100102657272_100000210718 [1,0,0,0,1,0|1,0,0]=3 10491 B9R1.11 CNC(=O)C1CCCS1 11a_106832991635_100012002731 [1,0,0,0,1,0|2,0,0]=4 10492 B9R1.11 CNC(=O)C1CCCS1 1626a_100102657272_100012002731 [1,0,0,0,1,0|2,0,0]=4 10493 B9R1.11 CNC(=O)C1CCCS1 240690a_100102657272_100012002731 [1,0,0,0,1,0|2,0,0]=4 10494 B9R1.11 CNC(=O)C1CCCS1 527a_100102657272_100012002731 [1,0,0,0,1,0|2,0,0]=4 10495 B9R1.11 CNC(=O)C1CCOC1 11a_106832991635_100011219752 [1,0,0,0,1,0|2,0,0]=4 10496 B9R1.11 CNC(=O)C1CCOC1 1626a_100102657272_100011219752 [1,0,0,0,1,0|2,0,0]=4 10497 B9R1.11 CNC(=O)C1CCOC1 240690a_100102657272_100011219752 [1,0,0,0,1,0|2,0,0]=4 10498 B9R1.11 CNC(=O)C1CCOC1 527a_100102657272_100011219752 [1,0,0,0,1,0|2,0,0]=4 10499 B9R1.11 CNC(=O)N1CCCC1 2708a_100102657272_100000188435 [1,0,0,0,1,0|2,0,0]=4 10500 B9R1.11 CNC(=O)N1CCCC1 273464a_100102657272_100000188435 [1,0,0,0,1,0|2,0,0]=4 10501 B9R1.11 CNC(=O)[C@@H]1CCCO1 11a_106832991635_100000686382 [1,0,0,0,1,0|2,0,0]=4 10502 B9R1.11 CNC(=O)[C@@H]1CCCO1 1626a_100102657272_100000686382 [1,0,0,0,1,0|2,0,0]=4 10503 B9R1.11 CNC(=O)[C@@H]1CCCO1 240690a_100102657272_100000686382 [1,0,0,0,1,0|2,0,0]=4 10504 B9R1.11 CNC(=O)[C@@H]1CCCO1 527a_100102657272_100000686382 [1,0,0,0,1,0|2,0,0]=4 10505 B9R1.11 COC(C)C1CCCC1 34a_100011216366_200000210301 [1,0,0,0,1,0|1,0,1]=4 10506 B9R1.11 COC(C)C1CCCC1 7a_100011216366_200000210301 [1,0,0,0,1,0|1,0,1]=4 10507 B9R1.11 O=C(CF)C1CCCC1 1458a_100000210718_100015361967 [1,0,0,0,1,0|1,0,0]=3 10508 B9R1.11 O=C(CF)C1CCCS1 1458a_100012002731_100015361967 [1,0,0,0,1,0|2,0,0]=4 10509 B9R1.11 O=C(CF)C1CCOC1 1458a_100011219752_100015361967 [1,0,0,0,1,0|2,0,0]=4 10510 B9R1.11 O=C(CF)[C@@H]1CCCO1 1458a_100000686382_100015361967 [1,0,0,0,1,0|2,0,0]=4 10511 B9R1.11 O=C(CO)C1CCCC1 1458a_100000210174_100000179811 [1,0,0,0,1,0|1,0,0]=3 10512 B9R1.11 O=C(CO)C1CCOC1 1458a_100000210174_100000690089 [1,0,0,0,1,0|2,0,0]=4 10513 B9R1.11 O=C(CO)N1CCCC1 240690a_100000188435_100000210174 [1,0,0,0,1,0|2,0,0]=4 10514 B9R1.11 O=C(CO)N1CCCC1 527a_100000188435_100000210174 [1,0,0,0,1,0|2,0,0]=4 10515 B9R1.12 CCCNC1CCCC1 2230a_100000211070_100000210303 [1,0,0,0,1,0|2,0,0]=4 10516 B9R1.12 CCCNC1CCCC1 270004a_100020643023_100000210133 [1,0,0,0,1,0|2,0,0]=4 10517 B9R1.12 CCCNC1CCCC1 34a_100000211070_100000210303 [1,0,0,0,1,0|2,0,0]=4 10518 B9R1.12 CCCOC1CCCC1 34a_100000210258_100000179811 [1,0,0,0,1,0|2,0,0]=4 10519 B9R1.12 CCCOC1CCCC1 34a_100000210269_100000210303 [1,0,0,0,1,0|2,0,0]=4 10520 B9R1.12 CCCOC1CCCC1 7a_100000210269_100000210303 [1,0,0,0,1,0|2,0,0]=4 10521 B9R1.12 CCCSC1CCCC1 62a_100000210303_100000179811 [1,0,0,0,1,0|2,0,0]=4 10522 B9R1.12 CCCSC1CCCC1 62a_100011217020_100000210303 [1,0,0,0,1,0|2,0,0]=4 10523 B9R1.12 CCNCC1CCCC1 2230a_100000737975_100000210202 [1,0,0,0,1,0|1,0,1]=4 10524 B9R1.12 CCNCC1CCCC1 2230a_100015525214_100000740388 [1,0,0,0,1,0|1,0,1]=4 10525 B9R1.12 CCNCC1CCCC1 269862a_100015525214_100000746403 [1,0,0,0,1,0|1,0,1]=4 10526 B9R1.12 CCNCC1CCCC1 34a_100000737975_100000210202 [1,0,0,0,1,0|1,0,1]=4 10527 B9R1.12 CCOCC1CCCC1 34a_100000742336_100000210202 [1,0,0,0,1,0|0,0,1]=3 10528 B9R1.12 CCOCC1CCCC1 34a_100121572206_100000740388 [1,0,0,0,1,0|0,0,1]=3 10529 B9R1.12 CCOCC1CCCC1 7a_100000742336_100000210202 [1,0,0,0,1,0|0,0,1]=3 10530 B9R1.12 CCOCC1CCCO1 34a_100000210270_100000210202 [1,0,0,0,1,0|1,0,1]=4 10531 B9R1.12 CCOCC1CCCO1 7a_100000210270_100000210202 [1,0,0,0,1,0|1,0,1]=4 10532 B9R1.12 CCOCC1CCNC1 34a_100000748654_100000210202 [1,0,0,0,1,0|1,0,1]=4 10533 B9R1.12 CCOCC1CCOC1 34a_100000740260_100000210202 [1,0,0,0,1,0|1,0,1]=4 10534 B9R1.12 CCOCC1CCOC1 34a_100121572206_100011261433 [1,0,0,0,1,0|1,0,1]=4 10535 B9R1.12 CCOCN1CCCC1 269982a_100000188435_100000739092 [1,0,0,0,1,0|1,0,1]=4 10536 B9R1.12 CCOC[C@H]1CCCN1 34a_100000745186_100000210202 [1,0,0,0,1,0|1,0,1]=4 10537 B9R1.12 CCSCC1CCCC1 62a_100000210202_100000740388 [1,0,0,0,1,0|0,1,1]=4 10538 B9R1.12 CCSCC1CCCC1 62a_100000740388_100000210202 [1,0,0,0,1,0|0,1,1]=4 10539 B9R1.12 FCOCC1CCCC1 34a_100000742336_100015361967 [1,0,0,0,1,0|1,0,1]=4 10540 B9R1.12 FCOCC1CCCC1 7a_100000742336_100015361967 [1,0,0,0,1,0|1,0,1]=4 10541 B9R1.73 CC#CC(=O)C1CCC1 1458a_100000763181_100000749161 [0,0,0,0,2,0|1,0,1]=4 10542 B9R1.73 CC=CC(=O)C1CCC1 1458a_100000210699_100000749161 [0,0,0,0,2,0|1,0,1]=4 10543 B9R1.73 CCCC(=O)C1CCC1 1458a_100000209988_100000210303 [0,0,0,0,2,0|1,0,0]=3 10544 B9R1.73 CCCC(=O)C1CCC1 1458a_100000211992_100000749161 [0,0,0,0,2,0|1,0,0]=3 10545 B9R1.73 CCCC(=O)C1CCO1 1458a_100000089072_100000210303 [0,0,0,0,2,0|2,0,0]=4 10546 B9R1.73 CCCC(=O)C1COC1 1458a_100000211992_100000687716 [0,0,0,0,2,0|2,0,0]=4 10547 B9R1.73 CCCC(=O)C1COC1 1458a_100000758290_100000210303 [0,0,0,0,2,0|2,0,0]=4 10548 B9R1.73 CCCC(=O)N1CCC1 11a_100000754969_100000211992 [0,0,0,0,2,0|2,0,0]=4 10549 B9R1.73 CCCC(=O)N1CCC1 240690a_100000754969_100000211992 [0,0,0,0,2,0|2,0,0]=4 10550 B9R1.73 CCCC(=O)N1CCC1 527a_100000754969_100000211992 [0,0,0,0,2,0|2,0,0]=4 10551 B9R1.73 CCNC(=O)C1CCC1 11a_100015525214_100000209988 [0,0,0,0,2,0|1,0,0]=3 10552 B9R1.73 CCNC(=O)C1CCC1 240690a_100015525214_100000209988 [0,0,0,0,2,0|1,0,0]=3 10553 B9R1.73 CCNC(=O)C1CCC1 527a_100015525214_100000209988 [0,0,0,0,2,0|1,0,0]=3 10554 B9R1.73 CCNC(=O)C1CCO1 11a_100015525214_100000089072 [0,0,0,0,2,0|2,0,0]=4 10555 B9R1.73 CCNC(=O)C1CCO1 240690a_100015525214_100000089072 [0,0,0,0,2,0|2,0,0]=4 10556 B9R1.73 CCNC(=O)C1CCO1 527a_100015525214_100000089072 [0,0,0,0,2,0|2,0,0]=4 10557 B9R1.73 CCNC(=O)C1COC1 11a_100015525214_100000758290 [0,0,0,0,2,0|2,0,0]=4 10558 B9R1.73 CCNC(=O)C1COC1 240690a_100015525214_100000758290 [0,0,0,0,2,0|2,0,0]=4 10559 B9R1.73 CCNC(=O)C1COC1 527a_100015525214_100000758290 [0,0,0,0,2,0|2,0,0]=4 10560 B9R1.73 CCNC(=O)N1CCC1 2708a_100015525214_100000754969 [0,0,0,0,2,0|2,0,0]=4 10561 B9R1.73 CCNC(=O)N1CCC1 273464a_100015525214_100000754969 [0,0,0,0,2,0|2,0,0]=4 10562 B9R1.73 CCOC(C)C1CCC1 34a_100000766398_100000210202 [0,0,0,0,2,0|1,0,1]=4 10563 B9R1.73 CCOC(C)C1CCC1 7a_100000766398_100000210202 [0,0,0,0,2,0|1,0,1]=4 10564 B9R1.73 CNCC(=O)C1CCC1 2230a_106832991635_100000686122 [0,0,0,0,2,0|2,0,0]=4 10565 B9R1.73 CNCC(=O)C1CCC1 34a_100102657272_100000686122 [0,0,0,0,2,0|2,0,0]=4 10566 B9R1.73 CNCC(=O)C1CCC1 7a_106832991635_100000686122 [0,0,0,0,2,0|2,0,0]=4 10567 B9R1.73 CNNC(=O)C1CCC1 22a_100016993582_100000209988 [0,0,0,0,2,0|2,0,0]=4 10568 B9R1.73 COCC(=O)C1CCC1 1458a_100000210968_100000749161 [0,0,0,0,2,0|2,0,0]=4 10569 B9R1.73 COCC(=O)C1CCC1 34a_100138415774_100000686122 [0,0,0,0,2,0|2,0,0]=4 10570 B9R1.73 CSCC(=O)C1CCC1 1458a_100000184570_100000749161 [0,0,0,0,2,0|2,0,0]=4 10571 B9R1.73 CSCC(=O)C1CCC1 62a_100000686122_200000210301 [0,0,0,0,2,0|2,0,0]=4 10572 B9R1.73 CSCC(=O)C1CCC1 62a_200000210301_100000686122 [0,0,0,0,2,0|2,0,0]=4 10573 B9R1.73 O=C(CCF)C1CCC1 1458a_100000209988_100011217306 [0,0,0,0,2,0|2,0,0]=4 10574 B9R1.73 O=C(CCO)C1CCC1 1458a_100000209988_100000211926 [0,0,0,0,2,0|2,0,0]=4 10575 B9R1.73 O=C(CCO)C1CCC1 1458a_100011216618_100000749161 [0,0,0,0,2,0|2,0,0]=4 10576 B9R1.73 [13CH3]SCC(=O)C1CCC1 62a_100000686122_200025704644 [0,0,0,0,2,0|2,0,0]=4 10577 B9R1.73 [13CH3]SCC(=O)C1CCC1 62a_200025704644_100000686122 [0,0,0,0,2,0|2,0,0]=4 10578 B11R0.182 CC=CC(=O)NC(CC)CCC 11a_100000747048_100000210699 [0,0,1,0,0,1|1,0,1]=4 10579 B11R0.182 CC=CC(=O)NC(CC)CCC 1626a_100000747048_100000210699 [0,0,1,0,0,1|1,0,1]=4 10580 B11R0.182 CC=CC(=O)NC(CC)CCC 240690a_100000747048_100000210699 [0,0,1,0,0,1|1,0,1]=4 10581 B11R0.182 CCCC(=O)CN(CC)CCC 2230a_100000226822_100000747444 [0,0,1,0,0,1|2,0,0]=4 10582 B11R0.182 CCCC(=O)CN(CC)CCC 269982a_100000226822_100000747444 [0,0,1,0,0,1|2,0,0]=4 10583 B11R0.182 CCCC(=O)NC(CC)CCC 11a_100000747048_100000211992 [0,0,1,0,0,1|1,0,0]=3 10584 B11R0.182 CCCC(=O)NC(CC)CCC 1626a_100000747048_100000211992 [0,0,1,0,0,1|1,0,0]=3 10585 B11R0.182 CCCC(=O)NC(CC)CCC 240690a_100000747048_100000211992 [0,0,1,0,0,1|1,0,0]=3 10586 B11R0.182 CCCC(=O)NC(CC)CCC 527a_100000747048_100000211992 [0,0,1,0,0,1|1,0,0]=3 10587 B11R0.182 CCCC(=O)NC(CC)COC 11a_100000757820_100000211992 [0,0,1,0,0,1|2,0,0]=4 10588 B11R0.182 CCCC(=O)NC(CC)COC 1626a_100000757820_100000211992 [0,0,1,0,0,1|2,0,0]=4 10589 B11R0.182 CCCC(=O)NC(CC)COC 240690a_100000757820_100000211992 [0,0,1,0,0,1|2,0,0]=4 10590 B11R0.182 CCCC(=O)NC(CC)COC 527a_100000757820_100000211992 [0,0,1,0,0,1|2,0,0]=4 10591 B11R0.182 CCCC(=O)N[C@H](CO)CCC 240690a_100000732646_100000211992 [0,0,1,0,0,1|2,0,0]=4 10592 B11R0.182 CCCC(=O)N[C@H](CO)CCC 527a_100000732646_100000211992 [0,0,1,0,0,1|2,0,0]=4 10593 B11R0.182 CCCC(CC(=O)OCC)OC 7a_100011216533_200000210301 [0,0,1,0,0,1|1,0,0]=3 10594 B11R0.182 CCCC(CC(=O)OCC)O[13CH3] 7a_100011216533_200025704644 [0,0,1,0,0,1|1,0,0]=3 10595 B11R0.182 CCCC(CC)NC(=O)CCO 240690a_100000747048_100011216618 [0,0,1,0,0,1|2,0,0]=4 10596 B11R0.182 CCCC(CC)NC(=O)COC 11a_100000747048_100000210968 [0,0,1,0,0,1|2,0,0]=4 10597 B11R0.182 CCCC(CC)NC(=O)COC 1626a_100000747048_100000210968 [0,0,1,0,0,1|2,0,0]=4 10598 B11R0.182 CCCC(CC)NC(=O)COC 240690a_100000747048_100000210968 [0,0,1,0,0,1|2,0,0]=4 10599 B11R0.182 CCCC(CC)NC(=O)COC 527a_100000747048_100000210968 [0,0,1,0,0,1|2,0,0]=4 10600 B11R0.182 CCCC(CC)NC(=O)CSC 11a_100000747048_100000184570 [0,0,1,0,0,1|2,0,0]=4 10601 B11R0.182 CCCC(CC)NC(=O)CSC 1626a_100000747048_100000184570 [0,0,1,0,0,1|2,0,0]=4 10602 B11R0.182 CCCC(CC)NC(=O)CSC 240690a_100000747048_100000184570 [0,0,1,0,0,1|2,0,0]=4 10603 B11R0.182 CCCC(CC)NC(=O)CSC 527a_100000747048_100000184570 [0,0,1,0,0,1|2,0,0]=4 10604 B11R0.182 CCCC(CC)NC(=O)NCC 2708a_100000747048_100015525214 [0,0,1,0,0,1|1,0,0]=3 10605 B11R0.182 CCCC(CC)NC(=O)NCC 2708a_100015525214_100000747048 [0,0,1,0,0,1|1,0,0]=3 10606 B11R0.182 CCCC(CC)NC(=O)NCC 273464a_100000747048_100015525214 [0,0,1,0,0,1|1,0,0]=3 10607 B11R0.182 CCCC(CC)NC(=O)NCC 273464a_100015525214_100000747048 [0,0,1,0,0,1|1,0,0]=3 10608 B11R0.182 CCCC(CC)NC(=O)NCC 512a_100000747048_100015525214 [0,0,1,0,0,1|1,0,0]=3 10609 B11R0.182 CCCC(CC)NC(=O)NCC 512a_100015525214_100000747048 [0,0,1,0,0,1|1,0,0]=3 10610 B11R0.182 CCCC(CC)NC(=O)NNC 273464a_100000747048_100016993582 [0,0,1,0,0,1|2,0,0]=4 10611 B11R0.182 CCCC(CC)NC(=O)NNC 512a_100000747048_100016993582 [0,0,1,0,0,1|2,0,0]=4 10612 B11R0.182 CCCC(CC)NC(=O)NNC 512a_100016993582_100000747048 [0,0,1,0,0,1|2,0,0]=4 10613 B11R0.182 CCCN(CC)CC(=O)NCC 2230a_100000226822_100000183381 [0,0,1,0,0,1|2,0,0]=4 10614 B11R0.182 CCCN(CC)CC(=O)NCC 269982a_100000226822_100000183381 [0,0,1,0,0,1|2,0,0]=4 10615 B11R0.182 CCCN(CC)CC(=O)OCC 2230a_100000220607_100000210303 [0,0,1,0,0,1|1,0,0]=3 10616 B11R0.182 CCCN(CC)CC(=O)OCC 2230a_100000221057_100000210202 [0,0,1,0,0,1|1,0,0]=3 10617 B11R0.182 CCCN(CC)CC(=O)OCC 2230a_100000226822_100000188475 [0,0,1,0,0,1|1,0,0]=3 10618 B11R0.182 CCCN(CC)CC(=O)OCC 269982a_100000220607_100000210303 [0,0,1,0,0,1|1,0,0]=3 10619 B11R0.182 CCCN(CC)CC(=O)OCC 269982a_100000221057_100000204670 [0,0,1,0,0,1|1,0,0]=3 10620 B11R0.182 CCCN(CC)CC(=O)OCC 269982a_100000226822_100000188475 [0,0,1,0,0,1|1,0,0]=3 10621 B11R0.182 CCCN(CF)CC(=O)OCC 269982a_100000221057_100015361967 [0,0,1,0,0,1|2,0,0]=4 10622 B11R0.182 CCC[C@@H](CO)NC(=O)NCC 2708a_100015525214_100000732646 [0,0,1,0,0,1|2,0,0]=4 10623 B11R0.182 CCC[C@@H](CO)NC(=O)NCC 273464a_100000732646_100015525214 [0,0,1,0,0,1|2,0,0]=4 10624 B11R0.182 CCC[C@@H](CO)NC(=O)NCC 273464a_100015525214_100000732646 [0,0,1,0,0,1|2,0,0]=4 10625 B11R0.182 CCC[C@@H](CO)NC(=O)NCC 512a_100000732646_100015525214 [0,0,1,0,0,1|2,0,0]=4 10626 B11R0.182 CCC[C@@H](CO)NC(=O)NCC 512a_100015525214_100000732646 [0,0,1,0,0,1|2,0,0]=4 10627 B11R0.182 CCNC(=O)NC(CC)COC 2708a_100000757820_100015525214 [0,0,1,0,0,1|2,0,0]=4 10628 B11R0.182 CCNC(=O)NC(CC)COC 2708a_100015525214_100000757820 [0,0,1,0,0,1|2,0,0]=4 10629 B11R0.182 CCNC(=O)NC(CC)COC 273464a_100000757820_100015525214 [0,0,1,0,0,1|2,0,0]=4 10630 B11R0.182 CCNC(=O)NC(CC)COC 273464a_100015525214_100000757820 [0,0,1,0,0,1|2,0,0]=4 10631 B11R0.182 CCNC(=O)NC(CC)COC 512a_100000757820_100015525214 [0,0,1,0,0,1|2,0,0]=4 10632 B11R0.182 CCNC(=O)NC(CC)COC 512a_100015525214_100000757820 [0,0,1,0,0,1|2,0,0]=4 10633 B11R0.182 CCOC(=O)CN(CC)CCF 2230a_100000220607_100011217306 [0,0,1,0,0,1|2,0,0]=4 10634 B11R0.182 CCOC(=O)CN(CC)CCF 269982a_100000220607_100011217306 [0,0,1,0,0,1|2,0,0]=4 10635 B11R0.182 CCOC(=O)CN(CC)CCO 2230a_100000210973_100000188475 [0,0,1,0,0,1|2,0,0]=4 10636 B11R0.182 CCOC(=O)CN(CC)CCO 2230a_100000220607_100000211926 [0,0,1,0,0,1|2,0,0]=4 10637 B11R0.182 CCOC(=O)CN(CC)CCO 269982a_100000210973_100000188475 [0,0,1,0,0,1|2,0,0]=4 10638 B11R0.182 CCOC(=O)CN(CC)CCO 269982a_100000220607_100000211926 [0,0,1,0,0,1|2,0,0]=4 10639 B11R0.182 CCOC(=O)CN(CC)COC 2230a_100000220607_100000766300 [0,0,1,0,0,1|2,0,0]=4 10640 B11R0.182 CCOC(=O)CN(CC)COC 269982a_100000220607_100000766300 [0,0,1,0,0,1|2,0,0]=4 10641 B11R0.182 CCOC(=O)CN(CC)CSC 2230a_100000220607_100011218213 [0,0,1,0,0,1|2,0,0]=4 10642 B11R0.182 CCOC(=O)CN(CC)CSC 269982a_100000220607_100011218213 [0,0,1,0,0,1|2,0,0]=4 10643 B11R0.182 CCOC(=O)C[C@@H](CCl)OCC 7a_100000688340_100000210202 [0,0,1,0,0,1|2,0,0]=4 10644 B11R1.852 C#CC(=O)C1CCCCCC1 1458a_100000211873_100011217769 [1,0,0,0,0,1|0,0,2]=4 10645 B11R1.852 C=CC(=O)C1CCCCCC1 1458a_100000185746_100011217769 [1,0,0,0,0,1|0,0,2]=4 10646 B11R1.852 CCC(=O)C1CCC=CCC1 1458a_100000048548_100000210202 [1,0,0,0,0,1|0,0,1]=3 10647 B11R1.852 CCC(=O)C1CCCCCC1 1458a_100000210414_100011217769 [1,0,0,0,0,1|0,0,0]=2 10648 B11R1.852 CCC(=O)C1CCCCCC1 1458a_100000749507_100000210202 [1,0,0,0,0,1|0,0,0]=2 10649 B11R1.852 CCC(=O)N1CCCCCC1 11a_100000185865_100000210414 [1,0,0,0,0,1|1,0,0]=3 10650 B11R1.852 CCC(=O)N1CCCCCC1 1626a_100000185865_100000210414 [1,0,0,0,0,1|1,0,0]=3 10651 B11R1.852 CCC(=O)N1CCCCCC1 240690a_100000185865_100000210414 [1,0,0,0,0,1|1,0,0]=3 10652 B11R1.852 CCC(=O)N1CCCCCC1 527a_100000185865_100000210414 [1,0,0,0,0,1|1,0,0]=3 10653 B11R1.852 CCC(=O)N1CCCOCC1 11a_100000685342_100000210414 [1,0,0,0,0,1|1,0,0]=3 10654 B11R1.852 CCC(=O)N1CCCOCC1 1626a_100000685342_100000210414 [1,0,0,0,0,1|1,0,0]=3 10655 B11R1.852 CCC(=O)N1CCCOCC1 240690a_100000685342_100000210414 [1,0,0,0,0,1|1,0,0]=3 10656 B11R1.852 CCC(=O)N1CCCOCC1 527a_100000685342_100000210414 [1,0,0,0,0,1|1,0,0]=3 10657 B11R1.852 CCN(C)C1CCCCCC1 2230a_100015185097_100000210202 [1,0,0,0,0,1|2,0,0]=4 10658 B11R1.852 CCN(C)C1CCCCCC1 2230a_114901603759_200000210301 [1,0,0,0,0,1|2,0,0]=4 10659 B11R1.852 CCN(C)C1CCCCCC1 269982a_100000225621_100011217769 [1,0,0,0,0,1|2,0,0]=4 10660 B11R1.852 CCN(C)C1CCCCCC1 269982a_100015185097_100000204670 [1,0,0,0,0,1|2,0,0]=4 10661 B11R1.852 CCN(C)C1CCCCCC1 269982a_114901603759_200000210301 [1,0,0,0,0,1|2,0,0]=4 10662 B11R1.852 CCN(C)C1CCCCCC1 34a_100015185097_100000210202 [1,0,0,0,0,1|2,0,0]=4 10663 B11R1.852 CCN(C)C1CCCCCC1 34a_114901603759_200000210301 [1,0,0,0,0,1|2,0,0]=4 10664 B11R1.852 CCN([13CH3])C1CCCCCC1 2230a_114901603759_200025704644 [1,0,0,0,0,1|2,0,0]=4 10665 B11R1.852 CCN([13CH3])C1CCCCCC1 269982a_114901603759_200025704644 [1,0,0,0,0,1|2,0,0]=4 10666 B11R1.852 CCN([13CH3])C1CCCCCC1 34a_114901603759_200025704644 [1,0,0,0,0,1|2,0,0]=4 10667 B11R1.852 CNC(=O)C1CCC=CCC1 11a_106832991635_100000048548 [1,0,0,0,0,1|1,0,1]=4 10668 B11R1.852 CNC(=O)C1CCC=CCC1 1626a_100102657272_100000048548 [1,0,0,0,0,1|1,0,1]=4 10669 B11R1.852 CNC(=O)C1CCC=CCC1 240690a_100102657272_100000048548 [1,0,0,0,0,1|1,0,1]=4 10670 B11R1.852 CNC(=O)C1CCC=CCC1 527a_100102657272_100000048548 [1,0,0,0,0,1|1,0,1]=4 10671 B11R1.852 CNC(=O)C1CCCCCC1 11a_106832991635_100000749507 [1,0,0,0,0,1|1,0,0]=3 10672 B11R1.852 CNC(=O)C1CCCCCC1 1626a_100102657272_100000749507 [1,0,0,0,0,1|1,0,0]=3 10673 B11R1.852 CNC(=O)C1CCCCCC1 240690a_100102657272_100000749507 [1,0,0,0,0,1|1,0,0]=3 10674 B11R1.852 CNC(=O)C1CCCCCC1 527a_100102657272_100000749507 [1,0,0,0,0,1|1,0,0]=3 10675 B11R1.852 CNC(=O)N1CCCCCC1 2708a_100102657272_100000185865 [1,0,0,0,0,1|2,0,0]=4 10676 B11R1.852 CNC(=O)N1CCCCCC1 273464a_100102657272_100000185865 [1,0,0,0,0,1|2,0,0]=4 10677 B11R1.852 CNC(=O)N1CCCOCC1 2708a_100102657272_100000685342 [1,0,0,0,0,1|2,0,0]=4 10678 B11R1.852 CNC(=O)N1CCCOCC1 273464a_100102657272_100000685342 [1,0,0,0,0,1|2,0,0]=4 10679 B11R1.852 O=C(CF)C1CCC=CCC1 1458a_100000048548_100015361967 [1,0,0,0,0,1|1,0,1]=4 10680 B11R1.852 O=C(CF)C1CCCCCC1 1458a_100000749507_100015361967 [1,0,0,0,0,1|1,0,0]=3 10681 B11R1.852 O=C(CO)C1CCCCCC1 1458a_100000210174_100011217769 [1,0,0,0,0,1|1,0,0]=3 10682 B11R1.852 O=C(CO)N1CCCCCC1 240690a_100000185865_100000210174 [1,0,0,0,0,1|2,0,0]=4 10683 B11R1.852 O=C(CO)N1CCCCCC1 527a_100000185865_100000210174 [1,0,0,0,0,1|2,0,0]=4 10684 B11R1.852 O=C(CO)N1CCCOCC1 240690a_100000685342_100000210174 [1,0,0,0,0,1|2,0,0]=4 10685 B11R1.852 O=C(CO)N1CCCOCC1 527a_100000685342_100000210174 [1,0,0,0,0,1|2,0,0]=4 10686 B11R1.203 CCCNC1CCCCCC1 2230a_100000210984_100000210303 [1,0,0,0,0,1|2,0,0]=4 10687 B11R1.203 CCCNC1CCCCCC1 270004a_100020643023_100000210131 [1,0,0,0,0,1|2,0,0]=4 10688 B11R1.203 CCCNC1CCCCCC1 34a_100000210984_100000210303 [1,0,0,0,0,1|2,0,0]=4 10689 B11R1.203 CCCNC1CCCNCC1 270004a_100020643023_100015187895 [1,0,0,0,0,1|2,0,0]=4 10690 B11R1.203 CCCOC1CCCCCC1 34a_100000210258_100011217769 [1,0,0,0,0,1|2,0,0]=4 10691 B11R1.203 CCCOC1CCCCCC1 34a_100000210887_100000210303 [1,0,0,0,0,1|2,0,0]=4 10692 B11R1.203 CCCOC1CCCCCC1 7a_100000210887_100000210303 [1,0,0,0,0,1|2,0,0]=4 10693 B11R1.203 CCCSC1CCCCCC1 62a_100000210303_100011217769 [1,0,0,0,0,1|2,0,0]=4 10694 B11R1.203 CCCSC1CCCCCC1 62a_100011217769_100000210303 [1,0,0,0,0,1|2,0,0]=4 10695 B11R1.203 CCNCC1CCCCCC1 2230a_100015204231_100000210202 [1,0,0,0,0,1|1,0,1]=4 10696 B11R1.203 CCNCC1CCCCCC1 2230a_100015525214_200000696569 [1,0,0,0,0,1|1,0,1]=4 10697 B11R1.203 CCNCC1CCCCCC1 269862a_100015525214_200000763224 [1,0,0,0,0,1|1,0,1]=4 10698 B11R1.203 CCNCC1CCCCCC1 34a_100015204231_100000210202 [1,0,0,0,0,1|1,0,1]=4 10699 B11R1.203 CCOCC1CCCCCC1 34a_100000699130_100000210202 [1,0,0,0,0,1|0,0,1]=3 10700 B11R1.203 CCOCC1CCCCCC1 34a_100121572206_200000696569 [1,0,0,0,0,1|0,0,1]=3 10701 B11R1.203 CCOCC1CCCCCC1 7a_100000699130_100000210202 [1,0,0,0,0,1|0,0,1]=3 10702 B11R1.203 CCOCC1CNCCOC1 34a_100103147999_100000210202 [1,0,0,0,0,1|1,0,1]=4 10703 B11R1.203 CCOCN1CCCCCC1 269982a_100000185865_100000739092 [1,0,0,0,0,1|1,0,1]=4 10704 B11R1.203 CCOCN1CCCOCC1 269982a_100000685342_100000739092 [1,0,0,0,0,1|1,0,1]=4 10705 B11R1.203 CCSCC1CCCCCC1 62a_100000210202_200000696569 [1,0,0,0,0,1|0,1,1]=4 10706 B11R1.203 CCSCC1CCCCCC1 62a_200000696569_100000210202 [1,0,0,0,0,1|0,1,1]=4 10707 B11R1.203 FCOCC1CCCCCC1 34a_100000699130_100015361967 [1,0,0,0,0,1|1,0,1]=4 10708 B11R1.203 FCOCC1CCCCCC1 7a_100000699130_100015361967 [1,0,0,0,0,1|1,0,1]=4 10709 B13R1.42 C=COC(=O)CNC1CCCCC1 2230a_100000182618_100000036128 [0,0,0,0,0,2|0,0,2]=4 10710 B13R1.42 C=COC(=O)CNC1CCCCC1 34a_100000182618_100000036128 [0,0,0,0,0,2|0,0,2]=4 10711 B13R1.42 C=COC(=O)COC1CCCCC1 34a_100000210231_100000036128 [0,0,0,0,0,2|0,0,2]=4 10712 B13R1.42 C=COC(=O)CSC1CCCCC1 62a_100000036128_100000210327 [0,0,0,0,0,2|0,0,2]=4 10713 B13R1.42 C=COC(=O)CSC1CCCCC1 62a_100000210327_100000036128 [0,0,0,0,0,2|0,0,2]=4 10714 B13R1.42 CC#CC(=O)CCC1CCCCC1 1458a_100000763181_100011273959 [0,0,0,0,0,2|1,0,1]=4 10715 B13R1.42 CC#CC(=O)COC1CCCCC1 1458a_100000763181_100011935260 [0,0,0,0,0,2|1,0,1]=4 10716 B13R1.42 CC#CC(=O)NNC1CCCCC1 22a_100000709804_100000763181 [0,0,0,0,0,2|1,0,1]=4 10717 B13R1.42 CC=CC(=O)CCC1CCCCC1 1458a_100000210699_100011273959 [0,0,0,0,0,2|1,0,1]=4 10718 B13R1.42 CC=CC(=O)COC1CCCCC1 1458a_100000210699_100011935260 [0,0,0,0,0,2|1,0,1]=4 10719 B13R1.42 CC=CC(=O)NCC1CCCCC1 11a_100000210473_100000210699 [0,0,0,0,0,2|1,0,1]=4 10720 B13R1.42 CC=CC(=O)NCC1CCCCC1 1626a_100000210473_100000210699 [0,0,0,0,0,2|1,0,1]=4 10721 B13R1.42 CC=CC(=O)NCC1CCCCC1 240690a_100000210473_100000210699 [0,0,0,0,0,2|1,0,1]=4 10722 B13R1.42 CC=CC(=O)NNC1CCCCC1 22a_100000709804_100000210699 [0,0,0,0,0,2|1,0,1]=4 10723 B13R1.42 CCCC(=NNC1CCCCC1)C 4a_100000709804_100000211909 [0,0,0,0,0,2|2,0,0]=4 10724 B13R1.42 CCCC(=O)C=CC1CCCCC1 1458a_100102566626_100000210303 [0,0,0,0,0,2|1,0,0]=3 10725 B13R1.42 CCCC(=O)CCC1CCCCC1 1458a_100000211375_100000210303 [0,0,0,0,0,2|1,0,0]=3 10726 B13R1.42 CCCC(=O)CCC1CCCCC1 1458a_100000211992_100011273959 [0,0,0,0,0,2|1,0,0]=3 10727 B13R1.42 CCCC(=O)CCC1CCOCC1 1458a_100000211992_100011934994 [0,0,0,0,0,2|2,0,0]=4 10728 B13R1.42 CCCC(=O)CCN1CCCCC1 1458a_100000211992_100000739454 [0,0,0,0,0,2|2,0,0]=4 10729 B13R1.42 CCCC(=O)CCN1CCCCC1 1458a_100000743487_100000210303 [0,0,0,0,0,2|2,0,0]=4 10730 B13R1.42 CCCC(=O)CNC1CCCCC1 2230a_100000182618_100000747444 [0,0,0,0,0,2|1,0,0]=3 10731 B13R1.42 CCCC(=O)CNC1CCCOC1 2230a_100000719290_100000747444 [0,0,0,0,0,2|2,0,0]=4 10732 B13R1.42 CCCC(=O)CNC1CCOCC1 2230a_100000741149_100000747444 [0,0,0,0,0,2|2,0,0]=4 10733 B13R1.42 CCCC(=O)CNC1CCSCC1 2230a_100000748639_100000747444 [0,0,0,0,0,2|2,0,0]=4 10734 B13R1.42 CCCC(=O)COC1CCCCC1 1458a_100000211992_100011935260 [0,0,0,0,0,2|1,0,0]=3 10735 B13R1.42 CCCC(=O)COC1CCCCC1 1458a_100011223303_100000210303 [0,0,0,0,0,2|1,0,0]=3 10736 B13R1.42 CCCC(=O)COC1CCCCC1 7a_100000210231_100000747444 [0,0,0,0,0,2|1,0,0]=3 10737 B13R1.42 CCCC(=O)COC1CCCSC1 7a_100015962668_100000747444 [0,0,0,0,0,2|2,0,0]=4 10738 B13R1.42 CCCC(=O)COC1CCSCC1 7a_100000731022_100000747444 [0,0,0,0,0,2|2,0,0]=4 10739 B13R1.42 CCCC(=O)CSC1CCCCC1 62a_100000210327_100000747444 [0,0,0,0,0,2|1,0,0]=3 10740 B13R1.42 CCCC(=O)CSC1CCCCC1 62a_100000747444_100000210327 [0,0,0,0,0,2|1,0,0]=3 10741 B13R1.42 CCCC(=O)CSC1CCCOC1 62a_100000747444_100000693364 [0,0,0,0,0,2|2,0,0]=4 10742 B13R1.42 CCCC(=O)CSC1CCOCC1 62a_100000747444_100011324220 [0,0,0,0,0,2|2,0,0]=4 10743 B13R1.42 CCCC(=O)CSC1CCSCC1 62a_100000747444_100000069128 [0,0,0,0,0,2|2,0,0]=4 10744 B13R1.42 CCCC(=O)NCC1CCCCC1 11a_100000210473_100000211992 [0,0,0,0,0,2|1,0,0]=3 10745 B13R1.42 CCCC(=O)NCC1CCCCC1 1626a_100000210473_100000211992 [0,0,0,0,0,2|1,0,0]=3 10746 B13R1.42 CCCC(=O)NCC1CCCCC1 240690a_100000210473_100000211992 [0,0,0,0,0,2|1,0,0]=3 10747 B13R1.42 CCCC(=O)NCC1CCCCC1 527a_100000210473_100000211992 [0,0,0,0,0,2|1,0,0]=3 10748 B13R1.42 CCCC(=O)NCC1CCCCO1 11a_100000174945_100000211992 [0,0,0,0,0,2|2,0,0]=4 10749 B13R1.42 CCCC(=O)NCC1CCCCO1 1626a_100000174945_100000211992 [0,0,0,0,0,2|2,0,0]=4 10750 B13R1.42 CCCC(=O)NCC1CCCCO1 240690a_100000174945_100000211992 [0,0,0,0,0,2|2,0,0]=4 10751 B13R1.42 CCCC(=O)NCC1CCCCO1 527a_100000174945_100000211992 [0,0,0,0,0,2|2,0,0]=4 10752 B13R1.42 CCCC(=O)NCC1CCCOC1 11a_100000720124_100000211992 [0,0,0,0,0,2|2,0,0]=4 10753 B13R1.42 CCCC(=O)NCC1CCCOC1 1626a_100000720124_100000211992 [0,0,0,0,0,2|2,0,0]=4 10754 B13R1.42 CCCC(=O)NCC1CCCOC1 240690a_100000720124_100000211992 [0,0,0,0,0,2|2,0,0]=4 10755 B13R1.42 CCCC(=O)NCC1CCCOC1 527a_100000720124_100000211992 [0,0,0,0,0,2|2,0,0]=4 10756 B13R1.42 CCCC(=O)NCC1CCOCC1 11a_100000746373_100000211992 [0,0,0,0,0,2|2,0,0]=4 10757 B13R1.42 CCCC(=O)NCC1CCOCC1 1626a_100000746373_100000211992 [0,0,0,0,0,2|2,0,0]=4 10758 B13R1.42 CCCC(=O)NCC1CCOCC1 240690a_100000746373_100000211992 [0,0,0,0,0,2|2,0,0]=4 10759 B13R1.42 CCCC(=O)NCC1CCOCC1 527a_100000746373_100000211992 [0,0,0,0,0,2|2,0,0]=4 10760 B13R1.42 CCCC(=O)NCC1CCSCC1 11a_100015188806_100000211992 [0,0,0,0,0,2|2,0,0]=4 10761 B13R1.42 CCCC(=O)NCC1CCSCC1 240690a_100015188806_100000211992 [0,0,0,0,0,2|2,0,0]=4 10762 B13R1.42 CCCC(=O)NCC1CCSCC1 527a_100015188806_100000211992 [0,0,0,0,0,2|2,0,0]=4 10763 B13R1.42 CCCC(=O)NN=C1CCCCC1 4a_100000189770_100000210434 [0,0,0,0,0,2|1,0,1]=4 10764 B13R1.42 CCCC(=O)NNC1CCCCC1 22a_100000709804_100000211992 [0,0,0,0,0,2|1,0,0]=3 10765 B13R1.42 CCCC(=O)NNC1CCOCC1 22a_100000687383_100000211992 [0,0,0,0,0,2|2,0,0]=4 10766 B13R1.42 CCNC(=O)C=CC1CCCCC1 11a_100015525214_100102566626 [0,0,0,0,0,2|1,0,0]=3 10767 B13R1.42 CCNC(=O)C=CC1CCCCC1 240690a_100015525214_100102566626 [0,0,0,0,0,2|1,0,0]=3 10768 B13R1.42 CCNC(=O)CCC1CCCCC1 11a_100015525214_100000211375 [0,0,0,0,0,2|1,0,0]=3 10769 B13R1.42 CCNC(=O)CCC1CCCCC1 240690a_100015525214_100000211375 [0,0,0,0,0,2|1,0,0]=3 10770 B13R1.42 CCNC(=O)CCC1CCCCC1 527a_100015525214_100000211375 [0,0,0,0,0,2|1,0,0]=3 10771 B13R1.42 CCNC(=O)CCN1CCCCC1 240690a_100015525214_100000743487 [0,0,0,0,0,2|2,0,0]=4 10772 B13R1.42 CCNC(=O)CNC1CCCCC1 2230a_100000182618_100000183381 [0,0,0,0,0,2|1,0,0]=3 10773 B13R1.42 CCNC(=O)CNC1CCCCC1 270004a_100016988866_100000210434 [0,0,0,0,0,2|1,0,0]=3 10774 B13R1.42 CCNC(=O)CNC1CCCCC1 34a_100000182618_100000183381 [0,0,0,0,0,2|1,0,0]=3 10775 B13R1.42 CCNC(=O)CNC1CCCOC1 2230a_100000719290_100000183381 [0,0,0,0,0,2|2,0,0]=4 10776 B13R1.42 CCNC(=O)CNC1CCCOC1 270004a_100016988866_100000753404 [0,0,0,0,0,2|2,0,0]=4 10777 B13R1.42 CCNC(=O)CNC1CCCOC1 34a_100000719290_100000183381 [0,0,0,0,0,2|2,0,0]=4 10778 B13R1.42 CCNC(=O)CNC1CCCSC1 270004a_100016988866_100000057913 [0,0,0,0,0,2|2,0,0]=4 10779 B13R1.42 CCNC(=O)CNC1CCNCC1 270004a_100016988866_100015192401 [0,0,0,0,0,2|2,0,0]=4 10780 B13R1.42 CCNC(=O)CNC1CCOCC1 2230a_100000741149_100000183381 [0,0,0,0,0,2|2,0,0]=4 10781 B13R1.42 CCNC(=O)CNC1CCOCC1 270004a_100016988866_100011217826 [0,0,0,0,0,2|2,0,0]=4 10782 B13R1.42 CCNC(=O)CNC1CCOCC1 34a_100000741149_100000183381 [0,0,0,0,0,2|2,0,0]=4 10783 B13R1.42 CCNC(=O)CNC1CCSCC1 2230a_100000748639_100000183381 [0,0,0,0,0,2|2,0,0]=4 10784 B13R1.42 CCNC(=O)CNC1CCSCC1 270004a_100016988866_100000203788 [0,0,0,0,0,2|2,0,0]=4 10785 B13R1.42 CCNC(=O)CNC1CCSCC1 34a_100000748639_100000183381 [0,0,0,0,0,2|2,0,0]=4 10786 B13R1.42 CCNC(=O)COC1CCCCC1 11a_100015525214_100011223303 [0,0,0,0,0,2|1,0,0]=3 10787 B13R1.42 CCNC(=O)COC1CCCCC1 240690a_100015525214_100011223303 [0,0,0,0,0,2|1,0,0]=3 10788 B13R1.42 CCNC(=O)COC1CCCCC1 34a_100000210231_100000183381 [0,0,0,0,0,2|1,0,0]=3 10789 B13R1.42 CCNC(=O)COC1CCCCC1 527a_100015525214_100011223303 [0,0,0,0,0,2|1,0,0]=3 10790 B13R1.42 CCNC(=O)COC1CCCCC1 7a_100000210231_100000183381 [0,0,0,0,0,2|1,0,0]=3 10791 B13R1.42 CCNC(=O)COC1CCCCO1 34a_100000033831_100000183381 [0,0,0,0,0,2|2,0,0]=4 10792 B13R1.42 CCNC(=O)COC1CCCOC1 34a_100000754041_100000183381 [0,0,0,0,0,2|2,0,0]=4 10793 B13R1.42 CCNC(=O)COC1CCCSC1 7a_100015962668_100000183381 [0,0,0,0,0,2|2,0,0]=4 10794 B13R1.42 CCNC(=O)COC1CCOCC1 34a_100000744328_100000183381 [0,0,0,0,0,2|2,0,0]=4 10795 B13R1.42 CCNC(=O)COC1CCSCC1 34a_100000731022_100000183381 [0,0,0,0,0,2|2,0,0]=4 10796 B13R1.42 CCNC(=O)COC1CCSCC1 7a_100000731022_100000183381 [0,0,0,0,0,2|2,0,0]=4 10797 B13R1.42 CCNC(=O)CSC1CCCCC1 62a_100000183381_100000210327 [0,0,0,0,0,2|1,0,0]=3 10798 B13R1.42 CCNC(=O)CSC1CCCCC1 62a_100000210327_100000183381 [0,0,0,0,0,2|1,0,0]=3 10799 B13R1.42 CCNC(=O)CSC1CCCOC1 62a_100000183381_100000693364 [0,0,0,0,0,2|2,0,0]=4 10800 B13R1.42 CCNC(=O)CSC1CCOCC1 62a_100000183381_100011324220 [0,0,0,0,0,2|2,0,0]=4 10801 B13R1.42 CCNC(=O)CSC1CCSCC1 62a_100000183381_100000069128 [0,0,0,0,0,2|2,0,0]=4 10802 B13R1.42 CCNC(=O)NCC1CCCCC1 2708a_100000210473_100015525214 [0,0,0,0,0,2|1,0,0]=3 10803 B13R1.42 CCNC(=O)NCC1CCCCC1 2708a_100015525214_100000210473 [0,0,0,0,0,2|1,0,0]=3 10804 B13R1.42 CCNC(=O)NCC1CCCCC1 273464a_100000210473_100015525214 [0,0,0,0,0,2|1,0,0]=3 10805 B13R1.42 CCNC(=O)NCC1CCCCC1 273464a_100015525214_100000210473 [0,0,0,0,0,2|1,0,0]=3 10806 B13R1.42 CCNC(=O)NCC1CCCCC1 512a_100015525214_100000210473 [0,0,0,0,0,2|1,0,0]=3 10807 B13R1.42 CCNC(=O)NCC1CCCCO1 2708a_100000174945_100015525214 [0,0,0,0,0,2|2,0,0]=4 10808 B13R1.42 CCNC(=O)NCC1CCCCO1 2708a_100015525214_100000174945 [0,0,0,0,0,2|2,0,0]=4 10809 B13R1.42 CCNC(=O)NCC1CCCCO1 273464a_100000174945_100015525214 [0,0,0,0,0,2|2,0,0]=4 10810 B13R1.42 CCNC(=O)NCC1CCCCO1 273464a_100015525214_100000174945 [0,0,0,0,0,2|2,0,0]=4 10811 B13R1.42 CCNC(=O)NCC1CCCCO1 512a_100000174945_100015525214 [0,0,0,0,0,2|2,0,0]=4 10812 B13R1.42 CCNC(=O)NCC1CCCCO1 512a_100015525214_100000174945 [0,0,0,0,0,2|2,0,0]=4 10813 B13R1.42 CCNC(=O)NCC1CCCOC1 2708a_100000720124_100015525214 [0,0,0,0,0,2|2,0,0]=4 10814 B13R1.42 CCNC(=O)NCC1CCCOC1 2708a_100015525214_100000720124 [0,0,0,0,0,2|2,0,0]=4 10815 B13R1.42 CCNC(=O)NCC1CCCOC1 273464a_100000720124_100015525214 [0,0,0,0,0,2|2,0,0]=4 10816 B13R1.42 CCNC(=O)NCC1CCCOC1 273464a_100015525214_100000720124 [0,0,0,0,0,2|2,0,0]=4 10817 B13R1.42 CCNC(=O)NCC1CCCOC1 512a_100000720124_100015525214 [0,0,0,0,0,2|2,0,0]=4 10818 B13R1.42 CCNC(=O)NCC1CCCOC1 512a_100015525214_100000720124 [0,0,0,0,0,2|2,0,0]=4 10819 B13R1.42 CCNC(=O)NCC1CCOCC1 2708a_100000746373_100015525214 [0,0,0,0,0,2|2,0,0]=4 10820 B13R1.42 CCNC(=O)NCC1CCOCC1 2708a_100015525214_100000746373 [0,0,0,0,0,2|2,0,0]=4 10821 B13R1.42 CCNC(=O)NCC1CCOCC1 273464a_100000746373_100015525214 [0,0,0,0,0,2|2,0,0]=4 10822 B13R1.42 CCNC(=O)NCC1CCOCC1 273464a_100015525214_100000746373 [0,0,0,0,0,2|2,0,0]=4 10823 B13R1.42 CCNC(=O)NCC1CCOCC1 512a_100000746373_100015525214 [0,0,0,0,0,2|2,0,0]=4 10824 B13R1.42 CCNC(=O)NCC1CCOCC1 512a_100015525214_100000746373 [0,0,0,0,0,2|2,0,0]=4 10825 B13R1.42 CCNC(=O)NCC1CCSCC1 2708a_100015188806_100015525214 [0,0,0,0,0,2|2,0,0]=4 10826 B13R1.42 CCNC(=O)NCC1CCSCC1 2708a_100015525214_100015188806 [0,0,0,0,0,2|2,0,0]=4 10827 B13R1.42 CCNC(=O)NCC1CCSCC1 273464a_100015188806_100015525214 [0,0,0,0,0,2|2,0,0]=4 10828 B13R1.42 CCNC(=O)NCC1CCSCC1 273464a_100015525214_100015188806 [0,0,0,0,0,2|2,0,0]=4 10829 B13R1.42 CCNC(=O)NCC1CCSCC1 512a_100015188806_100015525214 [0,0,0,0,0,2|2,0,0]=4 10830 B13R1.42 CCNC(=O)NCC1CCSCC1 512a_100015525214_100015188806 [0,0,0,0,0,2|2,0,0]=4 10831 B13R1.42 CCNC(=O)NNC1CCCCC1 273464a_100015525214_100000709804 [0,0,0,0,0,2|1,0,0]=3 10832 B13R1.42 CCNC(=O)NNC1CCOCC1 273464a_100015525214_100000687383 [0,0,0,0,0,2|2,0,0]=4 10833 B13R1.42 CCNC(=O)NNC1CCOCC1 512a_100000687383_100015525214 [0,0,0,0,0,2|2,0,0]=4 10834 B13R1.42 CCNC(=O)NNC1CCOCC1 512a_100015525214_100000687383 [0,0,0,0,0,2|2,0,0]=4 10835 B13R1.42 CCOC(=O)CCN1CCCOC1 2230a_100000131196_100011206558 [0,0,0,0,0,2|2,0,0]=4 10836 B13R1.42 CCOC(=O)CCN1CCCOC1 269982a_100000131196_100011206558 [0,0,0,0,0,2|2,0,0]=4 10837 B13R1.42 CCOC(=O)CCN1CCCOC1 34a_100000131196_100000765890 [0,0,0,0,0,2|2,0,0]=4 10838 B13R1.42 CCOC(=O)CCN1CCOCC1 2230a_100015191051_100011206558 [0,0,0,0,0,2|2,0,0]=4 10839 B13R1.42 CCOC(=O)CCN1CCOCC1 269982a_100015191051_100011206558 [0,0,0,0,0,2|2,0,0]=4 10840 B13R1.42 CCOC(=O)CCN1CCOCC1 34a_100015191051_100000765890 [0,0,0,0,0,2|2,0,0]=4 10841 B13R1.42 CCOC(=O)CCN1CCSCC1 2230a_100000737611_100011206558 [0,0,0,0,0,2|2,0,0]=4 10842 B13R1.42 CCOC(=O)CCN1CCSCC1 269982a_100000737611_100011206558 [0,0,0,0,0,2|2,0,0]=4 10843 B13R1.42 CCOC(=O)CNC1CCCCC1 2230a_100000182618_100000188475 [0,0,0,0,0,2|0,0,0]=2 10844 B13R1.42 CCOC(=O)CNC1CCCCC1 34a_100000182618_100000188475 [0,0,0,0,0,2|0,0,0]=2 10845 B13R1.42 CCOC(=O)CNC1CCCOC1 2230a_100000719290_100000188475 [0,0,0,0,0,2|1,0,0]=3 10846 B13R1.42 CCOC(=O)CNC1CCCOC1 34a_100000719290_100000188475 [0,0,0,0,0,2|1,0,0]=3 10847 B13R1.42 CCOC(=O)CNC1CCOCC1 2230a_100000741149_100000188475 [0,0,0,0,0,2|1,0,0]=3 10848 B13R1.42 CCOC(=O)CNC1CCOCC1 34a_100000741149_100000188475 [0,0,0,0,0,2|1,0,0]=3 10849 B13R1.42 CCOC(=O)CNC1CCSCC1 2230a_100000748639_100000188475 [0,0,0,0,0,2|1,0,0]=3 10850 B13R1.42 CCOC(=O)CNC1CCSCC1 34a_100000748639_100000188475 [0,0,0,0,0,2|1,0,0]=3 10851 B13R1.42 CCOC(=O)COC1C=CCCC1 34a_100011215024_100000188475 [0,0,0,0,0,2|0,0,2]=4 10852 B13R1.42 CCOC(=O)COC1CC=CCC1 34a_100000073881_100000188475 [0,0,0,0,0,2|0,0,2]=4 10853 B13R1.42 CCOC(=O)COC1CCCCC1 34a_100000210231_100000188475 [0,0,0,0,0,2|0,0,0]=2 10854 B13R1.42 CCOC(=O)COC1CCCCC1 7a_100000210231_100000188475 [0,0,0,0,0,2|0,0,0]=2 10855 B13R1.42 CCOC(=O)COC1CCCCO1 34a_100000033831_100000188475 [0,0,0,0,0,2|1,0,0]=3 10856 B13R1.42 CCOC(=O)COC1CCCOC1 34a_100000754041_100000188475 [0,0,0,0,0,2|1,0,0]=3 10857 B13R1.42 CCOC(=O)COC1CCCSC1 7a_100015962668_100000188475 [0,0,0,0,0,2|1,0,0]=3 10858 B13R1.42 CCOC(=O)COC1CCOCC1 34a_100000744328_100000188475 [0,0,0,0,0,2|1,0,0]=3 10859 B13R1.42 CCOC(=O)COC1CCSCC1 34a_100000731022_100000188475 [0,0,0,0,0,2|1,0,0]=3 10860 B13R1.42 CCOC(=O)COC1CCSCC1 7a_100000731022_100000188475 [0,0,0,0,0,2|1,0,0]=3 10861 B13R1.42 CCOC(=O)CSC1C=CCCC1 62a_100000188475_100000751183 [0,0,0,0,0,2|0,0,2]=4 10862 B13R1.42 CCOC(=O)CSC1C=CCCC1 62a_100000751183_100000188475 [0,0,0,0,0,2|0,0,2]=4 10863 B13R1.42 CCOC(=O)CSC1CCCCC1 62a_100000188475_100000210327 [0,0,0,0,0,2|0,0,0]=2 10864 B13R1.42 CCOC(=O)CSC1CCCCC1 62a_100000210327_100000188475 [0,0,0,0,0,2|0,0,0]=2 10865 B13R1.42 CCOC(=O)CSC1CCCOC1 62a_100000188475_100000693364 [0,0,0,0,0,2|1,0,0]=3 10866 B13R1.42 CCOC(=O)CSC1CCOCC1 62a_100000188475_100011324220 [0,0,0,0,0,2|1,0,0]=3 10867 B13R1.42 CCOC(=O)CSC1CCSCC1 62a_100000188475_100000069128 [0,0,0,0,0,2|1,0,0]=3 10868 B13R1.42 CCOC(C)CNC1CCCCC1 34a_100000202029_100000210202 [0,0,0,0,0,2|1,0,1]=4 10869 B13R1.42 CNCC(=O)NCC1CCCCC1 2230a_106832991635_100000183341 [0,0,0,0,0,2|2,0,0]=4 10870 B13R1.42 CNCC(=O)NCC1CCCCC1 34a_100102657272_100000183341 [0,0,0,0,0,2|2,0,0]=4 10871 B13R1.42 CNCC(=O)NCC1CCCCC1 7a_106832991635_100000183341 [0,0,0,0,0,2|2,0,0]=4 10872 B13R1.42 CNNC(=O)C=CC1CCCCC1 22a_100016993582_100102566626 [0,0,0,0,0,2|2,0,0]=4 10873 B13R1.42 CNNC(=O)CCC1CCCCC1 22a_100016993582_100000211375 [0,0,0,0,0,2|2,0,0]=4 10874 B13R1.42 CNNC(=O)COC1CCCCC1 22a_100016993582_100011223303 [0,0,0,0,0,2|2,0,0]=4 10875 B13R1.42 CNNC(=O)NCC1CCCCC1 273464a_100000210473_100016993582 [0,0,0,0,0,2|2,0,0]=4 10876 B13R1.42 CNNC(=O)NCC1CCCCC1 512a_100016993582_100000210473 [0,0,0,0,0,2|2,0,0]=4 10877 B13R1.42 COCC(=O)CCC1CCCCC1 1458a_100000210968_100011273959 [0,0,0,0,0,2|2,0,0]=4 10878 B13R1.42 COCC(=O)COC1CCCCC1 1458a_100000210968_100011935260 [0,0,0,0,0,2|2,0,0]=4 10879 B13R1.42 COCC(=O)NCC1CCCCC1 11a_100000210473_100000210968 [0,0,0,0,0,2|2,0,0]=4 10880 B13R1.42 COCC(=O)NCC1CCCCC1 1626a_100000210473_100000210968 [0,0,0,0,0,2|2,0,0]=4 10881 B13R1.42 COCC(=O)NCC1CCCCC1 240690a_100000210473_100000210968 [0,0,0,0,0,2|2,0,0]=4 10882 B13R1.42 COCC(=O)NCC1CCCCC1 34a_100138415774_100000183341 [0,0,0,0,0,2|2,0,0]=4 10883 B13R1.42 COCC(=O)NCC1CCCCC1 527a_100000210473_100000210968 [0,0,0,0,0,2|2,0,0]=4 10884 B13R1.42 COCC(=O)NNC1CCCCC1 22a_100000709804_100000210968 [0,0,0,0,0,2|2,0,0]=4 10885 B13R1.42 CSCC(=O)CCC1CCCCC1 1458a_100000184570_100011273959 [0,0,0,0,0,2|2,0,0]=4 10886 B13R1.42 CSCC(=O)COC1CCCCC1 1458a_100000184570_100011935260 [0,0,0,0,0,2|2,0,0]=4 10887 B13R1.42 CSCC(=O)NCC1CCCCC1 11a_100000210473_100000184570 [0,0,0,0,0,2|2,0,0]=4 10888 B13R1.42 CSCC(=O)NCC1CCCCC1 1626a_100000210473_100000184570 [0,0,0,0,0,2|2,0,0]=4 10889 B13R1.42 CSCC(=O)NCC1CCCCC1 240690a_100000210473_100000184570 [0,0,0,0,0,2|2,0,0]=4 10890 B13R1.42 CSCC(=O)NCC1CCCCC1 527a_100000210473_100000184570 [0,0,0,0,0,2|2,0,0]=4 10891 B13R1.42 CSCC(=O)NCC1CCCCC1 62a_100000183341_200000210301 [0,0,0,0,0,2|2,0,0]=4 10892 B13R1.42 CSCC(=O)NCC1CCCCC1 62a_200000210301_100000183341 [0,0,0,0,0,2|2,0,0]=4 10893 B13R1.42 CSCC(=O)NNC1CCCCC1 22a_100000709804_100000184570 [0,0,0,0,0,2|2,0,0]=4 10894 B13R1.42 O=C(C=CC1CCCCC1)CCF 1458a_100102566626_100011217306 [0,0,0,0,0,2|2,0,0]=4 10895 B13R1.42 O=C(C=CC1CCCCC1)CCO 1458a_100102566626_100000211926 [0,0,0,0,0,2|2,0,0]=4 10896 B13R1.42 O=C(CCF)CCC1CCCCC1 1458a_100000211375_100011217306 [0,0,0,0,0,2|2,0,0]=4 10897 B13R1.42 O=C(CCF)COC1CCCCC1 1458a_100011223303_100011217306 [0,0,0,0,0,2|2,0,0]=4 10898 B13R1.42 O=C(CCO)CCC1CCCCC1 1458a_100000211375_100000211926 [0,0,0,0,0,2|2,0,0]=4 10899 B13R1.42 O=C(CCO)CCC1CCCCC1 1458a_100011216618_100011273959 [0,0,0,0,0,2|2,0,0]=4 10900 B13R1.42 O=C(CCO)COC1CCCCC1 1458a_100011216618_100011935260 [0,0,0,0,0,2|2,0,0]=4 10901 B13R1.42 O=C(CCO)COC1CCCCC1 1458a_100011223303_100000211926 [0,0,0,0,0,2|2,0,0]=4 10902 B13R1.42 O=C(CCO)NCC1CCCCC1 240690a_100000210473_100011216618 [0,0,0,0,0,2|2,0,0]=4 10903 B13R1.42 O=C(CCO)NNC1CCCCC1 22a_100000709804_100011216618 [0,0,0,0,0,2|2,0,0]=4 10904 B13R1.42 O=C(CNC1CCCCC1)NCO 2230a_100000182618_100000185155 [0,0,0,0,0,2|2,0,0]=4 10905 B13R1.42 O=C(CNC1CCCCC1)NCO 34a_100000182618_100000185155 [0,0,0,0,0,2|2,0,0]=4 10906 B13R1.42 O=C(COC1CCCCC1)NCO 34a_100000210231_100000185155 [0,0,0,0,0,2|2,0,0]=4 10907 B13R1.42 O=C(COC1CCCCC1)NCO 7a_100000210231_100000185155 [0,0,0,0,0,2|2,0,0]=4 10908 B13R1.42 O=C(CSC1CCCCC1)NCO 62a_100000185155_100000210327 [0,0,0,0,0,2|2,0,0]=4 10909 B13R1.42 O=C(CSC1CCCCC1)NCO 62a_100000210327_100000185155 [0,0,0,0,0,2|2,0,0]=4 10910 B13R1.42 [13CH3]SCC(=O)NCC1CCCCC1 62a_100000183341_200025704644 [0,0,0,0,0,2|2,0,0]=4 10911 B13R1.42 [13CH3]SCC(=O)NCC1CCCCC1 62a_200025704644_100000183341 [0,0,0,0,0,2|2,0,0]=4 10912 B13R1.1575 CC#CC(=O)CC1CCCCCC1 1458a_100000763181_200000696569 [0,0,0,0,0,2|1,0,1]=4 10913 B13R1.1575 CC=CC(=O)CC1CCCCCC1 1458a_100000210699_200000696569 [0,0,0,0,0,2|1,0,1]=4 10914 B13R1.1575 CC=CC(=O)NC1CCCCCC1 11a_100000210984_100000210699 [0,0,0,0,0,2|1,0,1]=4 10915 B13R1.1575 CC=CC(=O)NC1CCCCCC1 1626a_100000210984_100000210699 [0,0,0,0,0,2|1,0,1]=4 10916 B13R1.1575 CC=CC(=O)NC1CCCCCC1 240690a_100000210984_100000210699 [0,0,0,0,0,2|1,0,1]=4 10917 B13R1.1575 CCCC(=O)C=C1CCCCCC1 1458a_100011240665_100000210303 [0,0,0,0,0,2|1,0,1]=4 10918 B13R1.1575 CCCC(=O)CC1CCCCCC1 1458a_100000211992_200000696569 [0,0,0,0,0,2|1,0,0]=3 10919 B13R1.1575 CCCC(=O)CC1CCCCCC1 1458a_100000685095_100000210303 [0,0,0,0,0,2|1,0,0]=3 10920 B13R1.1575 CCCC(=O)CN1CCCCCC1 1458a_100000740298_100000210303 [0,0,0,0,0,2|2,0,0]=4 10921 B13R1.1575 CCCC(=O)CN1CCCCCC1 2230a_100000185865_100000747444 [0,0,0,0,0,2|2,0,0]=4 10922 B13R1.1575 CCCC(=O)CN1CCCCCC1 269982a_100000185865_100000747444 [0,0,0,0,0,2|2,0,0]=4 10923 B13R1.1575 CCCC(=O)CN1CCCOCC1 2230a_100000685342_100000747444 [0,0,0,0,0,2|2,0,0]=4 10924 B13R1.1575 CCCC(=O)CN1CCCOCC1 269982a_100000685342_100000747444 [0,0,0,0,0,2|2,0,0]=4 10925 B13R1.1575 CCCC(=O)NC1CCCCCC1 11a_100000210984_100000211992 [0,0,0,0,0,2|1,0,0]=3 10926 B13R1.1575 CCCC(=O)NC1CCCCCC1 1626a_100000210984_100000211992 [0,0,0,0,0,2|1,0,0]=3 10927 B13R1.1575 CCCC(=O)NC1CCCCCC1 240690a_100000210984_100000211992 [0,0,0,0,0,2|1,0,0]=3 10928 B13R1.1575 CCCC(=O)NC1CCCCCC1 527a_100000210984_100000211992 [0,0,0,0,0,2|1,0,0]=3 10929 B13R1.1575 CCNC(=O)C=C1CCCCCC1 11a_100015525214_100011240665 [0,0,0,0,0,2|1,0,1]=4 10930 B13R1.1575 CCNC(=O)C=C1CCCCCC1 240690a_100015525214_100011240665 [0,0,0,0,0,2|1,0,1]=4 10931 B13R1.1575 CCNC(=O)CC1CCCCCC1 11a_100015525214_100000685095 [0,0,0,0,0,2|1,0,0]=3 10932 B13R1.1575 CCNC(=O)CC1CCCCCC1 240690a_100015525214_100000685095 [0,0,0,0,0,2|1,0,0]=3 10933 B13R1.1575 CCNC(=O)CC1CCCCCC1 527a_100015525214_100000685095 [0,0,0,0,0,2|1,0,0]=3 10934 B13R1.1575 CCNC(=O)CN1CCCCCC1 11a_100015525214_100000740298 [0,0,0,0,0,2|2,0,0]=4 10935 B13R1.1575 CCNC(=O)CN1CCCCCC1 2230a_100000185865_100000183381 [0,0,0,0,0,2|2,0,0]=4 10936 B13R1.1575 CCNC(=O)CN1CCCCCC1 240690a_100015525214_100000740298 [0,0,0,0,0,2|2,0,0]=4 10937 B13R1.1575 CCNC(=O)CN1CCCCCC1 269982a_100000185865_100000183381 [0,0,0,0,0,2|2,0,0]=4 10938 B13R1.1575 CCNC(=O)CN1CCCCCC1 34a_100000185865_100000183381 [0,0,0,0,0,2|2,0,0]=4 10939 B13R1.1575 CCNC(=O)CN1CCCCCC1 527a_100015525214_100000740298 [0,0,0,0,0,2|2,0,0]=4 10940 B13R1.1575 CCNC(=O)CN1CCCOCC1 2230a_100000685342_100000183381 [0,0,0,0,0,2|2,0,0]=4 10941 B13R1.1575 CCNC(=O)CN1CCCOCC1 269982a_100000685342_100000183381 [0,0,0,0,0,2|2,0,0]=4 10942 B13R1.1575 CCNC(=O)CN1CCCOCC1 34a_100000685342_100000183381 [0,0,0,0,0,2|2,0,0]=4 10943 B13R1.1575 CCNC(=O)NC1CCCCCC1 2708a_100000210984_100015525214 [0,0,0,0,0,2|1,0,0]=3 10944 B13R1.1575 CCNC(=O)NC1CCCCCC1 2708a_100015525214_100000210984 [0,0,0,0,0,2|1,0,0]=3 10945 B13R1.1575 CCNC(=O)NC1CCCCCC1 273464a_100000210984_100015525214 [0,0,0,0,0,2|1,0,0]=3 10946 B13R1.1575 CCNC(=O)NC1CCCCCC1 273464a_100015525214_100000210984 [0,0,0,0,0,2|1,0,0]=3 10947 B13R1.1575 CCNC(=O)NC1CCCCCC1 512a_100015525214_100000210984 [0,0,0,0,0,2|1,0,0]=3 10948 B13R1.1575 CCOC(=O)CN1CCCCCC1 2230a_100000185865_100000188475 [0,0,0,0,0,2|1,0,0]=3 10949 B13R1.1575 CCOC(=O)CN1CCCCCC1 269982a_100000185865_100000188475 [0,0,0,0,0,2|1,0,0]=3 10950 B13R1.1575 CCOC(=O)CN1CCCCCC1 34a_100000185865_100000188475 [0,0,0,0,0,2|1,0,0]=3 10951 B13R1.1575 CCOC(=O)CN1CCCOCC1 2230a_100000685342_100000188475 [0,0,0,0,0,2|1,0,0]=3 10952 B13R1.1575 CCOC(=O)CN1CCCOCC1 269982a_100000685342_100000188475 [0,0,0,0,0,2|1,0,0]=3 10953 B13R1.1575 CCOC(=O)CN1CCCOCC1 34a_100000685342_100000188475 [0,0,0,0,0,2|1,0,0]=3 10954 B13R1.1575 CNCC(=O)NC1CCCCCC1 2230a_106832991635_100000183474 [0,0,0,0,0,2|2,0,0]=4 10955 B13R1.1575 CNCC(=O)NC1CCCCCC1 34a_100102657272_100000183474 [0,0,0,0,0,2|2,0,0]=4 10956 B13R1.1575 CNCC(=O)NC1CCCCCC1 7a_106832991635_100000183474 [0,0,0,0,0,2|2,0,0]=4 10957 B13R1.1575 CNNC(=O)CC1CCCCCC1 22a_100016993582_100000685095 [0,0,0,0,0,2|2,0,0]=4 10958 B13R1.1575 CNNC(=O)NC1CCCCCC1 273464a_100000210984_100016993582 [0,0,0,0,0,2|2,0,0]=4 10959 B13R1.1575 CNNC(=O)NC1CCCCCC1 512a_100016993582_100000210984 [0,0,0,0,0,2|2,0,0]=4 10960 B13R1.1575 COCC(=O)CC1CCCCCC1 1458a_100000210968_200000696569 [0,0,0,0,0,2|2,0,0]=4 10961 B13R1.1575 COCC(=O)NC1CCCCCC1 11a_100000210984_100000210968 [0,0,0,0,0,2|2,0,0]=4 10962 B13R1.1575 COCC(=O)NC1CCCCCC1 1626a_100000210984_100000210968 [0,0,0,0,0,2|2,0,0]=4 10963 B13R1.1575 COCC(=O)NC1CCCCCC1 240690a_100000210984_100000210968 [0,0,0,0,0,2|2,0,0]=4 10964 B13R1.1575 COCC(=O)NC1CCCCCC1 34a_100138415774_100000183474 [0,0,0,0,0,2|2,0,0]=4 10965 B13R1.1575 COCC(=O)NC1CCCCCC1 527a_100000210984_100000210968 [0,0,0,0,0,2|2,0,0]=4 10966 B13R1.1575 CSCC(=O)CC1CCCCCC1 1458a_100000184570_200000696569 [0,0,0,0,0,2|2,0,0]=4 10967 B13R1.1575 CSCC(=O)NC1CCCCCC1 11a_100000210984_100000184570 [0,0,0,0,0,2|2,0,0]=4 10968 B13R1.1575 CSCC(=O)NC1CCCCCC1 1626a_100000210984_100000184570 [0,0,0,0,0,2|2,0,0]=4 10969 B13R1.1575 CSCC(=O)NC1CCCCCC1 240690a_100000210984_100000184570 [0,0,0,0,0,2|2,0,0]=4 10970 B13R1.1575 CSCC(=O)NC1CCCCCC1 527a_100000210984_100000184570 [0,0,0,0,0,2|2,0,0]=4 10971 B13R1.1575 CSCC(=O)NC1CCCCCC1 62a_100000183474_200000210301 [0,0,0,0,0,2|2,0,0]=4 10972 B13R1.1575 CSCC(=O)NC1CCCCCC1 62a_200000210301_100000183474 [0,0,0,0,0,2|2,0,0]=4 10973 B13R1.1575 O=C(CCF)CC1CCCCCC1 1458a_100000685095_100011217306 [0,0,0,0,0,2|2,0,0]=4 10974 B13R1.1575 O=C(CCO)CC1CCCCCC1 1458a_100000685095_100000211926 [0,0,0,0,0,2|2,0,0]=4 10975 B13R1.1575 O=C(CCO)CC1CCCCCC1 1458a_100011216618_200000696569 [0,0,0,0,0,2|2,0,0]=4 10976 B13R1.1575 O=C(CCO)NC1CCCCCC1 240690a_100000210984_100011216618 [0,0,0,0,0,2|2,0,0]=4 10977 B13R1.1575 [13CH3]SCC(=O)NC1CCCCCC1 62a_100000183474_200025704644 [0,0,0,0,0,2|2,0,0]=4 10978 B13R1.1575 [13CH3]SCC(=O)NC1CCCCCC1 62a_200025704644_100000183474 [0,0,0,0,0,2|2,0,0]=4 10979 B13R1.1464 CC#CC(=O)C1CC/C=C\CCC1 1458a_100000763181_100021000466 [0,0,0,0,0,2|1,0,1]=4 10980 B13R1.1464 CC=CC(=O)C1CC/C=C\CCC1 1458a_100000210699_100021000466 [0,0,0,0,0,2|1,0,1]=4 10981 B13R1.1464 CCCC(=O)C1CC/C=C\CCC1 1458a_100000211992_100021000466 [0,0,0,0,0,2|1,0,0]=3 10982 B13R1.1464 CCCC(=O)N1CCCCCCC1 11a_100000211400_100000211992 [0,0,0,0,0,2|2,0,0]=4 10983 B13R1.1464 CCCC(=O)N1CCCCCCC1 1626a_100000211400_100000211992 [0,0,0,0,0,2|2,0,0]=4 10984 B13R1.1464 CCCC(=O)N1CCCCCCC1 240690a_100000211400_100000211992 [0,0,0,0,0,2|2,0,0]=4 10985 B13R1.1464 CCCC(=O)N1CCCCCCC1 527a_100000211400_100000211992 [0,0,0,0,0,2|2,0,0]=4 10986 B13R1.1464 CCNC(=O)N1CCCCCCC1 2708a_100015525214_100000211400 [0,0,0,0,0,2|2,0,0]=4 10987 B13R1.1464 CCNC(=O)N1CCCCCCC1 273464a_100015525214_100000211400 [0,0,0,0,0,2|2,0,0]=4 10988 B13R1.1464 COCC(=O)C1CC/C=C\CCC1 1458a_100000210968_100021000466 [0,0,0,0,0,2|2,0,0]=4 10989 B13R1.1464 CSCC(=O)C1CC/C=C\CCC1 1458a_100000184570_100021000466 [0,0,0,0,0,2|2,0,0]=4 10990 B13R1.1464 O=C(CCO)C1CC/C=C\CCC1 1458a_100011216618_100021000466 [0,0,0,0,0,2|2,0,0]=4