0 B13R1.3523 CC(C)(C)CCNC1CCCCC1 2230a_100000182618_100000755188 [0,0,0,0,0,0|4,0,0]=4 1 B13R1.3523 CC(C)(C)CCNC1CCCCC1 270004a_100000738805_100000210434 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.3523 CC(C)(C)CCNC1CCCCC1 34a_100000182618_100000755188 [0,0,0,0,0,0|4,0,0]=4 3 B13R1.3523 CC(C)(F)CCNC1CCCCC1 270004a_100016253952_100000210434 [0,0,0,0,0,0|4,0,0]=4 4 B13R1.3523 CC(C)(O)CCNC1CCCCC1 2230a_100000182618_100000702414 [0,0,0,0,0,0|3,0,0]=3 5 B13R1.3523 CC(C)(O)CCNC1CCCCC1 270004a_100000707701_100000210434 [0,0,0,0,0,0|3,0,0]=3 6 B13R1.3523 CC(C)(O)CCNC1CCCCC1 34a_100000182618_100000702414 [0,0,0,0,0,0|3,0,0]=3 7 B13R1.3523 CC(C)(O)CCNC1CCCOC1 2230a_100000719290_100000702414 [0,0,0,0,0,0|4,0,0]=4 8 B13R1.3523 CC(C)(O)CCNC1CCCOC1 270004a_100000707701_100000753404 [0,0,0,0,0,0|4,0,0]=4 9 B13R1.3523 CC(C)(O)CCNC1CCCOC1 34a_100000719290_100000702414 [0,0,0,0,0,0|4,0,0]=4 10 B13R1.3523 CC(C)(O)CCNC1CCCSC1 270004a_100000707701_100000057913 [0,0,0,0,0,0|4,0,0]=4 11 B13R1.3523 CC(C)(O)CCNC1CCNCC1 270004a_100000707701_100015192401 [0,0,0,0,0,0|4,0,0]=4 12 B13R1.3523 CC(C)(O)CCNC1CCOCC1 2230a_100000741149_100000702414 [0,0,0,0,0,0|4,0,0]=4 13 B13R1.3523 CC(C)(O)CCNC1CCOCC1 270004a_100000707701_100011217826 [0,0,0,0,0,0|4,0,0]=4 14 B13R1.3523 CC(C)(O)CCNC1CCOCC1 34a_100000741149_100000702414 [0,0,0,0,0,0|4,0,0]=4 15 B13R1.3523 CC(C)(O)CCNC1CCSCC1 2230a_100000748639_100000702414 [0,0,0,0,0,0|4,0,0]=4 16 B13R1.3523 CC(C)(O)CCNC1CCSCC1 270004a_100000707701_100000203788 [0,0,0,0,0,0|4,0,0]=4 17 B13R1.3523 CC(C)(O)CCNC1CCSCC1 34a_100000748639_100000702414 [0,0,0,0,0,0|4,0,0]=4 18 B13R1.3523 CC(C)(O)CCOC1CCCCC1 34a_100000210231_100000702414 [0,0,0,0,0,0|4,0,0]=4 19 B13R1.3523 CC(C)(O)CCOC1CCCCC1 7a_100000210231_100000702414 [0,0,0,0,0,0|4,0,0]=4 20 B13R1.3523 CC(C)(O)CCSC1CCCCC1 62a_100000210327_100000702414 [0,0,0,0,0,0|4,0,0]=4 21 B13R1.3523 CC(C)(O)CCSC1CCCCC1 62a_100000702414_100000210327 [0,0,0,0,0,0|4,0,0]=4 22 B13R1.3523 CS(=O)(=O)CCCN1CCCOC1 2230a_100000131196_100000754308 [0,0,0,0,0,0|4,0,0]=4 23 B13R1.3523 CS(=O)(=O)CCCN1CCCOC1 269982a_100000131196_100000754308 [0,0,0,0,0,0|4,0,0]=4 24 B13R1.3523 CS(=O)(=O)CCCN1CCCOC1 34a_100000131196_100000754308 [0,0,0,0,0,0|4,0,0]=4 25 B13R1.3523 CS(=O)(=O)CCCN1CCOCC1 2230a_100015191051_100000754308 [0,0,0,0,0,0|4,0,0]=4 26 B13R1.3523 CS(=O)(=O)CCCN1CCOCC1 269982a_100015191051_100000754308 [0,0,0,0,0,0|4,0,0]=4 27 B13R1.3523 CS(=O)(=O)CCCN1CCOCC1 34a_100015191051_100000754308 [0,0,0,0,0,0|4,0,0]=4 28 B13R1.3523 CS(=O)(=O)CCCN1CCSCC1 2230a_100000737611_100000754308 [0,0,0,0,0,0|4,0,0]=4 29 B13R1.3523 CS(=O)(=O)CCCN1CCSCC1 269982a_100000737611_100000754308 [0,0,0,0,0,0|4,0,0]=4 30 B13R1.3523 CS(=O)(=O)CCNC1C=CCCC1 2230a_100000740961_100000751183 [0,0,0,0,0,0|1,0,2]=3 31 B13R1.3523 CS(=O)(=O)CCNC1CCCCC1 2230a_100000182618_100000731031 [0,0,0,0,0,0|1,0,0]=1 32 B13R1.3523 CS(=O)(=O)CCNC1CCCCC1 270004a_100000740961_100000210434 [0,0,0,0,0,0|1,0,0]=1 33 B13R1.3523 CS(=O)(=O)CCNC1CCCCC1 34a_100000182618_100000731031 [0,0,0,0,0,0|1,0,0]=1 34 B13R1.3523 CS(=O)(=O)CCNC1CCCCC1 34a_100000740961_100000210327 [0,0,0,0,0,0|1,0,0]=1 35 B13R1.3523 CS(=O)(=O)CCNC1CCCOC1 2230a_100000719290_100000731031 [0,0,0,0,0,0|2,0,0]=2 36 B13R1.3523 CS(=O)(=O)CCNC1CCCOC1 270004a_100000740961_100000753404 [0,0,0,0,0,0|2,0,0]=2 37 B13R1.3523 CS(=O)(=O)CCNC1CCCOC1 34a_100000719290_100000731031 [0,0,0,0,0,0|2,0,0]=2 38 B13R1.3523 CS(=O)(=O)CCNC1CCCOC1 34a_100000740961_100000693364 [0,0,0,0,0,0|2,0,0]=2 39 B13R1.3523 CS(=O)(=O)CCNC1CCCSC1 270004a_100000740961_100000057913 [0,0,0,0,0,0|2,0,0]=2 40 B13R1.3523 CS(=O)(=O)CCNC1CCNCC1 270004a_100000740961_100015192401 [0,0,0,0,0,0|2,0,0]=2 41 B13R1.3523 CS(=O)(=O)CCNC1CCOCC1 2230a_100000741149_100000731031 [0,0,0,0,0,0|2,0,0]=2 42 B13R1.3523 CS(=O)(=O)CCNC1CCOCC1 270004a_100000740961_100011217826 [0,0,0,0,0,0|2,0,0]=2 43 B13R1.3523 CS(=O)(=O)CCNC1CCOCC1 34a_100000741149_100000731031 [0,0,0,0,0,0|2,0,0]=2 44 B13R1.3523 CS(=O)(=O)CCNC1CCSCC1 2230a_100000748639_100000731031 [0,0,0,0,0,0|2,0,0]=2 45 B13R1.3523 CS(=O)(=O)CCNC1CCSCC1 270004a_100000740961_100000203788 [0,0,0,0,0,0|2,0,0]=2 46 B13R1.3523 CS(=O)(=O)CCNC1CCSCC1 34a_100000740961_100000069128 [0,0,0,0,0,0|2,0,0]=2 47 B13R1.3523 CS(=O)(=O)CCNC1CCSCC1 34a_100000748639_100000731031 [0,0,0,0,0,0|2,0,0]=2 48 B13R1.3523 CS(=O)(=O)CCOC1C=CCCC1 34a_100011215024_100000731031 [0,0,0,0,0,0|2,0,2]=4 49 B13R1.3523 CS(=O)(=O)CCOC1C=CCCC1 7a_100000211924_100000751183 [0,0,0,0,0,0|2,0,2]=4 50 B13R1.3523 CS(=O)(=O)CCOC1CC=CCC1 34a_100000073881_100000731031 [0,0,0,0,0,0|2,0,2]=4 51 B13R1.3523 CS(=O)(=O)CCOC1CCCCC1 34a_100000210231_100000731031 [0,0,0,0,0,0|2,0,0]=2 52 B13R1.3523 CS(=O)(=O)CCOC1CCCCC1 34a_100000211924_100000210327 [0,0,0,0,0,0|2,0,0]=2 53 B13R1.3523 CS(=O)(=O)CCOC1CCCCC1 7a_100000210231_100000230027 [0,0,0,0,0,0|2,0,0]=2 54 B13R1.3523 CS(=O)(=O)CCOC1CCCCC1 7a_100000211924_100000210327 [0,0,0,0,0,0|2,0,0]=2 55 B13R1.3523 CS(=O)(=O)CCOC1CCCCO1 34a_100000033831_100000731031 [0,0,0,0,0,0|3,0,0]=3 56 B13R1.3523 CS(=O)(=O)CCOC1CCCOC1 34a_100000211924_100000693364 [0,0,0,0,0,0|3,0,0]=3 57 B13R1.3523 CS(=O)(=O)CCOC1CCCOC1 34a_100000754041_100000731031 [0,0,0,0,0,0|3,0,0]=3 58 B13R1.3523 CS(=O)(=O)CCOC1CCCOC1 7a_100000211924_100000693364 [0,0,0,0,0,0|3,0,0]=3 59 B13R1.3523 CS(=O)(=O)CCOC1CCCSC1 7a_100015962668_100000230027 [0,0,0,0,0,0|3,0,0]=3 60 B13R1.3523 CS(=O)(=O)CCOC1CCOCC1 34a_100000744328_100000731031 [0,0,0,0,0,0|3,0,0]=3 61 B13R1.3523 CS(=O)(=O)CCOC1CCOCC1 7a_100000211924_100000686592 [0,0,0,0,0,0|3,0,0]=3 62 B13R1.3523 CS(=O)(=O)CCOC1CCSCC1 34a_100000211924_100000069128 [0,0,0,0,0,0|3,0,0]=3 63 B13R1.3523 CS(=O)(=O)CCOC1CCSCC1 34a_100000731022_100000731031 [0,0,0,0,0,0|3,0,0]=3 64 B13R1.3523 CS(=O)(=O)CCOC1CCSCC1 7a_100000211924_100011500858 [0,0,0,0,0,0|3,0,0]=3 65 B13R1.3523 CS(=O)(=O)CCOC1CCSCC1 7a_100000731022_100000230027 [0,0,0,0,0,0|3,0,0]=3 66 B13R1.3523 CS(=O)(=O)CCSC1C=CCCC1 62a_100000731031_100000751183 [0,0,0,0,0,0|2,0,2]=4 67 B13R1.3523 CS(=O)(=O)CCSC1C=CCCC1 62a_100000751183_100000230027 [0,0,0,0,0,0|2,0,2]=4 68 B13R1.3523 CS(=O)(=O)CCSC1CCCCC1 62a_100000210327_100000230027 [0,0,0,0,0,0|2,0,0]=2 69 B13R1.3523 CS(=O)(=O)CCSC1CCCCC1 62a_100000731031_100000210327 [0,0,0,0,0,0|2,0,0]=2 70 B13R1.3523 CS(=O)(=O)CCSC1CCCOC1 62a_100000731031_100000693364 [0,0,0,0,0,0|3,0,0]=3 71 B13R1.3523 CS(=O)(=O)CCSC1CCOCC1 62a_100000731031_100011324220 [0,0,0,0,0,0|3,0,0]=3 72 B13R1.3523 CS(=O)(=O)CCSC1CCSCC1 62a_100000731031_100000069128 [0,0,0,0,0,0|3,0,0]=3 73 B13R1.3523 CS(=O)(=O)NCCC1CCCCC1 40a_100000738074_100000738038 [0,0,0,0,0,0|3,0,0]=3 74 B13R1.3523 CS(=O)(=O)NCCC1CCCCO1 40a_100015183643_100000738038 [0,0,0,0,0,0|4,0,0]=4 75 B13R1.3523 CS(=O)(=O)NCCC1CCOCC1 40a_100000755988_100000738038 [0,0,0,0,0,0|4,0,0]=4 76 B13R1.3523 CS(=O)(=O)NCCN1CCCCC1 40a_100000216509_100000738038 [0,0,0,0,0,0|4,0,0]=4 77 B13R1.3523 CS(=O)(=O)NNCC1CCCCC1 40a_100000740227_100000738038 [0,0,0,0,0,0|4,0,0]=4 78 B13R1.3523 C[N+](C)(C)CCNC1CCCCC1 270004a_100000106457_100000210434 [0,0,0,0,0,0|4,0,0]=4 79 B13R1.3523 C[N+](C)(C)CCNC1CCCCC1 34a_100000182618_100000085578 [0,0,0,0,0,0|4,0,0]=4 80 B13R1.3523 C[Si](C)(C)CCNC1CCCCC1 2230a_100000182618_200000733723 [0,0,0,0,0,0|4,0,0]=4 81 B13R1.3523 C[Si](C)(C)CCNC1CCCCC1 34a_100000182618_200000733723 [0,0,0,0,0,0|4,0,0]=4 82 B13R1.3523 FC(F)(F)CCNC1CCCCC1 270004a_100000740434_100000210434 [0,0,0,0,0,0|4,0,0]=4 83 B13R1.3523 FC(F)(F)CCNC1CCCCC1 34a_100000182618_100011219754 [0,0,0,0,0,0|4,0,0]=4 84 B13R1.3523 FC(F)(F)CCNC1CCCCC1 34a_100000740434_100000210327 [0,0,0,0,0,0|4,0,0]=4 85 B13R1.3523 NS(=O)(=O)CCCN1CCCOC1 2230a_100000131196_100000750626 [0,0,0,0,0,0|4,0,0]=4 86 B13R1.3523 NS(=O)(=O)CCCN1CCCOC1 269982a_100000131196_100000750626 [0,0,0,0,0,0|4,0,0]=4 87 B13R1.3523 NS(=O)(=O)CCCN1CCCOC1 34a_100000131196_100000750626 [0,0,0,0,0,0|4,0,0]=4 88 B13R1.3523 NS(=O)(=O)CCCN1CCOCC1 2230a_100015191051_100000750626 [0,0,0,0,0,0|4,0,0]=4 89 B13R1.3523 NS(=O)(=O)CCCN1CCOCC1 269982a_100015191051_100000750626 [0,0,0,0,0,0|4,0,0]=4 90 B13R1.3523 NS(=O)(=O)CCCN1CCOCC1 34a_100015191051_100000750626 [0,0,0,0,0,0|4,0,0]=4 91 B13R1.3523 NS(=O)(=O)CCCN1CCSCC1 2230a_100000737611_100000750626 [0,0,0,0,0,0|4,0,0]=4 92 B13R1.3523 NS(=O)(=O)CCCN1CCSCC1 269982a_100000737611_100000750626 [0,0,0,0,0,0|4,0,0]=4 93 B13R1.3523 NS(=O)(=O)CCNC1C=CCCC1 2230a_100000738205_100000751183 [0,0,0,0,0,0|1,0,2]=3 94 B13R1.3523 NS(=O)(=O)CCNC1CCCCC1 270004a_100000738205_100000210434 [0,0,0,0,0,0|1,0,0]=1 95 B13R1.3523 NS(=O)(=O)CCNC1CCCCC1 34a_100000738205_100000210327 [0,0,0,0,0,0|1,0,0]=1 96 B13R1.3523 NS(=O)(=O)CCNC1CCCOC1 270004a_100000738205_100000753404 [0,0,0,0,0,0|2,0,0]=2 97 B13R1.3523 NS(=O)(=O)CCNC1CCCOC1 34a_100000738205_100000693364 [0,0,0,0,0,0|2,0,0]=2 98 B13R1.3523 NS(=O)(=O)CCNC1CCCSC1 270004a_100000738205_100000057913 [0,0,0,0,0,0|2,0,0]=2 99 B13R1.3523 NS(=O)(=O)CCNC1CCNCC1 270004a_100000738205_100015192401 [0,0,0,0,0,0|2,0,0]=2 100 B13R1.3523 NS(=O)(=O)CCNC1CCOCC1 270004a_100000738205_100011217826 [0,0,0,0,0,0|2,0,0]=2 101 B13R1.3523 NS(=O)(=O)CCNC1CCSCC1 270004a_100000738205_100000203788 [0,0,0,0,0,0|2,0,0]=2 102 B13R1.3523 NS(=O)(=O)CCNC1CCSCC1 34a_100000738205_100000069128 [0,0,0,0,0,0|2,0,0]=2 103 B13R1.3523 NS(=O)(=O)CCOC1CCCCC1 34a_100012334274_100000210327 [0,0,0,0,0,0|2,0,0]=2 104 B13R1.3523 NS(=O)(=O)CCOC1CCCOC1 34a_100012334274_100000693364 [0,0,0,0,0,0|3,0,0]=3 105 B13R1.3523 NS(=O)(=O)CCOC1CCSCC1 34a_100012334274_100000069128 [0,0,0,0,0,0|3,0,0]=3 106 B13R1.3523 NS(=O)(=O)CSCC1CCCCC1 62a_100000211423_100000741382 [0,0,0,0,0,0|3,0,0]=3 107 B13R1.3523 NS(=O)(=O)CSCC1CCCCC1 62a_100000741382_100000211423 [0,0,0,0,0,0|3,0,0]=3 108 B13R1.3523 NS(=O)(=O)CSCC1CCCCO1 62a_100000211543_100000741382 [0,0,0,0,0,0|4,0,0]=4 109 B13R1.3523 NS(=O)(=O)CSCC1CCCCO1 62a_100000741382_100000211543 [0,0,0,0,0,0|4,0,0]=4 110 B13R1.3523 NS(=O)(=O)CSCC1CCCOC1 62a_100000741382_100000741521 [0,0,0,0,0,0|4,0,0]=4 111 B13R1.3523 NS(=O)(=O)CSCC1CCCOC1 62a_100000741521_100000741382 [0,0,0,0,0,0|4,0,0]=4 112 B13R1.3523 NS(=O)(=O)CSCC1CCOCC1 62a_100000741382_100000749018 [0,0,0,0,0,0|4,0,0]=4 113 B13R1.3523 NS(=O)(=O)CSCC1CCOCC1 62a_100000754603_100000741382 [0,0,0,0,0,0|4,0,0]=4 114 B13R1.3523 O=S(=O)([O-])CCCN1CCCOC1 269982a_100000131196_100009813499 [0,0,0,0,0,0|3,0,1]=4 115 B13R1.3523 O=S(=O)([O-])CCCN1CCCOC1 34a_100000131196_100009813499 [0,0,0,0,0,0|3,0,1]=4 116 B13R1.3523 O=S(=O)([O-])CCCN1CCOCC1 269982a_100015191051_100009813499 [0,0,0,0,0,0|3,0,1]=4 117 B13R1.3523 O=S(=O)([O-])CCCN1CCOCC1 34a_100015191051_100009813499 [0,0,0,0,0,0|3,0,1]=4 118 B13R1.3523 O=S(=O)([O-])CCCN1CCSCC1 269982a_100000737611_100009813499 [0,0,0,0,0,0|3,0,1]=4 119 B13R1.3523 O=S(=O)([O-])CCNC1CCCCC1 2230a_100000182618_100000737633 [0,0,0,0,0,0|0,0,1]=1 120 B13R1.3523 O=S(=O)([O-])CCNC1CCCCC1 34a_100000182618_100000762736 [0,0,0,0,0,0|0,0,1]=1 121 B13R1.3523 O=S(=O)([O-])CCNC1CCCOC1 2230a_100000719290_100000737633 [0,0,0,0,0,0|1,0,1]=2 122 B13R1.3523 O=S(=O)([O-])CCNC1CCCOC1 34a_100000719290_100000762736 [0,0,0,0,0,0|1,0,1]=2 123 B13R1.3523 O=S(=O)([O-])CCNC1CCOCC1 2230a_100000741149_100000737633 [0,0,0,0,0,0|1,0,1]=2 124 B13R1.3523 O=S(=O)([O-])CCNC1CCOCC1 34a_100000741149_100000762736 [0,0,0,0,0,0|1,0,1]=2 125 B13R1.3523 O=S(=O)([O-])CCNC1CCSCC1 2230a_100000748639_100000737633 [0,0,0,0,0,0|1,0,1]=2 126 B13R1.3523 O=S(=O)([O-])CCNC1CCSCC1 34a_100000748639_100000762736 [0,0,0,0,0,0|1,0,1]=2 127 B13R1.3523 O=S(=O)([O-])CCOC1C=CCCC1 34a_100011215024_100000762736 [0,0,0,0,0,0|1,0,3]=4 128 B13R1.3523 O=S(=O)([O-])CCOC1CC=CCC1 34a_100000073881_100000762736 [0,0,0,0,0,0|1,0,3]=4 129 B13R1.3523 O=S(=O)([O-])CCOC1CCCCC1 34a_100000210231_100000762736 [0,0,0,0,0,0|1,0,1]=2 130 B13R1.3523 O=S(=O)([O-])CCOC1CCCCO1 34a_100000033831_100000762736 [0,0,0,0,0,0|2,0,1]=3 131 B13R1.3523 O=S(=O)([O-])CCOC1CCCOC1 34a_100000754041_100000762736 [0,0,0,0,0,0|2,0,1]=3 132 B13R1.3523 O=S(=O)([O-])CCOC1CCOCC1 34a_100000744328_100000762736 [0,0,0,0,0,0|2,0,1]=3 133 B13R1.3523 O=S(=O)([O-])CCOC1CCSCC1 34a_100000731022_100000762736 [0,0,0,0,0,0|2,0,1]=3 134 B13R1.3523 O=S(=O)([O-])CCSC1C=CCCC1 62a_100000751183_100000762736 [0,0,0,0,0,0|1,0,3]=4 135 B13R1.3523 O=S(=O)([O-])CCSC1C=CCCC1 62a_100000762736_100000751183 [0,0,0,0,0,0|1,0,3]=4 136 B13R1.3523 O=S(=O)([O-])CCSC1CCCCC1 62a_100000210327_100000762736 [0,0,0,0,0,0|1,0,1]=2 137 B13R1.3523 O=S(=O)([O-])CCSC1CCCCC1 62a_100000762736_100000210327 [0,0,0,0,0,0|1,0,1]=2 138 B13R1.3523 O=S(=O)([O-])CCSC1CCCOC1 62a_100000762736_100000693364 [0,0,0,0,0,0|2,0,1]=3 139 B13R1.3523 O=S(=O)([O-])CCSC1CCOCC1 62a_100000762736_100011324220 [0,0,0,0,0,0|2,0,1]=3 140 B13R1.3523 O=S(=O)([O-])CCSC1CCSCC1 62a_100000762736_100000069128 [0,0,0,0,0,0|2,0,1]=3 141 B13R1.3523 O=S(=O)([O-])CNCC1CCCCC1 34a_100000210473_100009817235 [0,0,0,0,0,0|2,0,1]=3 142 B13R1.3523 O=S(=O)([O-])CNCC1CCCCO1 34a_100000174945_100009817235 [0,0,0,0,0,0|3,0,1]=4 143 B13R1.3523 O=S(=O)([O-])CNCC1CCCOC1 34a_100000720124_100009817235 [0,0,0,0,0,0|3,0,1]=4 144 B13R1.3523 O=S(=O)([O-])CNCC1CCOCC1 34a_100000746373_100009817235 [0,0,0,0,0,0|3,0,1]=4 145 B13R1.3523 O=S(=O)([O-])CNCC1CCSCC1 34a_100015188806_100009817235 [0,0,0,0,0,0|3,0,1]=4 146 B13R1.3523 O=S(=O)([O-])COCC1CCCCC1 34a_100000212181_100009817235 [0,0,0,0,0,0|2,0,1]=3 147 B13R1.3523 O=S(=O)([O-])COCC1CCCCN1 34a_100000210821_100009817235 [0,0,0,0,0,0|3,0,1]=4 148 B13R1.3523 O=S(=O)([O-])COCC1CCCCO1 34a_100000211370_100009817235 [0,0,0,0,0,0|3,0,1]=4 149 B13R1.3523 O=S(=O)([O-])COCC1CCCNC1 34a_100000211344_100009817235 [0,0,0,0,0,0|3,0,1]=4 150 B13R1.3523 O=S(=O)([O-])COCC1CCCOC1 34a_100000741520_100009817235 [0,0,0,0,0,0|3,0,1]=4 151 B13R1.3523 O=S(=O)([O-])COCC1CCNCC1 34a_100000738675_100009817235 [0,0,0,0,0,0|3,0,1]=4 152 B13R1.3523 O=S(=O)([O-])COCC1CCOCC1 34a_100000749013_100009817235 [0,0,0,0,0,0|3,0,1]=4 153 B13R1.3523 O=S(=O)([O-])COCC1CCSCC1 34a_100000070558_100009817235 [0,0,0,0,0,0|3,0,1]=4 154 B13R1.3523 O=S(=O)([O-])CSCC1CCCCC1 62a_100000211423_100009817235 [0,0,0,0,0,0|2,0,1]=3 155 B13R1.3523 O=S(=O)([O-])CSCC1CCCCC1 62a_100009817235_100000211423 [0,0,0,0,0,0|2,0,1]=3 156 B13R1.3523 O=S(=O)([O-])CSCC1CCCCO1 62a_100000211543_100009817235 [0,0,0,0,0,0|3,0,1]=4 157 B13R1.3523 O=S(=O)([O-])CSCC1CCCCO1 62a_100009817235_100000211543 [0,0,0,0,0,0|3,0,1]=4 158 B13R1.3523 O=S(=O)([O-])CSCC1CCCOC1 62a_100000741521_100009817235 [0,0,0,0,0,0|3,0,1]=4 159 B13R1.3523 O=S(=O)([O-])CSCC1CCCOC1 62a_100009817235_100000741521 [0,0,0,0,0,0|3,0,1]=4 160 B13R1.3523 O=S(=O)([O-])CSCC1CCOCC1 62a_100000754603_100009817235 [0,0,0,0,0,0|3,0,1]=4 161 B13R1.3523 O=S(=O)([O-])CSCC1CCOCC1 62a_100009817235_100000749018 [0,0,0,0,0,0|3,0,1]=4 162 B12R1.252 C=C(C)CCNC1CCCCC1 2230a_100000182618_100000730704 [1,0,0,0,0,0|3,0,0]=4 163 B12R1.252 C=C(C)CCNC1CCCCC1 34a_100000182618_100000730704 [1,0,0,0,0,0|3,0,0]=4 164 B12R1.252 CC(=O)CCCC1CCCCC1 1458a_100000070787_100011713725 [1,0,0,0,0,0|3,0,0]=4 165 B12R1.252 CC(=O)CCCC1CCCCC1 1458a_100000211478_200000210301 [1,0,0,0,0,0|3,0,0]=4 166 B12R1.252 CC(=O)CCOC1CCCCC1 1458a_100000070787_100011211530 [1,0,0,0,0,0|3,0,0]=4 167 B12R1.252 CC(=O)CCOC1CCCCC1 34a_100000759926_100000210327 [1,0,0,0,0,0|3,0,0]=4 168 B12R1.252 CC(=O)CCOC1CCCCC1 7a_100000210231_100000053229 [1,0,0,0,0,0|3,0,0]=4 169 B12R1.252 CC(=O)CCOC1CCCCC1 7a_100000759926_100000210327 [1,0,0,0,0,0|3,0,0]=4 170 B12R1.252 CC(=O)CCSC1CCCCC1 62a_100000053229_100000210327 [1,0,0,0,0,0|3,0,0]=4 171 B12R1.252 CC(=O)CCSC1CCCCC1 62a_100000210327_100000053229 [1,0,0,0,0,0|3,0,0]=4 172 B12R1.252 CC(=O)OCNC1CCCCC1 34a_100000182618_100009813279 [1,0,0,0,0,0|3,0,0]=4 173 B12R1.252 CC(C)CCNC1CCCCC1 2230a_100000182618_100000210312 [1,0,0,0,0,0|3,0,0]=4 174 B12R1.252 CC(C)CCNC1CCCCC1 269862a_100000182618_100000185833 [1,0,0,0,0,0|3,0,0]=4 175 B12R1.252 CC(C)CCNC1CCCCC1 270004a_100000210545_100000210434 [1,0,0,0,0,0|3,0,0]=4 176 B12R1.252 CC(C)CCNC1CCCCC1 34a_100000182618_100000210312 [1,0,0,0,0,0|3,0,0]=4 177 B12R1.252 CC(O)CCNC1CCCCC1 2230a_100000182618_100012276601 [1,0,0,0,0,0|2,0,0]=3 178 B12R1.252 CC(O)CCNC1CCCCC1 270004a_200000755665_100000210434 [1,0,0,0,0,0|2,0,0]=3 179 B12R1.252 CC(O)CCNC1CCCCC1 34a_100000182618_100012276601 [1,0,0,0,0,0|2,0,0]=3 180 B12R1.252 CC(O)CCNC1CCCOC1 2230a_100000719290_100012276601 [1,0,0,0,0,0|3,0,0]=4 181 B12R1.252 CC(O)CCNC1CCCOC1 270004a_200000755665_100000753404 [1,0,0,0,0,0|3,0,0]=4 182 B12R1.252 CC(O)CCNC1CCCOC1 34a_100000719290_100012276601 [1,0,0,0,0,0|3,0,0]=4 183 B12R1.252 CC(O)CCNC1CCCSC1 270004a_200000755665_100000057913 [1,0,0,0,0,0|3,0,0]=4 184 B12R1.252 CC(O)CCNC1CCNCC1 270004a_200000755665_100015192401 [1,0,0,0,0,0|3,0,0]=4 185 B12R1.252 CC(O)CCNC1CCOCC1 2230a_100000741149_100012276601 [1,0,0,0,0,0|3,0,0]=4 186 B12R1.252 CC(O)CCNC1CCOCC1 270004a_200000755665_100011217826 [1,0,0,0,0,0|3,0,0]=4 187 B12R1.252 CC(O)CCNC1CCOCC1 34a_100000741149_100012276601 [1,0,0,0,0,0|3,0,0]=4 188 B12R1.252 CC(O)CCNC1CCSCC1 2230a_100000748639_100012276601 [1,0,0,0,0,0|3,0,0]=4 189 B12R1.252 CC(O)CCNC1CCSCC1 270004a_200000755665_100000203788 [1,0,0,0,0,0|3,0,0]=4 190 B12R1.252 CC(O)CCNC1CCSCC1 34a_100000748639_100012276601 [1,0,0,0,0,0|3,0,0]=4 191 B12R1.252 CC(O)CCOC1CCCCC1 34a_100000210231_100012276601 [1,0,0,0,0,0|3,0,0]=4 192 B12R1.252 CC(O)CCOC1CCCCC1 7a_100000210231_100012276601 [1,0,0,0,0,0|3,0,0]=4 193 B12R1.252 CC(O)CCSC1CCCCC1 62a_100000210327_100012276601 [1,0,0,0,0,0|3,0,0]=4 194 B12R1.252 CC(O)CCSC1CCCCC1 62a_100012276601_100000210327 [1,0,0,0,0,0|3,0,0]=4 195 B12R1.252 CN(C)CCNC1CCCCC1 270004a_100000210585_100000210434 [1,0,0,0,0,0|3,0,0]=4 196 B12R1.252 NC(=O)CCNC1CCCCC1 2230a_100000182618_100000744528 [1,0,0,0,0,0|2,0,0]=3 197 B12R1.252 NC(=O)CCNC1CCCCC1 34a_100000182618_100000731001 [1,0,0,0,0,0|2,0,0]=3 198 B12R1.252 NC(=O)CCNC1CCCOC1 2230a_100000719290_100000744528 [1,0,0,0,0,0|3,0,0]=4 199 B12R1.252 NC(=O)CCNC1CCCOC1 34a_100000719290_100000731001 [1,0,0,0,0,0|3,0,0]=4 200 B12R1.252 NC(=O)CCNC1CCOCC1 2230a_100000741149_100000744528 [1,0,0,0,0,0|3,0,0]=4 201 B12R1.252 NC(=O)CCNC1CCOCC1 34a_100000741149_100000731001 [1,0,0,0,0,0|3,0,0]=4 202 B12R1.252 NC(=O)CCNC1CCSCC1 2230a_100000748639_100000744528 [1,0,0,0,0,0|3,0,0]=4 203 B12R1.252 NC(=O)CCNC1CCSCC1 34a_100000748639_100000731001 [1,0,0,0,0,0|3,0,0]=4 204 B12R1.252 NC(=O)CCOC1CCCCC1 34a_100000210231_100000731001 [1,0,0,0,0,0|3,0,0]=4 205 B12R1.252 NC(=O)CCOC1CCCCC1 34a_100000757172_100000210327 [1,0,0,0,0,0|3,0,0]=4 206 B12R1.252 NC(=O)CCOC1CCCCC1 7a_100000210231_100000744528 [1,0,0,0,0,0|3,0,0]=4 207 B12R1.252 NC(=O)CCOC1CCCCC1 7a_100000757172_100000210327 [1,0,0,0,0,0|3,0,0]=4 208 B12R1.252 NC(=O)CCSC1CCCCC1 62a_100000210327_100000744528 [1,0,0,0,0,0|3,0,0]=4 209 B12R1.252 NC(=O)CCSC1CCCCC1 62a_100000744528_100000210327 [1,0,0,0,0,0|3,0,0]=4 210 B12R1.252 O=C(O)CNCC1CCCCC1 269956a_100016091260_100000211423 [1,0,0,0,0,0|3,0,0]=4 211 B12R1.252 O=C(O)CONC1CCCCC1 269956a_100000106656_100000210327 [1,0,0,0,0,0|2,0,0]=3 212 B12R1.252 O=C(O)CONC1CCCOC1 269956a_100000106656_100000693364 [1,0,0,0,0,0|3,0,0]=4 213 B12R1.252 O=C(O)CONC1CCOCC1 269956a_100000106656_100011324220 [1,0,0,0,0,0|3,0,0]=4 214 B12R1.252 O=C(O)CONC1CCSCC1 269956a_100000106656_100000069128 [1,0,0,0,0,0|3,0,0]=4 215 B12R1.252 [13CH3]C(=O)CCCC1CCCCC1 1458a_100000211478_200025704644 [1,0,0,0,0,0|3,0,0]=4 216 B14R1.131 C=C1CCC(CC1)NCCS(=O)(=O)C 270004a_100000740961_100010272673 [0,1,0,0,0,0|1,0,1]=3 217 B14R1.131 C=C1CCC(CC1)NCCS(=O)(=O)N 270004a_100000738205_100010272673 [0,1,0,0,0,0|1,0,1]=3 218 B14R1.131 CC(C)(O)CCNC1CCC(CC1)O 270004a_100000707701_100000764474 [0,1,0,0,0,0|3,0,0]=4 219 B14R1.131 CC(C)(O)CCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000702414 [0,1,0,0,0,0|3,0,0]=4 220 B14R1.131 CC(C)(O)CCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000702414 [0,1,0,0,0,0|3,0,0]=4 221 B14R1.131 CC1CCC(CC1)CNCS(=O)(=O)[O-] 34a_103436935547_100009817235 [0,1,0,0,0,0|2,0,1]=4 222 B14R1.131 CC1CCC(CC1)COCS(=O)(=O)[O-] 34a_100000701341_100009817235 [0,1,0,0,0,0|2,0,1]=4 223 B14R1.131 CC1CCC(CC1)NCCC(C)(C)O 270004a_100000707701_100000185489 [0,1,0,0,0,0|3,0,0]=4 224 B14R1.131 CC1CCC(CC1)NCCS(=O)(=O)C 270004a_100000740961_100000185489 [0,1,0,0,0,0|1,0,0]=2 225 B14R1.131 CC1CCC(CC1)NCCS(=O)(=O)C 34a_100000740961_200011216234 [0,1,0,0,0,0|1,0,0]=2 226 B14R1.131 CC1CCC(CC1)NCCS(=O)(=O)N 270004a_100000738205_100000185489 [0,1,0,0,0,0|1,0,0]=2 227 B14R1.131 CC1CCC(CC1)NCCS(=O)(=O)N 34a_100000738205_200011216234 [0,1,0,0,0,0|1,0,0]=2 228 B14R1.131 CC1CCC(CC1)OCCS(=O)(=O)C 34a_100000210714_100000731031 [0,1,0,0,0,0|2,0,0]=3 229 B14R1.131 CC1CCC(CC1)OCCS(=O)(=O)C 34a_100000211924_200011216234 [0,1,0,0,0,0|2,0,0]=3 230 B14R1.131 CC1CCC(CC1)OCCS(=O)(=O)C 7a_100000210714_100000230027 [0,1,0,0,0,0|2,0,0]=3 231 B14R1.131 CC1CCC(CC1)OCCS(=O)(=O)N 34a_100012334274_200011216234 [0,1,0,0,0,0|2,0,0]=3 232 B14R1.131 CC1CCC(CC1)OCCS(=O)(=O)[O-] 34a_100000210714_100000762736 [0,1,0,0,0,0|1,0,1]=3 233 B14R1.131 CC1CCC(CC1)SCCS(=O)(=O)C 62a_100000731031_200011216234 [0,1,0,0,0,0|2,0,0]=3 234 B14R1.131 CC1CCC(CC1)SCCS(=O)(=O)[O-] 62a_100000762736_200011216234 [0,1,0,0,0,0|1,0,1]=3 235 B14R1.131 CC1CCN(CC1)CCCS(=O)(=O)C 2230a_100000188429_100000754308 [0,1,0,0,0,0|3,0,0]=4 236 B14R1.131 CC1CCN(CC1)CCCS(=O)(=O)C 269982a_100000188429_100000754308 [0,1,0,0,0,0|3,0,0]=4 237 B14R1.131 CC1CCN(CC1)CCCS(=O)(=O)C 34a_100000188429_100000754308 [0,1,0,0,0,0|3,0,0]=4 238 B14R1.131 CC1CCN(CC1)CCCS(=O)(=O)N 2230a_100000188429_100000750626 [0,1,0,0,0,0|3,0,0]=4 239 B14R1.131 CC1CCN(CC1)CCCS(=O)(=O)N 269982a_100000188429_100000750626 [0,1,0,0,0,0|3,0,0]=4 240 B14R1.131 CC1CCN(CC1)CCCS(=O)(=O)N 34a_100000188429_100000750626 [0,1,0,0,0,0|3,0,0]=4 241 B14R1.131 CC1CCN(CC1)CCCS(=O)(=O)[O-] 269982a_100000188429_100009813499 [0,1,0,0,0,0|2,0,1]=4 242 B14R1.131 CC1CCN(CC1)CCCS(=O)(=O)[O-] 34a_100000188429_100009813499 [0,1,0,0,0,0|2,0,1]=4 243 B14R1.131 CN1CCC(CC1)NCCS(=O)(=O)C 270004a_100000740961_100000210137 [0,1,0,0,0,0|2,0,0]=3 244 B14R1.131 CN1CCC(CC1)NCCS(=O)(=O)N 270004a_100000738205_100000210137 [0,1,0,0,0,0|2,0,0]=3 245 B14R1.131 CN1CCC(CC1)SCCS(=O)(=O)C 62a_100000731031_100011215917 [0,1,0,0,0,0|3,0,0]=4 246 B14R1.131 CN1CCC(CC1)SCCS(=O)(=O)[O-] 62a_100000762736_100011215917 [0,1,0,0,0,0|2,0,1]=4 247 B14R1.131 CS(=O)(=O)CCCN1CCC(CC1)F 2230a_100015193889_100000754308 [0,1,0,0,0,0|3,0,0]=4 248 B14R1.131 CS(=O)(=O)CCCN1CCC(CC1)F 269982a_100015193889_100000754308 [0,1,0,0,0,0|3,0,0]=4 249 B14R1.131 CS(=O)(=O)CCCN1CCC(CC1)F 34a_100015193889_100000754308 [0,1,0,0,0,0|3,0,0]=4 250 B14R1.131 CS(=O)(=O)CCCN1CCC(CC1)O 2230a_100025773856_100000754308 [0,1,0,0,0,0|3,0,0]=4 251 B14R1.131 CS(=O)(=O)CCCN1CCC(CC1)O 269982a_100025773856_100000754308 [0,1,0,0,0,0|3,0,0]=4 252 B14R1.131 CS(=O)(=O)CCNC1CCC(=O)NC1 2230a_100000748762_100000731031 [0,1,0,0,0,0|2,0,1]=4 253 B14R1.131 CS(=O)(=O)CCNC1CCC(=O)NC1 34a_100000748762_100000731031 [0,1,0,0,0,0|2,0,1]=4 254 B14R1.131 CS(=O)(=O)CCNC1CCC(CC1)O 270004a_100000740961_100000764474 [0,1,0,0,0,0|1,0,0]=2 255 B14R1.131 CS(=O)(=O)CCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000731031 [0,1,0,0,0,0|1,0,0]=2 256 B14R1.131 CS(=O)(=O)CCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000731031 [0,1,0,0,0,0|1,0,0]=2 257 B14R1.131 CS(=O)(=O)CCOC1CCC(=O)CC1 34a_100000764474_100000731031 [0,1,0,0,0,0|2,0,1]=4 258 B14R1.131 CS(=O)(=O)CCOC1CCC(=O)CC1 7a_100000764474_100000230027 [0,1,0,0,0,0|2,0,1]=4 259 B14R1.131 CS(=O)(=O)CCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000731031 [0,1,0,0,0,0|2,0,0]=3 260 B14R1.131 CS(=O)(=O)NCCC1CCC(CC1)O 40a_200011935226_100000738038 [0,1,0,0,0,0|3,0,0]=4 261 B14R1.131 C[C@H]1CC[C@@H](CC1)NCCS(=O)(=O)[O-] 2230a_100020625639_100000737633 [0,1,0,0,0,0|0,0,1]=2 262 B14R1.131 C[C@H]1CC[C@@H](CC1)NCCS(=O)(=O)[O-] 34a_100020625639_100000762736 [0,1,0,0,0,0|0,0,1]=2 263 B14R1.131 NS(=O)(=O)CCCN1CCC(CC1)F 2230a_100015193889_100000750626 [0,1,0,0,0,0|3,0,0]=4 264 B14R1.131 NS(=O)(=O)CCCN1CCC(CC1)F 269982a_100015193889_100000750626 [0,1,0,0,0,0|3,0,0]=4 265 B14R1.131 NS(=O)(=O)CCCN1CCC(CC1)F 34a_100015193889_100000750626 [0,1,0,0,0,0|3,0,0]=4 266 B14R1.131 NS(=O)(=O)CCCN1CCC(CC1)O 2230a_100025773856_100000750626 [0,1,0,0,0,0|3,0,0]=4 267 B14R1.131 NS(=O)(=O)CCCN1CCC(CC1)O 269982a_100025773856_100000750626 [0,1,0,0,0,0|3,0,0]=4 268 B14R1.131 NS(=O)(=O)CCNC1CCC(CC1)O 270004a_100000738205_100000764474 [0,1,0,0,0,0|1,0,0]=2 269 B14R1.131 N[C@H]1CC[C@@H](CC1)COCS(=O)(=O)[O-] 34a_100009821084_100009817235 [0,1,0,0,0,0|2,0,1]=4 270 B14R1.131 N[C@H]1CC[C@H](CC1)OCCS(=O)(=O)[O-] 34a_100020628982_100000762736 [0,1,0,0,0,0|1,0,1]=3 271 B14R1.131 O=C1CCC(CC1)OCCS(=O)(=O)[O-] 34a_100000764474_100000762736 [0,1,0,0,0,0|1,0,2]=4 272 B14R1.131 O=C1CCC(CN1)NCCS(=O)(=O)[O-] 2230a_100000748762_100000737633 [0,1,0,0,0,0|1,0,2]=4 273 B14R1.131 O=C1CCC(CN1)NCCS(=O)(=O)[O-] 34a_100000748762_100000762736 [0,1,0,0,0,0|1,0,2]=4 274 B14R1.131 O=S(=O)([O-])CCCN1CCC(CC1)F 269982a_100015193889_100009813499 [0,1,0,0,0,0|2,0,1]=4 275 B14R1.131 O=S(=O)([O-])CCCN1CCC(CC1)F 34a_100015193889_100009813499 [0,1,0,0,0,0|2,0,1]=4 276 B14R1.131 O=S(=O)([O-])CCCN1CCC(CC1)O 269982a_100025773856_100009813499 [0,1,0,0,0,0|2,0,1]=4 277 B14R1.147 CC(C)(O)CCNC1CCCC(C1)O 2230a_100015190357_100000702414 [0,1,0,0,0,0|3,0,0]=4 278 B14R1.147 CC(C)(O)CCNC1CCCC(C1)O 270004a_100000707701_100012613340 [0,1,0,0,0,0|3,0,0]=4 279 B14R1.147 CC1CC(CCO1)NCCS(=O)(=O)C 270004a_100000740961_100000755752 [0,1,0,0,0,0|2,0,0]=3 280 B14R1.147 CC1CC(CCO1)NCCS(=O)(=O)N 270004a_100000738205_100000755752 [0,1,0,0,0,0|2,0,0]=3 281 B14R1.147 CC1CC(CCO1)OCCS(=O)(=O)C 34a_100011986385_100000731031 [0,1,0,0,0,0|3,0,0]=4 282 B14R1.147 CC1CC(CCO1)OCCS(=O)(=O)C 7a_100011986385_100000230027 [0,1,0,0,0,0|3,0,0]=4 283 B14R1.147 CC1CC(CCO1)OCCS(=O)(=O)[O-] 34a_100011986385_100000762736 [0,1,0,0,0,0|2,0,1]=4 284 B14R1.147 CC1CCCC(C1)NCCC(C)(C)O 2230a_100011194320_100000702414 [0,1,0,0,0,0|3,0,0]=4 285 B14R1.147 CC1CCCC(C1)NCCC(C)(C)O 270004a_100000707701_100000183594 [0,1,0,0,0,0|3,0,0]=4 286 B14R1.147 CC1CCCC(C1)NCCC(C)(C)O 34a_100011194320_100000702414 [0,1,0,0,0,0|3,0,0]=4 287 B14R1.147 CC1CCCC(C1)NCCS(=O)(=O)C 2230a_100011194320_100000731031 [0,1,0,0,0,0|1,0,0]=2 288 B14R1.147 CC1CCCC(C1)NCCS(=O)(=O)C 270004a_100000740961_100000183594 [0,1,0,0,0,0|1,0,0]=2 289 B14R1.147 CC1CCCC(C1)NCCS(=O)(=O)C 34a_100011194320_100000731031 [0,1,0,0,0,0|1,0,0]=2 290 B14R1.147 CC1CCCC(C1)NCCS(=O)(=O)N 270004a_100000738205_100000183594 [0,1,0,0,0,0|1,0,0]=2 291 B14R1.147 CC1CCCC(C1)NCCS(=O)(=O)[O-] 2230a_100011194320_100000737633 [0,1,0,0,0,0|0,0,1]=2 292 B14R1.147 CC1CCCC(C1)NCCS(=O)(=O)[O-] 34a_100011194320_100000762736 [0,1,0,0,0,0|0,0,1]=2 293 B14R1.147 CC1CCCC(C1)OCCS(=O)(=O)C 34a_100000211399_100000731031 [0,1,0,0,0,0|2,0,0]=3 294 B14R1.147 CC1CCCC(C1)OCCS(=O)(=O)[O-] 34a_100000211399_100000762736 [0,1,0,0,0,0|1,0,1]=3 295 B14R1.147 CS(=O)(=O)CCCN1CCCC(C1)F 2230a_100000697950_100000754308 [0,1,0,0,0,0|3,0,0]=4 296 B14R1.147 CS(=O)(=O)CCCN1CCCC(C1)F 269982a_100000697950_100000754308 [0,1,0,0,0,0|3,0,0]=4 297 B14R1.147 CS(=O)(=O)CCCN1CCCC(C1)F 34a_100000697950_100000754308 [0,1,0,0,0,0|3,0,0]=4 298 B14R1.147 CS(=O)(=O)CCCN1CCCC(C1)O 2230a_100000211013_100000754308 [0,1,0,0,0,0|3,0,0]=4 299 B14R1.147 CS(=O)(=O)CCCN1CCCC(C1)O 269982a_100000211013_100000754308 [0,1,0,0,0,0|3,0,0]=4 300 B14R1.147 CS(=O)(=O)CCNC1CCCC(C1)O 2230a_100015190357_100000731031 [0,1,0,0,0,0|1,0,0]=2 301 B14R1.147 CS(=O)(=O)CCNC1CCCC(C1)O 270004a_100000740961_100012613340 [0,1,0,0,0,0|1,0,0]=2 302 B14R1.147 CS(=O)(=O)CCNC1CCNC(=O)C1 2230a_100016994916_100000731031 [0,1,0,0,0,0|2,0,1]=4 303 B14R1.147 CS(=O)(=O)CCNC1CCNC(=O)C1 34a_100016994916_100000731031 [0,1,0,0,0,0|2,0,1]=4 304 B14R1.147 CS(=O)(=O)CCOC1CCCC(=O)C1 34a_100012613340_100000731031 [0,1,0,0,0,0|2,0,1]=4 305 B14R1.147 C[C@@H]1CC(CCN1)NCCS(=O)(=O)C 270004a_100000740961_100016994030 [0,1,0,0,0,0|2,0,0]=3 306 B14R1.147 C[C@@H]1CC(CCN1)NCCS(=O)(=O)N 270004a_100000738205_100016994030 [0,1,0,0,0,0|2,0,0]=3 307 B14R1.147 C[C@H]1CCCN(C1)CCCS(=O)(=O)C 2230a_100000717927_100000754308 [0,1,0,0,0,0|3,0,0]=4 308 B14R1.147 C[C@H]1CCCN(C1)CCCS(=O)(=O)C 269982a_100000717927_100000754308 [0,1,0,0,0,0|3,0,0]=4 309 B14R1.147 C[C@H]1CCCN(C1)CCCS(=O)(=O)C 34a_100000717927_100000754308 [0,1,0,0,0,0|3,0,0]=4 310 B14R1.147 C[C@H]1CCCN(C1)CCCS(=O)(=O)N 2230a_100000717927_100000750626 [0,1,0,0,0,0|3,0,0]=4 311 B14R1.147 C[C@H]1CCCN(C1)CCCS(=O)(=O)N 269982a_100000717927_100000750626 [0,1,0,0,0,0|3,0,0]=4 312 B14R1.147 C[C@H]1CCCN(C1)CCCS(=O)(=O)N 34a_100000717927_100000750626 [0,1,0,0,0,0|3,0,0]=4 313 B14R1.147 C[C@H]1CCCN(C1)CCCS(=O)(=O)[O-] 269982a_100000717927_100009813499 [0,1,0,0,0,0|2,0,1]=4 314 B14R1.147 C[C@H]1CCCN(C1)CCCS(=O)(=O)[O-] 34a_100000717927_100009813499 [0,1,0,0,0,0|2,0,1]=4 315 B14R1.147 NS(=O)(=O)CCCN1CCCC(C1)F 2230a_100000697950_100000750626 [0,1,0,0,0,0|3,0,0]=4 316 B14R1.147 NS(=O)(=O)CCCN1CCCC(C1)F 269982a_100000697950_100000750626 [0,1,0,0,0,0|3,0,0]=4 317 B14R1.147 NS(=O)(=O)CCCN1CCCC(C1)F 34a_100000697950_100000750626 [0,1,0,0,0,0|3,0,0]=4 318 B14R1.147 NS(=O)(=O)CCCN1CCCC(C1)O 2230a_100000211013_100000750626 [0,1,0,0,0,0|3,0,0]=4 319 B14R1.147 NS(=O)(=O)CCCN1CCCC(C1)O 269982a_100000211013_100000750626 [0,1,0,0,0,0|3,0,0]=4 320 B14R1.147 NS(=O)(=O)CCNC1CCCC(C1)O 270004a_100000738205_100012613340 [0,1,0,0,0,0|1,0,0]=2 321 B14R1.147 O=C1CC(CCN1)NCCS(=O)(=O)[O-] 2230a_100016994916_100000737633 [0,1,0,0,0,0|1,0,2]=4 322 B14R1.147 O=C1CC(CCN1)NCCS(=O)(=O)[O-] 34a_100016994916_100000762736 [0,1,0,0,0,0|1,0,2]=4 323 B14R1.147 O=C1CCCC(C1)OCCS(=O)(=O)[O-] 34a_100012613340_100000762736 [0,1,0,0,0,0|1,0,2]=4 324 B14R1.147 O=S(=O)([O-])CCCN1CCCC(C1)F 269982a_100000697950_100009813499 [0,1,0,0,0,0|2,0,1]=4 325 B14R1.147 O=S(=O)([O-])CCCN1CCCC(C1)F 34a_100000697950_100009813499 [0,1,0,0,0,0|2,0,1]=4 326 B14R1.147 O=S(=O)([O-])CCCN1CCCC(C1)O 269982a_100000211013_100009813499 [0,1,0,0,0,0|2,0,1]=4 327 B14R1.147 O=S(=O)([O-])CCNC1CCCC(C1)O 2230a_100015190357_100000737633 [0,1,0,0,0,0|0,0,1]=2 328 B14R1.242 CC(C)(O)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000702414 [0,1,0,0,0,0|3,0,0]=4 329 B14R1.242 CC(C)(O)CCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000702414 [0,1,0,0,0,0|3,0,0]=4 330 B14R1.242 CC1CCCCC1NCCC(C)(C)O 2230a_100000211402_100000702414 [0,1,0,0,0,0|3,0,0]=4 331 B14R1.242 CC1CCCCC1NCCC(C)(C)O 269862a_100000707701_100000210921 [0,1,0,0,0,0|3,0,0]=4 332 B14R1.242 CC1CCCCC1NCCC(C)(C)O 270004a_100000707701_100000210921 [0,1,0,0,0,0|3,0,0]=4 333 B14R1.242 CC1CCCCC1NCCC(C)(C)O 34a_100000211402_100000702414 [0,1,0,0,0,0|3,0,0]=4 334 B14R1.242 CC1CCCCC1NCCS(=O)(=O)C 2230a_100000211402_100000731031 [0,1,0,0,0,0|1,0,0]=2 335 B14R1.242 CC1CCCCC1NCCS(=O)(=O)C 269862a_100000740961_100000210921 [0,1,0,0,0,0|1,0,0]=2 336 B14R1.242 CC1CCCCC1NCCS(=O)(=O)C 270004a_100000740961_100000210921 [0,1,0,0,0,0|1,0,0]=2 337 B14R1.242 CC1CCCCC1NCCS(=O)(=O)C 34a_100000211402_100000731031 [0,1,0,0,0,0|1,0,0]=2 338 B14R1.242 CC1CCCCC1NCCS(=O)(=O)N 269862a_100000738205_100000210921 [0,1,0,0,0,0|1,0,0]=2 339 B14R1.242 CC1CCCCC1NCCS(=O)(=O)N 270004a_100000738205_100000210921 [0,1,0,0,0,0|1,0,0]=2 340 B14R1.242 CC1CCCCC1NCCS(=O)(=O)[O-] 2230a_100000211402_100000737633 [0,1,0,0,0,0|0,0,1]=2 341 B14R1.242 CC1CCCCC1NCCS(=O)(=O)[O-] 34a_100000211402_100000762736 [0,1,0,0,0,0|0,0,1]=2 342 B14R1.242 CC1CCCCC1OCCS(=O)(=O)C 34a_100000211207_100000731031 [0,1,0,0,0,0|2,0,0]=3 343 B14R1.242 CC1CCCCC1OCCS(=O)(=O)C 7a_100000211207_100000230027 [0,1,0,0,0,0|2,0,0]=3 344 B14R1.242 CC1CCCCC1OCCS(=O)(=O)[O-] 34a_100000211207_100000762736 [0,1,0,0,0,0|1,0,1]=3 345 B14R1.242 CC1CCCCN1CCCS(=O)(=O)C 2230a_100000211376_100000754308 [0,1,0,0,0,0|3,0,0]=4 346 B14R1.242 CC1CCCCN1CCCS(=O)(=O)C 269982a_100000211376_100000754308 [0,1,0,0,0,0|3,0,0]=4 347 B14R1.242 CC1CCCCN1CCCS(=O)(=O)C 34a_100000211376_100000754308 [0,1,0,0,0,0|3,0,0]=4 348 B14R1.242 CC1CCCCN1CCCS(=O)(=O)N 2230a_100000211376_100000750626 [0,1,0,0,0,0|3,0,0]=4 349 B14R1.242 CC1CCCCN1CCCS(=O)(=O)N 269982a_100000211376_100000750626 [0,1,0,0,0,0|3,0,0]=4 350 B14R1.242 CC1CCCCN1CCCS(=O)(=O)N 34a_100000211376_100000750626 [0,1,0,0,0,0|3,0,0]=4 351 B14R1.242 CC1CCCCN1CCCS(=O)(=O)[O-] 269982a_100000211376_100009813499 [0,1,0,0,0,0|2,0,1]=4 352 B14R1.242 CC1CCCCN1CCCS(=O)(=O)[O-] 34a_100000211376_100009813499 [0,1,0,0,0,0|2,0,1]=4 353 B14R1.242 CC1CCNCC1OCCS(=O)(=O)C 34a_100000696640_100000731031 [0,1,0,0,0,0|3,0,0]=4 354 B14R1.242 CC1CCNCC1OCCS(=O)(=O)[O-] 34a_100000696640_100000762736 [0,1,0,0,0,0|2,0,1]=4 355 B14R1.242 CC1CNCCC1NCCS(=O)(=O)C 270004a_100000740961_100000703950 [0,1,0,0,0,0|2,0,0]=3 356 B14R1.242 CC1CNCCC1NCCS(=O)(=O)N 270004a_100000738205_100000703950 [0,1,0,0,0,0|2,0,0]=3 357 B14R1.242 CC1CNCCC1OCCS(=O)(=O)C 34a_100011998114_100000731031 [0,1,0,0,0,0|3,0,0]=4 358 B14R1.242 CC1CNCCC1OCCS(=O)(=O)[O-] 34a_100011998114_100000762736 [0,1,0,0,0,0|2,0,1]=4 359 B14R1.242 CC1COCCC1NCCS(=O)(=O)C 270004a_100000740961_100000755695 [0,1,0,0,0,0|2,0,0]=3 360 B14R1.242 CC1COCCC1NCCS(=O)(=O)N 270004a_100000738205_100000755695 [0,1,0,0,0,0|2,0,0]=3 361 B14R1.242 CS(=O)(=O)CCNC1CCCCC1=O 34a_100000740961_100000754470 [0,1,0,0,0,0|1,0,1]=3 362 B14R1.242 CS(=O)(=O)CCNC1CCCCC1F 34a_100000740961_100015423560 [0,1,0,0,0,0|1,0,0]=2 363 B14R1.242 CS(=O)(=O)CCNC1CCCCC1O 34a_100000740961_100000038908 [0,1,0,0,0,0|1,0,0]=2 364 B14R1.242 CS(=O)(=O)CCNC1CCCNC1=O 2230a_100000740961_100000687798 [0,1,0,0,0,0|2,0,1]=4 365 B14R1.242 CS(=O)(=O)CCNC1CCCNC1=O 2230a_100000747585_100000731031 [0,1,0,0,0,0|2,0,1]=4 366 B14R1.242 CS(=O)(=O)CCNC1CCCNC1=O 34a_100000740961_100000687798 [0,1,0,0,0,0|2,0,1]=4 367 B14R1.242 CS(=O)(=O)CCNC1CCCNC1=O 34a_100000747585_100000731031 [0,1,0,0,0,0|2,0,1]=4 368 B14R1.242 CS(=O)(=O)CCNC1COCCC1=O 34a_100000740961_100012180262 [0,1,0,0,0,0|2,0,1]=4 369 B14R1.242 CS(=O)(=O)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000731031 [0,1,0,0,0,0|1,0,0]=2 370 B14R1.242 CS(=O)(=O)CCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000731031 [0,1,0,0,0,0|1,0,0]=2 371 B14R1.242 CS(=O)(=O)CCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000731031 [0,1,0,0,0,0|2,0,0]=3 372 B14R1.242 CS(=O)(=O)CCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000731031 [0,1,0,0,0,0|2,0,0]=3 373 B14R1.242 CS(=O)(=O)CCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000731031 [0,1,0,0,0,0|2,0,0]=3 374 B14R1.242 CS(=O)(=O)CCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000731031 [0,1,0,0,0,0|2,0,0]=3 375 B14R1.242 CS(=O)(=O)CCOC1CCCCC1=O 34a_100000211924_100000754470 [0,1,0,0,0,0|2,0,1]=4 376 B14R1.242 CS(=O)(=O)CCOC1CCCCC1=O 34a_100011214950_100000731031 [0,1,0,0,0,0|2,0,1]=4 377 B14R1.242 CS(=O)(=O)CCOC1CCCCC1=O 7a_100000211924_100000204591 [0,1,0,0,0,0|2,0,1]=4 378 B14R1.242 CS(=O)(=O)CCOC1CCCCC1Cl 34a_100000038908_100000731031 [0,1,0,0,0,0|2,0,0]=3 379 B14R1.242 CS(=O)(=O)CCOC1CCCCC1Cl 7a_100000038908_100000230027 [0,1,0,0,0,0|2,0,0]=3 380 B14R1.242 CS(=O)(=O)CCOC1CCCCC1F 34a_100000211924_100015423560 [0,1,0,0,0,0|2,0,0]=3 381 B14R1.242 CS(=O)(=O)CCOC1CCCCC1O 34a_100000211924_100000038908 [0,1,0,0,0,0|2,0,0]=3 382 B14R1.242 CS(=O)(=O)CCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000731031 [0,1,0,0,0,0|2,0,0]=3 383 B14R1.242 CS(=O)(=O)CCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000230027 [0,1,0,0,0,0|2,0,0]=3 384 B14R1.242 CS(=O)(=O)CCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100000731031 [0,1,0,0,0,0|3,0,0]=4 385 B14R1.242 CS(=O)(=O)CCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000731031 [0,1,0,0,0,0|2,0,0]=3 386 B14R1.242 CS(=O)(=O)CCO[C@H]1CCOC[C@@H]1N 34a_100015739063_100000731031 [0,1,0,0,0,0|3,0,0]=4 387 B14R1.242 CS(=O)(=O)CCO[C@H]1COCC[C@H]1N 34a_100016994285_100000731031 [0,1,0,0,0,0|3,0,0]=4 388 B14R1.242 CS(=O)(=O)CCSC1CCCCC1=O 62a_100000204591_100000230027 [0,1,0,0,0,0|2,0,1]=4 389 B14R1.242 CS(=O)(=O)CCSC1CCCCC1=O 62a_100000731031_100000204591 [0,1,0,0,0,0|2,0,1]=4 390 B14R1.242 CS(=O)(=O)CCSC1CCCCC1F 62a_100000731031_100015423560 [0,1,0,0,0,0|2,0,0]=3 391 B14R1.242 CS(=O)(=O)CCSC1CCCCC1F 62a_100015423560_100000230027 [0,1,0,0,0,0|2,0,0]=3 392 B14R1.242 CS(=O)(=O)CCSC1CCCCC1O 62a_100000038908_100000230027 [0,1,0,0,0,0|2,0,0]=3 393 B14R1.242 CS(=O)(=O)CCSC1CCCCC1O 62a_100000731031_100000038908 [0,1,0,0,0,0|2,0,0]=3 394 B14R1.242 NS(=O)(=O)CCNC1CCCCC1=O 34a_100000738205_100000754470 [0,1,0,0,0,0|1,0,1]=3 395 B14R1.242 NS(=O)(=O)CCNC1CCCCC1F 34a_100000738205_100015423560 [0,1,0,0,0,0|1,0,0]=2 396 B14R1.242 NS(=O)(=O)CCNC1CCCCC1O 34a_100000738205_100000038908 [0,1,0,0,0,0|1,0,0]=2 397 B14R1.242 NS(=O)(=O)CCNC1CCCNC1=O 2230a_100000738205_100000687798 [0,1,0,0,0,0|2,0,1]=4 398 B14R1.242 NS(=O)(=O)CCNC1CCCNC1=O 34a_100000738205_100000687798 [0,1,0,0,0,0|2,0,1]=4 399 B14R1.242 NS(=O)(=O)CCNC1COCCC1=O 34a_100000738205_100012180262 [0,1,0,0,0,0|2,0,1]=4 400 B14R1.242 NS(=O)(=O)CCOC1CCCCC1=O 34a_100012334274_100000754470 [0,1,0,0,0,0|2,0,1]=4 401 B14R1.242 NS(=O)(=O)CCOC1CCCCC1F 34a_100012334274_100015423560 [0,1,0,0,0,0|2,0,0]=3 402 B14R1.242 NS(=O)(=O)CCOC1CCCCC1O 34a_100012334274_100000038908 [0,1,0,0,0,0|2,0,0]=3 403 B14R1.242 N[C@@H]1CCCC[C@@H]1OCCS(=O)(=O)[O-] 34a_100015191688_100000762736 [0,1,0,0,0,0|1,0,1]=3 404 B14R1.242 N[C@@H]1CCOC[C@@H]1OCCS(=O)(=O)[O-] 34a_100016994285_100000762736 [0,1,0,0,0,0|2,0,1]=4 405 B14R1.242 N[C@H]1COCC[C@@H]1OCCS(=O)(=O)[O-] 34a_100015739063_100000762736 [0,1,0,0,0,0|2,0,1]=4 406 B14R1.242 O=C1CCCCC1OCCS(=O)(=O)[O-] 34a_100011214950_100000762736 [0,1,0,0,0,0|1,0,2]=4 407 B14R1.242 O=C1CCCCC1SCCS(=O)(=O)[O-] 62a_100000204591_100000762736 [0,1,0,0,0,0|1,0,2]=4 408 B14R1.242 O=C1CCCCC1SCCS(=O)(=O)[O-] 62a_100000762736_100000204591 [0,1,0,0,0,0|1,0,2]=4 409 B14R1.242 O=C1NCCCC1NCCS(=O)(=O)[O-] 2230a_100000747585_100000737633 [0,1,0,0,0,0|1,0,2]=4 410 B14R1.242 O=C1NCCCC1NCCS(=O)(=O)[O-] 34a_100000747585_100000762736 [0,1,0,0,0,0|1,0,2]=4 411 B14R1.242 O=S(=O)([O-])CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000737633 [0,1,0,0,0,0|0,0,1]=2 412 B14R1.242 O=S(=O)([O-])CCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000762736 [0,1,0,0,0,0|0,0,1]=2 413 B14R1.242 O=S(=O)([O-])CCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000737633 [0,1,0,0,0,0|1,0,1]=3 414 B14R1.242 O=S(=O)([O-])CCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000737633 [0,1,0,0,0,0|1,0,1]=3 415 B14R1.242 O=S(=O)([O-])CCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000762736 [0,1,0,0,0,0|1,0,1]=3 416 B14R1.242 O=S(=O)([O-])CCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000737633 [0,1,0,0,0,0|1,0,1]=3 417 B14R1.242 O=S(=O)([O-])CCOC1CCCCC1Cl 34a_100000038908_100000762736 [0,1,0,0,0,0|1,0,1]=3 418 B14R1.242 O=S(=O)([O-])CCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000762736 [0,1,0,0,0,0|1,0,1]=3 419 B14R1.242 O=S(=O)([O-])CCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100000762736 [0,1,0,0,0,0|2,0,1]=4 420 B14R1.242 O=S(=O)([O-])CCSC1CCCCC1F 62a_100000762736_100015423560 [0,1,0,0,0,0|1,0,1]=3 421 B14R1.242 O=S(=O)([O-])CCSC1CCCCC1F 62a_100015423560_100000762736 [0,1,0,0,0,0|1,0,1]=3 422 B14R1.242 O=S(=O)([O-])CCSC1CCCCC1O 62a_100000038908_100000762736 [0,1,0,0,0,0|1,0,1]=3 423 B14R1.242 O=S(=O)([O-])CCSC1CCCCC1O 62a_100000762736_100000038908 [0,1,0,0,0,0|1,0,1]=3 424 B14R1.242 O=S(=O)([O-])CNCC1CCCCC1O 34a_100011216029_100009817235 [0,1,0,0,0,0|2,0,1]=4 425 B14R1.292 CCS(=O)(=O)CCNC1C=CCCC1 2230a_100000751051_100000751183 [0,1,0,0,0,0|1,0,2]=4 426 B14R1.292 CCS(=O)(=O)CCNC1CCCCC1 2230a_100000182618_100000756660 [0,1,0,0,0,0|1,0,0]=2 427 B14R1.292 CCS(=O)(=O)CCNC1CCCCC1 270004a_100000751051_100000210434 [0,1,0,0,0,0|1,0,0]=2 428 B14R1.292 CCS(=O)(=O)CCNC1CCCCC1 34a_100000182618_100000756660 [0,1,0,0,0,0|1,0,0]=2 429 B14R1.292 CCS(=O)(=O)CCNC1CCCCC1 34a_100000751051_100000210327 [0,1,0,0,0,0|1,0,0]=2 430 B14R1.292 CCS(=O)(=O)CCNC1CCCOC1 2230a_100000719290_100000756660 [0,1,0,0,0,0|2,0,0]=3 431 B14R1.292 CCS(=O)(=O)CCNC1CCCOC1 270004a_100000751051_100000753404 [0,1,0,0,0,0|2,0,0]=3 432 B14R1.292 CCS(=O)(=O)CCNC1CCCOC1 34a_100000719290_100000756660 [0,1,0,0,0,0|2,0,0]=3 433 B14R1.292 CCS(=O)(=O)CCNC1CCCOC1 34a_100000751051_100000693364 [0,1,0,0,0,0|2,0,0]=3 434 B14R1.292 CCS(=O)(=O)CCNC1CCCSC1 270004a_100000751051_100000057913 [0,1,0,0,0,0|2,0,0]=3 435 B14R1.292 CCS(=O)(=O)CCNC1CCNCC1 270004a_100000751051_100015192401 [0,1,0,0,0,0|2,0,0]=3 436 B14R1.292 CCS(=O)(=O)CCNC1CCOCC1 2230a_100000741149_100000756660 [0,1,0,0,0,0|2,0,0]=3 437 B14R1.292 CCS(=O)(=O)CCNC1CCOCC1 270004a_100000751051_100011217826 [0,1,0,0,0,0|2,0,0]=3 438 B14R1.292 CCS(=O)(=O)CCNC1CCOCC1 34a_100000741149_100000756660 [0,1,0,0,0,0|2,0,0]=3 439 B14R1.292 CCS(=O)(=O)CCNC1CCSCC1 2230a_100000748639_100000756660 [0,1,0,0,0,0|2,0,0]=3 440 B14R1.292 CCS(=O)(=O)CCNC1CCSCC1 270004a_100000751051_100000203788 [0,1,0,0,0,0|2,0,0]=3 441 B14R1.292 CCS(=O)(=O)CCNC1CCSCC1 34a_100000748639_100000756660 [0,1,0,0,0,0|2,0,0]=3 442 B14R1.292 CCS(=O)(=O)CCNC1CCSCC1 34a_100000751051_100000069128 [0,1,0,0,0,0|2,0,0]=3 443 B14R1.292 CCS(=O)(=O)CCOC1CCCCC1 34a_100000210231_100000756660 [0,1,0,0,0,0|2,0,0]=3 444 B14R1.292 CCS(=O)(=O)CCOC1CCCCC1 34a_200011216379_100000210327 [0,1,0,0,0,0|2,0,0]=3 445 B14R1.292 CCS(=O)(=O)CCOC1CCCCC1 7a_100000210231_100000756660 [0,1,0,0,0,0|2,0,0]=3 446 B14R1.292 CCS(=O)(=O)CCOC1CCCCC1 7a_200011216379_100000210327 [0,1,0,0,0,0|2,0,0]=3 447 B14R1.292 CCS(=O)(=O)CCOC1CCCCO1 34a_100000033831_100000756660 [0,1,0,0,0,0|3,0,0]=4 448 B14R1.292 CCS(=O)(=O)CCOC1CCCOC1 34a_100000754041_100000756660 [0,1,0,0,0,0|3,0,0]=4 449 B14R1.292 CCS(=O)(=O)CCOC1CCCOC1 34a_200011216379_100000693364 [0,1,0,0,0,0|3,0,0]=4 450 B14R1.292 CCS(=O)(=O)CCOC1CCCOC1 7a_200011216379_100000693364 [0,1,0,0,0,0|3,0,0]=4 451 B14R1.292 CCS(=O)(=O)CCOC1CCCSC1 7a_100015962668_100000756660 [0,1,0,0,0,0|3,0,0]=4 452 B14R1.292 CCS(=O)(=O)CCOC1CCOCC1 34a_100000744328_100000756660 [0,1,0,0,0,0|3,0,0]=4 453 B14R1.292 CCS(=O)(=O)CCOC1CCOCC1 7a_200011216379_100000686592 [0,1,0,0,0,0|3,0,0]=4 454 B14R1.292 CCS(=O)(=O)CCOC1CCSCC1 34a_100000731022_100000756660 [0,1,0,0,0,0|3,0,0]=4 455 B14R1.292 CCS(=O)(=O)CCOC1CCSCC1 34a_200011216379_100000069128 [0,1,0,0,0,0|3,0,0]=4 456 B14R1.292 CCS(=O)(=O)CCOC1CCSCC1 7a_100000731022_100000756660 [0,1,0,0,0,0|3,0,0]=4 457 B14R1.292 CCS(=O)(=O)CCOC1CCSCC1 7a_200011216379_100011500858 [0,1,0,0,0,0|3,0,0]=4 458 B14R1.292 CCS(=O)(=O)CCSC1CCCCC1 62a_100000210327_100000756660 [0,1,0,0,0,0|2,0,0]=3 459 B14R1.292 CCS(=O)(=O)CCSC1CCCCC1 62a_100000756660_100000210327 [0,1,0,0,0,0|2,0,0]=3 460 B14R1.292 CCS(=O)(=O)CCSC1CCCOC1 62a_100000756660_100000693364 [0,1,0,0,0,0|3,0,0]=4 461 B14R1.292 CCS(=O)(=O)CCSC1CCOCC1 62a_100000756660_100011324220 [0,1,0,0,0,0|3,0,0]=4 462 B14R1.292 CCS(=O)(=O)CCSC1CCSCC1 62a_100000756660_100000069128 [0,1,0,0,0,0|3,0,0]=4 463 B14R1.292 CCS(=O)(=O)NCCC1CCCCC1 270084a_100000738074_100000211323 [0,1,0,0,0,0|3,0,0]=4 464 B14R1.292 CCS(=O)(=O)NCCC1CCCCC1 274078a_100000738074_100000211323 [0,1,0,0,0,0|3,0,0]=4 465 B14R1.292 CCS(=O)(=O)NCCC1CCCCC1 40a_100000738074_100000053943 [0,1,0,0,0,0|3,0,0]=4 466 B14R1.292 CNS(=O)(=O)CCNC1C=CCCC1 2230a_100000710037_100000751183 [0,1,0,0,0,0|1,0,2]=4 467 B14R1.292 CNS(=O)(=O)CCNC1CCCCC1 270004a_100000710037_100000210434 [0,1,0,0,0,0|1,0,0]=2 468 B14R1.292 CNS(=O)(=O)CCNC1CCCCC1 34a_100000710037_100000210327 [0,1,0,0,0,0|1,0,0]=2 469 B14R1.292 CNS(=O)(=O)CCNC1CCCOC1 270004a_100000710037_100000753404 [0,1,0,0,0,0|2,0,0]=3 470 B14R1.292 CNS(=O)(=O)CCNC1CCCOC1 34a_100000710037_100000693364 [0,1,0,0,0,0|2,0,0]=3 471 B14R1.292 CNS(=O)(=O)CCNC1CCCSC1 270004a_100000710037_100000057913 [0,1,0,0,0,0|2,0,0]=3 472 B14R1.292 CNS(=O)(=O)CCNC1CCNCC1 270004a_100000710037_100015192401 [0,1,0,0,0,0|2,0,0]=3 473 B14R1.292 CNS(=O)(=O)CCNC1CCOCC1 270004a_100000710037_100011217826 [0,1,0,0,0,0|2,0,0]=3 474 B14R1.292 CNS(=O)(=O)CCNC1CCSCC1 270004a_100000710037_100000203788 [0,1,0,0,0,0|2,0,0]=3 475 B14R1.292 CNS(=O)(=O)CCNC1CCSCC1 34a_100000710037_100000069128 [0,1,0,0,0,0|2,0,0]=3 476 B14R1.292 O=S(=O)(CCl)NCCC1CCCCC1 270084a_100000738074_100000031410 [0,1,0,0,0,0|3,0,0]=4 477 B14R1.292 O=S(=O)(CCl)NCCC1CCCCC1 274078a_100000738074_100000031410 [0,1,0,0,0,0|3,0,0]=4 478 B14R1.433 CN(CC1CCCCC1)CS(=O)(=O)[O-] 34a_100000736448_100009817235 [0,1,0,0,0,0|2,0,1]=4 479 B14R1.433 CS(=O)(=O)CC(=O)CC1CCCCC1 1458a_100000744497_100000211423 [0,1,0,0,0,0|2,0,1]=4 480 B14R1.433 CS(=O)(=O)CC(=O)NC1CCCCC1 11a_100000182618_100000744497 [0,1,0,0,0,0|1,0,1]=3 481 B14R1.433 CS(=O)(=O)CC(=O)NC1CCCCC1 240690a_100000182618_100000744497 [0,1,0,0,0,0|1,0,1]=3 482 B14R1.433 CS(=O)(=O)CC(=O)NC1CCCCC1 527a_100000182618_100000744497 [0,1,0,0,0,0|1,0,1]=3 483 B14R1.433 CS(=O)(=O)CC(=O)NC1CCCOC1 11a_100000719290_100000744497 [0,1,0,0,0,0|2,0,1]=4 484 B14R1.433 CS(=O)(=O)CC(=O)NC1CCCOC1 240690a_100000719290_100000744497 [0,1,0,0,0,0|2,0,1]=4 485 B14R1.433 CS(=O)(=O)CC(=O)NC1CCCOC1 527a_100000719290_100000744497 [0,1,0,0,0,0|2,0,1]=4 486 B14R1.433 CS(=O)(=O)CC(=O)NC1CCOCC1 11a_100000741149_100000744497 [0,1,0,0,0,0|2,0,1]=4 487 B14R1.433 CS(=O)(=O)CC(=O)NC1CCOCC1 240690a_100000741149_100000744497 [0,1,0,0,0,0|2,0,1]=4 488 B14R1.433 CS(=O)(=O)CC(=O)NC1CCOCC1 527a_100000741149_100000744497 [0,1,0,0,0,0|2,0,1]=4 489 B14R1.433 CS(=O)(=O)CC(=O)NC1CCSCC1 11a_100000748639_100000744497 [0,1,0,0,0,0|2,0,1]=4 490 B14R1.433 CS(=O)(=O)CC(=O)NC1CCSCC1 240690a_100000748639_100000744497 [0,1,0,0,0,0|2,0,1]=4 491 B14R1.433 CS(=O)(=O)CC(=O)NC1CCSCC1 527a_100000748639_100000744497 [0,1,0,0,0,0|2,0,1]=4 492 B14R1.433 NS(=O)(=O)CC(=O)CC1CCCCC1 1458a_100000211666_100000741382 [0,1,0,0,0,0|2,0,1]=4 493 B14R1.433 O=C(CC1CCCCC1)CS(=O)(=O)[O-] 1458a_100000211666_100009817235 [0,1,0,0,0,0|1,0,2]=4 494 B14R1.3098 CC(OCS(=O)(=O)[O-])C1CCCCC1 34a_100011216961_100009817235 [0,1,0,0,0,0|2,0,1]=4 495 B14R1.3098 CN(CCC(C)(C)O)C1CCCCC1 2230a_100000207522_100000702414 [0,1,0,0,0,0|3,0,0]=4 496 B14R1.3098 CN(CCC(C)(C)O)C1CCCCC1 34a_100000207522_100000702414 [0,1,0,0,0,0|3,0,0]=4 497 B14R1.3098 CN(CCS(=O)(=O)C)C1C=CCCC1 2230a_100000750128_100000751183 [0,1,0,0,0,0|1,0,2]=4 498 B14R1.3098 CN(CCS(=O)(=O)C)C1C=CCCC1 269982a_100000750128_100000751183 [0,1,0,0,0,0|1,0,2]=4 499 B14R1.3098 CN(CCS(=O)(=O)C)C1CCCCC1 2230a_100000207522_100000731031 [0,1,0,0,0,0|1,0,0]=2 500 B14R1.3098 CN(CCS(=O)(=O)C)C1CCCCC1 269982a_100000207522_100000731031 [0,1,0,0,0,0|1,0,0]=2 501 B14R1.3098 CN(CCS(=O)(=O)C)C1CCCCC1 269982a_100000750128_100000210327 [0,1,0,0,0,0|1,0,0]=2 502 B14R1.3098 CN(CCS(=O)(=O)C)C1CCCCC1 270004a_100000750128_100000210434 [0,1,0,0,0,0|1,0,0]=2 503 B14R1.3098 CN(CCS(=O)(=O)C)C1CCCCC1 34a_100000207522_100000731031 [0,1,0,0,0,0|1,0,0]=2 504 B14R1.3098 CN(CCS(=O)(=O)C)C1CCCCC1 34a_100000750128_100000210327 [0,1,0,0,0,0|1,0,0]=2 505 B14R1.3098 CN(CCS(=O)(=O)C)C1CCCOC1 269982a_100000750128_100000693364 [0,1,0,0,0,0|2,0,0]=3 506 B14R1.3098 CN(CCS(=O)(=O)C)C1CCCOC1 270004a_100000750128_100000753404 [0,1,0,0,0,0|2,0,0]=3 507 B14R1.3098 CN(CCS(=O)(=O)C)C1CCCOC1 34a_100000750128_100000693364 [0,1,0,0,0,0|2,0,0]=3 508 B14R1.3098 CN(CCS(=O)(=O)C)C1CCCSC1 270004a_100000750128_100000057913 [0,1,0,0,0,0|2,0,0]=3 509 B14R1.3098 CN(CCS(=O)(=O)C)C1CCNCC1 270004a_100000750128_100015192401 [0,1,0,0,0,0|2,0,0]=3 510 B14R1.3098 CN(CCS(=O)(=O)C)C1CCOCC1 2230a_100020587155_100000731031 [0,1,0,0,0,0|2,0,0]=3 511 B14R1.3098 CN(CCS(=O)(=O)C)C1CCOCC1 269982a_100000750128_100011324220 [0,1,0,0,0,0|2,0,0]=3 512 B14R1.3098 CN(CCS(=O)(=O)C)C1CCOCC1 269982a_100020587155_100000731031 [0,1,0,0,0,0|2,0,0]=3 513 B14R1.3098 CN(CCS(=O)(=O)C)C1CCOCC1 270004a_100000750128_100011217826 [0,1,0,0,0,0|2,0,0]=3 514 B14R1.3098 CN(CCS(=O)(=O)C)C1CCOCC1 34a_100020587155_100000731031 [0,1,0,0,0,0|2,0,0]=3 515 B14R1.3098 CN(CCS(=O)(=O)C)C1CCSCC1 2230a_100015184757_100000731031 [0,1,0,0,0,0|2,0,0]=3 516 B14R1.3098 CN(CCS(=O)(=O)C)C1CCSCC1 269982a_100000750128_100000069128 [0,1,0,0,0,0|2,0,0]=3 517 B14R1.3098 CN(CCS(=O)(=O)C)C1CCSCC1 269982a_100015184757_100000731031 [0,1,0,0,0,0|2,0,0]=3 518 B14R1.3098 CN(CCS(=O)(=O)C)C1CCSCC1 270004a_100000750128_100000203788 [0,1,0,0,0,0|2,0,0]=3 519 B14R1.3098 CN(CCS(=O)(=O)C)C1CCSCC1 34a_100000750128_100000069128 [0,1,0,0,0,0|2,0,0]=3 520 B14R1.3098 CN(CCS(=O)(=O)C)C1CCSCC1 34a_100015184757_100000731031 [0,1,0,0,0,0|2,0,0]=3 521 B14R1.3098 CN(CCS(=O)(=O)[O-])C1CCCCC1 2230a_100000207522_100000737633 [0,1,0,0,0,0|0,0,1]=2 522 B14R1.3098 CN(CCS(=O)(=O)[O-])C1CCCCC1 34a_100000207522_100000762736 [0,1,0,0,0,0|0,0,1]=2 523 B14R1.3098 CN(CCS(=O)(=O)[O-])C1CCOCC1 2230a_100020587155_100000737633 [0,1,0,0,0,0|1,0,1]=3 524 B14R1.3098 CN(CCS(=O)(=O)[O-])C1CCOCC1 34a_100020587155_100000762736 [0,1,0,0,0,0|1,0,1]=3 525 B14R1.3098 CN(CCS(=O)(=O)[O-])C1CCSCC1 2230a_100015184757_100000737633 [0,1,0,0,0,0|1,0,1]=3 526 B14R1.3098 CN(CCS(=O)(=O)[O-])C1CCSCC1 34a_100015184757_100000762736 [0,1,0,0,0,0|1,0,1]=3 527 B14R1.3098 CS(=O)(=O)CCC(=O)C1CCCCC1 1458a_100000210647_100000731031 [0,1,0,0,0,0|2,0,0]=3 528 B14R1.3098 CS(=O)(=O)CCC(=O)C1CCCCC1 1458a_100000737124_100000210327 [0,1,0,0,0,0|2,0,0]=3 529 B14R1.3098 CS(=O)(=O)CCC(=O)C1CCCCO1 1458a_100000748299_100000731031 [0,1,0,0,0,0|3,0,0]=4 530 B14R1.3098 CS(=O)(=O)CCC(=O)C1CCCOC1 1458a_100000737124_100000693364 [0,1,0,0,0,0|3,0,0]=4 531 B14R1.3098 CS(=O)(=O)CCC(=O)C1CCCOC1 1458a_100000741522_100000731031 [0,1,0,0,0,0|3,0,0]=4 532 B14R1.3098 CS(=O)(=O)CCC(=O)C1CCOCC1 1458a_100000195482_100000731031 [0,1,0,0,0,0|3,0,0]=4 533 B14R1.3098 CS(=O)(=O)CCC(=O)C1CCOCC1 1458a_100000737124_100011324220 [0,1,0,0,0,0|3,0,0]=4 534 B14R1.3098 CS(=O)(=O)CCC(=O)C1CCSCC1 1458a_100000755232_100000731031 [0,1,0,0,0,0|3,0,0]=4 535 B14R1.3098 CS(=O)(=O)NCC(=O)C1CCCCC1 1458a_100000737300_100000210327 [0,1,0,0,0,0|3,0,0]=4 536 B14R1.3098 C[C@@H](NCS(=O)(=O)[O-])C1CCCCC1 34a_100025707633_100009817235 [0,1,0,0,0,0|2,0,1]=4 537 B14R1.3098 NS(=O)(=O)CCC(=O)C1CCCCC1 1458a_100000737202_100000210327 [0,1,0,0,0,0|2,0,0]=3 538 B14R1.3098 NS(=O)(=O)CCC(=O)C1CCCOC1 1458a_100000737202_100000693364 [0,1,0,0,0,0|3,0,0]=4 539 B14R1.3098 NS(=O)(=O)CCC(=O)C1CCOCC1 1458a_100000737202_100011324220 [0,1,0,0,0,0|3,0,0]=4 540 B14R1.3098 O=C(CCS(=O)(=O)[O-])C1CCCCC1 1458a_100000210647_100000762736 [0,1,0,0,0,0|1,0,1]=3 541 B14R1.3098 O=C(CCS(=O)(=O)[O-])C1CCCCO1 1458a_100000748299_100000762736 [0,1,0,0,0,0|2,0,1]=4 542 B14R1.3098 O=C(CCS(=O)(=O)[O-])C1CCCOC1 1458a_100000741522_100000762736 [0,1,0,0,0,0|2,0,1]=4 543 B14R1.3098 O=C(CCS(=O)(=O)[O-])C1CCOCC1 1458a_100000195482_100000762736 [0,1,0,0,0,0|2,0,1]=4 544 B14R1.3098 O=C(CCS(=O)(=O)[O-])C1CCSCC1 1458a_100000755232_100000762736 [0,1,0,0,0,0|2,0,1]=4 545 B14R1.3099 CC(C)(O)[C@H](F)CNC1CCCCC1 270004a_100015379105_100000210434 [0,1,0,0,0,0|3,0,0]=4 546 B14R1.3099 O=S(=O)([O-])C(O)CSC1CCCCC1 62a_100000210327_200000035551 [0,1,0,0,0,0|1,0,1]=3 547 B14R1.3099 O=S(=O)([O-])C(O)CSC1CCCCC1 62a_200000035551_100000210327 [0,1,0,0,0,0|1,0,1]=3 548 B14R1.3099 O=S(=O)([O-])C(O)CSC1CCCOC1 62a_200000035551_100000693364 [0,1,0,0,0,0|2,0,1]=4 549 B14R1.3099 O=S(=O)([O-])C(O)CSC1CCOCC1 62a_200000035551_100011324220 [0,1,0,0,0,0|2,0,1]=4 550 B14R1.3099 O=S(=O)([O-])C(O)CSC1CCSCC1 62a_200000035551_100000069128 [0,1,0,0,0,0|2,0,1]=4 551 B14R1.14071 CC(C)(O)CCNC1(CCCCC1)C 2230a_100000741114_100000702414 [0,1,0,0,0,0|3,0,0]=4 552 B14R1.14071 CC(C)(O)CCNC1(CCCCC1)C 34a_100000741114_100000702414 [0,1,0,0,0,0|3,0,0]=4 553 B14R1.14071 CC1(CCCCC1)CNCS(=O)(=O)[O-] 34a_100000706052_100009817235 [0,1,0,0,0,0|2,0,1]=4 554 B14R1.14071 CC1(CCCCC1)COCS(=O)(=O)[O-] 34a_100000688186_100009817235 [0,1,0,0,0,0|2,0,1]=4 555 B14R1.14071 CC1(CCCCC1)NCCS(=O)(=O)C 2230a_100000741114_100000731031 [0,1,0,0,0,0|1,0,0]=2 556 B14R1.14071 CC1(CCCCC1)NCCS(=O)(=O)C 34a_100000741114_100000731031 [0,1,0,0,0,0|1,0,0]=2 557 B14R1.14071 CC1(CCCCC1)NCCS(=O)(=O)[O-] 2230a_100000741114_100000737633 [0,1,0,0,0,0|0,0,1]=2 558 B14R1.14071 CC1(CCCCC1)NCCS(=O)(=O)[O-] 34a_100000741114_100000762736 [0,1,0,0,0,0|0,0,1]=2 559 B14R1.14071 CC1(CCCCC1)OCCS(=O)(=O)C 34a_100011215885_100000731031 [0,1,0,0,0,0|2,0,0]=3 560 B14R1.14071 CC1(CCCCC1)OCCS(=O)(=O)C 7a_100011215885_100000230027 [0,1,0,0,0,0|2,0,0]=3 561 B14R1.14071 CC1(CCCCC1)OCCS(=O)(=O)[O-] 34a_100011215885_100000762736 [0,1,0,0,0,0|1,0,1]=3 562 B14R1.14071 CC1(CCOCC1)NCCS(=O)(=O)C 2230a_100000692449_100000731031 [0,1,0,0,0,0|2,0,0]=3 563 B14R1.14071 CC1(CCOCC1)NCCS(=O)(=O)C 34a_100000692449_100000731031 [0,1,0,0,0,0|2,0,0]=3 564 B14R1.14071 CC1(CCOCC1)NCCS(=O)(=O)[O-] 2230a_100000692449_100000737633 [0,1,0,0,0,0|1,0,1]=3 565 B14R1.14071 CC1(CCOCC1)NCCS(=O)(=O)[O-] 34a_100000692449_100000762736 [0,1,0,0,0,0|1,0,1]=3 566 B14R1.14071 CC1(CCOCC1)OCCS(=O)(=O)C 34a_100011827762_100000731031 [0,1,0,0,0,0|3,0,0]=4 567 B14R1.14071 CC1(CCOCC1)OCCS(=O)(=O)C 7a_100011827762_100000230027 [0,1,0,0,0,0|3,0,0]=4 568 B14R1.14071 CC1(CCOCC1)OCCS(=O)(=O)[O-] 34a_100011827762_100000762736 [0,1,0,0,0,0|2,0,1]=4 569 B14R1.14071 CC1(CCSCC1)OCCS(=O)(=O)C 34a_200011004327_100000731031 [0,1,0,0,0,0|3,0,0]=4 570 B14R1.14071 CC1(CCSCC1)OCCS(=O)(=O)C 7a_200011004327_100000230027 [0,1,0,0,0,0|3,0,0]=4 571 B14R1.14071 CC1(CCSCC1)OCCS(=O)(=O)[O-] 34a_200011004327_100000762736 [0,1,0,0,0,0|2,0,1]=4 572 B14R1.14071 CS(=O)(=O)NCCC1(CCCCC1)O 40a_100102740465_100000738038 [0,1,0,0,0,0|3,0,0]=4 573 B14R1.14071 NC1(CCCCC1)COCS(=O)(=O)[O-] 34a_100000740034_100009817235 [0,1,0,0,0,0|2,0,1]=4 574 B14R1.14071 O=S(=O)([O-])CNCC1(CCCCC1)O 34a_100000748649_100009817235 [0,1,0,0,0,0|2,0,1]=4 575 B14R1.14071 O=S(=O)([O-])COCC1(CCCCC1)F 34a_100000090305_100009817235 [0,1,0,0,0,0|2,0,1]=4 576 B12R0.104 C=CCCC(C)NCCS(=O)(=O)C 270004a_100000740961_100000762624 [0,0,1,0,0,0|1,0,2]=4 577 B12R0.104 C=CCCC(C)NCCS(=O)(=O)N 270004a_100000738205_100000762624 [0,0,1,0,0,0|1,0,2]=4 578 B12R0.104 CC(CCCCl)OCCS(=O)(=O)C 34a_200000718107_100000731031 [0,0,1,0,0,0|3,0,0]=4 579 B12R0.104 CC(CCCCl)OCCS(=O)(=O)C 7a_200000718107_100000230027 [0,0,1,0,0,0|3,0,0]=4 580 B12R0.104 CC(CCCCl)OCCS(=O)(=O)[O-] 34a_200000718107_100000762736 [0,0,1,0,0,0|2,0,1]=4 581 B12R0.104 CCCCC(=O)NCCS(=O)(=O)C 11a_100000740961_100000210183 [0,0,1,0,0,0|2,0,1]=4 582 B12R0.104 CCCCC(=O)NCCS(=O)(=O)C 1626a_100000740961_100000210183 [0,0,1,0,0,0|2,0,1]=4 583 B12R0.104 CCCCC(=O)NCCS(=O)(=O)C 240690a_100000740961_100000210183 [0,0,1,0,0,0|2,0,1]=4 584 B12R0.104 CCCCC(=O)NCCS(=O)(=O)C 527a_100000740961_100000210183 [0,0,1,0,0,0|2,0,1]=4 585 B12R0.104 CCCCC(=O)NCCS(=O)(=O)N 240690a_100000738205_100000210183 [0,0,1,0,0,0|2,0,1]=4 586 B12R0.104 CCCCC(=O)NCCS(=O)(=O)N 527a_100000738205_100000210183 [0,0,1,0,0,0|2,0,1]=4 587 B12R0.104 CCCCC(C)COCS(=O)(=O)[O-] 34a_100011995851_100009817235 [0,0,1,0,0,0|2,0,1]=4 588 B12R0.104 CCCCC(C)NCCC(C)(C)O 2230a_100000126638_100000702414 [0,0,1,0,0,0|3,0,0]=4 589 B12R0.104 CCCCC(C)NCCC(C)(C)O 270004a_100000707701_100000210087 [0,0,1,0,0,0|3,0,0]=4 590 B12R0.104 CCCCC(C)NCCS(=O)(=O)C 2230a_100000126638_100000731031 [0,0,1,0,0,0|1,0,0]=2 591 B12R0.104 CCCCC(C)NCCS(=O)(=O)C 2230a_100000740961_200011215066 [0,0,1,0,0,0|1,0,0]=2 592 B12R0.104 CCCCC(C)NCCS(=O)(=O)C 270004a_100000740961_100000210087 [0,0,1,0,0,0|1,0,0]=2 593 B12R0.104 CCCCC(C)NCCS(=O)(=O)C 34a_100000740961_200011215066 [0,0,1,0,0,0|1,0,0]=2 594 B12R0.104 CCCCC(C)NCCS(=O)(=O)N 2230a_100000738205_200011215066 [0,0,1,0,0,0|1,0,0]=2 595 B12R0.104 CCCCC(C)NCCS(=O)(=O)N 270004a_100000738205_100000210087 [0,0,1,0,0,0|1,0,0]=2 596 B12R0.104 CCCCC(C)NCCS(=O)(=O)N 34a_100000738205_200011215066 [0,0,1,0,0,0|1,0,0]=2 597 B12R0.104 CCCCC(C)NCCS(=O)(=O)[O-] 2230a_100000126638_100000737633 [0,0,1,0,0,0|0,0,1]=2 598 B12R0.104 CCCCC(C)OCCS(=O)(=O)C 34a_100000211924_200011215066 [0,0,1,0,0,0|2,0,0]=3 599 B12R0.104 CCCCC(C)OCCS(=O)(=O)C 34a_100000687866_100000731031 [0,0,1,0,0,0|2,0,0]=3 600 B12R0.104 CCCCC(C)OCCS(=O)(=O)C 7a_100000211924_200011215066 [0,0,1,0,0,0|2,0,0]=3 601 B12R0.104 CCCCC(C)OCCS(=O)(=O)C 7a_100000687866_100000230027 [0,0,1,0,0,0|2,0,0]=3 602 B12R0.104 CCCCC(C)OCCS(=O)(=O)N 34a_100012334274_200011215066 [0,0,1,0,0,0|2,0,0]=3 603 B12R0.104 CCCCC(C)OCCS(=O)(=O)[O-] 34a_100000687866_100000762736 [0,0,1,0,0,0|1,0,1]=3 604 B12R0.104 CCCCC(C)SCCS(=O)(=O)C 62a_100000731031_200011215066 [0,0,1,0,0,0|2,0,0]=3 605 B12R0.104 CCCCC(C)SCCS(=O)(=O)C 62a_200011215066_100000230027 [0,0,1,0,0,0|2,0,0]=3 606 B12R0.104 CCCCC(C)SCCS(=O)(=O)[O-] 62a_100000762736_200011215066 [0,0,1,0,0,0|1,0,1]=3 607 B12R0.104 CCCCC(C)SCCS(=O)(=O)[O-] 62a_200011215066_100000762736 [0,0,1,0,0,0|1,0,1]=3 608 B12R0.104 CCCCN(C)CCCS(=O)(=O)C 2230a_100000207549_100000754308 [0,0,1,0,0,0|3,0,0]=4 609 B12R0.104 CCCCN(C)CCCS(=O)(=O)C 269982a_100000207549_100000754308 [0,0,1,0,0,0|3,0,0]=4 610 B12R0.104 CCCCN(C)CCCS(=O)(=O)N 2230a_100000207549_100000750626 [0,0,1,0,0,0|3,0,0]=4 611 B12R0.104 CCCCN(C)CCCS(=O)(=O)N 269982a_100000207549_100000750626 [0,0,1,0,0,0|3,0,0]=4 612 B12R0.104 CCCCN(C)CCCS(=O)(=O)[O-] 269982a_100000207549_100009813499 [0,0,1,0,0,0|2,0,1]=4 613 B12R0.104 CCOCC(C)OCCS(=O)(=O)C 34a_100000718985_100000731031 [0,0,1,0,0,0|3,0,0]=4 614 B12R0.104 CCOCC(C)OCCS(=O)(=O)C 7a_100000718985_100000230027 [0,0,1,0,0,0|3,0,0]=4 615 B12R0.104 CCOCC(C)OCCS(=O)(=O)[O-] 34a_100000718985_100000762736 [0,0,1,0,0,0|2,0,1]=4 616 B12R0.104 CCSCC(C)NCCS(=O)(=O)C 270004a_100000740961_200011216171 [0,0,1,0,0,0|2,0,0]=3 617 B12R0.104 CCSCC(C)NCCS(=O)(=O)N 270004a_100000738205_200011216171 [0,0,1,0,0,0|2,0,0]=3 618 B12R0.104 COCCC(C)NCCS(=O)(=O)C 270004a_100000740961_100000742357 [0,0,1,0,0,0|2,0,0]=3 619 B12R0.104 COCCC(C)NCCS(=O)(=O)N 270004a_100000738205_100000742357 [0,0,1,0,0,0|2,0,0]=3 620 B12R0.104 CSCCC(C)NCCS(=O)(=O)C 270004a_100000740961_100011217047 [0,0,1,0,0,0|2,0,0]=3 621 B12R0.104 CSCCC(C)NCCS(=O)(=O)N 270004a_100000738205_100011217047 [0,0,1,0,0,0|2,0,0]=3 622 B12R0.119 C#CCCCCNCCS(=O)(=O)C 2230a_100000706060_100000731031 [0,0,1,0,0,0|1,0,2]=4 623 B12R0.119 C#CCCCCNCCS(=O)(=O)C 2230a_100000740961_100010269958 [0,0,1,0,0,0|1,0,2]=4 624 B12R0.119 C#CCCCCNCCS(=O)(=O)C 34a_100000706060_100000731031 [0,0,1,0,0,0|1,0,2]=4 625 B12R0.119 C#CCCCCNCCS(=O)(=O)C 34a_100000740961_100010269958 [0,0,1,0,0,0|1,0,2]=4 626 B12R0.119 C#CCCCCNCCS(=O)(=O)N 2230a_100000738205_100010269958 [0,0,1,0,0,0|1,0,2]=4 627 B12R0.119 C#CCCCCNCCS(=O)(=O)N 34a_100000738205_100010269958 [0,0,1,0,0,0|1,0,2]=4 628 B12R0.119 C#CCCCCNCCS(=O)(=O)[O-] 2230a_100000706060_100000737633 [0,0,1,0,0,0|0,0,3]=4 629 B12R0.119 C#CCCCCNCCS(=O)(=O)[O-] 34a_100000706060_100000762736 [0,0,1,0,0,0|0,0,3]=4 630 B12R0.119 C=CCCCCNCCS(=O)(=O)C 2230a_100000703577_100000731031 [0,0,1,0,0,0|1,0,2]=4 631 B12R0.119 C=CCCCCNCCS(=O)(=O)C 2230a_100000740961_100011215482 [0,0,1,0,0,0|1,0,2]=4 632 B12R0.119 C=CCCCCNCCS(=O)(=O)C 34a_100000703577_100000731031 [0,0,1,0,0,0|1,0,2]=4 633 B12R0.119 C=CCCCCNCCS(=O)(=O)C 34a_100000740961_100011215482 [0,0,1,0,0,0|1,0,2]=4 634 B12R0.119 C=CCCCCNCCS(=O)(=O)N 2230a_100000738205_100011215482 [0,0,1,0,0,0|1,0,2]=4 635 B12R0.119 C=CCCCCNCCS(=O)(=O)N 34a_100000738205_100011215482 [0,0,1,0,0,0|1,0,2]=4 636 B12R0.119 C=CCCCCNCCS(=O)(=O)[O-] 2230a_100000703577_100000737633 [0,0,1,0,0,0|0,0,3]=4 637 B12R0.119 C=CCCCCNCCS(=O)(=O)[O-] 34a_100000703577_100000762736 [0,0,1,0,0,0|0,0,3]=4 638 B12R0.119 CC/C=C\CCNCCS(=O)(=O)C 2230a_100000740961_100015370543 [0,0,1,0,0,0|1,0,2]=4 639 B12R0.119 CC/C=C\CCNCCS(=O)(=O)C 34a_100000740961_100015370543 [0,0,1,0,0,0|1,0,2]=4 640 B12R0.119 CC/C=C\CCNCCS(=O)(=O)N 2230a_100000738205_100015370543 [0,0,1,0,0,0|1,0,2]=4 641 B12R0.119 CC/C=C\CCNCCS(=O)(=O)N 34a_100000738205_100015370543 [0,0,1,0,0,0|1,0,2]=4 642 B12R0.119 CCCCCCCCNS(=O)(=O)C 40a_100000229939_100000738038 [0,0,1,0,0,0|3,0,0]=4 643 B12R0.119 CCCCCCCOCS(=O)(=O)[O-] 34a_100000210272_100009817235 [0,0,1,0,0,0|2,0,1]=4 644 B12R0.119 CCCCCCCSCS(=O)(=O)N 62a_100000210614_100000741382 [0,0,1,0,0,0|3,0,0]=4 645 B12R0.119 CCCCCCCSCS(=O)(=O)N 62a_100000741382_100000210316 [0,0,1,0,0,0|3,0,0]=4 646 B12R0.119 CCCCCCCSCS(=O)(=O)[O-] 62a_100000210614_100009817235 [0,0,1,0,0,0|2,0,1]=4 647 B12R0.119 CCCCCCCSCS(=O)(=O)[O-] 62a_100009817235_100000210316 [0,0,1,0,0,0|2,0,1]=4 648 B12R0.119 CCCCCCNCCC(C)(C)O 2230a_100000210581_100000702414 [0,0,1,0,0,0|3,0,0]=4 649 B12R0.119 CCCCCCNCCS(=O)(=O)C 2230a_100000210581_100000731031 [0,0,1,0,0,0|1,0,0]=2 650 B12R0.119 CCCCCCNCCS(=O)(=O)C 2230a_100000740961_100000210314 [0,0,1,0,0,0|1,0,0]=2 651 B12R0.119 CCCCCCNCCS(=O)(=O)C 34a_100000740961_100000210314 [0,0,1,0,0,0|1,0,0]=2 652 B12R0.119 CCCCCCNCCS(=O)(=O)N 2230a_100000738205_100000210314 [0,0,1,0,0,0|1,0,0]=2 653 B12R0.119 CCCCCCNCCS(=O)(=O)N 34a_100000738205_100000210314 [0,0,1,0,0,0|1,0,0]=2 654 B12R0.119 CCCCCCNCCS(=O)(=O)[O-] 2230a_100000210581_100000737633 [0,0,1,0,0,0|0,0,1]=2 655 B12R0.119 CCCCCCOCCS(=O)(=O)C 34a_100000210259_100000731031 [0,0,1,0,0,0|2,0,0]=3 656 B12R0.119 CCCCCCOCCS(=O)(=O)C 34a_100000211924_100000210314 [0,0,1,0,0,0|2,0,0]=3 657 B12R0.119 CCCCCCOCCS(=O)(=O)C 7a_100000210259_100000230027 [0,0,1,0,0,0|2,0,0]=3 658 B12R0.119 CCCCCCOCCS(=O)(=O)C 7a_100000211924_100000210314 [0,0,1,0,0,0|2,0,0]=3 659 B12R0.119 CCCCCCOCCS(=O)(=O)N 34a_100012334274_100000210314 [0,0,1,0,0,0|2,0,0]=3 660 B12R0.119 CCCCCCOCCS(=O)(=O)[O-] 34a_100000210259_100000762736 [0,0,1,0,0,0|1,0,1]=3 661 B12R0.119 CCCCCCSCCS(=O)(=O)C 62a_100000210314_100000230027 [0,0,1,0,0,0|2,0,0]=3 662 B12R0.119 CCCCCCSCCS(=O)(=O)C 62a_100000731031_100000210757 [0,0,1,0,0,0|2,0,0]=3 663 B12R0.119 CCCCCCSCCS(=O)(=O)[O-] 62a_100000210314_100000762736 [0,0,1,0,0,0|1,0,1]=3 664 B12R0.119 CCCCCCSCCS(=O)(=O)[O-] 62a_100000762736_100000210757 [0,0,1,0,0,0|1,0,1]=3 665 B12R0.119 CCCCCNCCCS(=O)(=O)C 2230a_100000209983_100000754308 [0,0,1,0,0,0|3,0,0]=4 666 B12R0.119 CCCCCNCCCS(=O)(=O)C 2230a_100000742409_100000210326 [0,0,1,0,0,0|3,0,0]=4 667 B12R0.119 CCCCCNCCCS(=O)(=O)C 34a_100000742409_100000718602 [0,0,1,0,0,0|3,0,0]=4 668 B12R0.119 CCCCCNCCCS(=O)(=O)N 2230a_100000209983_100000750626 [0,0,1,0,0,0|3,0,0]=4 669 B12R0.119 CCCCCOCCCS(=O)(=O)C 34a_100000210253_100000754308 [0,0,1,0,0,0|3,0,0]=4 670 B12R0.119 CCCCCOCCCS(=O)(=O)C 34a_100000689940_100000718602 [0,0,1,0,0,0|3,0,0]=4 671 B12R0.119 CCCCCOCCCS(=O)(=O)C 7a_100000210253_100000754308 [0,0,1,0,0,0|3,0,0]=4 672 B12R0.119 CCCCCOCCCS(=O)(=O)C 7a_100000689940_100000210326 [0,0,1,0,0,0|3,0,0]=4 673 B12R0.119 CCCCCOCCCS(=O)(=O)N 34a_100000210253_100000750626 [0,0,1,0,0,0|3,0,0]=4 674 B12R0.119 CCCCCOCCCS(=O)(=O)N 7a_100000210253_100000750626 [0,0,1,0,0,0|3,0,0]=4 675 B12R0.119 CCCCCOCCCS(=O)(=O)[O-] 34a_100000210253_100009813499 [0,0,1,0,0,0|2,0,1]=4 676 B12R0.119 CCCCCSCCCS(=O)(=O)C 62a_100000210326_100000754308 [0,0,1,0,0,0|3,0,0]=4 677 B12R0.119 CCCCCSCCCS(=O)(=O)C 62a_100000754308_100000210326 [0,0,1,0,0,0|3,0,0]=4 678 B12R0.119 CCCCCSCCCS(=O)(=O)N 62a_100000210326_100000750626 [0,0,1,0,0,0|3,0,0]=4 679 B12R0.119 CCCCCSCCCS(=O)(=O)N 62a_100000750626_100000210326 [0,0,1,0,0,0|3,0,0]=4 680 B12R0.119 CCCCCSCCCS(=O)(=O)[O-] 62a_100000210326_100009813499 [0,0,1,0,0,0|2,0,1]=4 681 B12R0.119 CCCCCSCCCS(=O)(=O)[O-] 62a_100009813499_100000210326 [0,0,1,0,0,0|2,0,1]=4 682 B12R0.119 CCCCOCNCCS(=O)(=O)C 2230a_100000740961_100011995733 [0,0,1,0,0,0|2,0,0]=3 683 B12R0.119 CCCCOCNCCS(=O)(=O)C 34a_100000740961_100011995733 [0,0,1,0,0,0|2,0,0]=3 684 B12R0.119 CCCCOCNCCS(=O)(=O)N 2230a_100000738205_100011995733 [0,0,1,0,0,0|2,0,0]=3 685 B12R0.119 CCCCOCNCCS(=O)(=O)N 34a_100000738205_100011995733 [0,0,1,0,0,0|2,0,0]=3 686 B12R0.119 CCCCOCOCCS(=O)(=O)C 34a_100000211924_100011995733 [0,0,1,0,0,0|3,0,0]=4 687 B12R0.119 CCCCOCOCCS(=O)(=O)N 34a_100012334274_100011995733 [0,0,1,0,0,0|3,0,0]=4 688 B12R0.119 CCCCOCSCCS(=O)(=O)C 62a_100000731031_100011995733 [0,0,1,0,0,0|3,0,0]=4 689 B12R0.119 CCCCOCSCCS(=O)(=O)C 62a_100011995733_100000230027 [0,0,1,0,0,0|3,0,0]=4 690 B12R0.119 CCCCOCSCCS(=O)(=O)[O-] 62a_100000762736_100011995733 [0,0,1,0,0,0|2,0,1]=4 691 B12R0.119 CCCCOCSCCS(=O)(=O)[O-] 62a_100011995733_100000762736 [0,0,1,0,0,0|2,0,1]=4 692 B12R0.119 CCCOCCNCCS(=O)(=O)C 2230a_100000740961_100011215938 [0,0,1,0,0,0|2,0,0]=3 693 B12R0.119 CCCOCCNCCS(=O)(=O)C 2230a_100161115042_100000731031 [0,0,1,0,0,0|2,0,0]=3 694 B12R0.119 CCCOCCNCCS(=O)(=O)C 34a_100000740961_100011215938 [0,0,1,0,0,0|2,0,0]=3 695 B12R0.119 CCCOCCNCCS(=O)(=O)C 34a_100161115042_100000731031 [0,0,1,0,0,0|2,0,0]=3 696 B12R0.119 CCCOCCNCCS(=O)(=O)N 2230a_100000738205_100011215938 [0,0,1,0,0,0|2,0,0]=3 697 B12R0.119 CCCOCCNCCS(=O)(=O)N 34a_100000738205_100011215938 [0,0,1,0,0,0|2,0,0]=3 698 B12R0.119 CCCOCCNCCS(=O)(=O)[O-] 2230a_100161115042_100000737633 [0,0,1,0,0,0|1,0,1]=3 699 B12R0.119 CCCOCCNCCS(=O)(=O)[O-] 34a_100161115042_100000762736 [0,0,1,0,0,0|1,0,1]=3 700 B12R0.119 CCCOCCOCCS(=O)(=O)C 34a_100000211924_100011215938 [0,0,1,0,0,0|3,0,0]=4 701 B12R0.119 CCCOCCOCCS(=O)(=O)C 34a_100000752267_100000731031 [0,0,1,0,0,0|3,0,0]=4 702 B12R0.119 CCCOCCOCCS(=O)(=O)C 7a_100000211924_100011215938 [0,0,1,0,0,0|3,0,0]=4 703 B12R0.119 CCCOCCOCCS(=O)(=O)C 7a_100000752267_100000230027 [0,0,1,0,0,0|3,0,0]=4 704 B12R0.119 CCCOCCOCCS(=O)(=O)N 34a_100012334274_100011215938 [0,0,1,0,0,0|3,0,0]=4 705 B12R0.119 CCCOCCOCCS(=O)(=O)[O-] 34a_100000752267_100000762736 [0,0,1,0,0,0|2,0,1]=4 706 B12R0.119 CCCOCCSCCS(=O)(=O)C 62a_100000731031_100011215938 [0,0,1,0,0,0|3,0,0]=4 707 B12R0.119 CCCOCCSCCS(=O)(=O)C 62a_100011215938_100000230027 [0,0,1,0,0,0|3,0,0]=4 708 B12R0.119 CCCOCCSCCS(=O)(=O)[O-] 62a_100000762736_100011215938 [0,0,1,0,0,0|2,0,1]=4 709 B12R0.119 CCCOCCSCCS(=O)(=O)[O-] 62a_100011215938_100000762736 [0,0,1,0,0,0|2,0,1]=4 710 B12R0.119 CCCSCCNCCS(=O)(=O)C 2230a_100020603323_100000731031 [0,0,1,0,0,0|2,0,0]=3 711 B12R0.119 CCCSCCNCCS(=O)(=O)[O-] 2230a_100020603323_100000737633 [0,0,1,0,0,0|1,0,1]=3 712 B12R0.119 CCCSCCOCCS(=O)(=O)C 34a_200000230433_100000731031 [0,0,1,0,0,0|3,0,0]=4 713 B12R0.119 CCCSCCOCCS(=O)(=O)C 7a_200000230433_100000230027 [0,0,1,0,0,0|3,0,0]=4 714 B12R0.119 CCCSCCOCCS(=O)(=O)[O-] 34a_200000230433_100000762736 [0,0,1,0,0,0|2,0,1]=4 715 B12R0.119 CCOCCCNCCS(=O)(=O)C 2230a_100000210961_100000731031 [0,0,1,0,0,0|2,0,0]=3 716 B12R0.119 CCOCCCNCCS(=O)(=O)C 2230a_100000740961_100012232248 [0,0,1,0,0,0|2,0,0]=3 717 B12R0.119 CCOCCCNCCS(=O)(=O)C 34a_100000210961_100000731031 [0,0,1,0,0,0|2,0,0]=3 718 B12R0.119 CCOCCCNCCS(=O)(=O)C 34a_100000740961_100012232248 [0,0,1,0,0,0|2,0,0]=3 719 B12R0.119 CCOCCCNCCS(=O)(=O)N 2230a_100000738205_100012232248 [0,0,1,0,0,0|2,0,0]=3 720 B12R0.119 CCOCCCNCCS(=O)(=O)N 34a_100000738205_100012232248 [0,0,1,0,0,0|2,0,0]=3 721 B12R0.119 CCOCCCNCCS(=O)(=O)[O-] 2230a_100000210961_100000737633 [0,0,1,0,0,0|1,0,1]=3 722 B12R0.119 CCOCCCNCCS(=O)(=O)[O-] 34a_100000210961_100000762736 [0,0,1,0,0,0|1,0,1]=3 723 B12R0.119 CCOCCCOCCS(=O)(=O)C 34a_100000211924_100012232248 [0,0,1,0,0,0|3,0,0]=4 724 B12R0.119 CCOCCCOCCS(=O)(=O)C 34a_100000757476_100000731031 [0,0,1,0,0,0|3,0,0]=4 725 B12R0.119 CCOCCCOCCS(=O)(=O)C 7a_100000211924_100012232248 [0,0,1,0,0,0|3,0,0]=4 726 B12R0.119 CCOCCCOCCS(=O)(=O)C 7a_100000757476_100000230027 [0,0,1,0,0,0|3,0,0]=4 727 B12R0.119 CCOCCCOCCS(=O)(=O)N 34a_100012334274_100012232248 [0,0,1,0,0,0|3,0,0]=4 728 B12R0.119 CCOCCCOCCS(=O)(=O)[O-] 34a_100000757476_100000762736 [0,0,1,0,0,0|2,0,1]=4 729 B12R0.119 CCOCCCSCCS(=O)(=O)C 62a_100000731031_100012232248 [0,0,1,0,0,0|3,0,0]=4 730 B12R0.119 CCOCCCSCCS(=O)(=O)C 62a_100012232248_100000230027 [0,0,1,0,0,0|3,0,0]=4 731 B12R0.119 CCOCCCSCCS(=O)(=O)[O-] 62a_100000762736_100012232248 [0,0,1,0,0,0|2,0,1]=4 732 B12R0.119 CCOCCCSCCS(=O)(=O)[O-] 62a_100012232248_100000762736 [0,0,1,0,0,0|2,0,1]=4 733 B12R0.119 CCSCCCOCCS(=O)(=O)C 34a_100011216438_100000731031 [0,0,1,0,0,0|3,0,0]=4 734 B12R0.119 CCSCCCOCCS(=O)(=O)C 7a_100011216438_100000230027 [0,0,1,0,0,0|3,0,0]=4 735 B12R0.119 CCSCCCOCCS(=O)(=O)[O-] 34a_100011216438_100000762736 [0,0,1,0,0,0|2,0,1]=4 736 B12R0.119 COCCCCNCCS(=O)(=O)C 2230a_100000740961_100000730899 [0,0,1,0,0,0|2,0,0]=3 737 B12R0.119 COCCCCNCCS(=O)(=O)C 34a_100000740961_100000755781 [0,0,1,0,0,0|2,0,0]=3 738 B12R0.119 COCCCCNCCS(=O)(=O)N 2230a_100000738205_100000730899 [0,0,1,0,0,0|2,0,0]=3 739 B12R0.119 COCCCCNCCS(=O)(=O)N 34a_100000738205_100000755781 [0,0,1,0,0,0|2,0,0]=3 740 B12R0.119 COCCCCOCCS(=O)(=O)C 34a_100000211924_100000755781 [0,0,1,0,0,0|3,0,0]=4 741 B12R0.119 COCCCCOCCS(=O)(=O)C 34a_100000740925_100000731031 [0,0,1,0,0,0|3,0,0]=4 742 B12R0.119 COCCCCOCCS(=O)(=O)C 7a_100000211924_100000730899 [0,0,1,0,0,0|3,0,0]=4 743 B12R0.119 COCCCCOCCS(=O)(=O)N 34a_100012334274_100000755781 [0,0,1,0,0,0|3,0,0]=4 744 B12R0.119 COCCCCOCCS(=O)(=O)[O-] 34a_100000740925_100000762736 [0,0,1,0,0,0|2,0,1]=4 745 B12R0.119 COCCCCSCCS(=O)(=O)C 62a_100000730899_100000230027 [0,0,1,0,0,0|3,0,0]=4 746 B12R0.119 COCCCCSCCS(=O)(=O)C 62a_100000731031_100000730899 [0,0,1,0,0,0|3,0,0]=4 747 B12R0.119 COCCCCSCCS(=O)(=O)[O-] 62a_100000730899_100000762736 [0,0,1,0,0,0|2,0,1]=4 748 B12R0.119 COCCCCSCCS(=O)(=O)[O-] 62a_100000762736_100000730899 [0,0,1,0,0,0|2,0,1]=4 749 B12R0.119 COCCOCNCCS(=O)(=O)C 2230a_100000740961_100000231047 [0,0,1,0,0,0|3,0,0]=4 750 B12R0.119 COCCOCNCCS(=O)(=O)N 2230a_100000738205_100000231047 [0,0,1,0,0,0|3,0,0]=4 751 B12R0.119 CS(=O)(=O)CCNCCCCC#N 2230a_100000740961_100000211819 [0,0,1,0,0,0|2,0,1]=4 752 B12R0.119 CS(=O)(=O)CCNCCCCC=O 2230a_100000740961_100000139335 [0,0,1,0,0,0|2,0,1]=4 753 B12R0.119 CS(=O)(=O)CCNCCCCCF 2230a_100000740961_100000729378 [0,0,1,0,0,0|2,0,0]=3 754 B12R0.119 CS(=O)(=O)CCNCCCCCF 34a_100000740961_100000729378 [0,0,1,0,0,0|2,0,0]=3 755 B12R0.119 CS(=O)(=O)CCNCCCCCO 2230a_100000740961_100000746330 [0,0,1,0,0,0|2,0,0]=3 756 B12R0.119 CS(=O)(=O)CCNCCCCCO 2230a_100000762737_100000731031 [0,0,1,0,0,0|2,0,0]=3 757 B12R0.119 CS(=O)(=O)CCNCCCCCO 34a_100000740961_100000746330 [0,0,1,0,0,0|2,0,0]=3 758 B12R0.119 CS(=O)(=O)CCNCCCCCO 34a_100000762737_100000731031 [0,0,1,0,0,0|2,0,0]=3 759 B12R0.119 CS(=O)(=O)CCNCCOCCO 2230a_100000211614_100000731031 [0,0,1,0,0,0|3,0,0]=4 760 B12R0.119 CS(=O)(=O)CCNCCOCCO 2230a_100000740961_100011215305 [0,0,1,0,0,0|3,0,0]=4 761 B12R0.119 CS(=O)(=O)CCNCCOCCO 34a_100000211614_100000731031 [0,0,1,0,0,0|3,0,0]=4 762 B12R0.119 CS(=O)(=O)CCNCCOCCO 34a_100000740961_100000692535 [0,0,1,0,0,0|3,0,0]=4 763 B12R0.119 CS(=O)(=O)CCNCCSCCO 2230a_100011219999_100000731031 [0,0,1,0,0,0|3,0,0]=4 764 B12R0.119 CS(=O)(=O)CCOCCCCCBr 34a_100000746331_100000731031 [0,0,1,0,0,0|3,0,0]=4 765 B12R0.119 CS(=O)(=O)CCOCCCCCBr 7a_100000746331_100000230027 [0,0,1,0,0,0|3,0,0]=4 766 B12R0.119 CS(=O)(=O)CCOCCCCCCl 34a_100000746330_100000731031 [0,0,1,0,0,0|3,0,0]=4 767 B12R0.119 CS(=O)(=O)CCOCCCCCCl 7a_100000746330_100000230027 [0,0,1,0,0,0|3,0,0]=4 768 B12R0.119 CS(=O)(=O)CCOCCCCCF 34a_100000211924_100000729378 [0,0,1,0,0,0|3,0,0]=4 769 B12R0.119 CS(=O)(=O)CCOCCCCCF 7a_100000211924_100000729378 [0,0,1,0,0,0|3,0,0]=4 770 B12R0.119 CS(=O)(=O)CCOCCCCCI 34a_200012148887_100000731031 [0,0,1,0,0,0|3,0,0]=4 771 B12R0.119 CS(=O)(=O)CCOCCCCCI 7a_200012148887_100000230027 [0,0,1,0,0,0|3,0,0]=4 772 B12R0.119 CS(=O)(=O)CCOCCCCCN 34a_100000762737_100000731031 [0,0,1,0,0,0|3,0,0]=4 773 B12R0.119 CS(=O)(=O)CCOCCCCCO 34a_100000211924_100000746330 [0,0,1,0,0,0|3,0,0]=4 774 B12R0.119 CS(=O)(=O)CCOCCCCCO 7a_100000211924_100000746330 [0,0,1,0,0,0|3,0,0]=4 775 B12R0.119 CS(=O)(=O)CCSCCCCCF 62a_100000729378_100000230027 [0,0,1,0,0,0|3,0,0]=4 776 B12R0.119 CS(=O)(=O)CCSCCCCCF 62a_100000731031_100000729378 [0,0,1,0,0,0|3,0,0]=4 777 B12R0.119 CS(=O)(=O)CCSCCCCCO 62a_100000731031_100000746330 [0,0,1,0,0,0|3,0,0]=4 778 B12R0.119 CS(=O)(=O)CCSCCCCCO 62a_100000746330_100000230027 [0,0,1,0,0,0|3,0,0]=4 779 B12R0.119 CSCCCCOCCS(=O)(=O)C 34a_100011217163_100000731031 [0,0,1,0,0,0|3,0,0]=4 780 B12R0.119 CSCCCCOCCS(=O)(=O)C 7a_100011217163_100000230027 [0,0,1,0,0,0|3,0,0]=4 781 B12R0.119 CSCCCCOCCS(=O)(=O)[O-] 34a_100011217163_100000762736 [0,0,1,0,0,0|2,0,1]=4 782 B12R0.119 N#CCCCCNCCS(=O)(=O)N 2230a_100000738205_100000211819 [0,0,1,0,0,0|2,0,1]=4 783 B12R0.119 NCCCCCOCCS(=O)(=O)[O-] 34a_100000762737_100000762736 [0,0,1,0,0,0|2,0,1]=4 784 B12R0.119 NS(=O)(=O)CCNCCCCC=O 2230a_100000738205_100000139335 [0,0,1,0,0,0|2,0,1]=4 785 B12R0.119 NS(=O)(=O)CCNCCCCCF 2230a_100000738205_100000729378 [0,0,1,0,0,0|2,0,0]=3 786 B12R0.119 NS(=O)(=O)CCNCCCCCF 34a_100000738205_100000729378 [0,0,1,0,0,0|2,0,0]=3 787 B12R0.119 NS(=O)(=O)CCNCCCCCO 2230a_100000738205_100000746330 [0,0,1,0,0,0|2,0,0]=3 788 B12R0.119 NS(=O)(=O)CCNCCCCCO 34a_100000738205_100000746330 [0,0,1,0,0,0|2,0,0]=3 789 B12R0.119 NS(=O)(=O)CCNCCOCCO 2230a_100000738205_100011215305 [0,0,1,0,0,0|3,0,0]=4 790 B12R0.119 NS(=O)(=O)CCNCCOCCO 34a_100000738205_100000692535 [0,0,1,0,0,0|3,0,0]=4 791 B12R0.119 NS(=O)(=O)CCOCCCCCF 34a_100012334274_100000729378 [0,0,1,0,0,0|3,0,0]=4 792 B12R0.119 NS(=O)(=O)CCOCCCCCO 34a_100012334274_100000746330 [0,0,1,0,0,0|3,0,0]=4 793 B12R0.119 O=S(=O)([O-])CCNCCCCCO 2230a_100000762737_100000737633 [0,0,1,0,0,0|1,0,1]=3 794 B12R0.119 O=S(=O)([O-])CCNCCCCCO 34a_100000762737_100000762736 [0,0,1,0,0,0|1,0,1]=3 795 B12R0.119 O=S(=O)([O-])CCNCCOCCO 2230a_100000211614_100000737633 [0,0,1,0,0,0|2,0,1]=4 796 B12R0.119 O=S(=O)([O-])CCNCCOCCO 34a_100000211614_100000762736 [0,0,1,0,0,0|2,0,1]=4 797 B12R0.119 O=S(=O)([O-])CCNCCSCCO 2230a_100011219999_100000737633 [0,0,1,0,0,0|2,0,1]=4 798 B12R0.119 O=S(=O)([O-])CCOCCCCCBr 34a_100000746331_100000762736 [0,0,1,0,0,0|2,0,1]=4 799 B12R0.119 O=S(=O)([O-])CCOCCCCCCl 34a_100000746330_100000762736 [0,0,1,0,0,0|2,0,1]=4 800 B12R0.119 O=S(=O)([O-])CCOCCCCCI 34a_200012148887_100000762736 [0,0,1,0,0,0|2,0,1]=4 801 B12R0.119 O=S(=O)([O-])CCSCCCCCF 62a_100000729378_100000762736 [0,0,1,0,0,0|2,0,1]=4 802 B12R0.119 O=S(=O)([O-])CCSCCCCCF 62a_100000762736_100000729378 [0,0,1,0,0,0|2,0,1]=4 803 B12R0.119 O=S(=O)([O-])CCSCCCCCO 62a_100000746330_100000762736 [0,0,1,0,0,0|2,0,1]=4 804 B12R0.119 O=S(=O)([O-])CCSCCCCCO 62a_100000762736_100000746330 [0,0,1,0,0,0|2,0,1]=4 805 B12R0.230 CCC(COC)NCCS(=O)(=O)C 2230a_100000757820_100000731031 [0,0,1,0,0,0|2,0,0]=3 806 B12R0.230 CCC(COC)NCCS(=O)(=O)C 270004a_100000740961_100000757811 [0,0,1,0,0,0|2,0,0]=3 807 B12R0.230 CCC(COC)NCCS(=O)(=O)N 270004a_100000738205_100000757811 [0,0,1,0,0,0|2,0,0]=3 808 B12R0.230 CCC(COC)NCCS(=O)(=O)[O-] 2230a_100000757820_100000737633 [0,0,1,0,0,0|1,0,1]=3 809 B12R0.230 CCC(COC)OCCS(=O)(=O)C 7a_200011214946_100000230027 [0,0,1,0,0,0|3,0,0]=4 810 B12R0.230 CCCC(CC)NCCC(C)(C)O 2230a_100000747048_100000702414 [0,0,1,0,0,0|3,0,0]=4 811 B12R0.230 CCCC(CC)NCCC(C)(C)O 270004a_100000707701_100000687865 [0,0,1,0,0,0|3,0,0]=4 812 B12R0.230 CCCC(CC)NCCS(=O)(=O)C 2230a_100000747048_100000731031 [0,0,1,0,0,0|1,0,0]=2 813 B12R0.230 CCCC(CC)NCCS(=O)(=O)C 270004a_100000740961_100000687865 [0,0,1,0,0,0|1,0,0]=2 814 B12R0.230 CCCC(CC)NCCS(=O)(=O)N 270004a_100000738205_100000687865 [0,0,1,0,0,0|1,0,0]=2 815 B12R0.230 CCCC(CC)NCCS(=O)(=O)[O-] 2230a_100000747048_100000737633 [0,0,1,0,0,0|0,0,1]=2 816 B12R0.230 CCCC(CC)OCCS(=O)(=O)C 34a_100000687864_100000731031 [0,0,1,0,0,0|2,0,0]=3 817 B12R0.230 CCCC(CC)OCCS(=O)(=O)C 7a_100000211924_100011219200 [0,0,1,0,0,0|2,0,0]=3 818 B12R0.230 CCCC(CC)OCCS(=O)(=O)C 7a_100000687864_100000230027 [0,0,1,0,0,0|2,0,0]=3 819 B12R0.230 CCCC(CC)OCCS(=O)(=O)[O-] 34a_100000687864_100000762736 [0,0,1,0,0,0|1,0,1]=3 820 B12R0.230 CCCC(CC)SCCS(=O)(=O)C 62a_100000731031_100011219200 [0,0,1,0,0,0|2,0,0]=3 821 B12R0.230 CCCC(CC)SCCS(=O)(=O)C 62a_100011219200_100000230027 [0,0,1,0,0,0|2,0,0]=3 822 B12R0.230 CCCC(CC)SCCS(=O)(=O)[O-] 62a_100000762736_100011219200 [0,0,1,0,0,0|1,0,1]=3 823 B12R0.230 CCCC(CC)SCCS(=O)(=O)[O-] 62a_100011219200_100000762736 [0,0,1,0,0,0|1,0,1]=3 824 B12R0.230 CCCN(CC)CCCS(=O)(=O)C 2230a_100000226822_100000754308 [0,0,1,0,0,0|3,0,0]=4 825 B12R0.230 CCCN(CC)CCCS(=O)(=O)C 269982a_100000226822_100000754308 [0,0,1,0,0,0|3,0,0]=4 826 B12R0.230 CCCN(CC)CCCS(=O)(=O)N 2230a_100000226822_100000750626 [0,0,1,0,0,0|3,0,0]=4 827 B12R0.230 CCCN(CC)CCCS(=O)(=O)N 269982a_100000226822_100000750626 [0,0,1,0,0,0|3,0,0]=4 828 B12R0.230 CCCN(CC)CCCS(=O)(=O)[O-] 269982a_100000226822_100009813499 [0,0,1,0,0,0|2,0,1]=4 829 B12R0.230 CCC[C@@H](CO)NCCS(=O)(=O)C 2230a_100000732646_100000731031 [0,0,1,0,0,0|2,0,0]=3 830 B12R0.230 CCC[C@@H](CO)NCCS(=O)(=O)C 34a_100000732646_100000731031 [0,0,1,0,0,0|2,0,0]=3 831 B12R0.230 CCC[C@@H](CO)NCCS(=O)(=O)[O-] 2230a_100000732646_100000737633 [0,0,1,0,0,0|1,0,1]=3 832 B12R0.230 CCC[C@@H](CO)NCCS(=O)(=O)[O-] 34a_100000732646_100000762736 [0,0,1,0,0,0|1,0,1]=3 833 B12R0.230 CC[C@H](CC#N)NCCS(=O)(=O)C 2230a_200009818565_100000731031 [0,0,1,0,0,0|2,0,1]=4 834 B12R0.230 CC[C@H](CC#N)NCCS(=O)(=O)[O-] 2230a_200009818565_100000737633 [0,0,1,0,0,0|1,0,2]=4 835 B12R0.230 COCC(CO)NCCS(=O)(=O)C 2230a_100000724102_100000731031 [0,0,1,0,0,0|3,0,0]=4 836 B12R0.230 COCC(CO)NCCS(=O)(=O)C 34a_100000724102_100000731031 [0,0,1,0,0,0|3,0,0]=4 837 B12R0.230 COCC(CO)NCCS(=O)(=O)[O-] 2230a_100000724102_100000737633 [0,0,1,0,0,0|2,0,1]=4 838 B12R0.230 COCC(CO)NCCS(=O)(=O)[O-] 34a_100000724102_100000762736 [0,0,1,0,0,0|2,0,1]=4 839 B14R2.403 CC1(CCN(C1)C2CCCCC2)O 269982a_100000718628_100000210327 [0,0,0,1,0,0|3,0,0]=4 840 B14R2.403 CC1(CCN(C1)C2CCCCC2)O 270004a_100000718628_100000210434 [0,0,0,1,0,0|3,0,0]=4 841 B14R2.4893 C[C@@]1(C[C@H](C1)NC2CCCCC2)O 270004a_100121572536_100000210434 [0,0,0,1,0,0|3,0,0]=4 842 B14R2.4893 O=S1(=O)CC(C1)NC2C=CCCC2 2230a_100000695474_100000751183 [0,0,0,1,0,0|1,0,2]=4 843 B14R2.4893 O=S1(=O)CC(C1)NC2CCCCC2 34a_100000695474_100000210327 [0,0,0,1,0,0|1,0,0]=2 844 B14R2.4893 O=S1(=O)CC(C1)NC2CCCOC2 34a_100000695474_100000693364 [0,0,0,1,0,0|2,0,0]=3 845 B14R2.4893 O=S1(=O)CC(C1)NC2CCSCC2 34a_100000695474_100000069128 [0,0,0,1,0,0|2,0,0]=3 846 B14R2.4893 O=S1(=O)CC(C1)OC2CCCCC2 34a_100000072295_100000210327 [0,0,0,1,0,0|2,0,0]=3 847 B14R2.4893 O=S1(=O)CC(C1)OC2CCCCC2 7a_100000072295_100000210327 [0,0,0,1,0,0|2,0,0]=3 848 B14R2.4893 O=S1(=O)CC(C1)OC2CCCOC2 34a_100000072295_100000693364 [0,0,0,1,0,0|3,0,0]=4 849 B14R2.4893 O=S1(=O)CC(C1)OC2CCCOC2 7a_100000072295_100000693364 [0,0,0,1,0,0|3,0,0]=4 850 B14R2.4893 O=S1(=O)CC(C1)OC2CCOCC2 7a_100000072295_100000686592 [0,0,0,1,0,0|3,0,0]=4 851 B14R2.4893 O=S1(=O)CC(C1)OC2CCSCC2 34a_100000072295_100000069128 [0,0,0,1,0,0|3,0,0]=4 852 B14R2.4893 O=S1(=O)CC(C1)OC2CCSCC2 7a_100000072295_100011500858 [0,0,0,1,0,0|3,0,0]=4 853 B14R2.15514 CC(C)(O)CCN1C2CCC1CC2 2230a_100000735658_100000702414 [0,0,0,1,0,0|3,0,0]=4 854 B14R2.15514 CC(C)(O)CCN1C2CCC1CC2 34a_100000735658_100000702414 [0,0,0,1,0,0|3,0,0]=4 855 B14R2.15514 CS(=O)(=O)CCN1C2CCC1CC2 2230a_100000735658_100000731031 [0,0,0,1,0,0|1,0,0]=2 856 B14R2.15514 CS(=O)(=O)CCN1C2CCC1CC2 269982a_100000735658_100000731031 [0,0,0,1,0,0|1,0,0]=2 857 B14R2.15514 CS(=O)(=O)CCN1C2CCC1CC2 34a_100000735658_100000731031 [0,0,0,1,0,0|1,0,0]=2 858 B14R2.15514 NS(=O)(=O)CSC1C2CCC1CC2 62a_100000741382_100009813300 [0,0,0,1,0,0|3,0,0]=4 859 B14R2.15514 NS(=O)(=O)CSC1C2CCC1CC2 62a_100009813300_100000741382 [0,0,0,1,0,0|3,0,0]=4 860 B14R2.15514 O=S(=O)([O-])CCN1C2CCC1CC2 2230a_100000735658_100000737633 [0,0,0,1,0,0|0,0,1]=2 861 B14R2.15514 O=S(=O)([O-])CCN1C2CCC1CC2 34a_100000735658_100000762736 [0,0,0,1,0,0|0,0,1]=2 862 B14R2.15514 O=S(=O)([O-])CSC1C2CCC1CC2 62a_100009813300_100009817235 [0,0,0,1,0,0|2,0,1]=4 863 B14R2.15514 O=S(=O)([O-])CSC1C2CCC1CC2 62a_100009817235_100009813300 [0,0,0,1,0,0|2,0,1]=4 864 B14R2.15529 CC(C)(O)CCNC1CC2CC2C1 270004a_100000707701_100010340937 [0,0,0,1,0,0|3,0,0]=4 865 B14R2.15529 CS(=O)(=O)CCCN1CC2CC2C1 2230a_100000741873_100000754308 [0,0,0,1,0,0|3,0,0]=4 866 B14R2.15529 CS(=O)(=O)CCCN1CC2CC2C1 269982a_100000741873_100000754308 [0,0,0,1,0,0|3,0,0]=4 867 B14R2.15529 CS(=O)(=O)CCCN1CC2CC2C1 34a_100000741873_100000754308 [0,0,0,1,0,0|3,0,0]=4 868 B14R2.15529 CS(=O)(=O)CCNC1CC2CC2C1 270004a_100000740961_100010340937 [0,0,0,1,0,0|1,0,0]=2 869 B14R2.15529 NS(=O)(=O)CCCN1CC2CC2C1 2230a_100000741873_100000750626 [0,0,0,1,0,0|3,0,0]=4 870 B14R2.15529 NS(=O)(=O)CCCN1CC2CC2C1 269982a_100000741873_100000750626 [0,0,0,1,0,0|3,0,0]=4 871 B14R2.15529 NS(=O)(=O)CCCN1CC2CC2C1 34a_100000741873_100000750626 [0,0,0,1,0,0|3,0,0]=4 872 B14R2.15529 NS(=O)(=O)CCNC1CC2CC2C1 270004a_100000738205_100010340937 [0,0,0,1,0,0|1,0,0]=2 873 B14R2.15529 O=S(=O)([O-])CCCN1CC2CC2C1 269982a_100000741873_100009813499 [0,0,0,1,0,0|2,0,1]=4 874 B14R2.15529 O=S(=O)([O-])CCCN1CC2CC2C1 34a_100000741873_100009813499 [0,0,0,1,0,0|2,0,1]=4 875 B14R2.15546 O=S(=O)([O-])CN1CC2CCC1CC2 34a_100000750499_100009817235 [0,0,0,1,0,0|2,0,1]=4 876 B14R2.53977 CS(=O)(=O)CCNC1C2C1COC2 2230a_100000702821_100000731031 [0,0,0,1,0,0|2,0,0]=3 877 B14R2.53977 CS(=O)(=O)CCNC1C2C1COC2 34a_100000702821_100000731031 [0,0,0,1,0,0|2,0,0]=3 878 B14R2.53977 O=S(=O)([O-])CCNC1C2C1COC2 2230a_100000702821_100000737633 [0,0,0,1,0,0|1,0,1]=3 879 B14R2.53977 O=S(=O)([O-])CCNC1C2C1COC2 34a_100000702821_100000762736 [0,0,0,1,0,0|1,0,1]=3 880 B14R2.53984 CC(C)(O)CCNC1CCC2C1C2 269862a_100000707701_100000692480 [0,0,0,1,0,0|3,0,0]=4 881 B14R2.53984 CC(C)(O)CCNC1CCC2C1C2 270004a_100000707701_100000692480 [0,0,0,1,0,0|3,0,0]=4 882 B14R2.53984 CS(=O)(=O)CCNC1CCC2C1C2 269862a_100000740961_100000692480 [0,0,0,1,0,0|1,0,0]=2 883 B14R2.53984 CS(=O)(=O)CCNC1CCC2C1C2 270004a_100000740961_100000692480 [0,0,0,1,0,0|1,0,0]=2 884 B14R2.53984 CS(=O)(=O)CCOC1CCC2C1C2 34a_200012295571_100000731031 [0,0,0,1,0,0|2,0,0]=3 885 B14R2.53984 NS(=O)(=O)CCNC1CCC2C1C2 269862a_100000738205_100000692480 [0,0,0,1,0,0|1,0,0]=2 886 B14R2.53984 NS(=O)(=O)CCNC1CCC2C1C2 270004a_100000738205_100000692480 [0,0,0,1,0,0|1,0,0]=2 887 B14R2.53984 O=S(=O)([O-])CCOC1CCC2C1C2 34a_200012295571_100000762736 [0,0,0,1,0,0|1,0,1]=3 888 B12R1.890 CC(C)(O)CCNC1CCCC1 2230a_100000211070_100000702414 [0,0,0,0,1,0|3,0,0]=4 889 B12R1.890 CC(C)(O)CCNC1CCCC1 270004a_100000707701_100000210133 [0,0,0,0,1,0|3,0,0]=4 890 B12R1.890 CC(C)(O)CCNC1CCCC1 34a_100000211070_100000702414 [0,0,0,0,1,0|3,0,0]=4 891 B12R1.890 CS(=O)(=O)CCCN1CCCC1 2230a_100000188435_100000754308 [0,0,0,0,1,0|3,0,0]=4 892 B12R1.890 CS(=O)(=O)CCCN1CCCC1 269982a_100000188435_100000754308 [0,0,0,0,1,0|3,0,0]=4 893 B12R1.890 CS(=O)(=O)CCNC1CC=CC1 2230a_100015188752_100000731031 [0,0,0,0,1,0|1,0,2]=4 894 B12R1.890 CS(=O)(=O)CCNC1CCCC1 2230a_100000211070_100000731031 [0,0,0,0,1,0|1,0,0]=2 895 B12R1.890 CS(=O)(=O)CCNC1CCCC1 2230a_100000740961_100000179811 [0,0,0,0,1,0|1,0,0]=2 896 B12R1.890 CS(=O)(=O)CCNC1CCCC1 270004a_100000740961_100000210133 [0,0,0,0,1,0|1,0,0]=2 897 B12R1.890 CS(=O)(=O)CCNC1CCCC1 34a_100000211070_100000731031 [0,0,0,0,1,0|1,0,0]=2 898 B12R1.890 CS(=O)(=O)CCNC1CCCC1 34a_100000740961_100000179811 [0,0,0,0,1,0|1,0,0]=2 899 B12R1.890 CS(=O)(=O)CCNC1CCOC1 2230a_100000740961_100000731011 [0,0,0,0,1,0|2,0,0]=3 900 B12R1.890 CS(=O)(=O)CCNC1CCOC1 270004a_100000740961_100000752484 [0,0,0,0,1,0|2,0,0]=3 901 B12R1.890 CS(=O)(=O)CCNC1CCOC1 34a_100000740961_100000690089 [0,0,0,0,1,0|2,0,0]=3 902 B12R1.890 CS(=O)(=O)CCNC1CCSC1 270004a_100000740961_100000212027 [0,0,0,0,1,0|2,0,0]=3 903 B12R1.890 CS(=O)(=O)CCN[C@@H]1CCOC1 2230a_200015188469_100000731031 [0,0,0,0,1,0|2,0,0]=3 904 B12R1.890 CS(=O)(=O)CCN[C@H]1CCOC1 2230a_100015188467_100000731031 [0,0,0,0,1,0|2,0,0]=3 905 B12R1.890 CS(=O)(=O)CCN[C@H]1CCOC1 34a_100015188467_100000731031 [0,0,0,0,1,0|2,0,0]=3 906 B12R1.890 CS(=O)(=O)CCOC1CCCC1 34a_100000210269_100000731031 [0,0,0,0,1,0|2,0,0]=3 907 B12R1.890 CS(=O)(=O)CCOC1CCCC1 34a_100000211924_100000179811 [0,0,0,0,1,0|2,0,0]=3 908 B12R1.890 CS(=O)(=O)CCOC1CCCC1 7a_100000210269_100000230027 [0,0,0,0,1,0|2,0,0]=3 909 B12R1.890 CS(=O)(=O)CCOC1CCCC1 7a_100000211924_100000179811 [0,0,0,0,1,0|2,0,0]=3 910 B12R1.890 CS(=O)(=O)CCOC1CCCO1 34a_100000085407_100000731031 [0,0,0,0,1,0|3,0,0]=4 911 B12R1.890 CS(=O)(=O)CCOC1CCOC1 34a_100000211924_100000690089 [0,0,0,0,1,0|3,0,0]=4 912 B12R1.890 CS(=O)(=O)CCOC1CCOC1 7a_100000211924_100000731011 [0,0,0,0,1,0|3,0,0]=4 913 B12R1.890 CS(=O)(=O)CCOC1CCSC1 7a_100011232664_100000230027 [0,0,0,0,1,0|3,0,0]=4 914 B12R1.890 CS(=O)(=O)CCO[C@H]1CCOC1 34a_100000717292_100000731031 [0,0,0,0,1,0|3,0,0]=4 915 B12R1.890 CS(=O)(=O)CCSC1CCCC1 62a_100000731031_100000179811 [0,0,0,0,1,0|2,0,0]=3 916 B12R1.890 CS(=O)(=O)CCSC1CCCC1 62a_100011217020_100000230027 [0,0,0,0,1,0|2,0,0]=3 917 B12R1.890 CS(=O)(=O)CCSC1CCOC1 62a_100000731031_100000690089 [0,0,0,0,1,0|3,0,0]=4 918 B12R1.890 CS(=O)(=O)NCCC1CCCC1 40a_100000739158_100000738038 [0,0,0,0,1,0|3,0,0]=4 919 B12R1.890 NS(=O)(=O)CCCN1CCCC1 2230a_100000188435_100000750626 [0,0,0,0,1,0|3,0,0]=4 920 B12R1.890 NS(=O)(=O)CCCN1CCCC1 269982a_100000188435_100000750626 [0,0,0,0,1,0|3,0,0]=4 921 B12R1.890 NS(=O)(=O)CCNC1CCCC1 2230a_100000738205_100000179811 [0,0,0,0,1,0|1,0,0]=2 922 B12R1.890 NS(=O)(=O)CCNC1CCCC1 270004a_100000738205_100000210133 [0,0,0,0,1,0|1,0,0]=2 923 B12R1.890 NS(=O)(=O)CCNC1CCCC1 34a_100000738205_100000179811 [0,0,0,0,1,0|1,0,0]=2 924 B12R1.890 NS(=O)(=O)CCNC1CCOC1 2230a_100000738205_100000731011 [0,0,0,0,1,0|2,0,0]=3 925 B12R1.890 NS(=O)(=O)CCNC1CCOC1 270004a_100000738205_100000752484 [0,0,0,0,1,0|2,0,0]=3 926 B12R1.890 NS(=O)(=O)CCNC1CCOC1 34a_100000738205_100000690089 [0,0,0,0,1,0|2,0,0]=3 927 B12R1.890 NS(=O)(=O)CCNC1CCSC1 270004a_100000738205_100000212027 [0,0,0,0,1,0|2,0,0]=3 928 B12R1.890 NS(=O)(=O)CCOC1CCCC1 34a_100012334274_100000179811 [0,0,0,0,1,0|2,0,0]=3 929 B12R1.890 NS(=O)(=O)CCOC1CCOC1 34a_100012334274_100000690089 [0,0,0,0,1,0|3,0,0]=4 930 B12R1.890 NS(=O)(=O)CSCC1CCCC1 62a_100000740388_100000741382 [0,0,0,0,1,0|3,0,0]=4 931 B12R1.890 NS(=O)(=O)CSCC1CCCC1 62a_100000741382_100000740388 [0,0,0,0,1,0|3,0,0]=4 932 B12R1.890 O=S(=O)([O-])CCCN1CCCC1 269982a_100000188435_100009813499 [0,0,0,0,1,0|2,0,1]=4 933 B12R1.890 O=S(=O)([O-])CCNC1CC=CC1 2230a_100015188752_100000737633 [0,0,0,0,1,0|0,0,3]=4 934 B12R1.890 O=S(=O)([O-])CCNC1CCCC1 2230a_100000211070_100000737633 [0,0,0,0,1,0|0,0,1]=2 935 B12R1.890 O=S(=O)([O-])CCNC1CCCC1 34a_100000211070_100000762736 [0,0,0,0,1,0|0,0,1]=2 936 B12R1.890 O=S(=O)([O-])CCN[C@@H]1CCOC1 2230a_200015188469_100000737633 [0,0,0,0,1,0|1,0,1]=3 937 B12R1.890 O=S(=O)([O-])CCN[C@H]1CCOC1 2230a_100015188467_100000737633 [0,0,0,0,1,0|1,0,1]=3 938 B12R1.890 O=S(=O)([O-])CCN[C@H]1CCOC1 34a_100015188467_100000762736 [0,0,0,0,1,0|1,0,1]=3 939 B12R1.890 O=S(=O)([O-])CCOC1CCCC1 34a_100000210269_100000762736 [0,0,0,0,1,0|1,0,1]=3 940 B12R1.890 O=S(=O)([O-])CCOC1CCCO1 34a_100000085407_100000762736 [0,0,0,0,1,0|2,0,1]=4 941 B12R1.890 O=S(=O)([O-])CCO[C@H]1CCOC1 34a_100000717292_100000762736 [0,0,0,0,1,0|2,0,1]=4 942 B12R1.890 O=S(=O)([O-])CCSC1CCCC1 62a_100000762736_100000179811 [0,0,0,0,1,0|1,0,1]=3 943 B12R1.890 O=S(=O)([O-])CCSC1CCCC1 62a_100011217020_100000762736 [0,0,0,0,1,0|1,0,1]=3 944 B12R1.890 O=S(=O)([O-])CCSC1CCOC1 62a_100000762736_100000690089 [0,0,0,0,1,0|2,0,1]=4 945 B12R1.890 O=S(=O)([O-])CNCC1CCCC1 34a_100000737975_100009817235 [0,0,0,0,1,0|2,0,1]=4 946 B12R1.890 O=S(=O)([O-])COCC1CCCC1 34a_100000742336_100009817235 [0,0,0,0,1,0|2,0,1]=4 947 B12R1.890 O=S(=O)([O-])CSCC1CCCC1 62a_100000740388_100009817235 [0,0,0,0,1,0|2,0,1]=4 948 B12R1.890 O=S(=O)([O-])CSCC1CCCC1 62a_100009817235_100000740388 [0,0,0,0,1,0|2,0,1]=4 949 B12R1.891 CC(C)(O)CNC1CCCCC1 270004a_100000751335_100000210434 [0,0,0,0,1,0|3,0,0]=4 950 B12R1.891 CC(C)(O)CNC1CCCCC1 34a_100000182618_100000764493 [0,0,0,0,1,0|3,0,0]=4 951 B12R1.891 CS(=O)(=O)CCN1CCCOC1 2230a_100000131196_100000731031 [0,0,0,0,1,0|3,0,0]=4 952 B12R1.891 CS(=O)(=O)CCN1CCCOC1 269982a_100000131196_100000731031 [0,0,0,0,1,0|3,0,0]=4 953 B12R1.891 CS(=O)(=O)CCN1CCCOC1 34a_100000131196_100000731031 [0,0,0,0,1,0|3,0,0]=4 954 B12R1.891 CS(=O)(=O)CCN1CCOCC1 2230a_100015191051_100000731031 [0,0,0,0,1,0|3,0,0]=4 955 B12R1.891 CS(=O)(=O)CCN1CCOCC1 269982a_100015191051_100000731031 [0,0,0,0,1,0|3,0,0]=4 956 B12R1.891 CS(=O)(=O)CCN1CCOCC1 34a_100015191051_100000731031 [0,0,0,0,1,0|3,0,0]=4 957 B12R1.891 CS(=O)(=O)CCN1CCSCC1 2230a_100000737611_100000731031 [0,0,0,0,1,0|3,0,0]=4 958 B12R1.891 CS(=O)(=O)CCN1CCSCC1 269982a_100000737611_100000731031 [0,0,0,0,1,0|3,0,0]=4 959 B12R1.891 CS(=O)(=O)NCC1CCCCC1 40a_100000210473_100000738038 [0,0,0,0,1,0|2,0,0]=3 960 B12R1.891 CS(=O)(=O)NCC1CCCCO1 40a_100000174945_100000738038 [0,0,0,0,1,0|3,0,0]=4 961 B12R1.891 CS(=O)(=O)NCC1CCCOC1 40a_100000720124_100000738038 [0,0,0,0,1,0|3,0,0]=4 962 B12R1.891 CS(=O)(=O)NCC1CCOCC1 40a_100000746373_100000738038 [0,0,0,0,1,0|3,0,0]=4 963 B12R1.891 CS(=O)(=O)NCC1CCSCC1 40a_100015188806_100000738038 [0,0,0,0,1,0|3,0,0]=4 964 B12R1.891 CS(=O)(=O)NNC1CCCCC1 40a_100000709804_100000738038 [0,0,0,0,1,0|2,0,0]=3 965 B12R1.891 CS(=O)(=O)NNC1CCOCC1 40a_100000687383_100000738038 [0,0,0,0,1,0|3,0,0]=4 966 B12R1.891 NS(=O)(=O)CSC1CCCCC1 62a_100000210327_100000741382 [0,0,0,0,1,0|2,0,0]=3 967 B12R1.891 NS(=O)(=O)CSC1CCCCC1 62a_100000741382_100000210327 [0,0,0,0,1,0|2,0,0]=3 968 B12R1.891 NS(=O)(=O)CSC1CCCOC1 62a_100000741382_100000693364 [0,0,0,0,1,0|3,0,0]=4 969 B12R1.891 NS(=O)(=O)CSC1CCOCC1 62a_100000741382_100011324220 [0,0,0,0,1,0|3,0,0]=4 970 B12R1.891 NS(=O)(=O)CSC1CCSCC1 62a_100000741382_100000069128 [0,0,0,0,1,0|3,0,0]=4 971 B12R1.891 O=S(=O)([O-])CCN1CCCOC1 2230a_100000131196_100000737633 [0,0,0,0,1,0|2,0,1]=4 972 B12R1.891 O=S(=O)([O-])CCN1CCCOC1 34a_100000131196_100000762736 [0,0,0,0,1,0|2,0,1]=4 973 B12R1.891 O=S(=O)([O-])CCN1CCOCC1 2230a_100015191051_100000737633 [0,0,0,0,1,0|2,0,1]=4 974 B12R1.891 O=S(=O)([O-])CCN1CCOCC1 34a_100015191051_100000762736 [0,0,0,0,1,0|2,0,1]=4 975 B12R1.891 O=S(=O)([O-])CCN1CCSCC1 2230a_100000737611_100000737633 [0,0,0,0,1,0|2,0,1]=4 976 B12R1.891 O=S(=O)([O-])CNC1CCCCC1 34a_100000182618_100009817235 [0,0,0,0,1,0|0,0,1]=2 977 B12R1.891 O=S(=O)([O-])CNC1CCCOC1 34a_100000719290_100009817235 [0,0,0,0,1,0|1,0,1]=3 978 B12R1.891 O=S(=O)([O-])CNC1CCOCC1 34a_100000741149_100009817235 [0,0,0,0,1,0|1,0,1]=3 979 B12R1.891 O=S(=O)([O-])CNC1CCSCC1 34a_100000748639_100009817235 [0,0,0,0,1,0|1,0,1]=3 980 B12R1.891 O=S(=O)([O-])COC1CCCCC1 34a_100000210231_100009817235 [0,0,0,0,1,0|1,0,1]=3 981 B12R1.891 O=S(=O)([O-])COC1CCCCO1 34a_100000033831_100009817235 [0,0,0,0,1,0|2,0,1]=4 982 B12R1.891 O=S(=O)([O-])COC1CCCOC1 34a_100000754041_100009817235 [0,0,0,0,1,0|2,0,1]=4 983 B12R1.891 O=S(=O)([O-])COC1CCOCC1 34a_100000744328_100009817235 [0,0,0,0,1,0|2,0,1]=4 984 B12R1.891 O=S(=O)([O-])COC1CCSCC1 34a_100000731022_100009817235 [0,0,0,0,1,0|2,0,1]=4 985 B12R1.891 O=S(=O)([O-])CSC1CCCCC1 62a_100000210327_100009817235 [0,0,0,0,1,0|1,0,1]=3 986 B12R1.891 O=S(=O)([O-])CSC1CCCCC1 62a_100009817235_100000210327 [0,0,0,0,1,0|1,0,1]=3 987 B12R1.891 O=S(=O)([O-])CSC1CCCOC1 62a_100009817235_100000693364 [0,0,0,0,1,0|2,0,1]=4 988 B12R1.891 O=S(=O)([O-])CSC1CCOCC1 62a_100009817235_100011324220 [0,0,0,0,1,0|2,0,1]=4 989 B12R1.891 O=S(=O)([O-])CSC1CCSCC1 62a_100009817235_100000069128 [0,0,0,0,1,0|2,0,1]=4 990 B14R1.3331 CC(C)(O)CCCNC1CCCCC1 2230a_100000182618_100009888830 [0,0,0,0,0,1|3,0,0]=4 991 B14R1.3331 CC(C)(O)CCCNC1CCCCC1 34a_100000182618_100009888830 [0,0,0,0,0,1|3,0,0]=4 992 B14R1.3331 CC(C)(O)CCNCC1CCCCC1 2230a_100000210473_100000702414 [0,0,0,0,0,1|3,0,0]=4 993 B14R1.3331 CC(C)(O)CCNCC1CCCCC1 269862a_100000707701_100000211278 [0,0,0,0,0,1|3,0,0]=4 994 B14R1.3331 CC(C)(O)CCNCC1CCCCC1 34a_100000210473_100000702414 [0,0,0,0,0,1|3,0,0]=4 995 B14R1.3331 CS(=O)(=O)CCCNC1C=CCCC1 2230a_100000742409_100000751183 [0,0,0,0,0,1|1,0,2]=4 996 B14R1.3331 CS(=O)(=O)CCCNC1CCCCC1 2230a_100000182618_100000754308 [0,0,0,0,0,1|1,0,0]=2 997 B14R1.3331 CS(=O)(=O)CCCNC1CCCCC1 270004a_100000742409_100000210434 [0,0,0,0,0,1|1,0,0]=2 998 B14R1.3331 CS(=O)(=O)CCCNC1CCCCC1 34a_100000182618_100000754308 [0,0,0,0,0,1|1,0,0]=2 999 B14R1.3331 CS(=O)(=O)CCCNC1CCCCC1 34a_100000742409_100000210327 [0,0,0,0,0,1|1,0,0]=2 1000 B14R1.3331 CS(=O)(=O)CCCNC1CCCOC1 2230a_100000719290_100000754308 [0,0,0,0,0,1|2,0,0]=3 1001 B14R1.3331 CS(=O)(=O)CCCNC1CCCOC1 270004a_100000742409_100000753404 [0,0,0,0,0,1|2,0,0]=3 1002 B14R1.3331 CS(=O)(=O)CCCNC1CCCOC1 34a_100000719290_100000754308 [0,0,0,0,0,1|2,0,0]=3 1003 B14R1.3331 CS(=O)(=O)CCCNC1CCCOC1 34a_100000742409_100000693364 [0,0,0,0,0,1|2,0,0]=3 1004 B14R1.3331 CS(=O)(=O)CCCNC1CCCSC1 270004a_100000742409_100000057913 [0,0,0,0,0,1|2,0,0]=3 1005 B14R1.3331 CS(=O)(=O)CCCNC1CCNCC1 270004a_100000742409_100015192401 [0,0,0,0,0,1|2,0,0]=3 1006 B14R1.3331 CS(=O)(=O)CCCNC1CCOCC1 2230a_100000741149_100000754308 [0,0,0,0,0,1|2,0,0]=3 1007 B14R1.3331 CS(=O)(=O)CCCNC1CCOCC1 270004a_100000742409_100011217826 [0,0,0,0,0,1|2,0,0]=3 1008 B14R1.3331 CS(=O)(=O)CCCNC1CCOCC1 34a_100000741149_100000754308 [0,0,0,0,0,1|2,0,0]=3 1009 B14R1.3331 CS(=O)(=O)CCCNC1CCSCC1 2230a_100000748639_100000754308 [0,0,0,0,0,1|2,0,0]=3 1010 B14R1.3331 CS(=O)(=O)CCCNC1CCSCC1 270004a_100000742409_100000203788 [0,0,0,0,0,1|2,0,0]=3 1011 B14R1.3331 CS(=O)(=O)CCCNC1CCSCC1 34a_100000742409_100000069128 [0,0,0,0,0,1|2,0,0]=3 1012 B14R1.3331 CS(=O)(=O)CCCNC1CCSCC1 34a_100000748639_100000754308 [0,0,0,0,0,1|2,0,0]=3 1013 B14R1.3331 CS(=O)(=O)CCCOC1CCCCC1 34a_100000210231_100000754308 [0,0,0,0,0,1|2,0,0]=3 1014 B14R1.3331 CS(=O)(=O)CCCOC1CCCCC1 34a_100000689940_100000210327 [0,0,0,0,0,1|2,0,0]=3 1015 B14R1.3331 CS(=O)(=O)CCCOC1CCCCC1 7a_100000210231_100000754308 [0,0,0,0,0,1|2,0,0]=3 1016 B14R1.3331 CS(=O)(=O)CCCOC1CCCCC1 7a_100000689940_100000210327 [0,0,0,0,0,1|2,0,0]=3 1017 B14R1.3331 CS(=O)(=O)CCCOC1CCCCO1 34a_100000033831_100000754308 [0,0,0,0,0,1|3,0,0]=4 1018 B14R1.3331 CS(=O)(=O)CCCOC1CCCOC1 34a_100000689940_100000693364 [0,0,0,0,0,1|3,0,0]=4 1019 B14R1.3331 CS(=O)(=O)CCCOC1CCCOC1 34a_100000754041_100000754308 [0,0,0,0,0,1|3,0,0]=4 1020 B14R1.3331 CS(=O)(=O)CCCOC1CCCOC1 7a_100000689940_100000693364 [0,0,0,0,0,1|3,0,0]=4 1021 B14R1.3331 CS(=O)(=O)CCCOC1CCCSC1 7a_100015962668_100000754308 [0,0,0,0,0,1|3,0,0]=4 1022 B14R1.3331 CS(=O)(=O)CCCOC1CCOCC1 34a_100000744328_100000754308 [0,0,0,0,0,1|3,0,0]=4 1023 B14R1.3331 CS(=O)(=O)CCCOC1CCOCC1 7a_100000689940_100000686592 [0,0,0,0,0,1|3,0,0]=4 1024 B14R1.3331 CS(=O)(=O)CCCOC1CCSCC1 34a_100000689940_100000069128 [0,0,0,0,0,1|3,0,0]=4 1025 B14R1.3331 CS(=O)(=O)CCCOC1CCSCC1 34a_100000731022_100000754308 [0,0,0,0,0,1|3,0,0]=4 1026 B14R1.3331 CS(=O)(=O)CCCOC1CCSCC1 7a_100000689940_100011500858 [0,0,0,0,0,1|3,0,0]=4 1027 B14R1.3331 CS(=O)(=O)CCCOC1CCSCC1 7a_100000731022_100000754308 [0,0,0,0,0,1|3,0,0]=4 1028 B14R1.3331 CS(=O)(=O)CCCSC1CCCCC1 62a_100000210327_100000754308 [0,0,0,0,0,1|2,0,0]=3 1029 B14R1.3331 CS(=O)(=O)CCCSC1CCCCC1 62a_100000754308_100000210327 [0,0,0,0,0,1|2,0,0]=3 1030 B14R1.3331 CS(=O)(=O)CCCSC1CCCOC1 62a_100000754308_100000693364 [0,0,0,0,0,1|3,0,0]=4 1031 B14R1.3331 CS(=O)(=O)CCCSC1CCOCC1 62a_100000754308_100011324220 [0,0,0,0,0,1|3,0,0]=4 1032 B14R1.3331 CS(=O)(=O)CCCSC1CCSCC1 62a_100000754308_100000069128 [0,0,0,0,0,1|3,0,0]=4 1033 B14R1.3331 CS(=O)(=O)CCNCC1CC=CCC1 270004a_100000740961_100000189434 [0,0,0,0,0,1|1,0,2]=4 1034 B14R1.3331 CS(=O)(=O)CCNCC1CCCCC1 2230a_100000210473_100000731031 [0,0,0,0,0,1|1,0,0]=2 1035 B14R1.3331 CS(=O)(=O)CCNCC1CCCCC1 2230a_100000740961_100000211423 [0,0,0,0,0,1|1,0,0]=2 1036 B14R1.3331 CS(=O)(=O)CCNCC1CCCCC1 269862a_100000740961_100000211278 [0,0,0,0,0,1|1,0,0]=2 1037 B14R1.3331 CS(=O)(=O)CCNCC1CCCCC1 34a_100000210473_100000731031 [0,0,0,0,0,1|1,0,0]=2 1038 B14R1.3331 CS(=O)(=O)CCNCC1CCCCC1 34a_100000740961_100000211423 [0,0,0,0,0,1|1,0,0]=2 1039 B14R1.3331 CS(=O)(=O)CCNCC1CCCCO1 2230a_100000174945_100000731031 [0,0,0,0,0,1|2,0,0]=3 1040 B14R1.3331 CS(=O)(=O)CCNCC1CCCCO1 2230a_100000740961_100000211543 [0,0,0,0,0,1|2,0,0]=3 1041 B14R1.3331 CS(=O)(=O)CCNCC1CCCCO1 34a_100000174945_100000731031 [0,0,0,0,0,1|2,0,0]=3 1042 B14R1.3331 CS(=O)(=O)CCNCC1CCCCO1 34a_100000740961_100000211543 [0,0,0,0,0,1|2,0,0]=3 1043 B14R1.3331 CS(=O)(=O)CCNCC1CCCOC1 2230a_100000720124_100000731031 [0,0,0,0,0,1|2,0,0]=3 1044 B14R1.3331 CS(=O)(=O)CCNCC1CCCOC1 2230a_100000740961_100000741521 [0,0,0,0,0,1|2,0,0]=3 1045 B14R1.3331 CS(=O)(=O)CCNCC1CCCOC1 34a_100000720124_100000731031 [0,0,0,0,0,1|2,0,0]=3 1046 B14R1.3331 CS(=O)(=O)CCNCC1CCCOC1 34a_100000740961_100000741521 [0,0,0,0,0,1|2,0,0]=3 1047 B14R1.3331 CS(=O)(=O)CCNCC1CCOCC1 2230a_100000740961_100000754603 [0,0,0,0,0,1|2,0,0]=3 1048 B14R1.3331 CS(=O)(=O)CCNCC1CCOCC1 2230a_100000746373_100000731031 [0,0,0,0,0,1|2,0,0]=3 1049 B14R1.3331 CS(=O)(=O)CCNCC1CCOCC1 269862a_100000740961_100000749017 [0,0,0,0,0,1|2,0,0]=3 1050 B14R1.3331 CS(=O)(=O)CCNCC1CCOCC1 34a_100000740961_100000754603 [0,0,0,0,0,1|2,0,0]=3 1051 B14R1.3331 CS(=O)(=O)CCNCC1CCOCC1 34a_100000746373_100000731031 [0,0,0,0,0,1|2,0,0]=3 1052 B14R1.3331 CS(=O)(=O)CCNCC1CCSCC1 2230a_100015188806_100000731031 [0,0,0,0,0,1|2,0,0]=3 1053 B14R1.3331 CS(=O)(=O)CCNCC1CCSCC1 269862a_100000740961_100000067145 [0,0,0,0,0,1|2,0,0]=3 1054 B14R1.3331 CS(=O)(=O)CCNCC1CCSCC1 270004a_100000740961_100000067145 [0,0,0,0,0,1|2,0,0]=3 1055 B14R1.3331 CS(=O)(=O)CCNCC1CCSCC1 34a_100015188806_100000731031 [0,0,0,0,0,1|2,0,0]=3 1056 B14R1.3331 CS(=O)(=O)CCNC[C@H]1COCCO1 2230a_100010981119_100000731031 [0,0,0,0,0,1|3,0,0]=4 1057 B14R1.3331 CS(=O)(=O)CCNC[C@H]1COCCO1 34a_100010981119_100000731031 [0,0,0,0,0,1|3,0,0]=4 1058 B14R1.3331 CS(=O)(=O)CCOCC1CCCCC1 34a_100000211924_100000211423 [0,0,0,0,0,1|2,0,0]=3 1059 B14R1.3331 CS(=O)(=O)CCOCC1CCCCC1 34a_100000212181_100000731031 [0,0,0,0,0,1|2,0,0]=3 1060 B14R1.3331 CS(=O)(=O)CCOCC1CCCCC1 7a_100000211924_100000211423 [0,0,0,0,0,1|2,0,0]=3 1061 B14R1.3331 CS(=O)(=O)CCOCC1CCCCC1 7a_100000212181_100000230027 [0,0,0,0,0,1|2,0,0]=3 1062 B14R1.3331 CS(=O)(=O)CCOCC1CCCCN1 34a_100000210821_100000731031 [0,0,0,0,0,1|3,0,0]=4 1063 B14R1.3331 CS(=O)(=O)CCOCC1CCCCO1 34a_100000211370_100000731031 [0,0,0,0,0,1|3,0,0]=4 1064 B14R1.3331 CS(=O)(=O)CCOCC1CCCCO1 34a_100000211924_100000211543 [0,0,0,0,0,1|3,0,0]=4 1065 B14R1.3331 CS(=O)(=O)CCOCC1CCCCO1 7a_100000211370_100000230027 [0,0,0,0,0,1|3,0,0]=4 1066 B14R1.3331 CS(=O)(=O)CCOCC1CCCCO1 7a_100000211924_100000211543 [0,0,0,0,0,1|3,0,0]=4 1067 B14R1.3331 CS(=O)(=O)CCOCC1CCCNC1 34a_100000211344_100000731031 [0,0,0,0,0,1|3,0,0]=4 1068 B14R1.3331 CS(=O)(=O)CCOCC1CCCOC1 34a_100000211924_100000741521 [0,0,0,0,0,1|3,0,0]=4 1069 B14R1.3331 CS(=O)(=O)CCOCC1CCCOC1 34a_100000741520_100000731031 [0,0,0,0,0,1|3,0,0]=4 1070 B14R1.3331 CS(=O)(=O)CCOCC1CCCOC1 7a_100000211924_100000741521 [0,0,0,0,0,1|3,0,0]=4 1071 B14R1.3331 CS(=O)(=O)CCOCC1CCNCC1 34a_100000738675_100000731031 [0,0,0,0,0,1|3,0,0]=4 1072 B14R1.3331 CS(=O)(=O)CCOCC1CCOCC1 34a_100000211924_100000754603 [0,0,0,0,0,1|3,0,0]=4 1073 B14R1.3331 CS(=O)(=O)CCOCC1CCOCC1 34a_100000749013_100000731031 [0,0,0,0,0,1|3,0,0]=4 1074 B14R1.3331 CS(=O)(=O)CCOCC1CCOCC1 7a_100000211924_100000754603 [0,0,0,0,0,1|3,0,0]=4 1075 B14R1.3331 CS(=O)(=O)CCOCC1CCSCC1 34a_100000070558_100000731031 [0,0,0,0,0,1|3,0,0]=4 1076 B14R1.3331 CS(=O)(=O)CCOCC1CCSCC1 7a_100000070558_100000230027 [0,0,0,0,0,1|3,0,0]=4 1077 B14R1.3331 CS(=O)(=O)CCSCC1CCCCC1 62a_100000211423_100000230027 [0,0,0,0,0,1|2,0,0]=3 1078 B14R1.3331 CS(=O)(=O)CCSCC1CCCCC1 62a_100000731031_100000211423 [0,0,0,0,0,1|2,0,0]=3 1079 B14R1.3331 CS(=O)(=O)CCSCC1CCCCO1 62a_100000211543_100000230027 [0,0,0,0,0,1|3,0,0]=4 1080 B14R1.3331 CS(=O)(=O)CCSCC1CCCCO1 62a_100000731031_100000211543 [0,0,0,0,0,1|3,0,0]=4 1081 B14R1.3331 CS(=O)(=O)CCSCC1CCCOC1 62a_100000731031_100000741521 [0,0,0,0,0,1|3,0,0]=4 1082 B14R1.3331 CS(=O)(=O)CCSCC1CCCOC1 62a_100000741521_100000230027 [0,0,0,0,0,1|3,0,0]=4 1083 B14R1.3331 CS(=O)(=O)CCSCC1CCOCC1 62a_100000731031_100000749018 [0,0,0,0,0,1|3,0,0]=4 1084 B14R1.3331 CS(=O)(=O)CCSCC1CCOCC1 62a_100000754603_100000230027 [0,0,0,0,0,1|3,0,0]=4 1085 B14R1.3331 CS(=O)(=O)NCCCC1CCCCC1 40a_100011211642_100000738038 [0,0,0,0,0,1|2,0,0]=3 1086 B14R1.3331 CS(=O)(=O)NCCCN1CCCCC1 40a_100000204581_100000738038 [0,0,0,0,0,1|3,0,0]=4 1087 B14R1.3331 CS(=O)(=O)NCCNC1CCCCC1 2230a_100000182618_100000754112 [0,0,0,0,0,1|1,0,0]=2 1088 B14R1.3331 CS(=O)(=O)NCCNC1CCCCC1 270004a_100000752411_100000210434 [0,0,0,0,0,1|1,0,0]=2 1089 B14R1.3331 CS(=O)(=O)NCCNC1CCCCC1 34a_100000752411_100000210327 [0,0,0,0,0,1|1,0,0]=2 1090 B14R1.3331 CS(=O)(=O)NCCNC1CCCOC1 2230a_100000719290_100000754112 [0,0,0,0,0,1|2,0,0]=3 1091 B14R1.3331 CS(=O)(=O)NCCNC1CCCOC1 270004a_100000752411_100000753404 [0,0,0,0,0,1|2,0,0]=3 1092 B14R1.3331 CS(=O)(=O)NCCNC1CCCOC1 34a_100000752411_100000693364 [0,0,0,0,0,1|2,0,0]=3 1093 B14R1.3331 CS(=O)(=O)NCCNC1CCCSC1 270004a_100000752411_100000057913 [0,0,0,0,0,1|2,0,0]=3 1094 B14R1.3331 CS(=O)(=O)NCCNC1CCNCC1 270004a_100000752411_100015192401 [0,0,0,0,0,1|2,0,0]=3 1095 B14R1.3331 CS(=O)(=O)NCCNC1CCOCC1 2230a_100000741149_100000754112 [0,0,0,0,0,1|2,0,0]=3 1096 B14R1.3331 CS(=O)(=O)NCCNC1CCOCC1 270004a_100000752411_100011217826 [0,0,0,0,0,1|2,0,0]=3 1097 B14R1.3331 CS(=O)(=O)NCCNC1CCSCC1 2230a_100000748639_100000754112 [0,0,0,0,0,1|2,0,0]=3 1098 B14R1.3331 CS(=O)(=O)NCCNC1CCSCC1 270004a_100000752411_100000203788 [0,0,0,0,0,1|2,0,0]=3 1099 B14R1.3331 CS(=O)(=O)NCCNC1CCSCC1 34a_100000752411_100000069128 [0,0,0,0,0,1|2,0,0]=3 1100 B14R1.3331 CS(=O)(=O)NCCOC1CCCCC1 40a_100015206981_100000738038 [0,0,0,0,0,1|2,0,0]=3 1101 B14R1.3331 CS(=O)(=O)NCCOC1CCCCC1 7a_100000210231_100000754112 [0,0,0,0,0,1|2,0,0]=3 1102 B14R1.3331 CS(=O)(=O)NCCOC1CCCSC1 7a_100015962668_100000754112 [0,0,0,0,0,1|3,0,0]=4 1103 B14R1.3331 CS(=O)(=O)NCCOC1CCSCC1 7a_100000731022_100000754112 [0,0,0,0,0,1|3,0,0]=4 1104 B14R1.3331 CS(=O)(=O)NCCSC1CCCCC1 62a_100000210327_100000754112 [0,0,0,0,0,1|2,0,0]=3 1105 B14R1.3331 CS(=O)(=O)NCCSC1CCCCC1 62a_100000754112_100000210327 [0,0,0,0,0,1|2,0,0]=3 1106 B14R1.3331 CS(=O)(=O)NCCSC1CCCOC1 62a_100000754112_100000693364 [0,0,0,0,0,1|3,0,0]=4 1107 B14R1.3331 CS(=O)(=O)NCCSC1CCOCC1 62a_100000754112_100011324220 [0,0,0,0,0,1|3,0,0]=4 1108 B14R1.3331 CS(=O)(=O)NCCSC1CCSCC1 62a_100000754112_100000069128 [0,0,0,0,0,1|3,0,0]=4 1109 B14R1.3331 CS(=O)(=O)OCCNC1CCCCC1 2230a_100000182618_200000036756 [0,0,0,0,0,1|1,0,0]=2 1110 B14R1.3331 CS(=O)(=O)OCCNC1CCCCC1 34a_100000182618_200000036756 [0,0,0,0,0,1|1,0,0]=2 1111 B14R1.3331 CS(=O)(=O)OCCNC1CCCOC1 2230a_100000719290_200000036756 [0,0,0,0,0,1|2,0,0]=3 1112 B14R1.3331 CS(=O)(=O)OCCNC1CCCOC1 34a_100000719290_200000036756 [0,0,0,0,0,1|2,0,0]=3 1113 B14R1.3331 CS(=O)(=O)OCCNC1CCOCC1 2230a_100000741149_200000036756 [0,0,0,0,0,1|2,0,0]=3 1114 B14R1.3331 CS(=O)(=O)OCCNC1CCOCC1 34a_100000741149_200000036756 [0,0,0,0,0,1|2,0,0]=3 1115 B14R1.3331 CS(=O)(=O)OCCNC1CCSCC1 2230a_100000748639_200000036756 [0,0,0,0,0,1|2,0,0]=3 1116 B14R1.3331 CS(=O)(=O)OCCNC1CCSCC1 34a_100000748639_200000036756 [0,0,0,0,0,1|2,0,0]=3 1117 B14R1.3331 CS(=O)(=O)OCCOC1CCCCC1 34a_100000210231_200000036756 [0,0,0,0,0,1|2,0,0]=3 1118 B14R1.3331 CS(=O)(=O)OCCOC1CCCCC1 7a_100000210231_200000036756 [0,0,0,0,0,1|2,0,0]=3 1119 B14R1.3331 CS(=O)(=O)OCCOC1CCCCO1 34a_100000033831_200000036756 [0,0,0,0,0,1|3,0,0]=4 1120 B14R1.3331 CS(=O)(=O)OCCOC1CCCOC1 34a_100000754041_200000036756 [0,0,0,0,0,1|3,0,0]=4 1121 B14R1.3331 CS(=O)(=O)OCCOC1CCCSC1 7a_100015962668_200000036756 [0,0,0,0,0,1|3,0,0]=4 1122 B14R1.3331 CS(=O)(=O)OCCOC1CCOCC1 34a_100000744328_200000036756 [0,0,0,0,0,1|3,0,0]=4 1123 B14R1.3331 CS(=O)(=O)OCCOC1CCSCC1 34a_100000731022_200000036756 [0,0,0,0,0,1|3,0,0]=4 1124 B14R1.3331 CS(=O)(=O)OCCOC1CCSCC1 7a_100000731022_200000036756 [0,0,0,0,0,1|3,0,0]=4 1125 B14R1.3331 CS(=O)(=O)OCCSC1CCCCC1 62a_100000210327_200000036756 [0,0,0,0,0,1|2,0,0]=3 1126 B14R1.3331 CS(=O)(=O)OCCSC1CCCCC1 62a_200000036756_100000210327 [0,0,0,0,0,1|2,0,0]=3 1127 B14R1.3331 CS(=O)(=O)OCCSC1CCCOC1 62a_200000036756_100000693364 [0,0,0,0,0,1|3,0,0]=4 1128 B14R1.3331 CS(=O)(=O)OCCSC1CCOCC1 62a_200000036756_100011324220 [0,0,0,0,0,1|3,0,0]=4 1129 B14R1.3331 CS(=O)(=O)OCCSC1CCSCC1 62a_200000036756_100000069128 [0,0,0,0,0,1|3,0,0]=4 1130 B14R1.3331 NS(=O)(=O)CCCNC1CCCCC1 2230a_100000182618_100000750626 [0,0,0,0,0,1|1,0,0]=2 1131 B14R1.3331 NS(=O)(=O)CCCNC1CCCCC1 34a_100000182618_100000750626 [0,0,0,0,0,1|1,0,0]=2 1132 B14R1.3331 NS(=O)(=O)CCCNC1CCCOC1 2230a_100000719290_100000750626 [0,0,0,0,0,1|2,0,0]=3 1133 B14R1.3331 NS(=O)(=O)CCCNC1CCCOC1 34a_100000719290_100000750626 [0,0,0,0,0,1|2,0,0]=3 1134 B14R1.3331 NS(=O)(=O)CCCNC1CCOCC1 2230a_100000741149_100000750626 [0,0,0,0,0,1|2,0,0]=3 1135 B14R1.3331 NS(=O)(=O)CCCNC1CCOCC1 34a_100000741149_100000750626 [0,0,0,0,0,1|2,0,0]=3 1136 B14R1.3331 NS(=O)(=O)CCCNC1CCSCC1 2230a_100000748639_100000750626 [0,0,0,0,0,1|2,0,0]=3 1137 B14R1.3331 NS(=O)(=O)CCCNC1CCSCC1 34a_100000748639_100000750626 [0,0,0,0,0,1|2,0,0]=3 1138 B14R1.3331 NS(=O)(=O)CCCOC1CCCCC1 34a_100000210231_100000750626 [0,0,0,0,0,1|2,0,0]=3 1139 B14R1.3331 NS(=O)(=O)CCCOC1CCCCC1 7a_100000210231_100000750626 [0,0,0,0,0,1|2,0,0]=3 1140 B14R1.3331 NS(=O)(=O)CCCOC1CCCCO1 34a_100000033831_100000750626 [0,0,0,0,0,1|3,0,0]=4 1141 B14R1.3331 NS(=O)(=O)CCCOC1CCCOC1 34a_100000754041_100000750626 [0,0,0,0,0,1|3,0,0]=4 1142 B14R1.3331 NS(=O)(=O)CCCOC1CCCSC1 7a_100015962668_100000750626 [0,0,0,0,0,1|3,0,0]=4 1143 B14R1.3331 NS(=O)(=O)CCCOC1CCOCC1 34a_100000744328_100000750626 [0,0,0,0,0,1|3,0,0]=4 1144 B14R1.3331 NS(=O)(=O)CCCOC1CCSCC1 34a_100000731022_100000750626 [0,0,0,0,0,1|3,0,0]=4 1145 B14R1.3331 NS(=O)(=O)CCCOC1CCSCC1 7a_100000731022_100000750626 [0,0,0,0,0,1|3,0,0]=4 1146 B14R1.3331 NS(=O)(=O)CCCSC1CCCCC1 62a_100000210327_100000750626 [0,0,0,0,0,1|2,0,0]=3 1147 B14R1.3331 NS(=O)(=O)CCCSC1CCCCC1 62a_100000750626_100000210327 [0,0,0,0,0,1|2,0,0]=3 1148 B14R1.3331 NS(=O)(=O)CCCSC1CCCOC1 62a_100000750626_100000693364 [0,0,0,0,0,1|3,0,0]=4 1149 B14R1.3331 NS(=O)(=O)CCCSC1CCOCC1 62a_100000750626_100011324220 [0,0,0,0,0,1|3,0,0]=4 1150 B14R1.3331 NS(=O)(=O)CCCSC1CCSCC1 62a_100000750626_100000069128 [0,0,0,0,0,1|3,0,0]=4 1151 B14R1.3331 NS(=O)(=O)CCNCC1CC=CCC1 270004a_100000738205_100000189434 [0,0,0,0,0,1|1,0,2]=4 1152 B14R1.3331 NS(=O)(=O)CCNCC1CCCCC1 2230a_100000738205_100000211423 [0,0,0,0,0,1|1,0,0]=2 1153 B14R1.3331 NS(=O)(=O)CCNCC1CCCCC1 269862a_100000738205_100000211278 [0,0,0,0,0,1|1,0,0]=2 1154 B14R1.3331 NS(=O)(=O)CCNCC1CCCCC1 34a_100000738205_100000211423 [0,0,0,0,0,1|1,0,0]=2 1155 B14R1.3331 NS(=O)(=O)CCNCC1CCCCO1 2230a_100000738205_100000211543 [0,0,0,0,0,1|2,0,0]=3 1156 B14R1.3331 NS(=O)(=O)CCNCC1CCCCO1 34a_100000738205_100000211543 [0,0,0,0,0,1|2,0,0]=3 1157 B14R1.3331 NS(=O)(=O)CCNCC1CCCOC1 2230a_100000738205_100000741521 [0,0,0,0,0,1|2,0,0]=3 1158 B14R1.3331 NS(=O)(=O)CCNCC1CCCOC1 34a_100000738205_100000741521 [0,0,0,0,0,1|2,0,0]=3 1159 B14R1.3331 NS(=O)(=O)CCNCC1CCOCC1 2230a_100000738205_100000754603 [0,0,0,0,0,1|2,0,0]=3 1160 B14R1.3331 NS(=O)(=O)CCNCC1CCOCC1 269862a_100000738205_100000749017 [0,0,0,0,0,1|2,0,0]=3 1161 B14R1.3331 NS(=O)(=O)CCNCC1CCOCC1 34a_100000738205_100000754603 [0,0,0,0,0,1|2,0,0]=3 1162 B14R1.3331 NS(=O)(=O)CCNCC1CCSCC1 269862a_100000738205_100000067145 [0,0,0,0,0,1|2,0,0]=3 1163 B14R1.3331 NS(=O)(=O)CCNCC1CCSCC1 270004a_100000738205_100000067145 [0,0,0,0,0,1|2,0,0]=3 1164 B14R1.3331 NS(=O)(=O)CCOCC1CCCCC1 34a_100012334274_100000211423 [0,0,0,0,0,1|2,0,0]=3 1165 B14R1.3331 NS(=O)(=O)CCOCC1CCCCO1 34a_100012334274_100000211543 [0,0,0,0,0,1|3,0,0]=4 1166 B14R1.3331 NS(=O)(=O)CCOCC1CCCOC1 34a_100012334274_100000741521 [0,0,0,0,0,1|3,0,0]=4 1167 B14R1.3331 NS(=O)(=O)CCOCC1CCOCC1 34a_100012334274_100000754603 [0,0,0,0,0,1|3,0,0]=4 1168 B14R1.3331 NS(=O)(=O)CSCCC1CCCCC1 62a_100000741382_100012355289 [0,0,0,0,0,1|2,0,0]=3 1169 B14R1.3331 NS(=O)(=O)CSCCC1CCCCC1 62a_100012355289_100000741382 [0,0,0,0,0,1|2,0,0]=3 1170 B14R1.3331 NS(=O)(=O)CSCCC1CCOCC1 62a_100000741382_100011934994 [0,0,0,0,0,1|3,0,0]=4 1171 B14R1.3331 NS(=O)(=O)CSCCC1CCOCC1 62a_100011934994_100000741382 [0,0,0,0,0,1|3,0,0]=4 1172 B14R1.3331 NS(=O)(=O)CSCCN1CCCCC1 62a_100000739454_100000741382 [0,0,0,0,0,1|3,0,0]=4 1173 B14R1.3331 NS(=O)(=O)CSCCN1CCCCC1 62a_100000741382_100000739454 [0,0,0,0,0,1|3,0,0]=4 1174 B14R1.3331 NS(=O)(=O)CSCOC1CCCCC1 62a_100000741382_100011935260 [0,0,0,0,0,1|2,0,0]=3 1175 B14R1.3331 NS(=O)(=O)CSCOC1CCCCC1 62a_100011935260_100000741382 [0,0,0,0,0,1|2,0,0]=3 1176 B14R1.3331 O=S(=O)([O-])CCCNC1CCCCC1 34a_100000182618_100009813499 [0,0,0,0,0,1|0,0,1]=2 1177 B14R1.3331 O=S(=O)([O-])CCCNC1CCCOC1 34a_100000719290_100009813499 [0,0,0,0,0,1|1,0,1]=3 1178 B14R1.3331 O=S(=O)([O-])CCCNC1CCOCC1 34a_100000741149_100009813499 [0,0,0,0,0,1|1,0,1]=3 1179 B14R1.3331 O=S(=O)([O-])CCCNC1CCSCC1 34a_100000748639_100009813499 [0,0,0,0,0,1|1,0,1]=3 1180 B14R1.3331 O=S(=O)([O-])CCCOC1CCCCC1 34a_100000210231_100009813499 [0,0,0,0,0,1|1,0,1]=3 1181 B14R1.3331 O=S(=O)([O-])CCCOC1CCCCO1 34a_100000033831_100009813499 [0,0,0,0,0,1|2,0,1]=4 1182 B14R1.3331 O=S(=O)([O-])CCCOC1CCCOC1 34a_100000754041_100009813499 [0,0,0,0,0,1|2,0,1]=4 1183 B14R1.3331 O=S(=O)([O-])CCCOC1CCOCC1 34a_100000744328_100009813499 [0,0,0,0,0,1|2,0,1]=4 1184 B14R1.3331 O=S(=O)([O-])CCCOC1CCSCC1 34a_100000731022_100009813499 [0,0,0,0,0,1|2,0,1]=4 1185 B14R1.3331 O=S(=O)([O-])CCCSC1CCCCC1 62a_100000210327_100009813499 [0,0,0,0,0,1|1,0,1]=3 1186 B14R1.3331 O=S(=O)([O-])CCCSC1CCCCC1 62a_100009813499_100000210327 [0,0,0,0,0,1|1,0,1]=3 1187 B14R1.3331 O=S(=O)([O-])CCCSC1CCCOC1 62a_100009813499_100000693364 [0,0,0,0,0,1|2,0,1]=4 1188 B14R1.3331 O=S(=O)([O-])CCCSC1CCOCC1 62a_100009813499_100011324220 [0,0,0,0,0,1|2,0,1]=4 1189 B14R1.3331 O=S(=O)([O-])CCCSC1CCSCC1 62a_100009813499_100000069128 [0,0,0,0,0,1|2,0,1]=4 1190 B14R1.3331 O=S(=O)([O-])CCNCC1CCCCC1 2230a_100000210473_100000737633 [0,0,0,0,0,1|0,0,1]=2 1191 B14R1.3331 O=S(=O)([O-])CCNCC1CCCCC1 34a_100000210473_100000762736 [0,0,0,0,0,1|0,0,1]=2 1192 B14R1.3331 O=S(=O)([O-])CCNCC1CCCCO1 2230a_100000174945_100000737633 [0,0,0,0,0,1|1,0,1]=3 1193 B14R1.3331 O=S(=O)([O-])CCNCC1CCCCO1 34a_100000174945_100000762736 [0,0,0,0,0,1|1,0,1]=3 1194 B14R1.3331 O=S(=O)([O-])CCNCC1CCCOC1 2230a_100000720124_100000737633 [0,0,0,0,0,1|1,0,1]=3 1195 B14R1.3331 O=S(=O)([O-])CCNCC1CCCOC1 34a_100000720124_100000762736 [0,0,0,0,0,1|1,0,1]=3 1196 B14R1.3331 O=S(=O)([O-])CCNCC1CCOCC1 2230a_100000746373_100000737633 [0,0,0,0,0,1|1,0,1]=3 1197 B14R1.3331 O=S(=O)([O-])CCNCC1CCOCC1 34a_100000746373_100000762736 [0,0,0,0,0,1|1,0,1]=3 1198 B14R1.3331 O=S(=O)([O-])CCNCC1CCSCC1 2230a_100015188806_100000737633 [0,0,0,0,0,1|1,0,1]=3 1199 B14R1.3331 O=S(=O)([O-])CCNCC1CCSCC1 34a_100015188806_100000762736 [0,0,0,0,0,1|1,0,1]=3 1200 B14R1.3331 O=S(=O)([O-])CCNC[C@H]1COCCO1 2230a_100010981119_100000737633 [0,0,0,0,0,1|2,0,1]=4 1201 B14R1.3331 O=S(=O)([O-])CCNC[C@H]1COCCO1 34a_100010981119_100000762736 [0,0,0,0,0,1|2,0,1]=4 1202 B14R1.3331 O=S(=O)([O-])CCOCC1CCCCC1 34a_100000212181_100000762736 [0,0,0,0,0,1|1,0,1]=3 1203 B14R1.3331 O=S(=O)([O-])CCOCC1CCCCN1 34a_100000210821_100000762736 [0,0,0,0,0,1|2,0,1]=4 1204 B14R1.3331 O=S(=O)([O-])CCOCC1CCCCO1 34a_100000211370_100000762736 [0,0,0,0,0,1|2,0,1]=4 1205 B14R1.3331 O=S(=O)([O-])CCOCC1CCCNC1 34a_100000211344_100000762736 [0,0,0,0,0,1|2,0,1]=4 1206 B14R1.3331 O=S(=O)([O-])CCOCC1CCCOC1 34a_100000741520_100000762736 [0,0,0,0,0,1|2,0,1]=4 1207 B14R1.3331 O=S(=O)([O-])CCOCC1CCNCC1 34a_100000738675_100000762736 [0,0,0,0,0,1|2,0,1]=4 1208 B14R1.3331 O=S(=O)([O-])CCOCC1CCOCC1 34a_100000749013_100000762736 [0,0,0,0,0,1|2,0,1]=4 1209 B14R1.3331 O=S(=O)([O-])CCOCC1CCSCC1 34a_100000070558_100000762736 [0,0,0,0,0,1|2,0,1]=4 1210 B14R1.3331 O=S(=O)([O-])CCSCC1CCCCC1 62a_100000211423_100000762736 [0,0,0,0,0,1|1,0,1]=3 1211 B14R1.3331 O=S(=O)([O-])CCSCC1CCCCC1 62a_100000762736_100000211423 [0,0,0,0,0,1|1,0,1]=3 1212 B14R1.3331 O=S(=O)([O-])CCSCC1CCCCO1 62a_100000211543_100000762736 [0,0,0,0,0,1|2,0,1]=4 1213 B14R1.3331 O=S(=O)([O-])CCSCC1CCCCO1 62a_100000762736_100000211543 [0,0,0,0,0,1|2,0,1]=4 1214 B14R1.3331 O=S(=O)([O-])CCSCC1CCCOC1 62a_100000741521_100000762736 [0,0,0,0,0,1|2,0,1]=4 1215 B14R1.3331 O=S(=O)([O-])CCSCC1CCCOC1 62a_100000762736_100000741521 [0,0,0,0,0,1|2,0,1]=4 1216 B14R1.3331 O=S(=O)([O-])CCSCC1CCOCC1 62a_100000754603_100000762736 [0,0,0,0,0,1|2,0,1]=4 1217 B14R1.3331 O=S(=O)([O-])CCSCC1CCOCC1 62a_100000762736_100000749018 [0,0,0,0,0,1|2,0,1]=4 1218 B14R1.3331 O=S(=O)([O-])CNCCC1CCCCC1 34a_100000738074_100009817235 [0,0,0,0,0,1|1,0,1]=3 1219 B14R1.3331 O=S(=O)([O-])CNCCC1CCCCO1 34a_100015183643_100009817235 [0,0,0,0,0,1|2,0,1]=4 1220 B14R1.3331 O=S(=O)([O-])CNCCC1CCOCC1 34a_100000755988_100009817235 [0,0,0,0,0,1|2,0,1]=4 1221 B14R1.3331 O=S(=O)([O-])COCCC1CCCCC1 34a_100011217863_100009817235 [0,0,0,0,0,1|1,0,1]=3 1222 B14R1.3331 O=S(=O)([O-])COCCC1CCCCN1 34a_100000211664_100009817235 [0,0,0,0,0,1|2,0,1]=4 1223 B14R1.3331 O=S(=O)([O-])COCCC1CCCNC1 34a_100000752241_100009817235 [0,0,0,0,0,1|2,0,1]=4 1224 B14R1.3331 O=S(=O)([O-])COCCC1CCNCC1 34a_100015190746_100009817235 [0,0,0,0,0,1|2,0,1]=4 1225 B14R1.3331 O=S(=O)([O-])COCCC1CCOCC1 34a_100011933979_100009817235 [0,0,0,0,0,1|2,0,1]=4 1226 B14R1.3331 O=S(=O)([O-])CSCCC1CCCCC1 62a_100009817235_100012355289 [0,0,0,0,0,1|1,0,1]=3 1227 B14R1.3331 O=S(=O)([O-])CSCCC1CCCCC1 62a_100012355289_100009817235 [0,0,0,0,0,1|1,0,1]=3 1228 B14R1.3331 O=S(=O)([O-])CSCCC1CCOCC1 62a_100009817235_100011934994 [0,0,0,0,0,1|2,0,1]=4 1229 B14R1.3331 O=S(=O)([O-])CSCCC1CCOCC1 62a_100011934994_100009817235 [0,0,0,0,0,1|2,0,1]=4 1230 B14R1.3331 O=S(=O)([O-])CSCCN1CCCCC1 62a_100000739454_100009817235 [0,0,0,0,0,1|2,0,1]=4 1231 B14R1.3331 O=S(=O)([O-])CSCCN1CCCCC1 62a_100009817235_100000739454 [0,0,0,0,0,1|2,0,1]=4 1232 B14R1.3331 O=S(=O)([O-])CSCOC1CCCCC1 62a_100009817235_100011935260 [0,0,0,0,0,1|1,0,1]=3 1233 B14R1.3331 O=S(=O)([O-])CSCOC1CCCCC1 62a_100011935260_100009817235 [0,0,0,0,0,1|1,0,1]=3 1234 B14R1.10310 CC(C)(O)CCNC1CCCCCC1 2230a_100000210984_100000702414 [0,0,0,0,0,1|3,0,0]=4 1235 B14R1.10310 CC(C)(O)CCNC1CCCCCC1 270004a_100000707701_100000210131 [0,0,0,0,0,1|3,0,0]=4 1236 B14R1.10310 CC(C)(O)CCNC1CCCCCC1 34a_100000210984_100000702414 [0,0,0,0,0,1|3,0,0]=4 1237 B14R1.10310 CC(C)(O)CCNC1CCCNCC1 270004a_100000707701_100015187895 [0,0,0,0,0,1|3,0,0]=4 1238 B14R1.10310 CS(=O)(=O)CCCN1CCCCCC1 2230a_100000185865_100000754308 [0,0,0,0,0,1|3,0,0]=4 1239 B14R1.10310 CS(=O)(=O)CCCN1CCCCCC1 269982a_100000185865_100000754308 [0,0,0,0,0,1|3,0,0]=4 1240 B14R1.10310 CS(=O)(=O)CCCN1CCCCCC1 34a_100000185865_100000754308 [0,0,0,0,0,1|3,0,0]=4 1241 B14R1.10310 CS(=O)(=O)CCCN1CCCOCC1 2230a_100000685342_100000754308 [0,0,0,0,0,1|3,0,0]=4 1242 B14R1.10310 CS(=O)(=O)CCCN1CCCOCC1 269982a_100000685342_100000754308 [0,0,0,0,0,1|3,0,0]=4 1243 B14R1.10310 CS(=O)(=O)CCCN1CCCOCC1 34a_100000685342_100000754308 [0,0,0,0,0,1|3,0,0]=4 1244 B14R1.10310 CS(=O)(=O)CCNC1CCCCCC1 2230a_100000210984_100000731031 [0,0,0,0,0,1|1,0,0]=2 1245 B14R1.10310 CS(=O)(=O)CCNC1CCCCCC1 270004a_100000740961_100000210131 [0,0,0,0,0,1|1,0,0]=2 1246 B14R1.10310 CS(=O)(=O)CCNC1CCCCCC1 34a_100000210984_100000731031 [0,0,0,0,0,1|1,0,0]=2 1247 B14R1.10310 CS(=O)(=O)CCNC1CCCCCC1 34a_100000740961_100011217769 [0,0,0,0,0,1|1,0,0]=2 1248 B14R1.10310 CS(=O)(=O)CCNC1CCCNCC1 270004a_100000740961_100015187895 [0,0,0,0,0,1|1,0,0]=2 1249 B14R1.10310 CS(=O)(=O)CCNC1CSCCSC1 270004a_100000740961_100000068409 [0,0,0,0,0,1|2,0,0]=3 1250 B14R1.10310 CS(=O)(=O)CCOC1CCCCCC1 34a_100000210887_100000731031 [0,0,0,0,0,1|2,0,0]=3 1251 B14R1.10310 CS(=O)(=O)CCOC1CCCCCC1 34a_100000211924_100011217769 [0,0,0,0,0,1|2,0,0]=3 1252 B14R1.10310 CS(=O)(=O)CCOC1CCCCCC1 7a_100000210887_100000230027 [0,0,0,0,0,1|2,0,0]=3 1253 B14R1.10310 CS(=O)(=O)CCSC1CCCCCC1 62a_100000731031_100011217769 [0,0,0,0,0,1|2,0,0]=3 1254 B14R1.10310 CS(=O)(=O)CCSC1CCCCCC1 62a_100011217769_100000230027 [0,0,0,0,0,1|2,0,0]=3 1255 B14R1.10310 CS(=O)(=O)NCCC1CCCCCC1 40a_100011532351_100000738038 [0,0,0,0,0,1|3,0,0]=4 1256 B14R1.10310 NS(=O)(=O)CCCN1CCCCCC1 2230a_100000185865_100000750626 [0,0,0,0,0,1|3,0,0]=4 1257 B14R1.10310 NS(=O)(=O)CCCN1CCCCCC1 269982a_100000185865_100000750626 [0,0,0,0,0,1|3,0,0]=4 1258 B14R1.10310 NS(=O)(=O)CCCN1CCCCCC1 34a_100000185865_100000750626 [0,0,0,0,0,1|3,0,0]=4 1259 B14R1.10310 NS(=O)(=O)CCCN1CCCOCC1 2230a_100000685342_100000750626 [0,0,0,0,0,1|3,0,0]=4 1260 B14R1.10310 NS(=O)(=O)CCCN1CCCOCC1 269982a_100000685342_100000750626 [0,0,0,0,0,1|3,0,0]=4 1261 B14R1.10310 NS(=O)(=O)CCCN1CCCOCC1 34a_100000685342_100000750626 [0,0,0,0,0,1|3,0,0]=4 1262 B14R1.10310 NS(=O)(=O)CCNC1CCCCCC1 270004a_100000738205_100000210131 [0,0,0,0,0,1|1,0,0]=2 1263 B14R1.10310 NS(=O)(=O)CCNC1CCCCCC1 34a_100000738205_100011217769 [0,0,0,0,0,1|1,0,0]=2 1264 B14R1.10310 NS(=O)(=O)CCNC1CCCNCC1 270004a_100000738205_100015187895 [0,0,0,0,0,1|1,0,0]=2 1265 B14R1.10310 NS(=O)(=O)CCNC1CSCCSC1 270004a_100000738205_100000068409 [0,0,0,0,0,1|2,0,0]=3 1266 B14R1.10310 NS(=O)(=O)CCOC1CCCCCC1 34a_100012334274_100011217769 [0,0,0,0,0,1|2,0,0]=3 1267 B14R1.10310 NS(=O)(=O)CSCC1CCCCCC1 62a_100000741382_200000696569 [0,0,0,0,0,1|3,0,0]=4 1268 B14R1.10310 NS(=O)(=O)CSCC1CCCCCC1 62a_200000696569_100000741382 [0,0,0,0,0,1|3,0,0]=4 1269 B14R1.10310 O=S(=O)([O-])CCCN1CCCCCC1 269982a_100000185865_100009813499 [0,0,0,0,0,1|2,0,1]=4 1270 B14R1.10310 O=S(=O)([O-])CCCN1CCCCCC1 34a_100000185865_100009813499 [0,0,0,0,0,1|2,0,1]=4 1271 B14R1.10310 O=S(=O)([O-])CCCN1CCCOCC1 269982a_100000685342_100009813499 [0,0,0,0,0,1|2,0,1]=4 1272 B14R1.10310 O=S(=O)([O-])CCCN1CCCOCC1 34a_100000685342_100009813499 [0,0,0,0,0,1|2,0,1]=4 1273 B14R1.10310 O=S(=O)([O-])CCNC1CCCCCC1 2230a_100000210984_100000737633 [0,0,0,0,0,1|0,0,1]=2 1274 B14R1.10310 O=S(=O)([O-])CCNC1CCCCCC1 34a_100000210984_100000762736 [0,0,0,0,0,1|0,0,1]=2 1275 B14R1.10310 O=S(=O)([O-])CCOC1CCCCCC1 34a_100000210887_100000762736 [0,0,0,0,0,1|1,0,1]=3 1276 B14R1.10310 O=S(=O)([O-])CCSC1CCCCCC1 62a_100000762736_100011217769 [0,0,0,0,0,1|1,0,1]=3 1277 B14R1.10310 O=S(=O)([O-])CCSC1CCCCCC1 62a_100011217769_100000762736 [0,0,0,0,0,1|1,0,1]=3 1278 B14R1.10310 O=S(=O)([O-])CNCC1CCCCCC1 34a_100015204231_100009817235 [0,0,0,0,0,1|2,0,1]=4 1279 B14R1.10310 O=S(=O)([O-])COCC1CCCCCC1 34a_100000699130_100009817235 [0,0,0,0,0,1|2,0,1]=4 1280 B14R1.10310 O=S(=O)([O-])CSCC1CCCCCC1 62a_100009817235_200000696569 [0,0,0,0,0,1|2,0,1]=4 1281 B14R1.10310 O=S(=O)([O-])CSCC1CCCCCC1 62a_200000696569_100009817235 [0,0,0,0,0,1|2,0,1]=4 1282 B11R0.147 CCCCC(C)NCCC(=O)N 2230a_100000126638_100000744528 [1,0,1,0,0,0|2,0,0]=4 1283 B11R0.147 CCCCC(C)NCCC(C)O 2230a_100000126638_100012276601 [1,0,1,0,0,0|2,0,0]=4 1284 B11R0.147 CCCCC(C)NCCC(C)O 2230a_200000755665_200011215066 [1,0,1,0,0,0|2,0,0]=4 1285 B11R0.147 CCCCC(C)NCCC(C)O 270004a_200000755665_100000210087 [1,0,1,0,0,0|2,0,0]=4 1286 B11R0.147 CCCCC(C)NOCC(=O)O 269956a_100000106656_200011215066 [1,0,1,0,0,0|2,0,0]=4 1287 B11R0.159 CCCCCCCNS(=O)(=O)C 40a_100000229938_100000738038 [1,0,1,0,0,0|2,0,0]=4 1288 B11R0.159 CCCCCCOCS(=O)(=O)[O-] 34a_100000210259_100009817235 [1,0,1,0,0,0|1,0,1]=4 1289 B11R0.159 CCCCCCSCS(=O)(=O)N 62a_100000210314_100000741382 [1,0,1,0,0,0|2,0,0]=4 1290 B11R0.159 CCCCCCSCS(=O)(=O)N 62a_100000741382_100000210757 [1,0,1,0,0,0|2,0,0]=4 1291 B11R0.159 CCCCCCSCS(=O)(=O)[O-] 62a_100000210314_100009817235 [1,0,1,0,0,0|1,0,1]=4 1292 B11R0.159 CCCCCCSCS(=O)(=O)[O-] 62a_100009817235_100000210757 [1,0,1,0,0,0|1,0,1]=4 1293 B11R0.159 CCCCCNCCS(=O)(=O)C 2230a_100000209983_100000731031 [1,0,1,0,0,0|1,0,0]=3 1294 B11R0.159 CCCCCNCCS(=O)(=O)C 2230a_100000740961_100000210326 [1,0,1,0,0,0|1,0,0]=3 1295 B11R0.159 CCCCCNCCS(=O)(=O)C 34a_100000740961_100000718602 [1,0,1,0,0,0|1,0,0]=3 1296 B11R0.159 CCCCCNCCS(=O)(=O)N 2230a_100000738205_100000210326 [1,0,1,0,0,0|1,0,0]=3 1297 B11R0.159 CCCCCNCCS(=O)(=O)N 34a_100000738205_100000718602 [1,0,1,0,0,0|1,0,0]=3 1298 B11R0.159 CCCCCNCCS(=O)(=O)[O-] 2230a_100000209983_100000737633 [1,0,1,0,0,0|0,0,1]=3 1299 B11R0.159 CCCCCOCCS(=O)(=O)C 34a_100000210253_100000731031 [1,0,1,0,0,0|2,0,0]=4 1300 B11R0.159 CCCCCOCCS(=O)(=O)C 34a_100000211924_100000718602 [1,0,1,0,0,0|2,0,0]=4 1301 B11R0.159 CCCCCOCCS(=O)(=O)C 7a_100000210253_100000230027 [1,0,1,0,0,0|2,0,0]=4 1302 B11R0.159 CCCCCOCCS(=O)(=O)C 7a_100000211924_100000210326 [1,0,1,0,0,0|2,0,0]=4 1303 B11R0.159 CCCCCOCCS(=O)(=O)N 34a_100012334274_100000718602 [1,0,1,0,0,0|2,0,0]=4 1304 B11R0.159 CCCCCOCCS(=O)(=O)[O-] 34a_100000210253_100000762736 [1,0,1,0,0,0|1,0,1]=4 1305 B11R0.159 CCCCCSCCS(=O)(=O)C 62a_100000210326_100000230027 [1,0,1,0,0,0|2,0,0]=4 1306 B11R0.159 CCCCCSCCS(=O)(=O)C 62a_100000731031_100000210326 [1,0,1,0,0,0|2,0,0]=4 1307 B11R0.159 CCCCCSCCS(=O)(=O)[O-] 62a_100000210326_100000762736 [1,0,1,0,0,0|1,0,1]=4 1308 B11R0.159 CCCCCSCCS(=O)(=O)[O-] 62a_100000762736_100000210326 [1,0,1,0,0,0|1,0,1]=4 1309 B11R0.159 CCCCNCCCS(=O)(=O)C 2230a_100000102301_100000754308 [1,0,1,0,0,0|2,0,0]=4 1310 B11R0.159 CCCCNCCCS(=O)(=O)C 2230a_100000742409_100000210211 [1,0,1,0,0,0|2,0,0]=4 1311 B11R0.159 CCCCNCCCS(=O)(=O)C 34a_100000742409_100000210210 [1,0,1,0,0,0|2,0,0]=4 1312 B11R0.159 CCCCNCCCS(=O)(=O)C 7a_106832991798_100000754308 [1,0,1,0,0,0|2,0,0]=4 1313 B11R0.159 CCCCNCCCS(=O)(=O)N 2230a_100000102301_100000750626 [1,0,1,0,0,0|2,0,0]=4 1314 B11R0.159 CCCCNCCCS(=O)(=O)N 7a_106832991798_100000750626 [1,0,1,0,0,0|2,0,0]=4 1315 B11R0.159 CCCCOCCCS(=O)(=O)C 34a_100000210227_100000754308 [1,0,1,0,0,0|2,0,0]=4 1316 B11R0.159 CCCCOCCCS(=O)(=O)C 34a_100000689940_100000210210 [1,0,1,0,0,0|2,0,0]=4 1317 B11R0.159 CCCCOCCCS(=O)(=O)C 7a_100000210227_100000754308 [1,0,1,0,0,0|2,0,0]=4 1318 B11R0.159 CCCCOCCCS(=O)(=O)C 7a_100000689940_100000210211 [1,0,1,0,0,0|2,0,0]=4 1319 B11R0.159 CCCCOCCCS(=O)(=O)N 34a_100000210227_100000750626 [1,0,1,0,0,0|2,0,0]=4 1320 B11R0.159 CCCCOCCCS(=O)(=O)N 7a_100000210227_100000750626 [1,0,1,0,0,0|2,0,0]=4 1321 B11R0.159 CCCCOCCCS(=O)(=O)[O-] 34a_100000210227_100009813499 [1,0,1,0,0,0|1,0,1]=4 1322 B11R0.159 CCCCSCCCS(=O)(=O)C 62a_100000210211_100000754308 [1,0,1,0,0,0|2,0,0]=4 1323 B11R0.159 CCCCSCCCS(=O)(=O)C 62a_100000754308_100000210210 [1,0,1,0,0,0|2,0,0]=4 1324 B11R0.159 CCCCSCCCS(=O)(=O)N 62a_100000210211_100000750626 [1,0,1,0,0,0|2,0,0]=4 1325 B11R0.159 CCCCSCCCS(=O)(=O)N 62a_100000750626_100000210210 [1,0,1,0,0,0|2,0,0]=4 1326 B11R0.159 CCCCSCCCS(=O)(=O)[O-] 62a_100000210211_100009813499 [1,0,1,0,0,0|1,0,1]=4 1327 B11R0.159 CCCCSCCCS(=O)(=O)[O-] 62a_100009813499_100000210210 [1,0,1,0,0,0|1,0,1]=4 1328 B11R0.159 CCCOCCNCS(=O)(=O)[O-] 34a_100161115042_100009817235 [1,0,1,0,0,0|1,0,1]=4 1329 B11R0.159 CCOCCCNCS(=O)(=O)[O-] 34a_100000210961_100009817235 [1,0,1,0,0,0|1,0,1]=4 1330 B11R0.159 CCOCCNCCS(=O)(=O)C 2230a_100000740961_100011215890 [1,0,1,0,0,0|2,0,0]=4 1331 B11R0.159 CCOCCNCCS(=O)(=O)C 2230a_102516460346_100000731031 [1,0,1,0,0,0|2,0,0]=4 1332 B11R0.159 CCOCCNCCS(=O)(=O)C 34a_100000740961_100000210147 [1,0,1,0,0,0|2,0,0]=4 1333 B11R0.159 CCOCCNCCS(=O)(=O)C 34a_102516460346_100000731031 [1,0,1,0,0,0|2,0,0]=4 1334 B11R0.159 CCOCCNCCS(=O)(=O)N 2230a_100000738205_100011215890 [1,0,1,0,0,0|2,0,0]=4 1335 B11R0.159 CCOCCNCCS(=O)(=O)N 34a_100000738205_100000210147 [1,0,1,0,0,0|2,0,0]=4 1336 B11R0.159 CCOCCNCCS(=O)(=O)[O-] 2230a_102516460346_100000737633 [1,0,1,0,0,0|1,0,1]=4 1337 B11R0.159 CCOCCNCCS(=O)(=O)[O-] 34a_102516460346_100000762736 [1,0,1,0,0,0|1,0,1]=4 1338 B11R0.159 CCSCCNCCS(=O)(=O)C 2230a_100000106463_100000731031 [1,0,1,0,0,0|2,0,0]=4 1339 B11R0.159 CCSCCNCCS(=O)(=O)C 2230a_100000740961_100000757381 [1,0,1,0,0,0|2,0,0]=4 1340 B11R0.159 CCSCCNCCS(=O)(=O)C 34a_100000740961_100000757381 [1,0,1,0,0,0|2,0,0]=4 1341 B11R0.159 CCSCCNCCS(=O)(=O)N 2230a_100000738205_100000757381 [1,0,1,0,0,0|2,0,0]=4 1342 B11R0.159 CCSCCNCCS(=O)(=O)N 34a_100000738205_100000757381 [1,0,1,0,0,0|2,0,0]=4 1343 B11R0.159 CCSCCNCCS(=O)(=O)[O-] 2230a_100000106463_100000737633 [1,0,1,0,0,0|1,0,1]=4 1344 B11R0.159 COCCCNCCS(=O)(=O)C 2230a_100000740961_100000740836 [1,0,1,0,0,0|2,0,0]=4 1345 B11R0.159 COCCCNCCS(=O)(=O)C 34a_100000740961_100000740836 [1,0,1,0,0,0|2,0,0]=4 1346 B11R0.159 COCCCNCCS(=O)(=O)C 34a_100150723488_100000731031 [1,0,1,0,0,0|2,0,0]=4 1347 B11R0.159 COCCCNCCS(=O)(=O)N 2230a_100000738205_100000740836 [1,0,1,0,0,0|2,0,0]=4 1348 B11R0.159 COCCCNCCS(=O)(=O)N 34a_100000738205_100000740836 [1,0,1,0,0,0|2,0,0]=4 1349 B11R0.159 COCCCNCCS(=O)(=O)[O-] 34a_100150723488_100000762736 [1,0,1,0,0,0|1,0,1]=4 1350 B11R0.159 CS(=O)(=O)CCNCCCCF 2230a_100000740961_100000729493 [1,0,1,0,0,0|2,0,0]=4 1351 B11R0.159 CS(=O)(=O)CCNCCCCF 34a_100000740961_100000729493 [1,0,1,0,0,0|2,0,0]=4 1352 B11R0.159 CS(=O)(=O)CCNCCCCO 2230a_100000740961_100000210776 [1,0,1,0,0,0|2,0,0]=4 1353 B11R0.159 CS(=O)(=O)CCNCCCCO 2230a_100000750430_100000731031 [1,0,1,0,0,0|2,0,0]=4 1354 B11R0.159 CS(=O)(=O)CCNCCCCO 34a_100000740961_100011216708 [1,0,1,0,0,0|2,0,0]=4 1355 B11R0.159 CS(=O)(=O)CCNCCCCO 34a_100000750430_100000731031 [1,0,1,0,0,0|2,0,0]=4 1356 B11R0.159 CSCCCNCCS(=O)(=O)C 2230a_100000749238_100000731031 [1,0,1,0,0,0|2,0,0]=4 1357 B11R0.159 CSCCCNCCS(=O)(=O)[O-] 2230a_100000749238_100000737633 [1,0,1,0,0,0|1,0,1]=4 1358 B11R0.159 NS(=O)(=O)CCNCCCCF 2230a_100000738205_100000729493 [1,0,1,0,0,0|2,0,0]=4 1359 B11R0.159 NS(=O)(=O)CCNCCCCF 34a_100000738205_100000729493 [1,0,1,0,0,0|2,0,0]=4 1360 B11R0.159 NS(=O)(=O)CCNCCCCO 2230a_100000738205_100000210776 [1,0,1,0,0,0|2,0,0]=4 1361 B11R0.159 NS(=O)(=O)CCNCCCCO 34a_100000738205_100011216708 [1,0,1,0,0,0|2,0,0]=4 1362 B11R0.159 O=S(=O)([O-])CCNCCCCO 2230a_100000750430_100000737633 [1,0,1,0,0,0|1,0,1]=4 1363 B11R0.159 O=S(=O)([O-])CCNCCCCO 34a_100000750430_100000762736 [1,0,1,0,0,0|1,0,1]=4 1364 B11R0.159 O=S(=O)([O-])CNCCCCCO 34a_100000762737_100009817235 [1,0,1,0,0,0|1,0,1]=4 1365 B11R0.180 CC(CCO)NCCS(=O)(=O)C 2230a_100000740961_100009893172 [1,0,1,0,0,0|2,0,0]=4 1366 B11R0.180 CC(CCO)NCCS(=O)(=O)C 34a_100000740961_100009893172 [1,0,1,0,0,0|2,0,0]=4 1367 B11R0.180 CC(CCO)NCCS(=O)(=O)N 2230a_100000738205_100009893172 [1,0,1,0,0,0|2,0,0]=4 1368 B11R0.180 CC(CCO)NCCS(=O)(=O)N 34a_100000738205_100009893172 [1,0,1,0,0,0|2,0,0]=4 1369 B11R0.180 CCCC(C)NCCS(=O)(=O)C 2230a_100000740961_100000766640 [1,0,1,0,0,0|1,0,0]=3 1370 B11R0.180 CCCC(C)NCCS(=O)(=O)C 2230a_100000741246_100000731031 [1,0,1,0,0,0|1,0,0]=3 1371 B11R0.180 CCCC(C)NCCS(=O)(=O)C 270004a_100000740961_100000211909 [1,0,1,0,0,0|1,0,0]=3 1372 B11R0.180 CCCC(C)NCCS(=O)(=O)C 34a_100000740961_100000766640 [1,0,1,0,0,0|1,0,0]=3 1373 B11R0.180 CCCC(C)NCCS(=O)(=O)N 2230a_100000738205_100000766640 [1,0,1,0,0,0|1,0,0]=3 1374 B11R0.180 CCCC(C)NCCS(=O)(=O)N 270004a_100000738205_100000211909 [1,0,1,0,0,0|1,0,0]=3 1375 B11R0.180 CCCC(C)NCCS(=O)(=O)N 34a_100000738205_100000766640 [1,0,1,0,0,0|1,0,0]=3 1376 B11R0.180 CCCC(C)NCCS(=O)(=O)[O-] 2230a_100000741246_100000737633 [1,0,1,0,0,0|0,0,1]=3 1377 B11R0.180 CCCC(C)OCCS(=O)(=O)C 34a_100000211924_100000766640 [1,0,1,0,0,0|2,0,0]=4 1378 B11R0.180 CCCC(C)OCCS(=O)(=O)C 34a_100000764384_100000731031 [1,0,1,0,0,0|2,0,0]=4 1379 B11R0.180 CCCC(C)OCCS(=O)(=O)C 7a_100000211924_100000766640 [1,0,1,0,0,0|2,0,0]=4 1380 B11R0.180 CCCC(C)OCCS(=O)(=O)C 7a_100000764384_100000230027 [1,0,1,0,0,0|2,0,0]=4 1381 B11R0.180 CCCC(C)OCCS(=O)(=O)N 34a_100012334274_100000766640 [1,0,1,0,0,0|2,0,0]=4 1382 B11R0.180 CCCC(C)OCCS(=O)(=O)[O-] 34a_100000764384_100000762736 [1,0,1,0,0,0|1,0,1]=4 1383 B11R0.180 CCCC(C)SCCS(=O)(=O)C 62a_100000731031_100000766640 [1,0,1,0,0,0|2,0,0]=4 1384 B11R0.180 CCCC(C)SCCS(=O)(=O)C 62a_100000766640_100000230027 [1,0,1,0,0,0|2,0,0]=4 1385 B11R0.180 CCCC(C)SCCS(=O)(=O)[O-] 62a_100000762736_100000766640 [1,0,1,0,0,0|1,0,1]=4 1386 B11R0.180 CCCC(C)SCCS(=O)(=O)[O-] 62a_100000766640_100000762736 [1,0,1,0,0,0|1,0,1]=4 1387 B11R0.180 COCC(C)NCCS(=O)(=O)C 2230a_100000740961_100000765312 [1,0,1,0,0,0|2,0,0]=4 1388 B11R0.180 COCC(C)NCCS(=O)(=O)C 270004a_100000740961_100000749346 [1,0,1,0,0,0|2,0,0]=4 1389 B11R0.180 COCC(C)NCCS(=O)(=O)C 34a_100000740961_100000765312 [1,0,1,0,0,0|2,0,0]=4 1390 B11R0.180 COCC(C)NCCS(=O)(=O)N 2230a_100000738205_100000765312 [1,0,1,0,0,0|2,0,0]=4 1391 B11R0.180 COCC(C)NCCS(=O)(=O)N 270004a_100000738205_100000749346 [1,0,1,0,0,0|2,0,0]=4 1392 B11R0.180 COCC(C)NCCS(=O)(=O)N 34a_100000738205_100000765312 [1,0,1,0,0,0|2,0,0]=4 1393 B11R0.180 COC[C@@H](C)NCCS(=O)(=O)C 2230a_100000764878_100000731031 [1,0,1,0,0,0|2,0,0]=4 1394 B11R0.180 COC[C@@H](C)NCCS(=O)(=O)[O-] 2230a_100000764878_100000737633 [1,0,1,0,0,0|1,0,1]=4 1395 B11R0.180 CSCC(C)NCCS(=O)(=O)C 270004a_100000740961_100011216314 [1,0,1,0,0,0|2,0,0]=4 1396 B11R0.180 CSCC(C)NCCS(=O)(=O)N 270004a_100000738205_100011216314 [1,0,1,0,0,0|2,0,0]=4 1397 B11R0.180 C[C@H](CCO)NCCS(=O)(=O)C 2230a_100000706166_100000731031 [1,0,1,0,0,0|2,0,0]=4 1398 B11R0.180 C[C@H](CCO)NCCS(=O)(=O)C 34a_100000706166_100000731031 [1,0,1,0,0,0|2,0,0]=4 1399 B11R0.180 C[C@H](CCO)NCCS(=O)(=O)[O-] 2230a_100000706166_100000737633 [1,0,1,0,0,0|1,0,1]=4 1400 B11R0.180 C[C@H](CCO)NCCS(=O)(=O)[O-] 34a_100000706166_100000762736 [1,0,1,0,0,0|1,0,1]=4 1401 B11R0.148 CCCCCCNCCC(=O)N 2230a_100000210581_100000744528 [1,0,1,0,0,0|2,0,0]=4 1402 B11R0.148 CCCCCCNCCC(C)O 2230a_100000210581_100012276601 [1,0,1,0,0,0|2,0,0]=4 1403 B11R0.148 CCCCCCNCCC(C)O 2230a_200000755665_100000210314 [1,0,1,0,0,0|2,0,0]=4 1404 B11R0.148 CCCCCCNOCC(=O)O 269956a_100000106656_100000210757 [1,0,1,0,0,0|2,0,0]=4 1405 B11R0.24 CCC(CC)NCCS(=O)(=O)C 2230a_100000199018_100000731031 [1,0,1,0,0,0|1,0,0]=3 1406 B11R0.24 CCC(CC)NCCS(=O)(=O)C 270004a_100000740961_100000210860 [1,0,1,0,0,0|1,0,0]=3 1407 B11R0.24 CCC(CC)NCCS(=O)(=O)N 270004a_100000738205_100000210860 [1,0,1,0,0,0|1,0,0]=3 1408 B11R0.24 CCC(CC)NCCS(=O)(=O)[O-] 2230a_100000199018_100000737633 [1,0,1,0,0,0|0,0,1]=3 1409 B11R0.24 CCC(CC)OCCS(=O)(=O)C 7a_100000211924_100000210505 [1,0,1,0,0,0|2,0,0]=4 1410 B11R0.24 CCC(CC)OCCS(=O)(=O)C 7a_100000688536_100000230027 [1,0,1,0,0,0|2,0,0]=4 1411 B11R0.24 CCC(CC)SCCS(=O)(=O)C 62a_100000210505_100000230027 [1,0,1,0,0,0|2,0,0]=4 1412 B11R0.24 CCC(CC)SCCS(=O)(=O)C 62a_100000731031_100000210505 [1,0,1,0,0,0|2,0,0]=4 1413 B11R0.24 CCC(CC)SCCS(=O)(=O)[O-] 62a_100000210505_100000762736 [1,0,1,0,0,0|1,0,1]=4 1414 B11R0.24 CCC(CC)SCCS(=O)(=O)[O-] 62a_100000762736_100000210505 [1,0,1,0,0,0|1,0,1]=4 1415 B11R0.24 CC[C@@H](CO)NCCS(=O)(=O)C 2230a_100000709445_100000731031 [1,0,1,0,0,0|2,0,0]=4 1416 B11R0.24 CC[C@@H](CO)NCCS(=O)(=O)[O-] 2230a_100000709445_100000737633 [1,0,1,0,0,0|1,0,1]=4 1417 B11R0.45 CCCC(CC)NCCC(=O)N 2230a_100000747048_100000744528 [1,0,1,0,0,0|2,0,0]=4 1418 B11R0.45 CCCC(CC)NCCC(C)O 2230a_100000747048_100012276601 [1,0,1,0,0,0|2,0,0]=4 1419 B11R0.45 CCCC(CC)NCCC(C)O 270004a_200000755665_100000687865 [1,0,1,0,0,0|2,0,0]=4 1420 B11R0.45 CCCC(CC)NOCC(=O)O 269956a_100000106656_100011219200 [1,0,1,0,0,0|2,0,0]=4 1421 B11R1.28 C#CCCNC1CCCCC1 2230a_100000182618_100000688953 [2,0,0,0,0,0|2,0,0]=4 1422 B11R1.28 C#CCCNC1CCCCC1 34a_100000182618_100000688953 [2,0,0,0,0,0|2,0,0]=4 1423 B11R1.28 C#CCCNC1CCCCC1 34a_100000755551_100000210327 [2,0,0,0,0,0|2,0,0]=4 1424 B11R1.28 C=CCCNC1CCCCC1 2230a_100000182618_100000754431 [2,0,0,0,0,0|2,0,0]=4 1425 B11R1.28 C=CCCNC1CCCCC1 270004a_100015191253_100000210434 [2,0,0,0,0,0|2,0,0]=4 1426 B11R1.28 C=CCCNC1CCCCC1 34a_100000182618_100000754431 [2,0,0,0,0,0|2,0,0]=4 1427 B11R1.28 CCCCNC1CCCCC1 2230a_100000182618_100000210211 [2,0,0,0,0,0|2,0,0]=4 1428 B11R1.28 CCCCNC1CCCCC1 270004a_100000102301_100000210434 [2,0,0,0,0,0|2,0,0]=4 1429 B11R1.28 CCCCNC1CCCCC1 34a_100000182618_100000210210 [2,0,0,0,0,0|2,0,0]=4 1430 B11R1.28 CCCCNC1CCCCC1 7a_106832991798_100000210327 [2,0,0,0,0,0|2,0,0]=4 1431 B11R1.28 COCCNC1CCCCC1 2230a_100000182618_100011201679 [2,0,0,0,0,0|1,1,0]=4 1432 B11R1.28 COCCNC1CCCCC1 270004a_100000209980_100000210434 [2,0,0,0,0,0|1,1,0]=4 1433 B11R1.28 COCCNC1CCCCC1 34a_100000182618_100011201679 [2,0,0,0,0,0|1,1,0]=4 1434 B11R1.28 COCCNC1CCCCC1 34a_100000200466_200000210301 [2,0,0,0,0,0|1,1,0]=4 1435 B11R1.28 CSCCNC1CCCCC1 2230a_100000182618_100000751147 [2,0,0,0,0,0|1,0,1]=4 1436 B11R1.28 CSCCNC1CCCCC1 270004a_100020590264_100000210434 [2,0,0,0,0,0|1,0,1]=4 1437 B11R1.28 CSCCNC1CCCCC1 34a_100000182618_100000212216 [2,0,0,0,0,0|1,0,1]=4 1438 B11R1.28 FCCCNC1CCCCC1 2230a_100000182618_100011934791 [2,0,0,0,0,0|2,0,0]=4 1439 B11R1.28 FCCCNC1CCCCC1 270004a_100015189416_100000210434 [2,0,0,0,0,0|2,0,0]=4 1440 B11R1.28 FCCCNC1CCCCC1 34a_100000182618_100011934791 [2,0,0,0,0,0|2,0,0]=4 1441 B11R1.28 FCCCNC1CCCCC1 34a_100015189416_100000210327 [2,0,0,0,0,0|2,0,0]=4 1442 B11R1.28 N#CCCNC1CCCCC1 2230a_100000182618_100011215226 [2,0,0,0,0,0|2,0,0]=4 1443 B11R1.28 N#CCCNC1CCCCC1 270004a_100000720768_100000210434 [2,0,0,0,0,0|2,0,0]=4 1444 B11R1.28 OCCCNC1CCCCC1 2230a_100000182618_100000230001 [2,0,0,0,0,0|1,0,0]=3 1445 B11R1.28 OCCCNC1CCCCC1 270004a_100000182051_100000210434 [2,0,0,0,0,0|1,0,0]=3 1446 B11R1.28 OCCCNC1CCCCC1 34a_100000182618_100000230001 [2,0,0,0,0,0|1,0,0]=3 1447 B11R1.28 OCCCNC1CCCOC1 2230a_100000719290_100000230001 [2,0,0,0,0,0|2,0,0]=4 1448 B11R1.28 OCCCNC1CCCOC1 270004a_100000182051_100000753404 [2,0,0,0,0,0|2,0,0]=4 1449 B11R1.28 OCCCNC1CCCOC1 34a_100000719290_100000230001 [2,0,0,0,0,0|2,0,0]=4 1450 B11R1.28 OCCCNC1CCCSC1 270004a_100000182051_100000057913 [2,0,0,0,0,0|2,0,0]=4 1451 B11R1.28 OCCCNC1CCNCC1 270004a_100000182051_100015192401 [2,0,0,0,0,0|2,0,0]=4 1452 B11R1.28 OCCCNC1CCOCC1 2230a_100000741149_100000230001 [2,0,0,0,0,0|2,0,0]=4 1453 B11R1.28 OCCCNC1CCOCC1 270004a_100000182051_100011217826 [2,0,0,0,0,0|2,0,0]=4 1454 B11R1.28 OCCCNC1CCOCC1 34a_100000741149_100000230001 [2,0,0,0,0,0|2,0,0]=4 1455 B11R1.28 OCCCNC1CCSCC1 2230a_100000748639_100000230001 [2,0,0,0,0,0|2,0,0]=4 1456 B11R1.28 OCCCNC1CCSCC1 270004a_100000182051_100000203788 [2,0,0,0,0,0|2,0,0]=4 1457 B11R1.28 OCCCNC1CCSCC1 34a_100000748639_100000230001 [2,0,0,0,0,0|2,0,0]=4 1458 B11R1.28 OCCCOC1CCCCC1 34a_100000210231_100000230001 [2,0,0,0,0,0|2,0,0]=4 1459 B11R1.28 OCCCOC1CCCCC1 7a_100000210231_100011215043 [2,0,0,0,0,0|2,0,0]=4 1460 B11R1.28 OCCCSC1CCCCC1 62a_100000210327_100011215043 [2,0,0,0,0,0|2,0,0]=4 1461 B11R1.28 OCCCSC1CCCCC1 62a_100011215043_100000210327 [2,0,0,0,0,0|2,0,0]=4 1462 B11R1.28 [13CH3]OCCNC1CCCCC1 34a_100000200466_200025704644 [2,0,0,0,0,0|1,1,0]=4 1463 B13R0.42 CCCCC(C)C(=O)CCS(=O)(=O)C 1458a_100000725509_100000731031 [0,1,1,0,0,0|2,0,0]=4 1464 B13R0.42 CCCCC(C)C(=O)CCS(=O)(=O)C 1458a_100000737124_200011215066 [0,1,1,0,0,0|2,0,0]=4 1465 B13R0.42 CCCCC(C)C(=O)CCS(=O)(=O)N 1458a_100000737202_200011215066 [0,1,1,0,0,0|2,0,0]=4 1466 B13R0.42 CCCCC(C)C(=O)CCS(=O)(=O)[O-] 1458a_100000725509_100000762736 [0,1,1,0,0,0|1,0,1]=4 1467 B13R0.42 CCCCC(C)N(C)CCS(=O)(=O)C 2230a_100000750128_200011215066 [0,1,1,0,0,0|1,0,0]=3 1468 B13R0.42 CCCCC(C)N(C)CCS(=O)(=O)C 269982a_100000750128_200011215066 [0,1,1,0,0,0|1,0,0]=3 1469 B13R0.42 CCCCC(C)N(C)CCS(=O)(=O)C 270004a_100000750128_100000210087 [0,1,1,0,0,0|1,0,0]=3 1470 B13R0.42 CCCCC(C)N(C)CCS(=O)(=O)C 34a_100000750128_200011215066 [0,1,1,0,0,0|1,0,0]=3 1471 B13R0.42 CCSCC(C)N(C)CCS(=O)(=O)C 270004a_100000750128_200011216171 [0,1,1,0,0,0|2,0,0]=4 1472 B13R0.42 COCCC(C)N(C)CCS(=O)(=O)C 270004a_100000750128_100000742357 [0,1,1,0,0,0|2,0,0]=4 1473 B13R0.42 CSCCC(C)N(C)CCS(=O)(=O)C 270004a_100000750128_100011217047 [0,1,1,0,0,0|2,0,0]=4 1474 B13R0.75 CCC(C)CC(C)NCCS(=O)(=O)C 2230a_100000763565_100000731031 [0,1,1,0,0,0|1,0,0]=3 1475 B13R0.75 CCC(C)CC(C)NCCS(=O)(=O)C 270004a_100000740961_100011710205 [0,1,1,0,0,0|1,0,0]=3 1476 B13R0.75 CCC(C)CC(C)NCCS(=O)(=O)N 270004a_100000738205_100011710205 [0,1,1,0,0,0|1,0,0]=3 1477 B13R0.75 CCC(C)CC(C)NCCS(=O)(=O)[O-] 2230a_100000763565_100000737633 [0,1,1,0,0,0|0,0,1]=3 1478 B13R0.130 CCCCC(C)NC(=O)CS(=O)(=O)C 11a_100000126638_100000744497 [0,1,1,0,0,0|1,0,1]=4 1479 B13R0.130 CCCCC(C)NC(=O)CS(=O)(=O)C 240690a_100000126638_100000744497 [0,1,1,0,0,0|1,0,1]=4 1480 B13R0.130 CCCCC(C)NC(=O)CS(=O)(=O)C 527a_100000126638_100000744497 [0,1,1,0,0,0|1,0,1]=4 1481 B13R0.167 CCCCC(C)SCC(O)S(=O)(=O)[O-] 62a_200000035551_200011215066 [0,1,1,0,0,0|1,0,1]=4 1482 B13R0.167 CCCCC(C)SCC(O)S(=O)(=O)[O-] 62a_200011215066_200000035551 [0,1,1,0,0,0|1,0,1]=4 1483 B13R0.196 CC(CCCC#N)NCCS(=O)(=O)C 270004a_100000740961_200000032708 [0,1,1,0,0,0|1,0,1]=4 1484 B13R0.196 CC(CCCC#N)NCCS(=O)(=O)N 270004a_100000738205_200000032708 [0,1,1,0,0,0|1,0,1]=4 1485 B13R0.196 CCCCCC(C)NCCS(=O)(=O)C 2230a_100000211957_100000731031 [0,1,1,0,0,0|1,0,0]=3 1486 B13R0.196 CCCCCC(C)NCCS(=O)(=O)C 2230a_100000740961_200011218191 [0,1,1,0,0,0|1,0,0]=3 1487 B13R0.196 CCCCCC(C)NCCS(=O)(=O)C 270004a_100000740961_100000211708 [0,1,1,0,0,0|1,0,0]=3 1488 B13R0.196 CCCCCC(C)NCCS(=O)(=O)C 34a_100000740961_200011218191 [0,1,1,0,0,0|1,0,0]=3 1489 B13R0.196 CCCCCC(C)NCCS(=O)(=O)N 2230a_100000738205_200011218191 [0,1,1,0,0,0|1,0,0]=3 1490 B13R0.196 CCCCCC(C)NCCS(=O)(=O)N 270004a_100000738205_100000211708 [0,1,1,0,0,0|1,0,0]=3 1491 B13R0.196 CCCCCC(C)NCCS(=O)(=O)N 34a_100000738205_200011218191 [0,1,1,0,0,0|1,0,0]=3 1492 B13R0.196 CCCCCC(C)NCCS(=O)(=O)[O-] 2230a_100000211957_100000737633 [0,1,1,0,0,0|0,0,1]=3 1493 B13R0.196 CCCCCC(C)OCCS(=O)(=O)C 34a_100000211924_200011218191 [0,1,1,0,0,0|2,0,0]=4 1494 B13R0.196 CCCCCC(C)OCCS(=O)(=O)C 34a_100011215632_100000731031 [0,1,1,0,0,0|2,0,0]=4 1495 B13R0.196 CCCCCC(C)OCCS(=O)(=O)C 7a_100000211924_200011218191 [0,1,1,0,0,0|2,0,0]=4 1496 B13R0.196 CCCCCC(C)OCCS(=O)(=O)C 7a_100011215632_100000230027 [0,1,1,0,0,0|2,0,0]=4 1497 B13R0.196 CCCCCC(C)OCCS(=O)(=O)N 34a_100012334274_200011218191 [0,1,1,0,0,0|2,0,0]=4 1498 B13R0.196 CCCCCC(C)OCCS(=O)(=O)[O-] 34a_100011215632_100000762736 [0,1,1,0,0,0|1,0,1]=4 1499 B13R0.196 CCCCCC(C)SCCS(=O)(=O)C 62a_100000731031_200011218191 [0,1,1,0,0,0|2,0,0]=4 1500 B13R0.196 CCCCCC(C)SCCS(=O)(=O)C 62a_200011218191_100000230027 [0,1,1,0,0,0|2,0,0]=4 1501 B13R0.196 CCCCCC(C)SCCS(=O)(=O)[O-] 62a_100000762736_200011218191 [0,1,1,0,0,0|1,0,1]=4 1502 B13R0.196 CCCCCC(C)SCCS(=O)(=O)[O-] 62a_200011218191_100000762736 [0,1,1,0,0,0|1,0,1]=4 1503 B13R0.196 CCCSCC(C)NCCS(=O)(=O)C 270004a_100000740961_100011343953 [0,1,1,0,0,0|1,0,0]=3 1504 B13R0.196 CCCSCC(C)NCCS(=O)(=O)N 270004a_100000738205_100011343953 [0,1,1,0,0,0|1,0,0]=3 1505 B13R0.196 CCOCCC(C)NCCS(=O)(=O)C 270004a_100000740961_200011216536 [0,1,1,0,0,0|1,0,0]=3 1506 B13R0.196 CCOCCC(C)NCCS(=O)(=O)N 270004a_100000738205_200011216536 [0,1,1,0,0,0|1,0,0]=3 1507 B13R0.196 COCCCC(C)OCCS(=O)(=O)C 34a_200011539412_100000731031 [0,1,1,0,0,0|2,0,0]=4 1508 B13R0.196 COCCCC(C)OCCS(=O)(=O)C 7a_200011539412_100000230027 [0,1,1,0,0,0|2,0,0]=4 1509 B13R0.196 COCCCC(C)OCCS(=O)(=O)[O-] 34a_200011539412_100000762736 [0,1,1,0,0,0|1,0,1]=4 1510 B13R0.196 CSCCCC(C)NCCS(=O)(=O)C 270004a_100000740961_100011399439 [0,1,1,0,0,0|1,0,0]=3 1511 B13R0.196 CSCCCC(C)NCCS(=O)(=O)N 270004a_100000738205_100011399439 [0,1,1,0,0,0|1,0,0]=3 1512 B13R0.268 CCCC(C)C(C)NCCS(=O)(=O)C 270004a_100000740961_100011216282 [0,1,1,0,0,0|1,0,0]=3 1513 B13R0.268 CCCC(C)C(C)NCCS(=O)(=O)N 270004a_100000738205_100011216282 [0,1,1,0,0,0|1,0,0]=3 1514 B13R0.268 CCCC(C)C(C)OCCS(=O)(=O)C 34a_100000708338_100000731031 [0,1,1,0,0,0|2,0,0]=4 1515 B13R0.268 CCCC(C)C(C)OCCS(=O)(=O)C 7a_100000708338_100000230027 [0,1,1,0,0,0|2,0,0]=4 1516 B13R0.268 CCCC(C)C(C)OCCS(=O)(=O)[O-] 34a_100000708338_100000762736 [0,1,1,0,0,0|1,0,1]=4 1517 B13R0.307 CCCCC(CC)NCCS(=O)(=O)C 270004a_100000740961_100000753412 [0,1,1,0,0,0|1,0,0]=3 1518 B13R0.307 CCCCC(CC)NCCS(=O)(=O)C 34a_100000740961_200011216223 [0,1,1,0,0,0|1,0,0]=3 1519 B13R0.307 CCCCC(CC)NCCS(=O)(=O)N 270004a_100000738205_100000753412 [0,1,1,0,0,0|1,0,0]=3 1520 B13R0.307 CCCCC(CC)NCCS(=O)(=O)N 34a_100000738205_200011216223 [0,1,1,0,0,0|1,0,0]=3 1521 B13R0.307 CCCCC(CC)OCCS(=O)(=O)C 34a_100000211924_200011216223 [0,1,1,0,0,0|2,0,0]=4 1522 B13R0.307 CCCCC(CC)OCCS(=O)(=O)C 34a_100011215227_100000731031 [0,1,1,0,0,0|2,0,0]=4 1523 B13R0.307 CCCCC(CC)OCCS(=O)(=O)C 7a_100000211924_200011216223 [0,1,1,0,0,0|2,0,0]=4 1524 B13R0.307 CCCCC(CC)OCCS(=O)(=O)C 7a_100011215227_100000230027 [0,1,1,0,0,0|2,0,0]=4 1525 B13R0.307 CCCCC(CC)OCCS(=O)(=O)N 34a_100012334274_200011216223 [0,1,1,0,0,0|2,0,0]=4 1526 B13R0.307 CCCCC(CC)OCCS(=O)(=O)[O-] 34a_100011215227_100000762736 [0,1,1,0,0,0|1,0,1]=4 1527 B13R0.307 CCCCC(CC)SCCS(=O)(=O)C 62a_100000731031_200011216223 [0,1,1,0,0,0|2,0,0]=4 1528 B13R0.307 CCCCC(CC)SCCS(=O)(=O)C 62a_200011216223_100000230027 [0,1,1,0,0,0|2,0,0]=4 1529 B13R0.307 CCCCC(CC)SCCS(=O)(=O)[O-] 62a_100000762736_200011216223 [0,1,1,0,0,0|1,0,1]=4 1530 B13R0.307 CCCCC(CC)SCCS(=O)(=O)[O-] 62a_200011216223_100000762736 [0,1,1,0,0,0|1,0,1]=4 1531 B13R0.307 CCCC[C@@H](CO)NCCS(=O)(=O)C 2230a_100011934283_100000731031 [0,1,1,0,0,0|1,0,0]=3 1532 B13R0.307 CCCC[C@@H](CO)NCCS(=O)(=O)C 34a_100011934283_100000731031 [0,1,1,0,0,0|1,0,0]=3 1533 B13R0.307 CCCC[C@@H](CO)NCCS(=O)(=O)[O-] 2230a_100011934283_100000737633 [0,1,1,0,0,0|0,0,1]=3 1534 B13R0.307 CCCC[C@@H](CO)NCCS(=O)(=O)[O-] 34a_100011934283_100000762736 [0,1,1,0,0,0|0,0,1]=3 1535 B13R0.307 CSCC[C@@H](CO)NCCS(=O)(=O)C 2230a_100011827619_100000731031 [0,1,1,0,0,0|2,0,0]=4 1536 B13R0.307 CSCC[C@@H](CO)NCCS(=O)(=O)[O-] 2230a_100011827619_100000737633 [0,1,1,0,0,0|1,0,1]=4 1537 B13R0.351 C=C(C)CCC(C)NCCS(=O)(=O)C 270004a_100000740961_100011215600 [0,1,1,0,0,0|1,0,1]=4 1538 B13R0.351 C=C(C)CCC(C)NCCS(=O)(=O)N 270004a_100000738205_100011215600 [0,1,1,0,0,0|1,0,1]=4 1539 B13R0.351 CC(C)CCC(C)NCCS(=O)(=O)C 2230a_100000740961_100011261404 [0,1,1,0,0,0|1,0,0]=3 1540 B13R0.351 CC(C)CCC(C)NCCS(=O)(=O)C 2230a_100138410893_100000731031 [0,1,1,0,0,0|1,0,0]=3 1541 B13R0.351 CC(C)CCC(C)NCCS(=O)(=O)C 270004a_100000740961_100000210476 [0,1,1,0,0,0|1,0,0]=3 1542 B13R0.351 CC(C)CCC(C)NCCS(=O)(=O)C 34a_100000740961_100011261404 [0,1,1,0,0,0|1,0,0]=3 1543 B13R0.351 CC(C)CCC(C)NCCS(=O)(=O)N 2230a_100000738205_100011261404 [0,1,1,0,0,0|1,0,0]=3 1544 B13R0.351 CC(C)CCC(C)NCCS(=O)(=O)N 270004a_100000738205_100000210476 [0,1,1,0,0,0|1,0,0]=3 1545 B13R0.351 CC(C)CCC(C)NCCS(=O)(=O)N 34a_100000738205_100011261404 [0,1,1,0,0,0|1,0,0]=3 1546 B13R0.351 CC(C)CCC(C)NCCS(=O)(=O)[O-] 2230a_100138410893_100000737633 [0,1,1,0,0,0|0,0,1]=3 1547 B13R0.351 CC(C)CCC(C)OCCS(=O)(=O)C 34a_100000211924_100011261404 [0,1,1,0,0,0|2,0,0]=4 1548 B13R0.351 CC(C)CCC(C)OCCS(=O)(=O)C 34a_100011215350_100000731031 [0,1,1,0,0,0|2,0,0]=4 1549 B13R0.351 CC(C)CCC(C)OCCS(=O)(=O)C 7a_100011215350_100000230027 [0,1,1,0,0,0|2,0,0]=4 1550 B13R0.351 CC(C)CCC(C)OCCS(=O)(=O)N 34a_100012334274_100011261404 [0,1,1,0,0,0|2,0,0]=4 1551 B13R0.351 CC(C)CCC(C)OCCS(=O)(=O)[O-] 34a_100011215350_100000762736 [0,1,1,0,0,0|1,0,1]=4 1552 B13R0.351 CC(C)CCC(C)SCCS(=O)(=O)C 62a_100000731031_100011261404 [0,1,1,0,0,0|2,0,0]=4 1553 B13R0.351 CC(C)CCC(C)SCCS(=O)(=O)C 62a_100011261404_100000230027 [0,1,1,0,0,0|2,0,0]=4 1554 B13R0.351 CC(C)CCC(C)SCCS(=O)(=O)[O-] 62a_100000762736_100011261404 [0,1,1,0,0,0|1,0,1]=4 1555 B13R0.351 CC(C)CCC(C)SCCS(=O)(=O)[O-] 62a_100011261404_100000762736 [0,1,1,0,0,0|1,0,1]=4 1556 B13R0.463 CCCCC(C)(C)OCCS(=O)(=O)C 7a_100011219641_100000230027 [0,1,1,0,0,0|2,0,0]=4 1557 B13R0.685 CCCCC(C)NCCS(=O)(=O)CC 2230a_100000126638_100000756660 [0,1,1,0,0,0|1,0,0]=3 1558 B13R0.685 CCCCC(C)NCCS(=O)(=O)CC 2230a_100000751051_200011215066 [0,1,1,0,0,0|1,0,0]=3 1559 B13R0.685 CCCCC(C)NCCS(=O)(=O)CC 270004a_100000751051_100000210087 [0,1,1,0,0,0|1,0,0]=3 1560 B13R0.685 CCCCC(C)NCCS(=O)(=O)CC 34a_100000751051_200011215066 [0,1,1,0,0,0|1,0,0]=3 1561 B13R0.685 CCCCC(C)NCCS(=O)(=O)NC 2230a_100000710037_200011215066 [0,1,1,0,0,0|1,0,0]=3 1562 B13R0.685 CCCCC(C)NCCS(=O)(=O)NC 270004a_100000710037_100000210087 [0,1,1,0,0,0|1,0,0]=3 1563 B13R0.685 CCCCC(C)NCCS(=O)(=O)NC 34a_100000710037_200011215066 [0,1,1,0,0,0|1,0,0]=3 1564 B13R0.685 CCCCC(C)OCCS(=O)(=O)CC 34a_100000687866_100000756660 [0,1,1,0,0,0|2,0,0]=4 1565 B13R0.685 CCCCC(C)OCCS(=O)(=O)CC 34a_200011216379_200011215066 [0,1,1,0,0,0|2,0,0]=4 1566 B13R0.685 CCCCC(C)OCCS(=O)(=O)CC 7a_100000687866_100000756660 [0,1,1,0,0,0|2,0,0]=4 1567 B13R0.685 CCCCC(C)OCCS(=O)(=O)CC 7a_200011216379_200011215066 [0,1,1,0,0,0|2,0,0]=4 1568 B13R0.685 CCCCC(C)SCCS(=O)(=O)CC 62a_100000756660_200011215066 [0,1,1,0,0,0|2,0,0]=4 1569 B13R0.685 CCCCC(C)SCCS(=O)(=O)CC 62a_200011215066_100000756660 [0,1,1,0,0,0|2,0,0]=4 1570 B13R0.685 CCS(=O)(=O)CCNC(C)CCOC 270004a_100000751051_100000742357 [0,1,1,0,0,0|2,0,0]=4 1571 B13R0.685 CCS(=O)(=O)CCNC(C)CCSC 270004a_100000751051_100011217047 [0,1,1,0,0,0|2,0,0]=4 1572 B13R0.685 CCSCC(C)NCCS(=O)(=O)CC 270004a_100000751051_200011216171 [0,1,1,0,0,0|2,0,0]=4 1573 B13R0.685 CCSCC(C)NCCS(=O)(=O)NC 270004a_100000710037_200011216171 [0,1,1,0,0,0|2,0,0]=4 1574 B13R0.685 CNS(=O)(=O)CCNC(C)CCOC 270004a_100000710037_100000742357 [0,1,1,0,0,0|2,0,0]=4 1575 B13R0.685 CNS(=O)(=O)CCNC(C)CCSC 270004a_100000710037_100011217047 [0,1,1,0,0,0|2,0,0]=4 1576 B13R0.21 CCCC(C)CCOCCS(=O)(=O)C 34a_100011217855_100000731031 [0,1,1,0,0,0|2,0,0]=4 1577 B13R0.21 CCCC(C)CCOCCS(=O)(=O)C 7a_100011217855_100000230027 [0,1,1,0,0,0|2,0,0]=4 1578 B13R0.21 CCCC(C)CCOCCS(=O)(=O)[O-] 34a_100011217855_100000762736 [0,1,1,0,0,0|1,0,1]=4 1579 B13R0.21 CCC[C@H](N)CCOCCS(=O)(=O)C 34a_100015193777_100000731031 [0,1,1,0,0,0|2,0,0]=4 1580 B13R0.21 CCC[C@H](N)CCOCCS(=O)(=O)[O-] 34a_100015193777_100000762736 [0,1,1,0,0,0|1,0,1]=4 1581 B13R0.57 CCCCCCSCC(O)S(=O)(=O)[O-] 62a_100000210314_200000035551 [0,1,1,0,0,0|1,0,1]=4 1582 B13R0.57 CCCCCCSCC(O)S(=O)(=O)[O-] 62a_200000035551_100000210757 [0,1,1,0,0,0|1,0,1]=4 1583 B13R0.124 CCCCC(C)COCCS(=O)(=O)C 34a_100011995851_100000731031 [0,1,1,0,0,0|2,0,0]=4 1584 B13R0.124 CCCCC(C)COCCS(=O)(=O)C 7a_100011995851_100000230027 [0,1,1,0,0,0|2,0,0]=4 1585 B13R0.124 CCCCC(C)COCCS(=O)(=O)[O-] 34a_100011995851_100000762736 [0,1,1,0,0,0|1,0,1]=4 1586 B13R0.124 CCCC[C@H](N)COCCS(=O)(=O)C 34a_100011934283_100000731031 [0,1,1,0,0,0|2,0,0]=4 1587 B13R0.124 CCCC[C@H](N)COCCS(=O)(=O)[O-] 34a_100011934283_100000762736 [0,1,1,0,0,0|1,0,1]=4 1588 B13R0.124 CCCOC(C)CNCCS(=O)(=O)C 2230a_100015185124_100000731031 [0,1,1,0,0,0|2,0,0]=4 1589 B13R0.124 CCCOC(C)CNCCS(=O)(=O)C 34a_100015185124_100000731031 [0,1,1,0,0,0|2,0,0]=4 1590 B13R0.124 CCCOC(C)CNCCS(=O)(=O)[O-] 2230a_100015185124_100000737633 [0,1,1,0,0,0|1,0,1]=4 1591 B13R0.124 CCCOC(C)CNCCS(=O)(=O)[O-] 34a_100015185124_100000762736 [0,1,1,0,0,0|1,0,1]=4 1592 B13R0.124 CCOCC(O)CNCCS(=O)(=O)C 2230a_102515437182_100000731031 [0,1,1,0,0,0|2,0,0]=4 1593 B13R0.124 CCOCC(O)CNCCS(=O)(=O)C 34a_102515437182_100000731031 [0,1,1,0,0,0|2,0,0]=4 1594 B13R0.124 CCOCC(O)CNCCS(=O)(=O)[O-] 2230a_102515437182_100000737633 [0,1,1,0,0,0|1,0,1]=4 1595 B13R0.124 CCOCC(O)CNCCS(=O)(=O)[O-] 34a_102515437182_100000762736 [0,1,1,0,0,0|1,0,1]=4 1596 B13R0.124 C[C@H](CCCO)CNCCS(=O)(=O)C 2230a_100160569302_100000731031 [0,1,1,0,0,0|2,0,0]=4 1597 B13R0.124 C[C@H](CCCO)CNCCS(=O)(=O)C 34a_100160569302_100000731031 [0,1,1,0,0,0|2,0,0]=4 1598 B13R0.124 C[C@H](CCCO)CNCCS(=O)(=O)[O-] 2230a_100160569302_100000737633 [0,1,1,0,0,0|1,0,1]=4 1599 B13R0.124 C[C@H](CCCO)CNCCS(=O)(=O)[O-] 34a_100160569302_100000762736 [0,1,1,0,0,0|1,0,1]=4 1600 B13R0.280 C#CCCCCCNCCS(=O)(=O)C 2230a_100000740961_100012094781 [0,1,1,0,0,0|1,0,1]=4 1601 B13R0.280 C#CCCCCCNCCS(=O)(=O)C 34a_100000740961_100012094781 [0,1,1,0,0,0|1,0,1]=4 1602 B13R0.280 C#CCCCCCNCCS(=O)(=O)N 2230a_100000738205_100012094781 [0,1,1,0,0,0|1,0,1]=4 1603 B13R0.280 C#CCCCCCNCCS(=O)(=O)N 34a_100000738205_100012094781 [0,1,1,0,0,0|1,0,1]=4 1604 B13R0.280 C=CCCCCCNCCS(=O)(=O)C 2230a_100000740961_100000700193 [0,1,1,0,0,0|1,0,1]=4 1605 B13R0.280 C=CCCCCCNCCS(=O)(=O)C 34a_100000740961_100000700193 [0,1,1,0,0,0|1,0,1]=4 1606 B13R0.280 C=CCCCCCNCCS(=O)(=O)N 2230a_100000738205_100000700193 [0,1,1,0,0,0|1,0,1]=4 1607 B13R0.280 C=CCCCCCNCCS(=O)(=O)N 34a_100000738205_100000700193 [0,1,1,0,0,0|1,0,1]=4 1608 B13R0.280 CCCCCCCCCNS(=O)(=O)C 40a_100000212291_100000738038 [0,1,1,0,0,0|2,0,0]=4 1609 B13R0.280 CCCCCCCCNCS(=O)(=O)[O-] 34a_100000229939_100009817235 [0,1,1,0,0,0|1,0,1]=4 1610 B13R0.280 CCCCCCCCOCS(=O)(=O)[O-] 34a_100000210232_100009817235 [0,1,1,0,0,0|1,0,1]=4 1611 B13R0.280 CCCCCCCCSCS(=O)(=O)N 62a_100000210759_100000741382 [0,1,1,0,0,0|2,0,0]=4 1612 B13R0.280 CCCCCCCCSCS(=O)(=O)N 62a_100000741382_100000210317 [0,1,1,0,0,0|2,0,0]=4 1613 B13R0.280 CCCCCCCCSCS(=O)(=O)[O-] 62a_100000210759_100009817235 [0,1,1,0,0,0|1,0,1]=4 1614 B13R0.280 CCCCCCCCSCS(=O)(=O)[O-] 62a_100009817235_100000210317 [0,1,1,0,0,0|1,0,1]=4 1615 B13R0.280 CCCCCCCNCCS(=O)(=O)C 2230a_100000229938_100000731031 [0,1,1,0,0,0|1,0,0]=3 1616 B13R0.280 CCCCCCCNCCS(=O)(=O)C 2230a_100000740961_100000210681 [0,1,1,0,0,0|1,0,0]=3 1617 B13R0.280 CCCCCCCNCCS(=O)(=O)C 34a_100000740961_100000210614 [0,1,1,0,0,0|1,0,0]=3 1618 B13R0.280 CCCCCCCNCCS(=O)(=O)N 2230a_100000738205_100000210681 [0,1,1,0,0,0|1,0,0]=3 1619 B13R0.280 CCCCCCCNCCS(=O)(=O)N 34a_100000738205_100000210614 [0,1,1,0,0,0|1,0,0]=3 1620 B13R0.280 CCCCCCCNCCS(=O)(=O)[O-] 2230a_100000229938_100000737633 [0,1,1,0,0,0|0,0,1]=3 1621 B13R0.280 CCCCCCCOCCS(=O)(=O)C 34a_100000210272_100000731031 [0,1,1,0,0,0|2,0,0]=4 1622 B13R0.280 CCCCCCCOCCS(=O)(=O)C 34a_100000211924_100000210614 [0,1,1,0,0,0|2,0,0]=4 1623 B13R0.280 CCCCCCCOCCS(=O)(=O)C 7a_100000210272_100000230027 [0,1,1,0,0,0|2,0,0]=4 1624 B13R0.280 CCCCCCCOCCS(=O)(=O)C 7a_100000211924_100000210614 [0,1,1,0,0,0|2,0,0]=4 1625 B13R0.280 CCCCCCCOCCS(=O)(=O)N 34a_100012334274_100000210614 [0,1,1,0,0,0|2,0,0]=4 1626 B13R0.280 CCCCCCCOCCS(=O)(=O)[O-] 34a_100000210272_100000762736 [0,1,1,0,0,0|1,0,1]=4 1627 B13R0.280 CCCCCCCSCCS(=O)(=O)C 62a_100000210614_100000230027 [0,1,1,0,0,0|2,0,0]=4 1628 B13R0.280 CCCCCCCSCCS(=O)(=O)C 62a_100000731031_100000210316 [0,1,1,0,0,0|2,0,0]=4 1629 B13R0.280 CCCCCCCSCCS(=O)(=O)[O-] 62a_100000210614_100000762736 [0,1,1,0,0,0|1,0,1]=4 1630 B13R0.280 CCCCCCCSCCS(=O)(=O)[O-] 62a_100000762736_100000210316 [0,1,1,0,0,0|1,0,1]=4 1631 B13R0.280 CCCCCCNCCCS(=O)(=O)C 2230a_100000210581_100000754308 [0,1,1,0,0,0|1,0,0]=3 1632 B13R0.280 CCCCCCNCCCS(=O)(=O)C 2230a_100000742409_100000210314 [0,1,1,0,0,0|1,0,0]=3 1633 B13R0.280 CCCCCCNCCCS(=O)(=O)C 34a_100000742409_100000210314 [0,1,1,0,0,0|1,0,0]=3 1634 B13R0.280 CCCCCCNCCCS(=O)(=O)N 2230a_100000210581_100000750626 [0,1,1,0,0,0|1,0,0]=3 1635 B13R0.280 CCCCCCNCCNS(=O)(=O)C 2230a_100000210581_100000754112 [0,1,1,0,0,0|1,0,0]=3 1636 B13R0.280 CCCCCCNCCNS(=O)(=O)C 34a_100000752411_100000210314 [0,1,1,0,0,0|1,0,0]=3 1637 B13R0.280 CCCCCCNCCOS(=O)(=O)C 2230a_100000210581_200000036756 [0,1,1,0,0,0|1,0,0]=3 1638 B13R0.280 CCCCCCOCCCS(=O)(=O)C 34a_100000210259_100000754308 [0,1,1,0,0,0|2,0,0]=4 1639 B13R0.280 CCCCCCOCCCS(=O)(=O)C 34a_100000689940_100000210314 [0,1,1,0,0,0|2,0,0]=4 1640 B13R0.280 CCCCCCOCCCS(=O)(=O)C 7a_100000210259_100000754308 [0,1,1,0,0,0|2,0,0]=4 1641 B13R0.280 CCCCCCOCCCS(=O)(=O)C 7a_100000689940_100000210314 [0,1,1,0,0,0|2,0,0]=4 1642 B13R0.280 CCCCCCOCCCS(=O)(=O)N 34a_100000210259_100000750626 [0,1,1,0,0,0|2,0,0]=4 1643 B13R0.280 CCCCCCOCCCS(=O)(=O)N 7a_100000210259_100000750626 [0,1,1,0,0,0|2,0,0]=4 1644 B13R0.280 CCCCCCOCCCS(=O)(=O)[O-] 34a_100000210259_100009813499 [0,1,1,0,0,0|1,0,1]=4 1645 B13R0.280 CCCCCCOCCNS(=O)(=O)C 7a_100000210259_100000754112 [0,1,1,0,0,0|2,0,0]=4 1646 B13R0.280 CCCCCCOCCOS(=O)(=O)C 34a_100000210259_200000036756 [0,1,1,0,0,0|2,0,0]=4 1647 B13R0.280 CCCCCCOCCOS(=O)(=O)C 7a_100000210259_200000036756 [0,1,1,0,0,0|2,0,0]=4 1648 B13R0.280 CCCCCCSCCCS(=O)(=O)C 62a_100000210314_100000754308 [0,1,1,0,0,0|2,0,0]=4 1649 B13R0.280 CCCCCCSCCCS(=O)(=O)C 62a_100000754308_100000210757 [0,1,1,0,0,0|2,0,0]=4 1650 B13R0.280 CCCCCCSCCCS(=O)(=O)N 62a_100000210314_100000750626 [0,1,1,0,0,0|2,0,0]=4 1651 B13R0.280 CCCCCCSCCCS(=O)(=O)N 62a_100000750626_100000210757 [0,1,1,0,0,0|2,0,0]=4 1652 B13R0.280 CCCCCCSCCCS(=O)(=O)[O-] 62a_100000210314_100009813499 [0,1,1,0,0,0|1,0,1]=4 1653 B13R0.280 CCCCCCSCCCS(=O)(=O)[O-] 62a_100009813499_100000210757 [0,1,1,0,0,0|1,0,1]=4 1654 B13R0.280 CCCCCCSCCNS(=O)(=O)C 62a_100000210314_100000754112 [0,1,1,0,0,0|2,0,0]=4 1655 B13R0.280 CCCCCCSCCNS(=O)(=O)C 62a_100000754112_100000210757 [0,1,1,0,0,0|2,0,0]=4 1656 B13R0.280 CCCCCCSCCOS(=O)(=O)C 62a_100000210314_200000036756 [0,1,1,0,0,0|2,0,0]=4 1657 B13R0.280 CCCCCCSCCOS(=O)(=O)C 62a_200000036756_100000210757 [0,1,1,0,0,0|2,0,0]=4 1658 B13R0.280 CCCCOCCNCCS(=O)(=O)C 2230a_100000740961_100000743108 [0,1,1,0,0,0|1,0,0]=3 1659 B13R0.280 CCCCOCCNCCS(=O)(=O)C 34a_100000740961_100000743108 [0,1,1,0,0,0|1,0,0]=3 1660 B13R0.280 CCCCOCCNCCS(=O)(=O)N 2230a_100000738205_100000743108 [0,1,1,0,0,0|1,0,0]=3 1661 B13R0.280 CCCCOCCNCCS(=O)(=O)N 34a_100000738205_100000743108 [0,1,1,0,0,0|1,0,0]=3 1662 B13R0.280 CCCCOCCOCCS(=O)(=O)C 34a_100000210238_100000731031 [0,1,1,0,0,0|2,0,0]=4 1663 B13R0.280 CCCCOCCOCCS(=O)(=O)C 34a_100000211924_100000743108 [0,1,1,0,0,0|2,0,0]=4 1664 B13R0.280 CCCCOCCOCCS(=O)(=O)C 7a_100000210238_100000230027 [0,1,1,0,0,0|2,0,0]=4 1665 B13R0.280 CCCCOCCOCCS(=O)(=O)C 7a_100000211924_100000743108 [0,1,1,0,0,0|2,0,0]=4 1666 B13R0.280 CCCCOCCOCCS(=O)(=O)N 34a_100012334274_100000743108 [0,1,1,0,0,0|2,0,0]=4 1667 B13R0.280 CCCCOCCOCCS(=O)(=O)[O-] 34a_100000210238_100000762736 [0,1,1,0,0,0|1,0,1]=4 1668 B13R0.280 CCCCOCCSCCS(=O)(=O)C 62a_100000731031_100000743108 [0,1,1,0,0,0|2,0,0]=4 1669 B13R0.280 CCCCOCCSCCS(=O)(=O)C 62a_100000743108_100000230027 [0,1,1,0,0,0|2,0,0]=4 1670 B13R0.280 CCCCOCCSCCS(=O)(=O)[O-] 62a_100000743108_100000762736 [0,1,1,0,0,0|1,0,1]=4 1671 B13R0.280 CCCCOCCSCCS(=O)(=O)[O-] 62a_100000762736_100000743108 [0,1,1,0,0,0|1,0,1]=4 1672 B13R0.280 CCCCOCNCCCS(=O)(=O)C 2230a_100000742409_100011995733 [0,1,1,0,0,0|2,0,0]=4 1673 B13R0.280 CCCCOCNCCCS(=O)(=O)C 34a_100000742409_100011995733 [0,1,1,0,0,0|2,0,0]=4 1674 B13R0.280 CCCCOCNCCNS(=O)(=O)C 34a_100000752411_100011995733 [0,1,1,0,0,0|2,0,0]=4 1675 B13R0.280 CCCCSCCNCCS(=O)(=O)C 2230a_100025743550_100000731031 [0,1,1,0,0,0|1,0,0]=3 1676 B13R0.280 CCCCSCCNCCS(=O)(=O)[O-] 2230a_100025743550_100000737633 [0,1,1,0,0,0|0,0,1]=3 1677 B13R0.280 CCCCSCCOCCS(=O)(=O)C 34a_200000230436_100000731031 [0,1,1,0,0,0|2,0,0]=4 1678 B13R0.280 CCCCSCCOCCS(=O)(=O)C 7a_200000230436_100000230027 [0,1,1,0,0,0|2,0,0]=4 1679 B13R0.280 CCCCSCCOCCS(=O)(=O)[O-] 34a_200000230436_100000762736 [0,1,1,0,0,0|1,0,1]=4 1680 B13R0.280 CCCOCCCNCCS(=O)(=O)C 2230a_100011217757_100000731031 [0,1,1,0,0,0|1,0,0]=3 1681 B13R0.280 CCCOCCCNCCS(=O)(=O)C 34a_100011217757_100000731031 [0,1,1,0,0,0|1,0,0]=3 1682 B13R0.280 CCCOCCCNCCS(=O)(=O)[O-] 2230a_100011217757_100000737633 [0,1,1,0,0,0|0,0,1]=3 1683 B13R0.280 CCCOCCCNCCS(=O)(=O)[O-] 34a_100011217757_100000762736 [0,1,1,0,0,0|0,0,1]=3 1684 B13R0.280 CCCOCCNCCCS(=O)(=O)C 2230a_100000742409_100011215938 [0,1,1,0,0,0|2,0,0]=4 1685 B13R0.280 CCCOCCNCCCS(=O)(=O)C 2230a_100161115042_100000754308 [0,1,1,0,0,0|2,0,0]=4 1686 B13R0.280 CCCOCCNCCCS(=O)(=O)C 34a_100000742409_100011215938 [0,1,1,0,0,0|2,0,0]=4 1687 B13R0.280 CCCOCCNCCCS(=O)(=O)C 34a_100161115042_100000754308 [0,1,1,0,0,0|2,0,0]=4 1688 B13R0.280 CCCOCCNCCCS(=O)(=O)N 2230a_100161115042_100000750626 [0,1,1,0,0,0|2,0,0]=4 1689 B13R0.280 CCCOCCNCCCS(=O)(=O)N 34a_100161115042_100000750626 [0,1,1,0,0,0|2,0,0]=4 1690 B13R0.280 CCCOCCNCCCS(=O)(=O)[O-] 34a_100161115042_100009813499 [0,1,1,0,0,0|1,0,1]=4 1691 B13R0.280 CCCOCCNCCNS(=O)(=O)C 2230a_100161115042_100000754112 [0,1,1,0,0,0|2,0,0]=4 1692 B13R0.280 CCCOCCNCCNS(=O)(=O)C 34a_100000752411_100011215938 [0,1,1,0,0,0|2,0,0]=4 1693 B13R0.280 CCCOCCNCCOS(=O)(=O)C 2230a_100161115042_200000036756 [0,1,1,0,0,0|2,0,0]=4 1694 B13R0.280 CCCOCCNCCOS(=O)(=O)C 34a_100161115042_200000036756 [0,1,1,0,0,0|2,0,0]=4 1695 B13R0.280 CCCSCCNCCCS(=O)(=O)C 2230a_100020603323_100000754308 [0,1,1,0,0,0|2,0,0]=4 1696 B13R0.280 CCCSCCNCCCS(=O)(=O)N 2230a_100020603323_100000750626 [0,1,1,0,0,0|2,0,0]=4 1697 B13R0.280 CCCSCCNCCNS(=O)(=O)C 2230a_100020603323_100000754112 [0,1,1,0,0,0|2,0,0]=4 1698 B13R0.280 CCCSCCNCCOS(=O)(=O)C 2230a_100020603323_200000036756 [0,1,1,0,0,0|2,0,0]=4 1699 B13R0.280 CCOCCCNCCCS(=O)(=O)C 2230a_100000210961_100000754308 [0,1,1,0,0,0|2,0,0]=4 1700 B13R0.280 CCOCCCNCCCS(=O)(=O)C 2230a_100000742409_100012232248 [0,1,1,0,0,0|2,0,0]=4 1701 B13R0.280 CCOCCCNCCCS(=O)(=O)C 34a_100000210961_100000754308 [0,1,1,0,0,0|2,0,0]=4 1702 B13R0.280 CCOCCCNCCCS(=O)(=O)C 34a_100000742409_100012232248 [0,1,1,0,0,0|2,0,0]=4 1703 B13R0.280 CCOCCCNCCCS(=O)(=O)N 2230a_100000210961_100000750626 [0,1,1,0,0,0|2,0,0]=4 1704 B13R0.280 CCOCCCNCCCS(=O)(=O)N 34a_100000210961_100000750626 [0,1,1,0,0,0|2,0,0]=4 1705 B13R0.280 CCOCCCNCCCS(=O)(=O)[O-] 34a_100000210961_100009813499 [0,1,1,0,0,0|1,0,1]=4 1706 B13R0.280 CCOCCCNCCNS(=O)(=O)C 2230a_100000210961_100000754112 [0,1,1,0,0,0|2,0,0]=4 1707 B13R0.280 CCOCCCNCCNS(=O)(=O)C 34a_100000752411_100012232248 [0,1,1,0,0,0|2,0,0]=4 1708 B13R0.280 CCOCCCNCCOS(=O)(=O)C 2230a_100000210961_200000036756 [0,1,1,0,0,0|2,0,0]=4 1709 B13R0.280 CCOCCCNCCOS(=O)(=O)C 34a_100000210961_200000036756 [0,1,1,0,0,0|2,0,0]=4 1710 B13R0.280 CNCCCCCOCCS(=O)(=O)C 34a_100000722520_100000731031 [0,1,1,0,0,0|2,0,0]=4 1711 B13R0.280 CNCCCCCOCCS(=O)(=O)[O-] 34a_100000722520_100000762736 [0,1,1,0,0,0|1,0,1]=4 1712 B13R0.280 COCCCCCNCCS(=O)(=O)C 2230a_100000747528_100000731031 [0,1,1,0,0,0|1,0,0]=3 1713 B13R0.280 COCCCCCNCCS(=O)(=O)C 34a_100000747528_100000731031 [0,1,1,0,0,0|1,0,0]=3 1714 B13R0.280 COCCCCCNCCS(=O)(=O)[O-] 2230a_100000747528_100000737633 [0,1,1,0,0,0|0,0,1]=3 1715 B13R0.280 COCCCCCNCCS(=O)(=O)[O-] 34a_100000747528_100000762736 [0,1,1,0,0,0|0,0,1]=3 1716 B13R0.280 COCCCCNCCCS(=O)(=O)C 2230a_100000742409_100000730899 [0,1,1,0,0,0|2,0,0]=4 1717 B13R0.280 COCCCCNCCCS(=O)(=O)C 34a_100000742409_100000755781 [0,1,1,0,0,0|2,0,0]=4 1718 B13R0.280 COCCCCNCCNS(=O)(=O)C 34a_100000752411_100000755781 [0,1,1,0,0,0|2,0,0]=4 1719 B13R0.280 COCCOCCNCCS(=O)(=O)C 2230a_100000740961_100000695917 [0,1,1,0,0,0|2,0,0]=4 1720 B13R0.280 COCCOCCNCCS(=O)(=O)C 2230a_100000745349_100000731031 [0,1,1,0,0,0|2,0,0]=4 1721 B13R0.280 COCCOCCNCCS(=O)(=O)C 34a_100000740961_100000695917 [0,1,1,0,0,0|2,0,0]=4 1722 B13R0.280 COCCOCCNCCS(=O)(=O)C 34a_100000745349_100000731031 [0,1,1,0,0,0|2,0,0]=4 1723 B13R0.280 COCCOCCNCCS(=O)(=O)N 2230a_100000738205_100000695917 [0,1,1,0,0,0|2,0,0]=4 1724 B13R0.280 COCCOCCNCCS(=O)(=O)N 34a_100000738205_100000695917 [0,1,1,0,0,0|2,0,0]=4 1725 B13R0.280 COCCOCCNCCS(=O)(=O)[O-] 2230a_100000745349_100000737633 [0,1,1,0,0,0|1,0,1]=4 1726 B13R0.280 COCCOCCNCCS(=O)(=O)[O-] 34a_100000745349_100000762736 [0,1,1,0,0,0|1,0,1]=4 1727 B13R0.280 CS(=O)(=O)CCCNCCCCCF 2230a_100000742409_100000729378 [0,1,1,0,0,0|2,0,0]=4 1728 B13R0.280 CS(=O)(=O)CCCNCCCCCF 34a_100000742409_100000729378 [0,1,1,0,0,0|2,0,0]=4 1729 B13R0.280 CS(=O)(=O)CCCNCCCCCO 2230a_100000742409_100000746330 [0,1,1,0,0,0|2,0,0]=4 1730 B13R0.280 CS(=O)(=O)CCCNCCCCCO 2230a_100000762737_100000754308 [0,1,1,0,0,0|2,0,0]=4 1731 B13R0.280 CS(=O)(=O)CCCNCCCCCO 34a_100000742409_100000746330 [0,1,1,0,0,0|2,0,0]=4 1732 B13R0.280 CS(=O)(=O)CCCNCCCCCO 34a_100000762737_100000754308 [0,1,1,0,0,0|2,0,0]=4 1733 B13R0.280 CS(=O)(=O)CCNCCCCCC#N 2230a_100000740961_100009813376 [0,1,1,0,0,0|1,0,1]=4 1734 B13R0.280 CS(=O)(=O)CCNCCCCCC=O 2230a_100000740961_100000139337 [0,1,1,0,0,0|1,0,1]=4 1735 B13R0.280 CS(=O)(=O)CCNCCCCCCF 2230a_100000740961_100015922095 [0,1,1,0,0,0|1,0,0]=3 1736 B13R0.280 CS(=O)(=O)CCNCCCCCCF 34a_100000740961_100015922095 [0,1,1,0,0,0|1,0,0]=3 1737 B13R0.280 CS(=O)(=O)CCNCCCCCCO 2230a_100000686447_100000731031 [0,1,1,0,0,0|1,0,0]=3 1738 B13R0.280 CS(=O)(=O)CCNCCCCCCO 2230a_100000740961_100000766143 [0,1,1,0,0,0|1,0,0]=3 1739 B13R0.280 CS(=O)(=O)CCNCCCCCCO 34a_100000686447_100000731031 [0,1,1,0,0,0|1,0,0]=3 1740 B13R0.280 CS(=O)(=O)CCNCCCCCCO 34a_100000740961_100000766143 [0,1,1,0,0,0|1,0,0]=3 1741 B13R0.280 CS(=O)(=O)CCOCCCCCCBr 34a_100011215345_100000731031 [0,1,1,0,0,0|2,0,0]=4 1742 B13R0.280 CS(=O)(=O)CCOCCCCCCBr 7a_100011215345_100000230027 [0,1,1,0,0,0|2,0,0]=4 1743 B13R0.280 CS(=O)(=O)CCOCCCCCCCl 34a_100000766143_100000731031 [0,1,1,0,0,0|2,0,0]=4 1744 B13R0.280 CS(=O)(=O)CCOCCCCCCCl 7a_100000766143_100000230027 [0,1,1,0,0,0|2,0,0]=4 1745 B13R0.280 CS(=O)(=O)CCOCCCCCCF 34a_100000211924_100015922095 [0,1,1,0,0,0|2,0,0]=4 1746 B13R0.280 CS(=O)(=O)CCOCCCCCCF 34a_100000732779_100000731031 [0,1,1,0,0,0|2,0,0]=4 1747 B13R0.280 CS(=O)(=O)CCOCCCCCCF 7a_100000211924_100015922095 [0,1,1,0,0,0|2,0,0]=4 1748 B13R0.280 CS(=O)(=O)CCOCCCCCCF 7a_100000732779_100000230027 [0,1,1,0,0,0|2,0,0]=4 1749 B13R0.280 CS(=O)(=O)CCOCCCCCCN 34a_100000686447_100000731031 [0,1,1,0,0,0|2,0,0]=4 1750 B13R0.280 CS(=O)(=O)CCOCCCCCCO 34a_100000211924_100000766143 [0,1,1,0,0,0|2,0,0]=4 1751 B13R0.280 CS(=O)(=O)CCOCCCCCCO 7a_100000211924_100000766143 [0,1,1,0,0,0|2,0,0]=4 1752 B13R0.280 CS(=O)(=O)CCSCCCCCCF 62a_100000731031_100015922095 [0,1,1,0,0,0|2,0,0]=4 1753 B13R0.280 CS(=O)(=O)CCSCCCCCCF 62a_100015922095_100000230027 [0,1,1,0,0,0|2,0,0]=4 1754 B13R0.280 CS(=O)(=O)CCSCCCCCCO 62a_100000731031_100000766143 [0,1,1,0,0,0|2,0,0]=4 1755 B13R0.280 CS(=O)(=O)CCSCCCCCCO 62a_100000766143_100000230027 [0,1,1,0,0,0|2,0,0]=4 1756 B13R0.280 CS(=O)(=O)NCCNCCCCCF 34a_100000752411_100000729378 [0,1,1,0,0,0|2,0,0]=4 1757 B13R0.280 CS(=O)(=O)NCCNCCCCCO 2230a_100000762737_100000754112 [0,1,1,0,0,0|2,0,0]=4 1758 B13R0.280 CS(=O)(=O)NCCNCCCCCO 34a_100000752411_100000746330 [0,1,1,0,0,0|2,0,0]=4 1759 B13R0.280 CS(=O)(=O)OCCNCCCCCO 2230a_100000762737_200000036756 [0,1,1,0,0,0|2,0,0]=4 1760 B13R0.280 CS(=O)(=O)OCCNCCCCCO 34a_100000762737_200000036756 [0,1,1,0,0,0|2,0,0]=4 1761 B13R0.280 N#CCCCCCNCCS(=O)(=O)N 2230a_100000738205_100009813376 [0,1,1,0,0,0|1,0,1]=4 1762 B13R0.280 NCCCCCCOCCS(=O)(=O)[O-] 34a_100000686447_100000762736 [0,1,1,0,0,0|1,0,1]=4 1763 B13R0.280 NS(=O)(=O)CCCNCCCCCO 2230a_100000762737_100000750626 [0,1,1,0,0,0|2,0,0]=4 1764 B13R0.280 NS(=O)(=O)CCCNCCCCCO 34a_100000762737_100000750626 [0,1,1,0,0,0|2,0,0]=4 1765 B13R0.280 NS(=O)(=O)CCNCCCCCC=O 2230a_100000738205_100000139337 [0,1,1,0,0,0|1,0,1]=4 1766 B13R0.280 NS(=O)(=O)CCNCCCCCCF 2230a_100000738205_100015922095 [0,1,1,0,0,0|1,0,0]=3 1767 B13R0.280 NS(=O)(=O)CCNCCCCCCF 34a_100000738205_100015922095 [0,1,1,0,0,0|1,0,0]=3 1768 B13R0.280 NS(=O)(=O)CCNCCCCCCO 2230a_100000738205_100000766143 [0,1,1,0,0,0|1,0,0]=3 1769 B13R0.280 NS(=O)(=O)CCNCCCCCCO 34a_100000738205_100000766143 [0,1,1,0,0,0|1,0,0]=3 1770 B13R0.280 NS(=O)(=O)CCOCCCCCCF 34a_100012334274_100015922095 [0,1,1,0,0,0|2,0,0]=4 1771 B13R0.280 NS(=O)(=O)CCOCCCCCCO 34a_100012334274_100000766143 [0,1,1,0,0,0|2,0,0]=4 1772 B13R0.280 O=S(=O)([O-])CCCNCCCCCO 34a_100000762737_100009813499 [0,1,1,0,0,0|1,0,1]=4 1773 B13R0.280 O=S(=O)([O-])CCNCCCCCCO 2230a_100000686447_100000737633 [0,1,1,0,0,0|0,0,1]=3 1774 B13R0.280 O=S(=O)([O-])CCNCCCCCCO 34a_100000686447_100000762736 [0,1,1,0,0,0|0,0,1]=3 1775 B13R0.280 O=S(=O)([O-])CCOCCCCCCBr 34a_100011215345_100000762736 [0,1,1,0,0,0|1,0,1]=4 1776 B13R0.280 O=S(=O)([O-])CCOCCCCCCCl 34a_100000766143_100000762736 [0,1,1,0,0,0|1,0,1]=4 1777 B13R0.280 O=S(=O)([O-])CCOCCCCCCF 34a_100000732779_100000762736 [0,1,1,0,0,0|1,0,1]=4 1778 B13R0.280 O=S(=O)([O-])CCSCCCCCCF 62a_100000762736_100015922095 [0,1,1,0,0,0|1,0,1]=4 1779 B13R0.280 O=S(=O)([O-])CCSCCCCCCF 62a_100015922095_100000762736 [0,1,1,0,0,0|1,0,1]=4 1780 B13R0.280 O=S(=O)([O-])CCSCCCCCCO 62a_100000762736_100000766143 [0,1,1,0,0,0|1,0,1]=4 1781 B13R0.280 O=S(=O)([O-])CCSCCCCCCO 62a_100000766143_100000762736 [0,1,1,0,0,0|1,0,1]=4 1782 B13R0.286 CCCCCCNC(=O)CS(=O)(=O)C 11a_100000210581_100000744497 [0,1,1,0,0,0|1,0,1]=4 1783 B13R0.286 CCCCCCNC(=O)CS(=O)(=O)C 240690a_100000210581_100000744497 [0,1,1,0,0,0|1,0,1]=4 1784 B13R0.286 CCCCCCNC(=O)CS(=O)(=O)C 527a_100000210581_100000744497 [0,1,1,0,0,0|1,0,1]=4 1785 B13R0.431 CCC(C)CCCOCCS(=O)(=O)C 7a_100011216074_100000230027 [0,1,1,0,0,0|2,0,0]=4 1786 B13R0.431 CCN(C)CCCNCCS(=O)(=O)C 2230a_100000740961_100015186262 [0,1,1,0,0,0|2,0,0]=4 1787 B13R0.431 CCN(C)CCCNCCS(=O)(=O)N 2230a_100000738205_100015186262 [0,1,1,0,0,0|2,0,0]=4 1788 B13R0.442 CC(=O)CCCCNCCS(=O)(=O)C 34a_100000740961_100009817362 [0,1,1,0,0,0|1,0,1]=4 1789 B13R0.442 CC(=O)CCCCNCCS(=O)(=O)N 34a_100000738205_100009817362 [0,1,1,0,0,0|1,0,1]=4 1790 B13R0.442 CC(C)CCCCNCCS(=O)(=O)C 2230a_100000740961_100011216152 [0,1,1,0,0,0|1,0,0]=3 1791 B13R0.442 CC(C)CCCCNCCS(=O)(=O)C 34a_100000740961_100011216152 [0,1,1,0,0,0|1,0,0]=3 1792 B13R0.442 CC(C)CCCCNCCS(=O)(=O)N 2230a_100000738205_100011216152 [0,1,1,0,0,0|1,0,0]=3 1793 B13R0.442 CC(C)CCCCNCCS(=O)(=O)N 34a_100000738205_100011216152 [0,1,1,0,0,0|1,0,0]=3 1794 B13R0.442 CC(C)CCCCOCCS(=O)(=O)C 34a_100000211924_100011216152 [0,1,1,0,0,0|2,0,0]=4 1795 B13R0.442 CC(C)CCCCOCCS(=O)(=O)C 34a_100011214890_100000731031 [0,1,1,0,0,0|2,0,0]=4 1796 B13R0.442 CC(C)CCCCOCCS(=O)(=O)C 7a_100000211924_100011216152 [0,1,1,0,0,0|2,0,0]=4 1797 B13R0.442 CC(C)CCCCOCCS(=O)(=O)C 7a_100011214890_100000230027 [0,1,1,0,0,0|2,0,0]=4 1798 B13R0.442 CC(C)CCCCOCCS(=O)(=O)N 34a_100012334274_100011216152 [0,1,1,0,0,0|2,0,0]=4 1799 B13R0.442 CC(C)CCCCOCCS(=O)(=O)[O-] 34a_100011214890_100000762736 [0,1,1,0,0,0|1,0,1]=4 1800 B13R0.442 CC(C)CCCCSCCS(=O)(=O)C 62a_100000731031_100011216152 [0,1,1,0,0,0|2,0,0]=4 1801 B13R0.442 CC(C)CCCCSCCS(=O)(=O)C 62a_100011216152_100000230027 [0,1,1,0,0,0|2,0,0]=4 1802 B13R0.442 CC(C)CCCCSCCS(=O)(=O)[O-] 62a_100000762736_100011216152 [0,1,1,0,0,0|1,0,1]=4 1803 B13R0.442 CC(C)CCCCSCCS(=O)(=O)[O-] 62a_100011216152_100000762736 [0,1,1,0,0,0|1,0,1]=4 1804 B13R0.442 CC(C)OCCCNCCS(=O)(=O)C 2230a_100000737246_100000731031 [0,1,1,0,0,0|2,0,0]=4 1805 B13R0.442 CC(C)OCCCNCCS(=O)(=O)C 34a_100000737246_100000731031 [0,1,1,0,0,0|2,0,0]=4 1806 B13R0.442 CC(C)OCCCNCCS(=O)(=O)[O-] 2230a_100000737246_100000737633 [0,1,1,0,0,0|1,0,1]=4 1807 B13R0.442 CC(C)OCCCNCCS(=O)(=O)[O-] 34a_100000737246_100000762736 [0,1,1,0,0,0|1,0,1]=4 1808 B13R0.1172 CCCCCCC(=O)CCS(=O)(=O)C 1458a_100000737124_100000210757 [0,1,1,0,0,0|2,0,0]=4 1809 B13R0.1172 CCCCCCC(=O)CCS(=O)(=O)C 1458a_100102632555_100000731031 [0,1,1,0,0,0|2,0,0]=4 1810 B13R0.1172 CCCCCCC(=O)CCS(=O)(=O)N 1458a_100000737202_100000210757 [0,1,1,0,0,0|2,0,0]=4 1811 B13R0.1172 CCCCCCC(=O)CCS(=O)(=O)[O-] 1458a_100102632555_100000762736 [0,1,1,0,0,0|1,0,1]=4 1812 B13R0.1172 CCCCCCN(C)CCS(=O)(=O)C 2230a_100000750128_100000210314 [0,1,1,0,0,0|1,0,0]=3 1813 B13R0.1172 CCCCCCN(C)CCS(=O)(=O)C 2230a_106256046315_100000731031 [0,1,1,0,0,0|1,0,0]=3 1814 B13R0.1172 CCCCCCN(C)CCS(=O)(=O)C 269982a_100000750128_100000210757 [0,1,1,0,0,0|1,0,0]=3 1815 B13R0.1172 CCCCCCN(C)CCS(=O)(=O)C 269982a_106256046315_100000731031 [0,1,1,0,0,0|1,0,0]=3 1816 B13R0.1172 CCCCCCN(C)CCS(=O)(=O)C 34a_100000750128_100000210314 [0,1,1,0,0,0|1,0,0]=3 1817 B13R0.1172 CCCCCCN(C)CCS(=O)(=O)[O-] 2230a_106256046315_100000737633 [0,1,1,0,0,0|0,0,1]=3 1818 B13R0.1172 CCCCOCN(C)CCS(=O)(=O)C 2230a_100000750128_100011995733 [0,1,1,0,0,0|2,0,0]=4 1819 B13R0.1172 CCCCOCN(C)CCS(=O)(=O)C 269982a_100000750128_100011995733 [0,1,1,0,0,0|2,0,0]=4 1820 B13R0.1172 CCCCOCN(C)CCS(=O)(=O)C 34a_100000750128_100011995733 [0,1,1,0,0,0|2,0,0]=4 1821 B13R0.1172 CCCOCCN(C)CCS(=O)(=O)C 2230a_100000750128_100011215938 [0,1,1,0,0,0|2,0,0]=4 1822 B13R0.1172 CCCOCCN(C)CCS(=O)(=O)C 269982a_100000750128_100011215938 [0,1,1,0,0,0|2,0,0]=4 1823 B13R0.1172 CCCOCCN(C)CCS(=O)(=O)C 34a_100000750128_100011215938 [0,1,1,0,0,0|2,0,0]=4 1824 B13R0.1172 CCOCCCN(C)CCS(=O)(=O)C 2230a_100000750128_100012232248 [0,1,1,0,0,0|2,0,0]=4 1825 B13R0.1172 CCOCCCN(C)CCS(=O)(=O)C 269982a_100000750128_100012232248 [0,1,1,0,0,0|2,0,0]=4 1826 B13R0.1172 CCOCCCN(C)CCS(=O)(=O)C 34a_100000750128_100012232248 [0,1,1,0,0,0|2,0,0]=4 1827 B13R0.1172 CN(CCCCCF)CCS(=O)(=O)C 2230a_100000750128_100000729378 [0,1,1,0,0,0|2,0,0]=4 1828 B13R0.1172 CN(CCCCCF)CCS(=O)(=O)C 269982a_100000750128_100000729378 [0,1,1,0,0,0|2,0,0]=4 1829 B13R0.1172 CN(CCCCCF)CCS(=O)(=O)C 34a_100000750128_100000729378 [0,1,1,0,0,0|2,0,0]=4 1830 B13R0.1172 CN(CCCCCO)CCS(=O)(=O)C 2230a_100000722520_100000731031 [0,1,1,0,0,0|2,0,0]=4 1831 B13R0.1172 CN(CCCCCO)CCS(=O)(=O)C 2230a_100000750128_100000746330 [0,1,1,0,0,0|2,0,0]=4 1832 B13R0.1172 CN(CCCCCO)CCS(=O)(=O)C 269982a_100000722520_100000731031 [0,1,1,0,0,0|2,0,0]=4 1833 B13R0.1172 CN(CCCCCO)CCS(=O)(=O)C 269982a_100000750128_100000746330 [0,1,1,0,0,0|2,0,0]=4 1834 B13R0.1172 CN(CCCCCO)CCS(=O)(=O)C 34a_100000750128_100000746330 [0,1,1,0,0,0|2,0,0]=4 1835 B13R0.1172 CN(CCCCCO)CCS(=O)(=O)[O-] 2230a_100000722520_100000737633 [0,1,1,0,0,0|1,0,1]=4 1836 B13R0.1172 COCCCCN(C)CCS(=O)(=O)C 2230a_100000750128_100000730899 [0,1,1,0,0,0|2,0,0]=4 1837 B13R0.1172 COCCCCN(C)CCS(=O)(=O)C 269982a_100000750128_100000730899 [0,1,1,0,0,0|2,0,0]=4 1838 B13R0.1172 COCCCCN(C)CCS(=O)(=O)C 34a_100000750128_100000755781 [0,1,1,0,0,0|2,0,0]=4 1839 B13R0.1215 CCCCCCNCCS(=O)(=O)CC 2230a_100000210581_100000756660 [0,1,1,0,0,0|1,0,0]=3 1840 B13R0.1215 CCCCCCNCCS(=O)(=O)CC 2230a_100000751051_100000210314 [0,1,1,0,0,0|1,0,0]=3 1841 B13R0.1215 CCCCCCNCCS(=O)(=O)CC 34a_100000751051_100000210314 [0,1,1,0,0,0|1,0,0]=3 1842 B13R0.1215 CCCCCCNCCS(=O)(=O)NC 2230a_100000710037_100000210314 [0,1,1,0,0,0|1,0,0]=3 1843 B13R0.1215 CCCCCCNCCS(=O)(=O)NC 34a_100000710037_100000210314 [0,1,1,0,0,0|1,0,0]=3 1844 B13R0.1215 CCCCCCOCCS(=O)(=O)CC 34a_100000210259_100000756660 [0,1,1,0,0,0|2,0,0]=4 1845 B13R0.1215 CCCCCCOCCS(=O)(=O)CC 34a_200011216379_100000210314 [0,1,1,0,0,0|2,0,0]=4 1846 B13R0.1215 CCCCCCOCCS(=O)(=O)CC 7a_100000210259_100000756660 [0,1,1,0,0,0|2,0,0]=4 1847 B13R0.1215 CCCCCCOCCS(=O)(=O)CC 7a_200011216379_100000210314 [0,1,1,0,0,0|2,0,0]=4 1848 B13R0.1215 CCCCCCSCCS(=O)(=O)CC 62a_100000210314_100000756660 [0,1,1,0,0,0|2,0,0]=4 1849 B13R0.1215 CCCCCCSCCS(=O)(=O)CC 62a_100000756660_100000210757 [0,1,1,0,0,0|2,0,0]=4 1850 B13R0.1215 CCCCOCNCCS(=O)(=O)CC 2230a_100000751051_100011995733 [0,1,1,0,0,0|2,0,0]=4 1851 B13R0.1215 CCCCOCNCCS(=O)(=O)CC 34a_100000751051_100011995733 [0,1,1,0,0,0|2,0,0]=4 1852 B13R0.1215 CCCCOCNCCS(=O)(=O)NC 2230a_100000710037_100011995733 [0,1,1,0,0,0|2,0,0]=4 1853 B13R0.1215 CCCCOCNCCS(=O)(=O)NC 34a_100000710037_100011995733 [0,1,1,0,0,0|2,0,0]=4 1854 B13R0.1215 CCCOCCNCCS(=O)(=O)CC 2230a_100000751051_100011215938 [0,1,1,0,0,0|2,0,0]=4 1855 B13R0.1215 CCCOCCNCCS(=O)(=O)CC 2230a_100161115042_100000756660 [0,1,1,0,0,0|2,0,0]=4 1856 B13R0.1215 CCCOCCNCCS(=O)(=O)CC 34a_100000751051_100011215938 [0,1,1,0,0,0|2,0,0]=4 1857 B13R0.1215 CCCOCCNCCS(=O)(=O)CC 34a_100161115042_100000756660 [0,1,1,0,0,0|2,0,0]=4 1858 B13R0.1215 CCCOCCNCCS(=O)(=O)NC 2230a_100000710037_100011215938 [0,1,1,0,0,0|2,0,0]=4 1859 B13R0.1215 CCCOCCNCCS(=O)(=O)NC 34a_100000710037_100011215938 [0,1,1,0,0,0|2,0,0]=4 1860 B13R0.1215 CCCSCCNCCS(=O)(=O)CC 2230a_100020603323_100000756660 [0,1,1,0,0,0|2,0,0]=4 1861 B13R0.1215 CCOCCCNCCS(=O)(=O)CC 2230a_100000210961_100000756660 [0,1,1,0,0,0|2,0,0]=4 1862 B13R0.1215 CCOCCCNCCS(=O)(=O)CC 2230a_100000751051_100012232248 [0,1,1,0,0,0|2,0,0]=4 1863 B13R0.1215 CCOCCCNCCS(=O)(=O)CC 34a_100000210961_100000756660 [0,1,1,0,0,0|2,0,0]=4 1864 B13R0.1215 CCOCCCNCCS(=O)(=O)CC 34a_100000751051_100012232248 [0,1,1,0,0,0|2,0,0]=4 1865 B13R0.1215 CCOCCCNCCS(=O)(=O)NC 2230a_100000710037_100012232248 [0,1,1,0,0,0|2,0,0]=4 1866 B13R0.1215 CCOCCCNCCS(=O)(=O)NC 34a_100000710037_100012232248 [0,1,1,0,0,0|2,0,0]=4 1867 B13R0.1215 CCS(=O)(=O)CCNCCCCCF 2230a_100000751051_100000729378 [0,1,1,0,0,0|2,0,0]=4 1868 B13R0.1215 CCS(=O)(=O)CCNCCCCCF 34a_100000751051_100000729378 [0,1,1,0,0,0|2,0,0]=4 1869 B13R0.1215 CCS(=O)(=O)CCNCCCCCO 2230a_100000751051_100000746330 [0,1,1,0,0,0|2,0,0]=4 1870 B13R0.1215 CCS(=O)(=O)CCNCCCCCO 2230a_100000762737_100000756660 [0,1,1,0,0,0|2,0,0]=4 1871 B13R0.1215 CCS(=O)(=O)CCNCCCCCO 34a_100000751051_100000746330 [0,1,1,0,0,0|2,0,0]=4 1872 B13R0.1215 CCS(=O)(=O)CCNCCCCCO 34a_100000762737_100000756660 [0,1,1,0,0,0|2,0,0]=4 1873 B13R0.1215 CCS(=O)(=O)CCNCCCCOC 2230a_100000751051_100000730899 [0,1,1,0,0,0|2,0,0]=4 1874 B13R0.1215 CCS(=O)(=O)CCNCCCCOC 34a_100000751051_100000755781 [0,1,1,0,0,0|2,0,0]=4 1875 B13R0.1215 CNS(=O)(=O)CCNCCCCCF 2230a_100000710037_100000729378 [0,1,1,0,0,0|2,0,0]=4 1876 B13R0.1215 CNS(=O)(=O)CCNCCCCCF 34a_100000710037_100000729378 [0,1,1,0,0,0|2,0,0]=4 1877 B13R0.1215 CNS(=O)(=O)CCNCCCCCO 2230a_100000710037_100000746330 [0,1,1,0,0,0|2,0,0]=4 1878 B13R0.1215 CNS(=O)(=O)CCNCCCCCO 34a_100000710037_100000746330 [0,1,1,0,0,0|2,0,0]=4 1879 B13R0.1215 CNS(=O)(=O)CCNCCCCOC 2230a_100000710037_100000730899 [0,1,1,0,0,0|2,0,0]=4 1880 B13R0.1215 CNS(=O)(=O)CCNCCCCOC 34a_100000710037_100000755781 [0,1,1,0,0,0|2,0,0]=4 1881 B13R0.223 CCCC(CCC)NCCS(=O)(=O)C 2230a_100011207992_100000731031 [0,1,1,0,0,0|1,0,0]=3 1882 B13R0.223 CCCC(CCC)NCCS(=O)(=O)C 270004a_100000740961_100000210088 [0,1,1,0,0,0|1,0,0]=3 1883 B13R0.223 CCCC(CCC)NCCS(=O)(=O)C 34a_100000740961_200011218217 [0,1,1,0,0,0|1,0,0]=3 1884 B13R0.223 CCCC(CCC)NCCS(=O)(=O)C 34a_100011207992_100000731031 [0,1,1,0,0,0|1,0,0]=3 1885 B13R0.223 CCCC(CCC)NCCS(=O)(=O)N 270004a_100000738205_100000210088 [0,1,1,0,0,0|1,0,0]=3 1886 B13R0.223 CCCC(CCC)NCCS(=O)(=O)N 34a_100000738205_200011218217 [0,1,1,0,0,0|1,0,0]=3 1887 B13R0.223 CCCC(CCC)NCCS(=O)(=O)[O-] 2230a_100011207992_100000737633 [0,1,1,0,0,0|0,0,1]=3 1888 B13R0.223 CCCC(CCC)NCCS(=O)(=O)[O-] 34a_100011207992_100000762736 [0,1,1,0,0,0|0,0,1]=3 1889 B13R0.223 CCCC(CCC)OCCS(=O)(=O)C 34a_100000211924_200011218217 [0,1,1,0,0,0|2,0,0]=4 1890 B13R0.223 CCCC(CCC)OCCS(=O)(=O)C 34a_200011218534_100000731031 [0,1,1,0,0,0|2,0,0]=4 1891 B13R0.223 CCCC(CCC)OCCS(=O)(=O)C 7a_100000211924_200011218217 [0,1,1,0,0,0|2,0,0]=4 1892 B13R0.223 CCCC(CCC)OCCS(=O)(=O)C 7a_200011218534_100000230027 [0,1,1,0,0,0|2,0,0]=4 1893 B13R0.223 CCCC(CCC)OCCS(=O)(=O)N 34a_100012334274_200011218217 [0,1,1,0,0,0|2,0,0]=4 1894 B13R0.223 CCCC(CCC)OCCS(=O)(=O)[O-] 34a_200011218534_100000762736 [0,1,1,0,0,0|1,0,1]=4 1895 B13R0.223 CCCC(CCC)SCCS(=O)(=O)C 62a_100000731031_200011218217 [0,1,1,0,0,0|2,0,0]=4 1896 B13R0.223 CCCC(CCC)SCCS(=O)(=O)C 62a_200011218217_100000230027 [0,1,1,0,0,0|2,0,0]=4 1897 B13R0.223 CCCC(CCC)SCCS(=O)(=O)[O-] 62a_100000762736_200011218217 [0,1,1,0,0,0|1,0,1]=4 1898 B13R0.223 CCCC(CCC)SCCS(=O)(=O)[O-] 62a_200011218217_100000762736 [0,1,1,0,0,0|1,0,1]=4 1899 B13R0.223 CCC[C@@H](CCO)NCCS(=O)(=O)C 2230a_100015193777_100000731031 [0,1,1,0,0,0|1,0,0]=3 1900 B13R0.223 CCC[C@@H](CCO)NCCS(=O)(=O)C 34a_100015193777_100000731031 [0,1,1,0,0,0|1,0,0]=3 1901 B13R0.223 CCC[C@@H](CCO)NCCS(=O)(=O)[O-] 2230a_100015193777_100000737633 [0,1,1,0,0,0|0,0,1]=3 1902 B13R0.223 CCC[C@@H](CCO)NCCS(=O)(=O)[O-] 34a_100015193777_100000762736 [0,1,1,0,0,0|0,0,1]=3 1903 B13R0.223 COCC(COC)NCCS(=O)(=O)C 2230a_100011997029_100000731031 [0,1,1,0,0,0|2,0,0]=4 1904 B13R0.223 COCC(COC)NCCS(=O)(=O)C 270004a_100000740961_100000761750 [0,1,1,0,0,0|2,0,0]=4 1905 B13R0.223 COCC(COC)NCCS(=O)(=O)N 270004a_100000738205_100000761750 [0,1,1,0,0,0|2,0,0]=4 1906 B13R0.223 COCC(COC)NCCS(=O)(=O)[O-] 2230a_100011997029_100000737633 [0,1,1,0,0,0|1,0,1]=4 1907 B13R0.322 CCCC(CC)NC(=O)CS(=O)(=O)C 11a_100000747048_100000744497 [0,1,1,0,0,0|1,0,1]=4 1908 B13R0.322 CCCC(CC)NC(=O)CS(=O)(=O)C 240690a_100000747048_100000744497 [0,1,1,0,0,0|1,0,1]=4 1909 B13R0.322 CCCC(CC)NC(=O)CS(=O)(=O)C 527a_100000747048_100000744497 [0,1,1,0,0,0|1,0,1]=4 1910 B13R0.569 CCC(COC)N(C)CCS(=O)(=O)C 270004a_100000750128_100000757811 [0,1,1,0,0,0|2,0,0]=4 1911 B13R0.569 CCCC(CC)C(=O)CCS(=O)(=O)C 1458a_100000737124_100011219200 [0,1,1,0,0,0|2,0,0]=4 1912 B13R0.569 CCCC(CC)C(=O)CCS(=O)(=O)C 1458a_100011416436_100000731031 [0,1,1,0,0,0|2,0,0]=4 1913 B13R0.569 CCCC(CC)C(=O)CCS(=O)(=O)N 1458a_100000737202_100011219200 [0,1,1,0,0,0|2,0,0]=4 1914 B13R0.569 CCCC(CC)C(=O)CCS(=O)(=O)[O-] 1458a_100011416436_100000762736 [0,1,1,0,0,0|1,0,1]=4 1915 B13R0.569 CCCC(CC)N(C)CCS(=O)(=O)C 269982a_100000750128_100011219200 [0,1,1,0,0,0|1,0,0]=3 1916 B13R0.569 CCCC(CC)N(C)CCS(=O)(=O)C 270004a_100000750128_100000687865 [0,1,1,0,0,0|1,0,0]=3 1917 B13R0.690 CC(C)C(CCO)NCCS(=O)(=O)C 2230a_100161115045_100000731031 [0,1,1,0,0,0|2,0,0]=4 1918 B13R0.690 CC(C)C(CCO)NCCS(=O)(=O)C 34a_100161115045_100000731031 [0,1,1,0,0,0|2,0,0]=4 1919 B13R0.690 CC(C)C(CCO)NCCS(=O)(=O)[O-] 2230a_100161115045_100000737633 [0,1,1,0,0,0|1,0,1]=4 1920 B13R0.690 CC(C)C(CCO)NCCS(=O)(=O)[O-] 34a_100161115045_100000762736 [0,1,1,0,0,0|1,0,1]=4 1921 B13R0.690 CCCC(OCCS(=O)(=O)C)C(C)C 34a_200011215069_100000731031 [0,1,1,0,0,0|2,0,0]=4 1922 B13R0.690 CCCC(OCCS(=O)(=O)C)C(C)C 7a_200011215069_100000230027 [0,1,1,0,0,0|2,0,0]=4 1923 B13R0.690 CCCC(OCCS(=O)(=O)[O-])C(C)C 34a_200011215069_100000762736 [0,1,1,0,0,0|1,0,1]=4 1924 B13R0.690 COCC(NCCS(=O)(=O)C)C(C)C 2230a_100000760233_100000731031 [0,1,1,0,0,0|2,0,0]=4 1925 B13R0.690 COCC(NCCS(=O)(=O)[O-])C(C)C 2230a_100000760233_100000737633 [0,1,1,0,0,0|1,0,1]=4 1926 B13R0.928 CC[C@H](C)[C@@H](CO)NCCS(=O)(=O)C 2230a_100011827617_100000731031 [0,1,1,0,0,0|2,0,0]=4 1927 B13R0.928 CC[C@H](C)[C@@H](CO)NCCS(=O)(=O)[O-] 2230a_100011827617_100000737633 [0,1,1,0,0,0|1,0,1]=4 1928 B13R0.1070 CCC(COC)NCCS(=O)(=O)CC 2230a_100000757820_100000756660 [0,1,1,0,0,0|2,0,0]=4 1929 B13R0.1070 CCC(COC)NCCS(=O)(=O)CC 270004a_100000751051_100000757811 [0,1,1,0,0,0|2,0,0]=4 1930 B13R0.1070 CCC(COC)NCCS(=O)(=O)NC 270004a_100000710037_100000757811 [0,1,1,0,0,0|2,0,0]=4 1931 B13R0.1070 CCCC(CC)NCCS(=O)(=O)CC 2230a_100000747048_100000756660 [0,1,1,0,0,0|1,0,0]=3 1932 B13R0.1070 CCCC(CC)NCCS(=O)(=O)CC 270004a_100000751051_100000687865 [0,1,1,0,0,0|1,0,0]=3 1933 B13R0.1070 CCCC(CC)NCCS(=O)(=O)NC 270004a_100000710037_100000687865 [0,1,1,0,0,0|1,0,0]=3 1934 B13R0.1070 CCCC(CC)OCCS(=O)(=O)CC 34a_100000687864_100000756660 [0,1,1,0,0,0|2,0,0]=4 1935 B13R0.1070 CCCC(CC)OCCS(=O)(=O)CC 7a_100000687864_100000756660 [0,1,1,0,0,0|2,0,0]=4 1936 B13R0.1070 CCCC(CC)OCCS(=O)(=O)CC 7a_200011216379_100011219200 [0,1,1,0,0,0|2,0,0]=4 1937 B13R0.1070 CCCC(CC)SCCS(=O)(=O)CC 62a_100000756660_100011219200 [0,1,1,0,0,0|2,0,0]=4 1938 B13R0.1070 CCCC(CC)SCCS(=O)(=O)CC 62a_100011219200_100000756660 [0,1,1,0,0,0|2,0,0]=4 1939 B13R0.1070 CCC[C@@H](CO)NCCS(=O)(=O)CC 2230a_100000732646_100000756660 [0,1,1,0,0,0|2,0,0]=4 1940 B13R0.1070 CCC[C@@H](CO)NCCS(=O)(=O)CC 34a_100000732646_100000756660 [0,1,1,0,0,0|2,0,0]=4 1941 B13R0.1084 CCCC(CC)SCC(O)S(=O)(=O)[O-] 62a_100011219200_200000035551 [0,1,1,0,0,0|1,0,1]=4 1942 B13R0.1084 CCCC(CC)SCC(O)S(=O)(=O)[O-] 62a_200000035551_100011219200 [0,1,1,0,0,0|1,0,1]=4 1943 B13R0.1474 CCCC(C)(CC)OCCS(=O)(=O)C 7a_100000211924_200000040151 [0,1,1,0,0,0|2,0,0]=4 1944 B13R0.1474 CCCC(C)(CC)OCCS(=O)(=O)C 7a_200011215934_100000230027 [0,1,1,0,0,0|2,0,0]=4 1945 B13R0.1474 CCCC(C)(CC)SCCS(=O)(=O)C 62a_100000731031_200000040151 [0,1,1,0,0,0|2,0,0]=4 1946 B13R0.1474 CCCC(C)(CC)SCCS(=O)(=O)C 62a_200000040151_100000230027 [0,1,1,0,0,0|2,0,0]=4 1947 B13R0.1474 CCCC(C)(CC)SCCS(=O)(=O)[O-] 62a_100000762736_200000040151 [0,1,1,0,0,0|1,0,1]=4 1948 B13R0.1474 CCCC(C)(CC)SCCS(=O)(=O)[O-] 62a_200000040151_100000762736 [0,1,1,0,0,0|1,0,1]=4 1949 B13R0.1865 CC(C)C[C@@H](CO)NCCS(=O)(=O)C 2230a_100011830311_100000731031 [0,1,1,0,0,0|2,0,0]=4 1950 B13R0.1865 CC(C)C[C@@H](CO)NCCS(=O)(=O)C 34a_100011830311_100000731031 [0,1,1,0,0,0|2,0,0]=4 1951 B13R0.1865 CC(C)C[C@@H](CO)NCCS(=O)(=O)[O-] 2230a_100011830311_100000737633 [0,1,1,0,0,0|1,0,1]=4 1952 B13R0.1865 CC(C)C[C@@H](CO)NCCS(=O)(=O)[O-] 34a_100011830311_100000762736 [0,1,1,0,0,0|1,0,1]=4 1953 B13R1.45 CC(=O)CCN(C)C1CCCCC1 269982a_100000207522_100000053229 [1,1,0,0,0,0|2,0,0]=4 1954 B13R1.45 CC(O)CCN(C)C1CCCCC1 2230a_100000207522_100012276601 [1,1,0,0,0,0|2,0,0]=4 1955 B13R1.45 CC(O)CCN(C)C1CCCCC1 269982a_100000207522_100012276601 [1,1,0,0,0,0|2,0,0]=4 1956 B13R1.45 CC(O)CCN(C)C1CCCCC1 34a_100000207522_100012276601 [1,1,0,0,0,0|2,0,0]=4 1957 B13R1.45 CN(CCC(=O)N)C1CCCCC1 2230a_100000207522_100000744528 [1,1,0,0,0,0|2,0,0]=4 1958 B13R1.45 CN(CCC(=O)N)C1CCCCC1 269982a_100000207522_100000744528 [1,1,0,0,0,0|2,0,0]=4 1959 B13R1.45 CN(CCC(=O)N)C1CCCCC1 270004a_100000730477_100000210434 [1,1,0,0,0,0|2,0,0]=4 1960 B13R1.45 CN(CCC(=O)N)C1CCCCC1 34a_100000207522_100000731001 [1,1,0,0,0,0|2,0,0]=4 1961 B13R1.149 CC(O)CCNC1CCCC(C1)C 2230a_100011194320_100012276601 [1,1,0,0,0,0|2,0,0]=4 1962 B13R1.149 CC(O)CCNC1CCCC(C1)C 270004a_200000755665_100000183594 [1,1,0,0,0,0|2,0,0]=4 1963 B13R1.149 CC(O)CCNC1CCCC(C1)C 34a_100011194320_100012276601 [1,1,0,0,0,0|2,0,0]=4 1964 B13R1.149 CC(O)CCNC1CCCC(C1)O 2230a_100015190357_100012276601 [1,1,0,0,0,0|2,0,0]=4 1965 B13R1.149 CC(O)CCNC1CCCC(C1)O 270004a_200000755665_100012613340 [1,1,0,0,0,0|2,0,0]=4 1966 B13R1.149 CC1CCCC(C1)NCCC(=O)N 2230a_100011194320_100000744528 [1,1,0,0,0,0|2,0,0]=4 1967 B13R1.149 CC1CCCC(C1)NCCC(=O)N 34a_100011194320_100000731001 [1,1,0,0,0,0|2,0,0]=4 1968 B13R1.149 NC(=O)CCNC1CCCC(C1)O 2230a_100015190357_100000744528 [1,1,0,0,0,0|2,0,0]=4 1969 B13R1.158 CC(O)CCNC1CCCCC1C 2230a_100000211402_100012276601 [1,1,0,0,0,0|2,0,0]=4 1970 B13R1.158 CC(O)CCNC1CCCCC1C 269862a_200000755665_100000210921 [1,1,0,0,0,0|2,0,0]=4 1971 B13R1.158 CC(O)CCNC1CCCCC1C 270004a_200000755665_100000210921 [1,1,0,0,0,0|2,0,0]=4 1972 B13R1.158 CC(O)CCNC1CCCCC1C 34a_100000211402_100012276601 [1,1,0,0,0,0|2,0,0]=4 1973 B13R1.158 CC(O)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100012276601 [1,1,0,0,0,0|2,0,0]=4 1974 B13R1.158 CC(O)CCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100012276601 [1,1,0,0,0,0|2,0,0]=4 1975 B13R1.158 CC1CCCCC1NCCC(=O)N 2230a_100000211402_100000744528 [1,1,0,0,0,0|2,0,0]=4 1976 B13R1.158 CC1CCCCC1NCCC(=O)N 269862a_100000740010_100000210921 [1,1,0,0,0,0|2,0,0]=4 1977 B13R1.158 CC1CCCCC1NCCC(=O)N 34a_100000211402_100000731001 [1,1,0,0,0,0|2,0,0]=4 1978 B13R1.158 NC(=O)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000744528 [1,1,0,0,0,0|2,0,0]=4 1979 B13R1.158 NC(=O)CCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000731001 [1,1,0,0,0,0|2,0,0]=4 1980 B13R1.158 O=C(O)CONC1CCCCC1F 269956a_100000106656_100015423560 [1,1,0,0,0,0|2,0,0]=4 1981 B13R1.158 O=C(O)CONC1CCCCC1O 269956a_100000106656_100000038908 [1,1,0,0,0,0|2,0,0]=4 1982 B13R1.351 CC(CNC1CCCCC1)C(=O)O 269956a_100000749485_100000210327 [1,1,0,0,0,0|1,0,0]=3 1983 B13R1.351 CC(CNC1CCCOC1)C(=O)O 269956a_100000749485_100000693364 [1,1,0,0,0,0|2,0,0]=4 1984 B13R1.351 CC(CNC1CCOCC1)C(=O)O 269956a_100000749485_100011324220 [1,1,0,0,0,0|2,0,0]=4 1985 B13R1.351 CC(CNC1CCSCC1)C(=O)O 269956a_100000749485_100000069128 [1,1,0,0,0,0|2,0,0]=4 1986 B13R1.351 O=C(O)C(F)CNC1CCCCC1 269956a_100000084737_100000210327 [1,1,0,0,0,0|1,0,0]=3 1987 B13R1.351 O=C(O)C(F)CNC1CCCOC1 269956a_100000084737_100000693364 [1,1,0,0,0,0|2,0,0]=4 1988 B13R1.351 O=C(O)C(F)CNC1CCOCC1 269956a_100000084737_100011324220 [1,1,0,0,0,0|2,0,0]=4 1989 B13R1.351 O=C(O)C(F)CNC1CCSCC1 269956a_100000084737_100000069128 [1,1,0,0,0,0|2,0,0]=4 1990 B13R1.513 CC(O)CCNC1CCC(CC1)C 270004a_200000755665_100000185489 [1,1,0,0,0,0|2,0,0]=4 1991 B13R1.513 CC(O)CCNC1CCC(CC1)O 270004a_200000755665_100000764474 [1,1,0,0,0,0|2,0,0]=4 1992 B13R1.513 CC(O)CCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100012276601 [1,1,0,0,0,0|2,0,0]=4 1993 B13R1.513 CC(O)CCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100012276601 [1,1,0,0,0,0|2,0,0]=4 1994 B13R1.513 CC1CCC(CC1)NOCC(=O)O 269956a_100000106656_200011216234 [1,1,0,0,0,0|2,0,0]=4 1995 B13R1.513 C[C@H]1CC[C@@H](CC1)NCCC(=O)N 2230a_100020625639_100000744528 [1,1,0,0,0,0|2,0,0]=4 1996 B13R1.513 C[C@H]1CC[C@@H](CC1)NCCC(=O)N 34a_100020625639_100000731001 [1,1,0,0,0,0|2,0,0]=4 1997 B13R1.718 CC(CO)CCNC1CCCCC1 270004a_106354213184_100000210434 [1,1,0,0,0,0|2,0,0]=4 1998 B13R1.718 CC(CO)CCNC1CCCCC1 34a_106354213184_100000210327 [1,1,0,0,0,0|2,0,0]=4 1999 B13R1.718 CNC(=O)CCNC1CCCCC1 2230a_100000182618_100000737683 [1,1,0,0,0,0|2,0,0]=4 2000 B13R1.718 CNC(=O)CCNC1CCCCC1 270004a_100000738227_100000210434 [1,1,0,0,0,0|2,0,0]=4 2001 B13R1.718 CNC(=O)CCNC1CCCCC1 34a_100000182618_100012179268 [1,1,0,0,0,0|2,0,0]=4 2002 B13R1.718 CNC(=O)CCNC1CCCCC1 34a_100000738227_100000210327 [1,1,0,0,0,0|2,0,0]=4 2003 B13R1.718 COC(=O)CCNC1CCCCC1 2230a_100000182618_100000204255 [1,1,0,0,0,0|1,0,0]=3 2004 B13R1.718 COC(=O)CCNC1CCCCC1 34a_100000182618_100000742370 [1,1,0,0,0,0|1,0,0]=3 2005 B13R1.718 COC(=O)CCNC1CCCOC1 2230a_100000719290_100000204255 [1,1,0,0,0,0|2,0,0]=4 2006 B13R1.718 COC(=O)CCNC1CCCOC1 34a_100000719290_100000742370 [1,1,0,0,0,0|2,0,0]=4 2007 B13R1.718 COC(=O)CCNC1CCOCC1 2230a_100000741149_100000204255 [1,1,0,0,0,0|2,0,0]=4 2008 B13R1.718 COC(=O)CCNC1CCOCC1 34a_100000741149_100000742370 [1,1,0,0,0,0|2,0,0]=4 2009 B13R1.718 COC(=O)CCNC1CCSCC1 2230a_100000748639_100000204255 [1,1,0,0,0,0|2,0,0]=4 2010 B13R1.718 COC(=O)CCNC1CCSCC1 34a_100000748639_100000742370 [1,1,0,0,0,0|2,0,0]=4 2011 B13R1.718 COC(=O)CCOC1CCCCC1 34a_100000210231_100000742370 [1,1,0,0,0,0|2,0,0]=4 2012 B13R1.718 COC(=O)CCOC1CCCCC1 7a_100000210231_100000204255 [1,1,0,0,0,0|2,0,0]=4 2013 B13R1.718 COC(=O)CCSC1CCCCC1 62a_100000204255_100000210327 [1,1,0,0,0,0|2,0,0]=4 2014 B13R1.718 COC(=O)CCSC1CCCCC1 62a_100000210327_100000204255 [1,1,0,0,0,0|2,0,0]=4 2015 B13R1.718 O=C(CO)CCCC1CCCCC1 1458a_100000210174_100011713725 [1,1,0,0,0,0|2,0,0]=4 2016 B13R1.718 O=C(CO)CCOC1CCCCC1 1458a_100000210174_100011211530 [1,1,0,0,0,0|2,0,0]=4 2017 B13R1.5134 CC(O)CCNC1(CCCCC1)C 2230a_100000741114_100012276601 [1,1,0,0,0,0|2,0,0]=4 2018 B13R1.5134 CC(O)CCNC1(CCCCC1)C 34a_100000741114_100012276601 [1,1,0,0,0,0|2,0,0]=4 2019 B13R1.5134 CC1(CCCCC1)NCCC(=O)N 2230a_100000741114_100000744528 [1,1,0,0,0,0|2,0,0]=4 2020 B13R1.5134 CC1(CCCCC1)NCCC(=O)N 34a_100000741114_100000731001 [1,1,0,0,0,0|2,0,0]=4 2021 B13R1.127 CC1CCC(C1)NCCS(=O)(=O)C 270004a_100000740961_100011215218 [0,1,0,0,1,0|1,0,0]=3 2022 B13R1.127 CC1CCC(C1)NCCS(=O)(=O)N 270004a_100000738205_100011215218 [0,1,0,0,1,0|1,0,0]=3 2023 B13R1.127 CC1CCC(C1)OCCS(=O)(=O)C 34a_100000698185_100000731031 [0,1,0,0,1,0|2,0,0]=4 2024 B13R1.127 CC1CCC(C1)OCCS(=O)(=O)[O-] 34a_100000698185_100000762736 [0,1,0,0,1,0|1,0,1]=4 2025 B13R1.127 CS(=O)(=O)CCNC1CCC(C1)O 270004a_100000740961_100012614533 [0,1,0,0,1,0|1,0,0]=3 2026 B13R1.127 CS(=O)(=O)CCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000731031 [0,1,0,0,1,0|1,0,0]=3 2027 B13R1.127 NS(=O)(=O)CCNC1CCC(C1)O 270004a_100000738205_100012614533 [0,1,0,0,1,0|1,0,0]=3 2028 B13R1.127 O=S(=O)([O-])CCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000737633 [0,1,0,0,1,0|0,0,1]=3 2029 B13R1.195 CC1CCCC1NCCS(=O)(=O)C 269862a_100000740961_100000752053 [0,1,0,0,1,0|1,0,0]=3 2030 B13R1.195 CC1CCCC1NCCS(=O)(=O)N 269862a_100000738205_100000752053 [0,1,0,0,1,0|1,0,0]=3 2031 B13R1.195 CC1CCCC1OCCS(=O)(=O)C 34a_100011216460_100000731031 [0,1,0,0,1,0|2,0,0]=4 2032 B13R1.195 CC1CCCC1OCCS(=O)(=O)C 7a_100011216460_100000230027 [0,1,0,0,1,0|2,0,0]=4 2033 B13R1.195 CC1CCCC1OCCS(=O)(=O)[O-] 34a_100011216460_100000762736 [0,1,0,0,1,0|1,0,1]=4 2034 B13R1.195 CC1OCCC1NCCS(=O)(=O)C 270004a_100000740961_100000691750 [0,1,0,0,1,0|2,0,0]=4 2035 B13R1.195 CC1OCCC1NCCS(=O)(=O)N 270004a_100000738205_100000691750 [0,1,0,0,1,0|2,0,0]=4 2036 B13R1.195 CS(=O)(=O)CCNC1CCCC1=O 2230a_100000740961_100000211823 [0,1,0,0,1,0|1,0,1]=4 2037 B13R1.195 CS(=O)(=O)CCNC1CCCC1=O 34a_100000740961_100000709159 [0,1,0,0,1,0|1,0,1]=4 2038 B13R1.195 CS(=O)(=O)CCNC1COCC1O 34a_100000740961_200000725654 [0,1,0,0,1,0|2,0,0]=4 2039 B13R1.195 CS(=O)(=O)CCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000731031 [0,1,0,0,1,0|2,0,0]=4 2040 B13R1.195 CS(=O)(=O)CCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000731031 [0,1,0,0,1,0|2,0,0]=4 2041 B13R1.195 CS(=O)(=O)CCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000731031 [0,1,0,0,1,0|2,0,0]=4 2042 B13R1.195 CS(=O)(=O)CCS[C@@H]1CCC[C@H]1O 62a_100000731031_200016002552 [0,1,0,0,1,0|2,0,0]=4 2043 B13R1.195 CS(=O)(=O)CCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000230027 [0,1,0,0,1,0|2,0,0]=4 2044 B13R1.195 NS(=O)(=O)CCNC1CCCC1=O 2230a_100000738205_100000211823 [0,1,0,0,1,0|1,0,1]=4 2045 B13R1.195 NS(=O)(=O)CCNC1CCCC1=O 34a_100000738205_100000709159 [0,1,0,0,1,0|1,0,1]=4 2046 B13R1.195 NS(=O)(=O)CCNC1COCC1O 34a_100000738205_200000725654 [0,1,0,0,1,0|2,0,0]=4 2047 B13R1.195 N[C@H]1CCC[C@@H]1OCCS(=O)(=O)[O-] 34a_100000748460_100000762736 [0,1,0,0,1,0|1,0,1]=4 2048 B13R1.195 O=S(=O)([O-])CCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000737633 [0,1,0,0,1,0|1,0,1]=4 2049 B13R1.195 O=S(=O)([O-])CCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000762736 [0,1,0,0,1,0|1,0,1]=4 2050 B13R1.195 O=S(=O)([O-])CCS[C@@H]1CCC[C@H]1O 62a_100000762736_200016002552 [0,1,0,0,1,0|1,0,1]=4 2051 B13R1.195 O=S(=O)([O-])CCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000762736 [0,1,0,0,1,0|1,0,1]=4 2052 B13R1.252 CCS(=O)(=O)CCNC1CCCC1 2230a_100000211070_100000756660 [0,1,0,0,1,0|1,0,0]=3 2053 B13R1.252 CCS(=O)(=O)CCNC1CCCC1 2230a_100000751051_100000179811 [0,1,0,0,1,0|1,0,0]=3 2054 B13R1.252 CCS(=O)(=O)CCNC1CCCC1 270004a_100000751051_100000210133 [0,1,0,0,1,0|1,0,0]=3 2055 B13R1.252 CCS(=O)(=O)CCNC1CCCC1 34a_100000211070_100000756660 [0,1,0,0,1,0|1,0,0]=3 2056 B13R1.252 CCS(=O)(=O)CCNC1CCCC1 34a_100000751051_100000179811 [0,1,0,0,1,0|1,0,0]=3 2057 B13R1.252 CCS(=O)(=O)CCNC1CCOC1 2230a_100000751051_100000731011 [0,1,0,0,1,0|2,0,0]=4 2058 B13R1.252 CCS(=O)(=O)CCNC1CCOC1 270004a_100000751051_100000752484 [0,1,0,0,1,0|2,0,0]=4 2059 B13R1.252 CCS(=O)(=O)CCNC1CCOC1 34a_100000751051_100000690089 [0,1,0,0,1,0|2,0,0]=4 2060 B13R1.252 CCS(=O)(=O)CCNC1CCSC1 270004a_100000751051_100000212027 [0,1,0,0,1,0|2,0,0]=4 2061 B13R1.252 CCS(=O)(=O)CCN[C@@H]1CCOC1 2230a_200015188469_100000756660 [0,1,0,0,1,0|2,0,0]=4 2062 B13R1.252 CCS(=O)(=O)CCN[C@H]1CCOC1 2230a_100015188467_100000756660 [0,1,0,0,1,0|2,0,0]=4 2063 B13R1.252 CCS(=O)(=O)CCN[C@H]1CCOC1 34a_100015188467_100000756660 [0,1,0,0,1,0|2,0,0]=4 2064 B13R1.252 CCS(=O)(=O)CCOC1CCCC1 34a_100000210269_100000756660 [0,1,0,0,1,0|2,0,0]=4 2065 B13R1.252 CCS(=O)(=O)CCOC1CCCC1 34a_200011216379_100000179811 [0,1,0,0,1,0|2,0,0]=4 2066 B13R1.252 CCS(=O)(=O)CCOC1CCCC1 7a_100000210269_100000756660 [0,1,0,0,1,0|2,0,0]=4 2067 B13R1.252 CCS(=O)(=O)CCOC1CCCC1 7a_200011216379_100000179811 [0,1,0,0,1,0|2,0,0]=4 2068 B13R1.252 CCS(=O)(=O)CCSC1CCCC1 62a_100000756660_100000179811 [0,1,0,0,1,0|2,0,0]=4 2069 B13R1.252 CCS(=O)(=O)CCSC1CCCC1 62a_100011217020_100000756660 [0,1,0,0,1,0|2,0,0]=4 2070 B13R1.252 CNS(=O)(=O)CCNC1CCCC1 2230a_100000710037_100000179811 [0,1,0,0,1,0|1,0,0]=3 2071 B13R1.252 CNS(=O)(=O)CCNC1CCCC1 270004a_100000710037_100000210133 [0,1,0,0,1,0|1,0,0]=3 2072 B13R1.252 CNS(=O)(=O)CCNC1CCCC1 34a_100000710037_100000179811 [0,1,0,0,1,0|1,0,0]=3 2073 B13R1.252 CNS(=O)(=O)CCNC1CCOC1 2230a_100000710037_100000731011 [0,1,0,0,1,0|2,0,0]=4 2074 B13R1.252 CNS(=O)(=O)CCNC1CCOC1 270004a_100000710037_100000752484 [0,1,0,0,1,0|2,0,0]=4 2075 B13R1.252 CNS(=O)(=O)CCNC1CCOC1 34a_100000710037_100000690089 [0,1,0,0,1,0|2,0,0]=4 2076 B13R1.252 CNS(=O)(=O)CCNC1CCSC1 270004a_100000710037_100000212027 [0,1,0,0,1,0|2,0,0]=4 2077 B13R1.1116 CS(=O)(=O)CC(=O)NC1CCCC1 11a_100000211070_100000744497 [0,1,0,0,1,0|1,0,1]=4 2078 B13R1.1116 CS(=O)(=O)CC(=O)NC1CCCC1 240690a_100000211070_100000744497 [0,1,0,0,1,0|1,0,1]=4 2079 B13R1.1116 CS(=O)(=O)CC(=O)NC1CCCC1 527a_100000211070_100000744497 [0,1,0,0,1,0|1,0,1]=4 2080 B13R1.2780 CN(CCS(=O)(=O)C)C1CCCC1 2230a_100000207505_100000731031 [0,1,0,0,1,0|1,0,0]=3 2081 B13R1.2780 CN(CCS(=O)(=O)C)C1CCCC1 2230a_100000750128_100000179811 [0,1,0,0,1,0|1,0,0]=3 2082 B13R1.2780 CN(CCS(=O)(=O)C)C1CCCC1 269982a_100000207505_100000731031 [0,1,0,0,1,0|1,0,0]=3 2083 B13R1.2780 CN(CCS(=O)(=O)C)C1CCCC1 269982a_100000750128_100000179811 [0,1,0,0,1,0|1,0,0]=3 2084 B13R1.2780 CN(CCS(=O)(=O)C)C1CCCC1 270004a_100000750128_100000210133 [0,1,0,0,1,0|1,0,0]=3 2085 B13R1.2780 CN(CCS(=O)(=O)C)C1CCCC1 34a_100000207505_100000731031 [0,1,0,0,1,0|1,0,0]=3 2086 B13R1.2780 CN(CCS(=O)(=O)C)C1CCCC1 34a_100000750128_100000179811 [0,1,0,0,1,0|1,0,0]=3 2087 B13R1.2780 CN(CCS(=O)(=O)C)C1CCOC1 2230a_100000750128_100000731011 [0,1,0,0,1,0|2,0,0]=4 2088 B13R1.2780 CN(CCS(=O)(=O)C)C1CCOC1 2230a_100016988252_100000731031 [0,1,0,0,1,0|2,0,0]=4 2089 B13R1.2780 CN(CCS(=O)(=O)C)C1CCOC1 269982a_100000750128_100000731011 [0,1,0,0,1,0|2,0,0]=4 2090 B13R1.2780 CN(CCS(=O)(=O)C)C1CCOC1 269982a_100016988252_100000731031 [0,1,0,0,1,0|2,0,0]=4 2091 B13R1.2780 CN(CCS(=O)(=O)C)C1CCOC1 270004a_100000750128_100000752484 [0,1,0,0,1,0|2,0,0]=4 2092 B13R1.2780 CN(CCS(=O)(=O)C)C1CCOC1 34a_100000750128_100000690089 [0,1,0,0,1,0|2,0,0]=4 2093 B13R1.2780 CN(CCS(=O)(=O)C)C1CCOC1 34a_100016988252_100000731031 [0,1,0,0,1,0|2,0,0]=4 2094 B13R1.2780 CN(CCS(=O)(=O)C)C1CCSC1 270004a_100000750128_100000212027 [0,1,0,0,1,0|2,0,0]=4 2095 B13R1.2780 CN(CCS(=O)(=O)[O-])C1CCCC1 2230a_100000207505_100000737633 [0,1,0,0,1,0|0,0,1]=3 2096 B13R1.2780 CN(CCS(=O)(=O)[O-])C1CCCC1 34a_100000207505_100000762736 [0,1,0,0,1,0|0,0,1]=3 2097 B13R1.2780 CN(CCS(=O)(=O)[O-])C1CCOC1 2230a_100016988252_100000737633 [0,1,0,0,1,0|1,0,1]=4 2098 B13R1.2780 CN(CCS(=O)(=O)[O-])C1CCOC1 34a_100016988252_100000762736 [0,1,0,0,1,0|1,0,1]=4 2099 B13R1.2780 CS(=O)(=O)CCC(=O)C1CCCC1 1458a_100000210718_100000731031 [0,1,0,0,1,0|2,0,0]=4 2100 B13R1.2780 CS(=O)(=O)CCC(=O)C1CCCC1 1458a_100000737124_100000179811 [0,1,0,0,1,0|2,0,0]=4 2101 B13R1.2780 NS(=O)(=O)CCC(=O)C1CCCC1 1458a_100000737202_100000179811 [0,1,0,0,1,0|2,0,0]=4 2102 B13R1.2780 O=C(CCS(=O)(=O)[O-])C1CCCC1 1458a_100000210718_100000762736 [0,1,0,0,1,0|1,0,1]=4 2103 B13R1.2781 O=S(=O)([O-])C(O)CSC1CCCC1 62a_100011217020_200000035551 [0,1,0,0,1,0|1,0,1]=4 2104 B13R1.2781 O=S(=O)([O-])C(O)CSC1CCCC1 62a_200000035551_100000179811 [0,1,0,0,1,0|1,0,1]=4 2105 B13R1.3822 CC1(CCCC1)OCCS(=O)(=O)C 34a_100000751722_100000731031 [0,1,0,0,1,0|2,0,0]=4 2106 B13R1.3822 CC1(CCCC1)OCCS(=O)(=O)C 7a_100000751722_100000230027 [0,1,0,0,1,0|2,0,0]=4 2107 B13R1.3822 CC1(CCCC1)OCCS(=O)(=O)[O-] 34a_100000751722_100000762736 [0,1,0,0,1,0|1,0,1]=4 2108 B13R1.3822 CC1(CCOC1)NCCS(=O)(=O)C 2230a_100000693475_100000731031 [0,1,0,0,1,0|2,0,0]=4 2109 B13R1.3822 CC1(CCOC1)NCCS(=O)(=O)[O-] 2230a_100000693475_100000737633 [0,1,0,0,1,0|1,0,1]=4 2110 B13R1.157 CC1CCCCC1NCS(=O)(=O)[O-] 34a_100000211402_100009817235 [0,1,0,0,1,0|0,0,1]=3 2111 B13R1.157 CC1CCCCC1OCS(=O)(=O)[O-] 34a_100000211207_100009817235 [0,1,0,0,1,0|1,0,1]=4 2112 B13R1.157 CC1CCCCN1CCS(=O)(=O)C 2230a_100000211376_100000731031 [0,1,0,0,1,0|2,0,0]=4 2113 B13R1.157 CC1CCCCN1CCS(=O)(=O)C 269982a_100000211376_100000731031 [0,1,0,0,1,0|2,0,0]=4 2114 B13R1.157 CC1CCCCN1CCS(=O)(=O)C 34a_100000211376_100000731031 [0,1,0,0,1,0|2,0,0]=4 2115 B13R1.157 CC1CCCCN1CCS(=O)(=O)[O-] 2230a_100000211376_100000737633 [0,1,0,0,1,0|1,0,1]=4 2116 B13R1.157 CC1CCCCN1CCS(=O)(=O)[O-] 34a_100000211376_100000762736 [0,1,0,0,1,0|1,0,1]=4 2117 B13R1.157 CN1CCCCC1CCS(=O)(=O)N 2230a_100025749748_200000210301 [0,1,0,0,1,0|2,0,0]=4 2118 B13R1.157 CN1CCCCC1CCS(=O)(=O)N 269982a_100025749748_200000210301 [0,1,0,0,1,0|2,0,0]=4 2119 B13R1.157 CN1CCCCC1CCS(=O)(=O)N 34a_100025749748_200000210301 [0,1,0,0,1,0|2,0,0]=4 2120 B13R1.157 CS(=O)(=O)NCC1CCCCC1O 40a_100011216029_100000738038 [0,1,0,0,1,0|2,0,0]=4 2121 B13R1.157 NS(=O)(=O)CSC1CCCCC1F 62a_100000741382_100015423560 [0,1,0,0,1,0|2,0,0]=4 2122 B13R1.157 NS(=O)(=O)CSC1CCCCC1F 62a_100015423560_100000741382 [0,1,0,0,1,0|2,0,0]=4 2123 B13R1.157 NS(=O)(=O)CSC1CCCCC1O 62a_100000038908_100000741382 [0,1,0,0,1,0|2,0,0]=4 2124 B13R1.157 NS(=O)(=O)CSC1CCCCC1O 62a_100000741382_100000038908 [0,1,0,0,1,0|2,0,0]=4 2125 B13R1.157 N[C@@H]1CCCC[C@@H]1OCS(=O)(=O)[O-] 34a_100015191688_100009817235 [0,1,0,0,1,0|1,0,1]=4 2126 B13R1.157 O=S(=O)([O-])CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100009817235 [0,1,0,0,1,0|0,0,1]=3 2127 B13R1.157 O=S(=O)([O-])CN[C@H]1CCOC[C@@H]1F 34a_100016994078_100009817235 [0,1,0,0,1,0|1,0,1]=4 2128 B13R1.157 O=S(=O)([O-])COC1CCCCC1Cl 34a_100000038908_100009817235 [0,1,0,0,1,0|1,0,1]=4 2129 B13R1.157 O=S(=O)([O-])CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100009817235 [0,1,0,0,1,0|1,0,1]=4 2130 B13R1.157 O=S(=O)([O-])CSC1CCCCC1F 62a_100009817235_100015423560 [0,1,0,0,1,0|1,0,1]=4 2131 B13R1.157 O=S(=O)([O-])CSC1CCCCC1F 62a_100015423560_100009817235 [0,1,0,0,1,0|1,0,1]=4 2132 B13R1.157 O=S(=O)([O-])CSC1CCCCC1O 62a_100000038908_100009817235 [0,1,0,0,1,0|1,0,1]=4 2133 B13R1.157 O=S(=O)([O-])CSC1CCCCC1O 62a_100009817235_100000038908 [0,1,0,0,1,0|1,0,1]=4 2134 B13R1.157 [13CH3]N1CCCCC1CCS(=O)(=O)N 2230a_100025749748_200025704644 [0,1,0,0,1,0|2,0,0]=4 2135 B13R1.157 [13CH3]N1CCCCC1CCS(=O)(=O)N 269982a_100025749748_200025704644 [0,1,0,0,1,0|2,0,0]=4 2136 B13R1.157 [13CH3]N1CCCCC1CCS(=O)(=O)N 34a_100025749748_200025704644 [0,1,0,0,1,0|2,0,0]=4 2137 B13R1.254 CCS(=O)(=O)NCC1CCCCC1 270084a_100000210473_100000211323 [0,1,0,0,1,0|2,0,0]=4 2138 B13R1.254 CCS(=O)(=O)NCC1CCCCC1 274078a_100000210473_100000211323 [0,1,0,0,1,0|2,0,0]=4 2139 B13R1.254 CCS(=O)(=O)NCC1CCCCC1 40a_100000210473_100000053943 [0,1,0,0,1,0|2,0,0]=4 2140 B13R1.254 CCS(=O)(=O)NNC1CCCCC1 40a_100000709804_100000053943 [0,1,0,0,1,0|2,0,0]=4 2141 B13R1.254 O=S(=O)(CCl)NCC1CCCCC1 270084a_100000210473_100000031410 [0,1,0,0,1,0|2,0,0]=4 2142 B13R1.254 O=S(=O)(CCl)NCC1CCCCC1 274078a_100000210473_100000031410 [0,1,0,0,1,0|2,0,0]=4 2143 B13R1.352 CN(CS(=O)(=O)[O-])C1CCCCC1 34a_100000207522_100009817235 [0,1,0,0,1,0|0,0,1]=3 2144 B13R1.352 CN(CS(=O)(=O)[O-])C1CCOCC1 34a_100020587155_100009817235 [0,1,0,0,1,0|1,0,1]=4 2145 B13R1.352 CN(CS(=O)(=O)[O-])C1CCSCC1 34a_100015184757_100009817235 [0,1,0,0,1,0|1,0,1]=4 2146 B13R1.352 CS(=O)(=O)CC(=O)C1CCCCC1 1458a_100000744497_100000210327 [0,1,0,0,1,0|1,0,1]=4 2147 B13R1.352 C[C@@H](NS(=O)(=O)C)C1CCCCC1 40a_100025707633_100000738038 [0,1,0,0,1,0|2,0,0]=4 2148 B13R1.352 NS(=O)(=O)CC(=O)C1CCCCC1 1458a_100000210647_100000741382 [0,1,0,0,1,0|1,0,1]=4 2149 B13R1.352 O=C(CS(=O)(=O)[O-])C1CCCCC1 1458a_100000210647_100009817235 [0,1,0,0,1,0|0,0,2]=4 2150 B13R1.353 CN(CC1CCCCC1)S(=O)(=O)C 40a_100000736448_100000738038 [0,1,0,0,1,0|2,0,0]=4 2151 B13R1.512 CC1CCC(CC1)CNS(=O)(=O)C 40a_103436935547_100000738038 [0,1,0,0,1,0|2,0,0]=4 2152 B13R1.512 CC1CCC(CC1)OCS(=O)(=O)[O-] 34a_100000210714_100009817235 [0,1,0,0,1,0|1,0,1]=4 2153 B13R1.512 CC1CCC(CC1)SCS(=O)(=O)N 62a_100000741382_200011216234 [0,1,0,0,1,0|2,0,0]=4 2154 B13R1.512 CC1CCC(CC1)SCS(=O)(=O)[O-] 62a_100009817235_200011216234 [0,1,0,0,1,0|1,0,1]=4 2155 B13R1.512 CC1CCN(CC1)CCS(=O)(=O)C 2230a_100000188429_100000731031 [0,1,0,0,1,0|2,0,0]=4 2156 B13R1.512 CC1CCN(CC1)CCS(=O)(=O)C 269982a_100000188429_100000731031 [0,1,0,0,1,0|2,0,0]=4 2157 B13R1.512 CC1CCN(CC1)CCS(=O)(=O)C 34a_100000188429_100000731031 [0,1,0,0,1,0|2,0,0]=4 2158 B13R1.512 CC1CCN(CC1)CCS(=O)(=O)[O-] 2230a_100000188429_100000737633 [0,1,0,0,1,0|1,0,1]=4 2159 B13R1.512 CC1CCN(CC1)CCS(=O)(=O)[O-] 34a_100000188429_100000762736 [0,1,0,0,1,0|1,0,1]=4 2160 B13R1.512 CS(=O)(=O)CCN1CCC(CC1)F 2230a_100015193889_100000731031 [0,1,0,0,1,0|2,0,0]=4 2161 B13R1.512 CS(=O)(=O)CCN1CCC(CC1)F 269982a_100015193889_100000731031 [0,1,0,0,1,0|2,0,0]=4 2162 B13R1.512 CS(=O)(=O)CCN1CCC(CC1)F 34a_100015193889_100000731031 [0,1,0,0,1,0|2,0,0]=4 2163 B13R1.512 CS(=O)(=O)CCN1CCC(CC1)O 2230a_100025773856_100000731031 [0,1,0,0,1,0|2,0,0]=4 2164 B13R1.512 CS(=O)(=O)CCN1CCC(CC1)O 269982a_100025773856_100000731031 [0,1,0,0,1,0|2,0,0]=4 2165 B13R1.512 C[C@H]1CC[C@@H](CC1)NCS(=O)(=O)[O-] 34a_100020625639_100009817235 [0,1,0,0,1,0|0,0,1]=3 2166 B13R1.512 N[C@H]1CC[C@H](CC1)OCS(=O)(=O)[O-] 34a_100020628982_100009817235 [0,1,0,0,1,0|1,0,1]=4 2167 B13R1.512 O=S(=O)([O-])CCN1CCC(CC1)F 2230a_100015193889_100000737633 [0,1,0,0,1,0|1,0,1]=4 2168 B13R1.512 O=S(=O)([O-])CCN1CCC(CC1)F 34a_100015193889_100000762736 [0,1,0,0,1,0|1,0,1]=4 2169 B13R1.512 O=S(=O)([O-])CCN1CCC(CC1)O 2230a_100025773856_100000737633 [0,1,0,0,1,0|1,0,1]=4 2170 B13R1.838 CC1CCCC(C1)NCS(=O)(=O)[O-] 34a_100011194320_100009817235 [0,1,0,0,1,0|0,0,1]=3 2171 B13R1.838 CC1CCCC(C1)OCS(=O)(=O)[O-] 34a_100000211399_100009817235 [0,1,0,0,1,0|1,0,1]=4 2172 B13R1.838 CS(=O)(=O)CCN1CCCC(C1)F 2230a_100000697950_100000731031 [0,1,0,0,1,0|2,0,0]=4 2173 B13R1.838 CS(=O)(=O)CCN1CCCC(C1)F 269982a_100000697950_100000731031 [0,1,0,0,1,0|2,0,0]=4 2174 B13R1.838 CS(=O)(=O)CCN1CCCC(C1)F 34a_100000697950_100000731031 [0,1,0,0,1,0|2,0,0]=4 2175 B13R1.838 CS(=O)(=O)CCN1CCCC(C1)O 2230a_100000211013_100000731031 [0,1,0,0,1,0|2,0,0]=4 2176 B13R1.838 CS(=O)(=O)CCN1CCCC(C1)O 269982a_100000211013_100000731031 [0,1,0,0,1,0|2,0,0]=4 2177 B13R1.838 CS(=O)(=O)NCC1CCCC(C1)O 40a_100011254705_100000738038 [0,1,0,0,1,0|2,0,0]=4 2178 B13R1.838 C[C@H]1CCCN(C1)CCS(=O)(=O)C 2230a_100000717927_100000731031 [0,1,0,0,1,0|2,0,0]=4 2179 B13R1.838 C[C@H]1CCCN(C1)CCS(=O)(=O)C 269982a_100000717927_100000731031 [0,1,0,0,1,0|2,0,0]=4 2180 B13R1.838 C[C@H]1CCCN(C1)CCS(=O)(=O)C 34a_100000717927_100000731031 [0,1,0,0,1,0|2,0,0]=4 2181 B13R1.838 C[C@H]1CCCN(C1)CCS(=O)(=O)[O-] 2230a_100000717927_100000737633 [0,1,0,0,1,0|1,0,1]=4 2182 B13R1.838 C[C@H]1CCCN(C1)CCS(=O)(=O)[O-] 34a_100000717927_100000762736 [0,1,0,0,1,0|1,0,1]=4 2183 B13R1.838 O=S(=O)([O-])CCN1CCCC(C1)F 2230a_100000697950_100000737633 [0,1,0,0,1,0|1,0,1]=4 2184 B13R1.838 O=S(=O)([O-])CCN1CCCC(C1)F 34a_100000697950_100000762736 [0,1,0,0,1,0|1,0,1]=4 2185 B13R1.838 O=S(=O)([O-])CCN1CCCC(C1)O 2230a_100000211013_100000737633 [0,1,0,0,1,0|1,0,1]=4 2186 B13R1.7986 CC1(CCCCC1)CNS(=O)(=O)C 40a_100000706052_100000738038 [0,1,0,0,1,0|2,0,0]=4 2187 B13R1.7986 CC1(CCCCC1)NCS(=O)(=O)[O-] 34a_100000741114_100009817235 [0,1,0,0,1,0|0,0,1]=3 2188 B13R1.7986 CC1(CCCCC1)OCS(=O)(=O)[O-] 34a_100011215885_100009817235 [0,1,0,0,1,0|1,0,1]=4 2189 B13R1.7986 CC1(CCOCC1)NCS(=O)(=O)[O-] 34a_100000692449_100009817235 [0,1,0,0,1,0|1,0,1]=4 2190 B13R1.7986 CS(=O)(=O)NCC1(CCCCC1)O 40a_100000748649_100000738038 [0,1,0,0,1,0|2,0,0]=4 2191 B15R1.315 CCS(=O)(=O)CCNCC1CCCCC1 2230a_100000210473_100000756660 [0,1,0,0,0,1|1,0,0]=3 2192 B15R1.315 CCS(=O)(=O)CCNCC1CCCCC1 2230a_100000751051_100000211423 [0,1,0,0,0,1|1,0,0]=3 2193 B15R1.315 CCS(=O)(=O)CCNCC1CCCCC1 269862a_100000751051_100000211278 [0,1,0,0,0,1|1,0,0]=3 2194 B15R1.315 CCS(=O)(=O)CCNCC1CCCCC1 34a_100000210473_100000756660 [0,1,0,0,0,1|1,0,0]=3 2195 B15R1.315 CCS(=O)(=O)CCNCC1CCCCC1 34a_100000751051_100000211423 [0,1,0,0,0,1|1,0,0]=3 2196 B15R1.315 CCS(=O)(=O)CCNCC1CCCCO1 2230a_100000174945_100000756660 [0,1,0,0,0,1|2,0,0]=4 2197 B15R1.315 CCS(=O)(=O)CCNCC1CCCCO1 2230a_100000751051_100000211543 [0,1,0,0,0,1|2,0,0]=4 2198 B15R1.315 CCS(=O)(=O)CCNCC1CCCCO1 34a_100000174945_100000756660 [0,1,0,0,0,1|2,0,0]=4 2199 B15R1.315 CCS(=O)(=O)CCNCC1CCCCO1 34a_100000751051_100000211543 [0,1,0,0,0,1|2,0,0]=4 2200 B15R1.315 CCS(=O)(=O)CCNCC1CCCOC1 2230a_100000720124_100000756660 [0,1,0,0,0,1|2,0,0]=4 2201 B15R1.315 CCS(=O)(=O)CCNCC1CCCOC1 2230a_100000751051_100000741521 [0,1,0,0,0,1|2,0,0]=4 2202 B15R1.315 CCS(=O)(=O)CCNCC1CCCOC1 34a_100000720124_100000756660 [0,1,0,0,0,1|2,0,0]=4 2203 B15R1.315 CCS(=O)(=O)CCNCC1CCCOC1 34a_100000751051_100000741521 [0,1,0,0,0,1|2,0,0]=4 2204 B15R1.315 CCS(=O)(=O)CCNCC1CCOCC1 2230a_100000746373_100000756660 [0,1,0,0,0,1|2,0,0]=4 2205 B15R1.315 CCS(=O)(=O)CCNCC1CCOCC1 2230a_100000751051_100000754603 [0,1,0,0,0,1|2,0,0]=4 2206 B15R1.315 CCS(=O)(=O)CCNCC1CCOCC1 269862a_100000751051_100000749017 [0,1,0,0,0,1|2,0,0]=4 2207 B15R1.315 CCS(=O)(=O)CCNCC1CCOCC1 34a_100000746373_100000756660 [0,1,0,0,0,1|2,0,0]=4 2208 B15R1.315 CCS(=O)(=O)CCNCC1CCOCC1 34a_100000751051_100000754603 [0,1,0,0,0,1|2,0,0]=4 2209 B15R1.315 CCS(=O)(=O)CCNCC1CCSCC1 2230a_100015188806_100000756660 [0,1,0,0,0,1|2,0,0]=4 2210 B15R1.315 CCS(=O)(=O)CCNCC1CCSCC1 269862a_100000751051_100000067145 [0,1,0,0,0,1|2,0,0]=4 2211 B15R1.315 CCS(=O)(=O)CCNCC1CCSCC1 270004a_100000751051_100000067145 [0,1,0,0,0,1|2,0,0]=4 2212 B15R1.315 CCS(=O)(=O)CCNCC1CCSCC1 34a_100015188806_100000756660 [0,1,0,0,0,1|2,0,0]=4 2213 B15R1.315 CCS(=O)(=O)CCOCC1CCCCC1 34a_100000212181_100000756660 [0,1,0,0,0,1|2,0,0]=4 2214 B15R1.315 CCS(=O)(=O)CCOCC1CCCCC1 34a_200011216379_100000211423 [0,1,0,0,0,1|2,0,0]=4 2215 B15R1.315 CCS(=O)(=O)CCOCC1CCCCC1 7a_100000212181_100000756660 [0,1,0,0,0,1|2,0,0]=4 2216 B15R1.315 CCS(=O)(=O)CCOCC1CCCCC1 7a_200011216379_100000211423 [0,1,0,0,0,1|2,0,0]=4 2217 B15R1.315 CCS(=O)(=O)CCSCC1CCCCC1 62a_100000211423_100000756660 [0,1,0,0,0,1|2,0,0]=4 2218 B15R1.315 CCS(=O)(=O)CCSCC1CCCCC1 62a_100000756660_100000211423 [0,1,0,0,0,1|2,0,0]=4 2219 B15R1.315 CCS(=O)(=O)NCCCC1CCCCC1 270084a_100011211642_100000211323 [0,1,0,0,0,1|2,0,0]=4 2220 B15R1.315 CCS(=O)(=O)NCCCC1CCCCC1 274078a_100011211642_100000211323 [0,1,0,0,0,1|2,0,0]=4 2221 B15R1.315 CCS(=O)(=O)NCCCC1CCCCC1 40a_100011211642_100000053943 [0,1,0,0,0,1|2,0,0]=4 2222 B15R1.315 CCS(=O)(=O)NCCOC1CCCCC1 270084a_100015206981_100000211323 [0,1,0,0,0,1|2,0,0]=4 2223 B15R1.315 CCS(=O)(=O)NCCOC1CCCCC1 274078a_100015206981_100000211323 [0,1,0,0,0,1|2,0,0]=4 2224 B15R1.315 CCS(=O)(=O)NCCOC1CCCCC1 40a_100015206981_100000053943 [0,1,0,0,0,1|2,0,0]=4 2225 B15R1.315 CNS(=O)(=O)CCNCC1CCCCC1 2230a_100000710037_100000211423 [0,1,0,0,0,1|1,0,0]=3 2226 B15R1.315 CNS(=O)(=O)CCNCC1CCCCC1 269862a_100000710037_100000211278 [0,1,0,0,0,1|1,0,0]=3 2227 B15R1.315 CNS(=O)(=O)CCNCC1CCCCC1 34a_100000710037_100000211423 [0,1,0,0,0,1|1,0,0]=3 2228 B15R1.315 CNS(=O)(=O)CCNCC1CCCCO1 2230a_100000710037_100000211543 [0,1,0,0,0,1|2,0,0]=4 2229 B15R1.315 CNS(=O)(=O)CCNCC1CCCCO1 34a_100000710037_100000211543 [0,1,0,0,0,1|2,0,0]=4 2230 B15R1.315 CNS(=O)(=O)CCNCC1CCCOC1 2230a_100000710037_100000741521 [0,1,0,0,0,1|2,0,0]=4 2231 B15R1.315 CNS(=O)(=O)CCNCC1CCCOC1 34a_100000710037_100000741521 [0,1,0,0,0,1|2,0,0]=4 2232 B15R1.315 CNS(=O)(=O)CCNCC1CCOCC1 2230a_100000710037_100000754603 [0,1,0,0,0,1|2,0,0]=4 2233 B15R1.315 CNS(=O)(=O)CCNCC1CCOCC1 269862a_100000710037_100000749017 [0,1,0,0,0,1|2,0,0]=4 2234 B15R1.315 CNS(=O)(=O)CCNCC1CCOCC1 34a_100000710037_100000754603 [0,1,0,0,0,1|2,0,0]=4 2235 B15R1.315 CNS(=O)(=O)CCNCC1CCSCC1 269862a_100000710037_100000067145 [0,1,0,0,0,1|2,0,0]=4 2236 B15R1.315 CNS(=O)(=O)CCNCC1CCSCC1 270004a_100000710037_100000067145 [0,1,0,0,0,1|2,0,0]=4 2237 B15R1.315 O=S(=O)(CCl)NCCCC1CCCCC1 270084a_100011211642_100000031410 [0,1,0,0,0,1|2,0,0]=4 2238 B15R1.315 O=S(=O)(CCl)NCCCC1CCCCC1 274078a_100011211642_100000031410 [0,1,0,0,0,1|2,0,0]=4 2239 B15R1.315 O=S(=O)(CCl)NCCOC1CCCCC1 270084a_100015206981_100000031410 [0,1,0,0,0,1|2,0,0]=4 2240 B15R1.315 O=S(=O)(CCl)NCCOC1CCCCC1 274078a_100015206981_100000031410 [0,1,0,0,0,1|2,0,0]=4 2241 B15R1.362 CC1CCCCC1NCCCS(=O)(=O)C 2230a_100000211402_100000754308 [0,1,0,0,0,1|1,0,0]=3 2242 B15R1.362 CC1CCCCC1NCCCS(=O)(=O)C 269862a_100000742409_100000210921 [0,1,0,0,0,1|1,0,0]=3 2243 B15R1.362 CC1CCCCC1NCCCS(=O)(=O)C 270004a_100000742409_100000210921 [0,1,0,0,0,1|1,0,0]=3 2244 B15R1.362 CC1CCCCC1NCCCS(=O)(=O)C 34a_100000211402_100000754308 [0,1,0,0,0,1|1,0,0]=3 2245 B15R1.362 CC1CCCCC1NCCCS(=O)(=O)N 2230a_100000211402_100000750626 [0,1,0,0,0,1|1,0,0]=3 2246 B15R1.362 CC1CCCCC1NCCCS(=O)(=O)N 34a_100000211402_100000750626 [0,1,0,0,0,1|1,0,0]=3 2247 B15R1.362 CC1CCCCC1NCCCS(=O)(=O)[O-] 34a_100000211402_100009813499 [0,1,0,0,0,1|0,0,1]=3 2248 B15R1.362 CC1CCCCC1NCCNS(=O)(=O)C 2230a_100000211402_100000754112 [0,1,0,0,0,1|1,0,0]=3 2249 B15R1.362 CC1CCCCC1NCCNS(=O)(=O)C 269862a_100000752411_100000210921 [0,1,0,0,0,1|1,0,0]=3 2250 B15R1.362 CC1CCCCC1NCCNS(=O)(=O)C 270004a_100000752411_100000210921 [0,1,0,0,0,1|1,0,0]=3 2251 B15R1.362 CC1CCCCC1NCCOS(=O)(=O)C 2230a_100000211402_200000036756 [0,1,0,0,0,1|1,0,0]=3 2252 B15R1.362 CC1CCCCC1NCCOS(=O)(=O)C 34a_100000211402_200000036756 [0,1,0,0,0,1|1,0,0]=3 2253 B15R1.362 CC1CCCCC1OCCCS(=O)(=O)C 34a_100000211207_100000754308 [0,1,0,0,0,1|2,0,0]=4 2254 B15R1.362 CC1CCCCC1OCCCS(=O)(=O)C 7a_100000211207_100000754308 [0,1,0,0,0,1|2,0,0]=4 2255 B15R1.362 CC1CCCCC1OCCCS(=O)(=O)N 34a_100000211207_100000750626 [0,1,0,0,0,1|2,0,0]=4 2256 B15R1.362 CC1CCCCC1OCCCS(=O)(=O)N 7a_100000211207_100000750626 [0,1,0,0,0,1|2,0,0]=4 2257 B15R1.362 CC1CCCCC1OCCCS(=O)(=O)[O-] 34a_100000211207_100009813499 [0,1,0,0,0,1|1,0,1]=4 2258 B15R1.362 CC1CCCCC1OCCNS(=O)(=O)C 7a_100000211207_100000754112 [0,1,0,0,0,1|2,0,0]=4 2259 B15R1.362 CC1CCCCC1OCCOS(=O)(=O)C 34a_100000211207_200000036756 [0,1,0,0,0,1|2,0,0]=4 2260 B15R1.362 CC1CCCCC1OCCOS(=O)(=O)C 7a_100000211207_200000036756 [0,1,0,0,0,1|2,0,0]=4 2261 B15R1.362 CC1CNCCC1NCCCS(=O)(=O)C 270004a_100000742409_100000703950 [0,1,0,0,0,1|2,0,0]=4 2262 B15R1.362 CC1CNCCC1NCCNS(=O)(=O)C 270004a_100000752411_100000703950 [0,1,0,0,0,1|2,0,0]=4 2263 B15R1.362 CC1COCCC1NCCCS(=O)(=O)C 270004a_100000742409_100000755695 [0,1,0,0,0,1|2,0,0]=4 2264 B15R1.362 CC1COCCC1NCCNS(=O)(=O)C 270004a_100000752411_100000755695 [0,1,0,0,0,1|2,0,0]=4 2265 B15R1.362 CN1CCCCC1CNCCS(=O)(=O)C 34a_100000740961_100015186950 [0,1,0,0,0,1|2,0,0]=4 2266 B15R1.362 CN1CCCCC1CNCCS(=O)(=O)C 34a_100011228421_100000731031 [0,1,0,0,0,1|2,0,0]=4 2267 B15R1.362 CN1CCCCC1CNCCS(=O)(=O)N 34a_100000738205_100015186950 [0,1,0,0,0,1|2,0,0]=4 2268 B15R1.362 CN1CCCCC1CNCCS(=O)(=O)[O-] 34a_100011228421_100000762736 [0,1,0,0,0,1|1,0,1]=4 2269 B15R1.362 CS(=O)(=O)CCCNC1CCCCC1=O 34a_100000742409_100000754470 [0,1,0,0,0,1|1,0,1]=4 2270 B15R1.362 CS(=O)(=O)CCCNC1CCCCC1F 34a_100000742409_100015423560 [0,1,0,0,0,1|1,0,0]=3 2271 B15R1.362 CS(=O)(=O)CCCNC1CCCCC1O 34a_100000742409_100000038908 [0,1,0,0,0,1|1,0,0]=3 2272 B15R1.362 CS(=O)(=O)CCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000754308 [0,1,0,0,0,1|1,0,0]=3 2273 B15R1.362 CS(=O)(=O)CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000754308 [0,1,0,0,0,1|1,0,0]=3 2274 B15R1.362 CS(=O)(=O)CCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000754308 [0,1,0,0,0,1|2,0,0]=4 2275 B15R1.362 CS(=O)(=O)CCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000754308 [0,1,0,0,0,1|2,0,0]=4 2276 B15R1.362 CS(=O)(=O)CCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000754308 [0,1,0,0,0,1|2,0,0]=4 2277 B15R1.362 CS(=O)(=O)CCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000754308 [0,1,0,0,0,1|2,0,0]=4 2278 B15R1.362 CS(=O)(=O)CCCOC1CCCCC1Cl 34a_100000038908_100000754308 [0,1,0,0,0,1|2,0,0]=4 2279 B15R1.362 CS(=O)(=O)CCCOC1CCCCC1Cl 7a_100000038908_100000754308 [0,1,0,0,0,1|2,0,0]=4 2280 B15R1.362 CS(=O)(=O)CCCOC1CCCCC1F 34a_100000689940_100015423560 [0,1,0,0,0,1|2,0,0]=4 2281 B15R1.362 CS(=O)(=O)CCCOC1CCCCC1O 34a_100000689940_100000038908 [0,1,0,0,0,1|2,0,0]=4 2282 B15R1.362 CS(=O)(=O)CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000754308 [0,1,0,0,0,1|2,0,0]=4 2283 B15R1.362 CS(=O)(=O)CCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000754308 [0,1,0,0,0,1|2,0,0]=4 2284 B15R1.362 CS(=O)(=O)CCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000754308 [0,1,0,0,0,1|2,0,0]=4 2285 B15R1.362 CS(=O)(=O)CCCSC1CCCCC1F 62a_100000754308_100015423560 [0,1,0,0,0,1|2,0,0]=4 2286 B15R1.362 CS(=O)(=O)CCCSC1CCCCC1F 62a_100015423560_100000754308 [0,1,0,0,0,1|2,0,0]=4 2287 B15R1.362 CS(=O)(=O)CCCSC1CCCCC1O 62a_100000038908_100000754308 [0,1,0,0,0,1|2,0,0]=4 2288 B15R1.362 CS(=O)(=O)CCCSC1CCCCC1O 62a_100000754308_100000038908 [0,1,0,0,0,1|2,0,0]=4 2289 B15R1.362 CS(=O)(=O)CCNCC1CCCCC1O 34a_100011216029_100000731031 [0,1,0,0,0,1|1,0,0]=3 2290 B15R1.362 CS(=O)(=O)NCCNC1CCCCC1=O 34a_100000752411_100000754470 [0,1,0,0,0,1|1,0,1]=4 2291 B15R1.362 CS(=O)(=O)NCCNC1CCCCC1F 34a_100000752411_100015423560 [0,1,0,0,0,1|1,0,0]=3 2292 B15R1.362 CS(=O)(=O)NCCNC1CCCCC1O 34a_100000752411_100000038908 [0,1,0,0,0,1|1,0,0]=3 2293 B15R1.362 CS(=O)(=O)NCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000754112 [0,1,0,0,0,1|1,0,0]=3 2294 B15R1.362 CS(=O)(=O)NCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000754112 [0,1,0,0,0,1|2,0,0]=4 2295 B15R1.362 CS(=O)(=O)NCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000754112 [0,1,0,0,0,1|2,0,0]=4 2296 B15R1.362 CS(=O)(=O)NCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000754112 [0,1,0,0,0,1|2,0,0]=4 2297 B15R1.362 CS(=O)(=O)NCCOC1CCCCC1Cl 7a_100000038908_100000754112 [0,1,0,0,0,1|2,0,0]=4 2298 B15R1.362 CS(=O)(=O)NCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000754112 [0,1,0,0,0,1|2,0,0]=4 2299 B15R1.362 CS(=O)(=O)NCCSC1CCCCC1F 62a_100000754112_100015423560 [0,1,0,0,0,1|2,0,0]=4 2300 B15R1.362 CS(=O)(=O)NCCSC1CCCCC1F 62a_100015423560_100000754112 [0,1,0,0,0,1|2,0,0]=4 2301 B15R1.362 CS(=O)(=O)NCCSC1CCCCC1O 62a_100000038908_100000754112 [0,1,0,0,0,1|2,0,0]=4 2302 B15R1.362 CS(=O)(=O)NCCSC1CCCCC1O 62a_100000754112_100000038908 [0,1,0,0,0,1|2,0,0]=4 2303 B15R1.362 CS(=O)(=O)OCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_200000036756 [0,1,0,0,0,1|1,0,0]=3 2304 B15R1.362 CS(=O)(=O)OCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_200000036756 [0,1,0,0,0,1|1,0,0]=3 2305 B15R1.362 CS(=O)(=O)OCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_200000036756 [0,1,0,0,0,1|2,0,0]=4 2306 B15R1.362 CS(=O)(=O)OCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_200000036756 [0,1,0,0,0,1|2,0,0]=4 2307 B15R1.362 CS(=O)(=O)OCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_200000036756 [0,1,0,0,0,1|2,0,0]=4 2308 B15R1.362 CS(=O)(=O)OCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_200000036756 [0,1,0,0,0,1|2,0,0]=4 2309 B15R1.362 CS(=O)(=O)OCCOC1CCCCC1Cl 34a_100000038908_200000036756 [0,1,0,0,0,1|2,0,0]=4 2310 B15R1.362 CS(=O)(=O)OCCOC1CCCCC1Cl 7a_100000038908_200000036756 [0,1,0,0,0,1|2,0,0]=4 2311 B15R1.362 CS(=O)(=O)OCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_200000036756 [0,1,0,0,0,1|2,0,0]=4 2312 B15R1.362 CS(=O)(=O)OCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_200000036756 [0,1,0,0,0,1|2,0,0]=4 2313 B15R1.362 CS(=O)(=O)OCCO[C@H]1CCCC[C@H]1N 34a_100015191688_200000036756 [0,1,0,0,0,1|2,0,0]=4 2314 B15R1.362 CS(=O)(=O)OCCSC1CCCCC1F 62a_100015423560_200000036756 [0,1,0,0,0,1|2,0,0]=4 2315 B15R1.362 CS(=O)(=O)OCCSC1CCCCC1F 62a_200000036756_100015423560 [0,1,0,0,0,1|2,0,0]=4 2316 B15R1.362 CS(=O)(=O)OCCSC1CCCCC1O 62a_100000038908_200000036756 [0,1,0,0,0,1|2,0,0]=4 2317 B15R1.362 CS(=O)(=O)OCCSC1CCCCC1O 62a_200000036756_100000038908 [0,1,0,0,0,1|2,0,0]=4 2318 B15R1.362 NS(=O)(=O)CCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000750626 [0,1,0,0,0,1|1,0,0]=3 2319 B15R1.362 NS(=O)(=O)CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000750626 [0,1,0,0,0,1|1,0,0]=3 2320 B15R1.362 NS(=O)(=O)CCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000750626 [0,1,0,0,0,1|2,0,0]=4 2321 B15R1.362 NS(=O)(=O)CCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000750626 [0,1,0,0,0,1|2,0,0]=4 2322 B15R1.362 NS(=O)(=O)CCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000750626 [0,1,0,0,0,1|2,0,0]=4 2323 B15R1.362 NS(=O)(=O)CCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000750626 [0,1,0,0,0,1|2,0,0]=4 2324 B15R1.362 NS(=O)(=O)CCCOC1CCCCC1Cl 34a_100000038908_100000750626 [0,1,0,0,0,1|2,0,0]=4 2325 B15R1.362 NS(=O)(=O)CCCOC1CCCCC1Cl 7a_100000038908_100000750626 [0,1,0,0,0,1|2,0,0]=4 2326 B15R1.362 NS(=O)(=O)CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000750626 [0,1,0,0,0,1|2,0,0]=4 2327 B15R1.362 NS(=O)(=O)CCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000750626 [0,1,0,0,0,1|2,0,0]=4 2328 B15R1.362 NS(=O)(=O)CCCSC1CCCCC1F 62a_100000750626_100015423560 [0,1,0,0,0,1|2,0,0]=4 2329 B15R1.362 NS(=O)(=O)CCCSC1CCCCC1F 62a_100015423560_100000750626 [0,1,0,0,0,1|2,0,0]=4 2330 B15R1.362 NS(=O)(=O)CCCSC1CCCCC1O 62a_100000038908_100000750626 [0,1,0,0,0,1|2,0,0]=4 2331 B15R1.362 NS(=O)(=O)CCCSC1CCCCC1O 62a_100000750626_100000038908 [0,1,0,0,0,1|2,0,0]=4 2332 B15R1.362 N[C@@H]1CCCC[C@@H]1OCCCS(=O)(=O)N 34a_100015191688_100000750626 [0,1,0,0,0,1|2,0,0]=4 2333 B15R1.362 N[C@@H]1CCCC[C@@H]1OCCCS(=O)(=O)[O-] 34a_100015191688_100009813499 [0,1,0,0,0,1|1,0,1]=4 2334 B15R1.362 O=S(=O)([O-])CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100009813499 [0,1,0,0,0,1|0,0,1]=3 2335 B15R1.362 O=S(=O)([O-])CCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100009813499 [0,1,0,0,0,1|1,0,1]=4 2336 B15R1.362 O=S(=O)([O-])CCCOC1CCCCC1Cl 34a_100000038908_100009813499 [0,1,0,0,0,1|1,0,1]=4 2337 B15R1.362 O=S(=O)([O-])CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100009813499 [0,1,0,0,0,1|1,0,1]=4 2338 B15R1.362 O=S(=O)([O-])CCCSC1CCCCC1F 62a_100009813499_100015423560 [0,1,0,0,0,1|1,0,1]=4 2339 B15R1.362 O=S(=O)([O-])CCCSC1CCCCC1F 62a_100015423560_100009813499 [0,1,0,0,0,1|1,0,1]=4 2340 B15R1.362 O=S(=O)([O-])CCCSC1CCCCC1O 62a_100000038908_100009813499 [0,1,0,0,0,1|1,0,1]=4 2341 B15R1.362 O=S(=O)([O-])CCCSC1CCCCC1O 62a_100009813499_100000038908 [0,1,0,0,0,1|1,0,1]=4 2342 B15R1.362 O=S(=O)([O-])CCNCC1CCCCC1O 34a_100011216029_100000762736 [0,1,0,0,0,1|0,0,1]=3 2343 B15R1.909 C=C1CCC(CC1)NCCCS(=O)(=O)C 270004a_100000742409_100010272673 [0,1,0,0,0,1|1,0,1]=4 2344 B15R1.909 C=C1CCC(CC1)NCCNS(=O)(=O)C 270004a_100000752411_100010272673 [0,1,0,0,0,1|1,0,1]=4 2345 B15R1.909 CC1CCC(CC1)CNCCS(=O)(=O)C 2230a_103436935547_100000731031 [0,1,0,0,0,1|1,0,0]=3 2346 B15R1.909 CC1CCC(CC1)CNCCS(=O)(=O)C 34a_103436935547_100000731031 [0,1,0,0,0,1|1,0,0]=3 2347 B15R1.909 CC1CCC(CC1)CNCCS(=O)(=O)[O-] 2230a_103436935547_100000737633 [0,1,0,0,0,1|0,0,1]=3 2348 B15R1.909 CC1CCC(CC1)CNCCS(=O)(=O)[O-] 34a_103436935547_100000762736 [0,1,0,0,0,1|0,0,1]=3 2349 B15R1.909 CC1CCC(CC1)COCCS(=O)(=O)C 34a_100000701341_100000731031 [0,1,0,0,0,1|2,0,0]=4 2350 B15R1.909 CC1CCC(CC1)COCCS(=O)(=O)[O-] 34a_100000701341_100000762736 [0,1,0,0,0,1|1,0,1]=4 2351 B15R1.909 CC1CCC(CC1)NCCCS(=O)(=O)C 270004a_100000742409_100000185489 [0,1,0,0,0,1|1,0,0]=3 2352 B15R1.909 CC1CCC(CC1)NCCCS(=O)(=O)C 34a_100000742409_200011216234 [0,1,0,0,0,1|1,0,0]=3 2353 B15R1.909 CC1CCC(CC1)NCCNS(=O)(=O)C 270004a_100000752411_100000185489 [0,1,0,0,0,1|1,0,0]=3 2354 B15R1.909 CC1CCC(CC1)NCCNS(=O)(=O)C 34a_100000752411_200011216234 [0,1,0,0,0,1|1,0,0]=3 2355 B15R1.909 CC1CCC(CC1)OCCCS(=O)(=O)C 34a_100000210714_100000754308 [0,1,0,0,0,1|2,0,0]=4 2356 B15R1.909 CC1CCC(CC1)OCCCS(=O)(=O)C 34a_100000689940_200011216234 [0,1,0,0,0,1|2,0,0]=4 2357 B15R1.909 CC1CCC(CC1)OCCCS(=O)(=O)C 7a_100000210714_100000754308 [0,1,0,0,0,1|2,0,0]=4 2358 B15R1.909 CC1CCC(CC1)OCCCS(=O)(=O)N 34a_100000210714_100000750626 [0,1,0,0,0,1|2,0,0]=4 2359 B15R1.909 CC1CCC(CC1)OCCCS(=O)(=O)N 7a_100000210714_100000750626 [0,1,0,0,0,1|2,0,0]=4 2360 B15R1.909 CC1CCC(CC1)OCCCS(=O)(=O)[O-] 34a_100000210714_100009813499 [0,1,0,0,0,1|1,0,1]=4 2361 B15R1.909 CC1CCC(CC1)OCCNS(=O)(=O)C 7a_100000210714_100000754112 [0,1,0,0,0,1|2,0,0]=4 2362 B15R1.909 CC1CCC(CC1)OCCOS(=O)(=O)C 34a_100000210714_200000036756 [0,1,0,0,0,1|2,0,0]=4 2363 B15R1.909 CC1CCC(CC1)OCCOS(=O)(=O)C 7a_100000210714_200000036756 [0,1,0,0,0,1|2,0,0]=4 2364 B15R1.909 CC1CCC(CC1)SCCCS(=O)(=O)C 62a_100000754308_200011216234 [0,1,0,0,0,1|2,0,0]=4 2365 B15R1.909 CC1CCC(CC1)SCCCS(=O)(=O)N 62a_100000750626_200011216234 [0,1,0,0,0,1|2,0,0]=4 2366 B15R1.909 CC1CCC(CC1)SCCCS(=O)(=O)[O-] 62a_100009813499_200011216234 [0,1,0,0,0,1|1,0,1]=4 2367 B15R1.909 CC1CCC(CC1)SCCNS(=O)(=O)C 62a_100000754112_200011216234 [0,1,0,0,0,1|2,0,0]=4 2368 B15R1.909 CC1CCC(CC1)SCCOS(=O)(=O)C 62a_200000036756_200011216234 [0,1,0,0,0,1|2,0,0]=4 2369 B15R1.909 CN1CCC(CC1)NCCCS(=O)(=O)C 270004a_100000742409_100000210137 [0,1,0,0,0,1|2,0,0]=4 2370 B15R1.909 CN1CCC(CC1)NCCNS(=O)(=O)C 270004a_100000752411_100000210137 [0,1,0,0,0,1|2,0,0]=4 2371 B15R1.909 CS(=O)(=O)CCCNC1CCC(CC1)O 270004a_100000742409_100000764474 [0,1,0,0,0,1|1,0,0]=3 2372 B15R1.909 CS(=O)(=O)CCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000754308 [0,1,0,0,0,1|1,0,0]=3 2373 B15R1.909 CS(=O)(=O)CCCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000754308 [0,1,0,0,0,1|1,0,0]=3 2374 B15R1.909 CS(=O)(=O)CCCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000754308 [0,1,0,0,0,1|2,0,0]=4 2375 B15R1.909 CS(=O)(=O)CCOC[C@H]1CC[C@@H](CC1)N 34a_100009821084_100000731031 [0,1,0,0,0,1|2,0,0]=4 2376 B15R1.909 CS(=O)(=O)NCCNC1CCC(CC1)O 270004a_100000752411_100000764474 [0,1,0,0,0,1|1,0,0]=3 2377 B15R1.909 CS(=O)(=O)NCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000754112 [0,1,0,0,0,1|1,0,0]=3 2378 B15R1.909 CS(=O)(=O)OCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_200000036756 [0,1,0,0,0,1|1,0,0]=3 2379 B15R1.909 CS(=O)(=O)OCCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_200000036756 [0,1,0,0,0,1|1,0,0]=3 2380 B15R1.909 CS(=O)(=O)OCCO[C@H]1CC[C@H](CC1)N 34a_100020628982_200000036756 [0,1,0,0,0,1|2,0,0]=4 2381 B15R1.909 C[C@H]1CC[C@@H](CC1)NCCCS(=O)(=O)N 2230a_100020625639_100000750626 [0,1,0,0,0,1|1,0,0]=3 2382 B15R1.909 C[C@H]1CC[C@@H](CC1)NCCCS(=O)(=O)N 34a_100020625639_100000750626 [0,1,0,0,0,1|1,0,0]=3 2383 B15R1.909 C[C@H]1CC[C@@H](CC1)NCCCS(=O)(=O)[O-] 34a_100020625639_100009813499 [0,1,0,0,0,1|0,0,1]=3 2384 B15R1.909 NC1CCC(CC1)CCOCS(=O)(=O)[O-] 34a_100000070672_100009817235 [0,1,0,0,0,1|1,0,1]=4 2385 B15R1.909 NS(=O)(=O)CCCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000750626 [0,1,0,0,0,1|2,0,0]=4 2386 B15R1.909 N[C@H]1CC[C@@H](CC1)COCCS(=O)(=O)[O-] 34a_100009821084_100000762736 [0,1,0,0,0,1|1,0,1]=4 2387 B15R1.909 N[C@H]1CC[C@H](CC1)OCCCS(=O)(=O)[O-] 34a_100020628982_100009813499 [0,1,0,0,0,1|1,0,1]=4 2388 B15R1.909 O=S(=O)([O-])CNCCC1CCC(CC1)O 34a_200011935226_100009817235 [0,1,0,0,0,1|1,0,1]=4 2389 B15R1.3465 CS(=O)(=O)CC(=O)CCC1CCCCC1 1458a_100000744497_100011273959 [0,1,0,0,0,1|2,0,0]=4 2390 B15R1.3465 CS(=O)(=O)CC(=O)COC1CCCCC1 1458a_100000744497_100011935260 [0,1,0,0,0,1|2,0,0]=4 2391 B15R1.3465 CS(=O)(=O)CC(=O)NCC1CCCCC1 11a_100000210473_100000744497 [0,1,0,0,0,1|1,0,1]=4 2392 B15R1.3465 CS(=O)(=O)CC(=O)NCC1CCCCC1 240690a_100000210473_100000744497 [0,1,0,0,0,1|1,0,1]=4 2393 B15R1.3465 CS(=O)(=O)CC(=O)NCC1CCCCC1 527a_100000210473_100000744497 [0,1,0,0,0,1|1,0,1]=4 2394 B15R1.3465 CS(=O)(=O)CC(=O)NNC1CCCCC1 22a_100000709804_100000744497 [0,1,0,0,0,1|1,0,1]=4 2395 B15R1.3465 NS(=O)(=O)CC(=O)CCC1CCCCC1 1458a_100000211375_100000741382 [0,1,0,0,0,1|2,0,0]=4 2396 B15R1.3465 NS(=O)(=O)CC(=O)COC1CCCCC1 1458a_100011223303_100000741382 [0,1,0,0,0,1|2,0,0]=4 2397 B15R1.3465 O=C(CCC1CCCCC1)CS(=O)(=O)[O-] 1458a_100000211375_100009817235 [0,1,0,0,0,1|1,0,1]=4 2398 B15R1.3465 O=C(COC1CCCCC1)CS(=O)(=O)[O-] 1458a_100011223303_100009817235 [0,1,0,0,0,1|1,0,1]=4 2399 B15R1.3465 O=S(=O)([O-])CC(O)CNC1CCCCC1 34a_100000182618_100016993520 [0,1,0,0,0,1|0,0,1]=3 2400 B15R1.3465 O=S(=O)([O-])CC(O)CNC1CCCOC1 34a_100000719290_100016993520 [0,1,0,0,0,1|1,0,1]=4 2401 B15R1.3465 O=S(=O)([O-])CC(O)CNC1CCOCC1 34a_100000741149_100016993520 [0,1,0,0,0,1|1,0,1]=4 2402 B15R1.3465 O=S(=O)([O-])CC(O)CNC1CCSCC1 34a_100000748639_100016993520 [0,1,0,0,0,1|1,0,1]=4 2403 B15R1.3465 O=S(=O)([O-])CC(O)COC1CCCCC1 34a_100000210231_100016993520 [0,1,0,0,0,1|1,0,1]=4 2404 B15R1.3465 O=S(=O)([O-])CC(O)COC1CCCCC1 7a_100000210231_100016993520 [0,1,0,0,0,1|1,0,1]=4 2405 B15R1.3465 O=S(=O)([O-])CC(O)CSC1CCCCC1 62a_100000210327_100016993520 [0,1,0,0,0,1|1,0,1]=4 2406 B15R1.3465 O=S(=O)([O-])CC(O)CSC1CCCCC1 62a_100016993520_100000210327 [0,1,0,0,0,1|1,0,1]=4 2407 B15R1.8300 CC1CC(CCO1)NCCCS(=O)(=O)C 270004a_100000742409_100000755752 [0,1,0,0,0,1|2,0,0]=4 2408 B15R1.8300 CC1CC(CCO1)NCCNS(=O)(=O)C 270004a_100000752411_100000755752 [0,1,0,0,0,1|2,0,0]=4 2409 B15R1.8300 CC1CCCC(C1)NCCCS(=O)(=O)C 2230a_100011194320_100000754308 [0,1,0,0,0,1|1,0,0]=3 2410 B15R1.8300 CC1CCCC(C1)NCCCS(=O)(=O)C 270004a_100000742409_100000183594 [0,1,0,0,0,1|1,0,0]=3 2411 B15R1.8300 CC1CCCC(C1)NCCCS(=O)(=O)C 34a_100011194320_100000754308 [0,1,0,0,0,1|1,0,0]=3 2412 B15R1.8300 CC1CCCC(C1)NCCCS(=O)(=O)N 2230a_100011194320_100000750626 [0,1,0,0,0,1|1,0,0]=3 2413 B15R1.8300 CC1CCCC(C1)NCCCS(=O)(=O)N 34a_100011194320_100000750626 [0,1,0,0,0,1|1,0,0]=3 2414 B15R1.8300 CC1CCCC(C1)NCCCS(=O)(=O)[O-] 34a_100011194320_100009813499 [0,1,0,0,0,1|0,0,1]=3 2415 B15R1.8300 CC1CCCC(C1)NCCNS(=O)(=O)C 2230a_100011194320_100000754112 [0,1,0,0,0,1|1,0,0]=3 2416 B15R1.8300 CC1CCCC(C1)NCCNS(=O)(=O)C 270004a_100000752411_100000183594 [0,1,0,0,0,1|1,0,0]=3 2417 B15R1.8300 CC1CCCC(C1)NCCOS(=O)(=O)C 2230a_100011194320_200000036756 [0,1,0,0,0,1|1,0,0]=3 2418 B15R1.8300 CC1CCCC(C1)NCCOS(=O)(=O)C 34a_100011194320_200000036756 [0,1,0,0,0,1|1,0,0]=3 2419 B15R1.8300 CC1CCCC(C1)OCCCS(=O)(=O)C 34a_100000211399_100000754308 [0,1,0,0,0,1|2,0,0]=4 2420 B15R1.8300 CC1CCCC(C1)OCCCS(=O)(=O)N 34a_100000211399_100000750626 [0,1,0,0,0,1|2,0,0]=4 2421 B15R1.8300 CC1CCCC(C1)OCCCS(=O)(=O)[O-] 34a_100000211399_100009813499 [0,1,0,0,0,1|1,0,1]=4 2422 B15R1.8300 CC1CCCC(C1)OCCOS(=O)(=O)C 34a_100000211399_200000036756 [0,1,0,0,0,1|2,0,0]=4 2423 B15R1.8300 CN1CCCC(C1)CNCCS(=O)(=O)C 34a_100000740961_100015183302 [0,1,0,0,0,1|2,0,0]=4 2424 B15R1.8300 CN1CCCC(C1)CNCCS(=O)(=O)N 34a_100000738205_100015183302 [0,1,0,0,0,1|2,0,0]=4 2425 B15R1.8300 CS(=O)(=O)CCCNC1CCCC(C1)O 2230a_100015190357_100000754308 [0,1,0,0,0,1|1,0,0]=3 2426 B15R1.8300 CS(=O)(=O)CCCNC1CCCC(C1)O 270004a_100000742409_100012613340 [0,1,0,0,0,1|1,0,0]=3 2427 B15R1.8300 CS(=O)(=O)CCNCC1CCCC(C1)O 2230a_100011254705_100000731031 [0,1,0,0,0,1|1,0,0]=3 2428 B15R1.8300 CS(=O)(=O)NCCNC1CCCC(C1)O 2230a_100015190357_100000754112 [0,1,0,0,0,1|1,0,0]=3 2429 B15R1.8300 CS(=O)(=O)NCCNC1CCCC(C1)O 270004a_100000752411_100012613340 [0,1,0,0,0,1|1,0,0]=3 2430 B15R1.8300 CS(=O)(=O)OCCNC1CCCC(C1)O 2230a_100015190357_200000036756 [0,1,0,0,0,1|1,0,0]=3 2431 B15R1.8300 C[C@@H]1CC(CCN1)NCCCS(=O)(=O)C 270004a_100000742409_100016994030 [0,1,0,0,0,1|2,0,0]=4 2432 B15R1.8300 C[C@@H]1CC(CCN1)NCCNS(=O)(=O)C 270004a_100000752411_100016994030 [0,1,0,0,0,1|2,0,0]=4 2433 B15R1.8300 NS(=O)(=O)CCCNC1CCCC(C1)O 2230a_100015190357_100000750626 [0,1,0,0,0,1|1,0,0]=3 2434 B15R1.8300 O=S(=O)([O-])CCNCC1CCCC(C1)O 2230a_100011254705_100000737633 [0,1,0,0,0,1|0,0,1]=3 2435 B15R1.9094 CC(NCCS(=O)(=O)C)C1CCCCC1 269862a_100000740961_100000210989 [0,1,0,0,0,1|1,0,0]=3 2436 B15R1.9094 CC(NCCS(=O)(=O)C)C1CCCCN1 269862a_100000740961_200011997754 [0,1,0,0,0,1|2,0,0]=4 2437 B15R1.9094 CC(NCCS(=O)(=O)C)C1CCCNC1 269862a_100000740961_100011320585 [0,1,0,0,0,1|2,0,0]=4 2438 B15R1.9094 CC(NCCS(=O)(=O)C)C1CCNCC1 269862a_100000740961_100015204191 [0,1,0,0,0,1|2,0,0]=4 2439 B15R1.9094 CC(NCCS(=O)(=O)C)C1CCOCC1 269862a_100000740961_100000759496 [0,1,0,0,0,1|2,0,0]=4 2440 B15R1.9094 CC(NCCS(=O)(=O)N)C1CCCCC1 269862a_100000738205_100000210989 [0,1,0,0,0,1|1,0,0]=3 2441 B15R1.9094 CC(NCCS(=O)(=O)N)C1CCCCN1 269862a_100000738205_200011997754 [0,1,0,0,0,1|2,0,0]=4 2442 B15R1.9094 CC(NCCS(=O)(=O)N)C1CCCNC1 269862a_100000738205_100011320585 [0,1,0,0,0,1|2,0,0]=4 2443 B15R1.9094 CC(NCCS(=O)(=O)N)C1CCNCC1 269862a_100000738205_100015204191 [0,1,0,0,0,1|2,0,0]=4 2444 B15R1.9094 CC(NCCS(=O)(=O)N)C1CCOCC1 269862a_100000738205_100000759496 [0,1,0,0,0,1|2,0,0]=4 2445 B15R1.9094 CC(OCCS(=O)(=O)C)C1CCCCC1 34a_100011216961_100000731031 [0,1,0,0,0,1|2,0,0]=4 2446 B15R1.9094 CC(OCCS(=O)(=O)C)C1CCCCC1 7a_100011216961_100000230027 [0,1,0,0,0,1|2,0,0]=4 2447 B15R1.9094 CC(OCCS(=O)(=O)[O-])C1CCCCC1 34a_100011216961_100000762736 [0,1,0,0,0,1|1,0,1]=4 2448 B15R1.9094 CN(CCCS(=O)(=O)C)C1CCCCC1 2230a_100000207522_100000754308 [0,1,0,0,0,1|1,0,0]=3 2449 B15R1.9094 CN(CCCS(=O)(=O)C)C1CCCCC1 269982a_100000207522_100000754308 [0,1,0,0,0,1|1,0,0]=3 2450 B15R1.9094 CN(CCCS(=O)(=O)C)C1CCCCC1 34a_100000207522_100000754308 [0,1,0,0,0,1|1,0,0]=3 2451 B15R1.9094 CN(CCCS(=O)(=O)C)C1CCOCC1 2230a_100020587155_100000754308 [0,1,0,0,0,1|2,0,0]=4 2452 B15R1.9094 CN(CCCS(=O)(=O)C)C1CCOCC1 269982a_100020587155_100000754308 [0,1,0,0,0,1|2,0,0]=4 2453 B15R1.9094 CN(CCCS(=O)(=O)C)C1CCOCC1 34a_100020587155_100000754308 [0,1,0,0,0,1|2,0,0]=4 2454 B15R1.9094 CN(CCCS(=O)(=O)C)C1CCSCC1 2230a_100015184757_100000754308 [0,1,0,0,0,1|2,0,0]=4 2455 B15R1.9094 CN(CCCS(=O)(=O)C)C1CCSCC1 269982a_100015184757_100000754308 [0,1,0,0,0,1|2,0,0]=4 2456 B15R1.9094 CN(CCCS(=O)(=O)C)C1CCSCC1 34a_100015184757_100000754308 [0,1,0,0,0,1|2,0,0]=4 2457 B15R1.9094 CN(CCCS(=O)(=O)N)C1CCCCC1 2230a_100000207522_100000750626 [0,1,0,0,0,1|1,0,0]=3 2458 B15R1.9094 CN(CCCS(=O)(=O)N)C1CCCCC1 269982a_100000207522_100000750626 [0,1,0,0,0,1|1,0,0]=3 2459 B15R1.9094 CN(CCCS(=O)(=O)N)C1CCCCC1 34a_100000207522_100000750626 [0,1,0,0,0,1|1,0,0]=3 2460 B15R1.9094 CN(CCCS(=O)(=O)N)C1CCOCC1 2230a_100020587155_100000750626 [0,1,0,0,0,1|2,0,0]=4 2461 B15R1.9094 CN(CCCS(=O)(=O)N)C1CCOCC1 269982a_100020587155_100000750626 [0,1,0,0,0,1|2,0,0]=4 2462 B15R1.9094 CN(CCCS(=O)(=O)N)C1CCOCC1 34a_100020587155_100000750626 [0,1,0,0,0,1|2,0,0]=4 2463 B15R1.9094 CN(CCCS(=O)(=O)N)C1CCSCC1 2230a_100015184757_100000750626 [0,1,0,0,0,1|2,0,0]=4 2464 B15R1.9094 CN(CCCS(=O)(=O)N)C1CCSCC1 269982a_100015184757_100000750626 [0,1,0,0,0,1|2,0,0]=4 2465 B15R1.9094 CN(CCCS(=O)(=O)N)C1CCSCC1 34a_100015184757_100000750626 [0,1,0,0,0,1|2,0,0]=4 2466 B15R1.9094 CN(CCCS(=O)(=O)[O-])C1CCCCC1 269982a_100000207522_100009813499 [0,1,0,0,0,1|0,0,1]=3 2467 B15R1.9094 CN(CCCS(=O)(=O)[O-])C1CCCCC1 34a_100000207522_100009813499 [0,1,0,0,0,1|0,0,1]=3 2468 B15R1.9094 CN(CCCS(=O)(=O)[O-])C1CCOCC1 269982a_100020587155_100009813499 [0,1,0,0,0,1|1,0,1]=4 2469 B15R1.9094 CN(CCCS(=O)(=O)[O-])C1CCOCC1 34a_100020587155_100009813499 [0,1,0,0,0,1|1,0,1]=4 2470 B15R1.9094 CN(CCCS(=O)(=O)[O-])C1CCSCC1 269982a_100015184757_100009813499 [0,1,0,0,0,1|1,0,1]=4 2471 B15R1.9094 CN(CCCS(=O)(=O)[O-])C1CCSCC1 34a_100015184757_100009813499 [0,1,0,0,0,1|1,0,1]=4 2472 B15R1.9094 CN(CCNS(=O)(=O)C)C1CCCCC1 2230a_100000207522_100000754112 [0,1,0,0,0,1|1,0,0]=3 2473 B15R1.9094 CN(CCNS(=O)(=O)C)C1CCCCC1 269982a_100000207522_100000754112 [0,1,0,0,0,1|1,0,0]=3 2474 B15R1.9094 CN(CCNS(=O)(=O)C)C1CCCCC1 40a_100011200935_100000738038 [0,1,0,0,0,1|1,0,0]=3 2475 B15R1.9094 CN(CCNS(=O)(=O)C)C1CCOCC1 2230a_100020587155_100000754112 [0,1,0,0,0,1|2,0,0]=4 2476 B15R1.9094 CN(CCNS(=O)(=O)C)C1CCOCC1 269982a_100020587155_100000754112 [0,1,0,0,0,1|2,0,0]=4 2477 B15R1.9094 CN(CCNS(=O)(=O)C)C1CCSCC1 2230a_100015184757_100000754112 [0,1,0,0,0,1|2,0,0]=4 2478 B15R1.9094 CN(CCNS(=O)(=O)C)C1CCSCC1 269982a_100015184757_100000754112 [0,1,0,0,0,1|2,0,0]=4 2479 B15R1.9094 CN(CCOS(=O)(=O)C)C1CCCCC1 2230a_100000207522_200000036756 [0,1,0,0,0,1|1,0,0]=3 2480 B15R1.9094 CN(CCOS(=O)(=O)C)C1CCCCC1 269982a_100000207522_200000036756 [0,1,0,0,0,1|1,0,0]=3 2481 B15R1.9094 CN(CCOS(=O)(=O)C)C1CCCCC1 34a_100000207522_200000036756 [0,1,0,0,0,1|1,0,0]=3 2482 B15R1.9094 CN(CCOS(=O)(=O)C)C1CCOCC1 2230a_100020587155_200000036756 [0,1,0,0,0,1|2,0,0]=4 2483 B15R1.9094 CN(CCOS(=O)(=O)C)C1CCOCC1 269982a_100020587155_200000036756 [0,1,0,0,0,1|2,0,0]=4 2484 B15R1.9094 CN(CCOS(=O)(=O)C)C1CCOCC1 34a_100020587155_200000036756 [0,1,0,0,0,1|2,0,0]=4 2485 B15R1.9094 CN(CCOS(=O)(=O)C)C1CCSCC1 2230a_100015184757_200000036756 [0,1,0,0,0,1|2,0,0]=4 2486 B15R1.9094 CN(CCOS(=O)(=O)C)C1CCSCC1 269982a_100015184757_200000036756 [0,1,0,0,0,1|2,0,0]=4 2487 B15R1.9094 CN(CCOS(=O)(=O)C)C1CCSCC1 34a_100015184757_200000036756 [0,1,0,0,0,1|2,0,0]=4 2488 B15R1.9094 CS(=O)(=O)CCCC(=O)C1CCCCC1 1458a_100000210647_100000754308 [0,1,0,0,0,1|2,0,0]=4 2489 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCCC1 11a_100000740961_100000210647 [0,1,0,0,0,1|1,0,0]=3 2490 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCCC1 1626a_100000740961_100000210647 [0,1,0,0,0,1|1,0,0]=3 2491 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCCC1 240690a_100000740961_100000210647 [0,1,0,0,0,1|1,0,0]=3 2492 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCCC1 527a_100000740961_100000210647 [0,1,0,0,0,1|1,0,0]=3 2493 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCCO1 11a_100000740961_100000748299 [0,1,0,0,0,1|2,0,0]=4 2494 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCCO1 1626a_100000740961_100000748299 [0,1,0,0,0,1|2,0,0]=4 2495 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCCO1 240690a_100000740961_100000748299 [0,1,0,0,0,1|2,0,0]=4 2496 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCCO1 527a_100000740961_100000748299 [0,1,0,0,0,1|2,0,0]=4 2497 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCOC1 11a_100000740961_100000741522 [0,1,0,0,0,1|2,0,0]=4 2498 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCOC1 1626a_100000740961_100000741522 [0,1,0,0,0,1|2,0,0]=4 2499 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCOC1 240690a_100000740961_100000741522 [0,1,0,0,0,1|2,0,0]=4 2500 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCCOC1 527a_100000740961_100000741522 [0,1,0,0,0,1|2,0,0]=4 2501 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCOCC1 11a_100000740961_100000195482 [0,1,0,0,0,1|2,0,0]=4 2502 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCOCC1 1626a_100000740961_100000195482 [0,1,0,0,0,1|2,0,0]=4 2503 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCOCC1 240690a_100000740961_100000195482 [0,1,0,0,0,1|2,0,0]=4 2504 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCOCC1 527a_100000740961_100000195482 [0,1,0,0,0,1|2,0,0]=4 2505 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCSCC1 11a_100000740961_100000755232 [0,1,0,0,0,1|2,0,0]=4 2506 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCSCC1 1626a_100000740961_100000755232 [0,1,0,0,0,1|2,0,0]=4 2507 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCSCC1 240690a_100000740961_100000755232 [0,1,0,0,0,1|2,0,0]=4 2508 B15R1.9094 CS(=O)(=O)CCNC(=O)C1CCSCC1 527a_100000740961_100000755232 [0,1,0,0,0,1|2,0,0]=4 2509 B15R1.9094 CS(=O)(=O)NCCC(=O)C1CCCCC1 1458a_100000165793_100000210327 [0,1,0,0,0,1|2,0,0]=4 2510 B15R1.9094 CS(=O)(=O)NCCC(=O)C1CCCCC1 1458a_100000210647_100000754112 [0,1,0,0,0,1|2,0,0]=4 2511 B15R1.9094 CS(=O)(=O)OCCC(=O)C1CCCCC1 1458a_100000210647_200000036756 [0,1,0,0,0,1|2,0,0]=4 2512 B15R1.9094 C[C@@H](NCCS(=O)(=O)C)C1CCCCC1 2230a_100025707633_100000731031 [0,1,0,0,0,1|1,0,0]=3 2513 B15R1.9094 C[C@@H](NCCS(=O)(=O)C)C1CCCCC1 34a_100025707633_100000731031 [0,1,0,0,0,1|1,0,0]=3 2514 B15R1.9094 C[C@@H](NCCS(=O)(=O)[O-])C1CCCCC1 2230a_100025707633_100000737633 [0,1,0,0,0,1|0,0,1]=3 2515 B15R1.9094 C[C@@H](NCCS(=O)(=O)[O-])C1CCCCC1 34a_100025707633_100000762736 [0,1,0,0,0,1|0,0,1]=3 2516 B15R1.9094 NS(=O)(=O)CCCC(=O)C1CCCCC1 1458a_100000210647_100000750626 [0,1,0,0,0,1|2,0,0]=4 2517 B15R1.9094 NS(=O)(=O)CCCC(=O)C1CCCCC1 1458a_100000739357_100000210327 [0,1,0,0,0,1|2,0,0]=4 2518 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCCCC1 240690a_100000738205_100000210647 [0,1,0,0,0,1|1,0,0]=3 2519 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCCCC1 527a_100000738205_100000210647 [0,1,0,0,0,1|1,0,0]=3 2520 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCCCO1 240690a_100000738205_100000748299 [0,1,0,0,0,1|2,0,0]=4 2521 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCCCO1 527a_100000738205_100000748299 [0,1,0,0,0,1|2,0,0]=4 2522 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCCOC1 240690a_100000738205_100000741522 [0,1,0,0,0,1|2,0,0]=4 2523 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCCOC1 527a_100000738205_100000741522 [0,1,0,0,0,1|2,0,0]=4 2524 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCOCC1 240690a_100000738205_100000195482 [0,1,0,0,0,1|2,0,0]=4 2525 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCOCC1 527a_100000738205_100000195482 [0,1,0,0,0,1|2,0,0]=4 2526 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCSCC1 240690a_100000738205_100000755232 [0,1,0,0,0,1|2,0,0]=4 2527 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCSCC1 527a_100000738205_100000755232 [0,1,0,0,0,1|2,0,0]=4 2528 B15R1.9094 NS(=O)(=O)CSCC(=O)C1CCCCC1 62a_100000241979_100000741382 [0,1,0,0,0,1|2,0,0]=4 2529 B15R1.9094 NS(=O)(=O)CSCC(=O)C1CCCCC1 62a_100000741382_100000241979 [0,1,0,0,0,1|2,0,0]=4 2530 B15R1.9094 N[C@@H](COCS(=O)(=O)[O-])C1CCCCC1 34a_100009817630_100009817235 [0,1,0,0,0,1|1,0,1]=4 2531 B15R1.9094 O=C(CCCS(=O)(=O)[O-])C1CCCCC1 1458a_100000210647_100009813499 [0,1,0,0,0,1|1,0,1]=4 2532 B15R1.9094 O=C(CSCS(=O)(=O)[O-])C1CCCCC1 62a_100000241979_100009817235 [0,1,0,0,0,1|1,0,1]=4 2533 B15R1.9094 O=C(CSCS(=O)(=O)[O-])C1CCCCC1 62a_100009817235_100000241979 [0,1,0,0,0,1|1,0,1]=4 2534 B15R1.9095 CN(CCNC1CCCCC1)S(=O)(=O)C 270004a_100015186441_100000210434 [0,1,0,0,0,1|1,0,0]=3 2535 B15R1.9095 CN(CCNC1CCCOC1)S(=O)(=O)C 270004a_100015186441_100000753404 [0,1,0,0,0,1|2,0,0]=4 2536 B15R1.9095 CN(CCNC1CCCSC1)S(=O)(=O)C 270004a_100015186441_100000057913 [0,1,0,0,0,1|2,0,0]=4 2537 B15R1.9095 CN(CCNC1CCNCC1)S(=O)(=O)C 270004a_100015186441_100015192401 [0,1,0,0,0,1|2,0,0]=4 2538 B15R1.9095 CN(CCNC1CCOCC1)S(=O)(=O)C 270004a_100015186441_100011217826 [0,1,0,0,0,1|2,0,0]=4 2539 B15R1.9095 CN(CCNC1CCSCC1)S(=O)(=O)C 270004a_100015186441_100000203788 [0,1,0,0,0,1|2,0,0]=4 2540 B15R1.9095 O=S(=O)([O-])C(O)CSCC1CCCCC1 62a_100000211423_200000035551 [0,1,0,0,0,1|1,0,1]=4 2541 B15R1.9095 O=S(=O)([O-])C(O)CSCC1CCCCC1 62a_200000035551_100000211423 [0,1,0,0,0,1|1,0,1]=4 2542 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCC1 2230a_100000736448_100000731031 [0,1,0,0,0,1|1,0,0]=3 2543 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCC1 2230a_100000750128_100000211423 [0,1,0,0,0,1|1,0,0]=3 2544 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCC1 269982a_100000736448_100000731031 [0,1,0,0,0,1|1,0,0]=3 2545 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCC1 269982a_100000750128_100000211423 [0,1,0,0,0,1|1,0,0]=3 2546 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCC1 34a_100000736448_100000731031 [0,1,0,0,0,1|1,0,0]=3 2547 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCC1 34a_100000750128_100000211423 [0,1,0,0,0,1|1,0,0]=3 2548 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCO1 2230a_100000225654_100000731031 [0,1,0,0,0,1|2,0,0]=4 2549 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCO1 2230a_100000750128_100000211543 [0,1,0,0,0,1|2,0,0]=4 2550 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCO1 269982a_100000225654_100000731031 [0,1,0,0,0,1|2,0,0]=4 2551 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCO1 269982a_100000750128_100000211543 [0,1,0,0,0,1|2,0,0]=4 2552 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCO1 34a_100000225654_100000731031 [0,1,0,0,0,1|2,0,0]=4 2553 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCCO1 34a_100000750128_100000211543 [0,1,0,0,0,1|2,0,0]=4 2554 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCOC1 2230a_100000750128_100000741521 [0,1,0,0,0,1|2,0,0]=4 2555 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCOC1 269982a_100000750128_100000741521 [0,1,0,0,0,1|2,0,0]=4 2556 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCCOC1 34a_100000750128_100000741521 [0,1,0,0,0,1|2,0,0]=4 2557 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCOCC1 2230a_100000750128_100000754603 [0,1,0,0,0,1|2,0,0]=4 2558 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCOCC1 2230a_100025706683_100000731031 [0,1,0,0,0,1|2,0,0]=4 2559 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCOCC1 269982a_100000750128_100000754603 [0,1,0,0,0,1|2,0,0]=4 2560 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCOCC1 269982a_100025706683_100000731031 [0,1,0,0,0,1|2,0,0]=4 2561 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCOCC1 34a_100000750128_100000754603 [0,1,0,0,0,1|2,0,0]=4 2562 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCOCC1 34a_100025706683_100000731031 [0,1,0,0,0,1|2,0,0]=4 2563 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCSCC1 2230a_100011935259_100000731031 [0,1,0,0,0,1|2,0,0]=4 2564 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCSCC1 269982a_100011935259_100000731031 [0,1,0,0,0,1|2,0,0]=4 2565 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCSCC1 270004a_100000750128_100000067145 [0,1,0,0,0,1|2,0,0]=4 2566 B15R1.9108 CN(CCS(=O)(=O)C)CC1CCSCC1 34a_100011935259_100000731031 [0,1,0,0,0,1|2,0,0]=4 2567 B15R1.9108 CN(CCS(=O)(=O)[O-])CC1CCCCC1 2230a_100000736448_100000737633 [0,1,0,0,0,1|0,0,1]=3 2568 B15R1.9108 CN(CCS(=O)(=O)[O-])CC1CCCCC1 34a_100000736448_100000762736 [0,1,0,0,0,1|0,0,1]=3 2569 B15R1.9108 CN(CCS(=O)(=O)[O-])CC1CCCCO1 2230a_100000225654_100000737633 [0,1,0,0,0,1|1,0,1]=4 2570 B15R1.9108 CN(CCS(=O)(=O)[O-])CC1CCCCO1 34a_100000225654_100000762736 [0,1,0,0,0,1|1,0,1]=4 2571 B15R1.9108 CN(CCS(=O)(=O)[O-])CC1CCOCC1 2230a_100025706683_100000737633 [0,1,0,0,0,1|1,0,1]=4 2572 B15R1.9108 CN(CCS(=O)(=O)[O-])CC1CCOCC1 34a_100025706683_100000762736 [0,1,0,0,0,1|1,0,1]=4 2573 B15R1.9108 CN(CCS(=O)(=O)[O-])CC1CCSCC1 2230a_100011935259_100000737633 [0,1,0,0,0,1|1,0,1]=4 2574 B15R1.9108 CN(CCS(=O)(=O)[O-])CC1CCSCC1 34a_100011935259_100000762736 [0,1,0,0,0,1|1,0,1]=4 2575 B15R1.9108 CS(=O)(=O)CCC(=O)CC1CCCCC1 1458a_100000211666_100000731031 [0,1,0,0,0,1|2,0,0]=4 2576 B15R1.9108 CS(=O)(=O)CCC(=O)CC1CCCCC1 1458a_100000737124_100000211423 [0,1,0,0,0,1|2,0,0]=4 2577 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCCCC1 11a_100000182618_100000737124 [0,1,0,0,0,1|1,0,0]=3 2578 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCCCC1 1626a_100000182618_100000737124 [0,1,0,0,0,1|1,0,0]=3 2579 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCCCC1 240690a_100000182618_100000737124 [0,1,0,0,0,1|1,0,0]=3 2580 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCCCC1 527a_100000182618_100000737124 [0,1,0,0,0,1|1,0,0]=3 2581 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCCOC1 11a_100000719290_100000737124 [0,1,0,0,0,1|2,0,0]=4 2582 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCCOC1 1626a_100000719290_100000737124 [0,1,0,0,0,1|2,0,0]=4 2583 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCCOC1 240690a_100000719290_100000737124 [0,1,0,0,0,1|2,0,0]=4 2584 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCCOC1 527a_100000719290_100000737124 [0,1,0,0,0,1|2,0,0]=4 2585 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCOCC1 11a_100000741149_100000737124 [0,1,0,0,0,1|2,0,0]=4 2586 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCOCC1 1626a_100000741149_100000737124 [0,1,0,0,0,1|2,0,0]=4 2587 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCOCC1 240690a_100000741149_100000737124 [0,1,0,0,0,1|2,0,0]=4 2588 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCOCC1 527a_100000741149_100000737124 [0,1,0,0,0,1|2,0,0]=4 2589 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCSCC1 11a_100000748639_100000737124 [0,1,0,0,0,1|2,0,0]=4 2590 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCSCC1 1626a_100000748639_100000737124 [0,1,0,0,0,1|2,0,0]=4 2591 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCSCC1 240690a_100000748639_100000737124 [0,1,0,0,0,1|2,0,0]=4 2592 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCSCC1 527a_100000748639_100000737124 [0,1,0,0,0,1|2,0,0]=4 2593 B15R1.9108 CS(=O)(=O)NCC(=O)NC1CCCCC1 11a_100000182618_100000737300 [0,1,0,0,0,1|1,0,1]=4 2594 B15R1.9108 CS(=O)(=O)NCC(=O)NC1CCCCC1 1626a_100000182618_100000737300 [0,1,0,0,0,1|1,0,1]=4 2595 B15R1.9108 CS(=O)(=O)NCC(=O)NC1CCCCC1 240690a_100000182618_100000737300 [0,1,0,0,0,1|1,0,1]=4 2596 B15R1.9108 CS(=O)(=O)NCC(=O)NC1CCCCC1 40a_100015207117_100000738038 [0,1,0,0,0,1|1,0,1]=4 2597 B15R1.9108 NS(=O)(=O)CCC(=O)CC1CCCCC1 1458a_100000737202_100000211423 [0,1,0,0,0,1|2,0,0]=4 2598 B15R1.9108 NS(=O)(=O)CCC(=O)NC1CCCCC1 240690a_100000182618_100000737202 [0,1,0,0,0,1|1,0,0]=3 2599 B15R1.9108 NS(=O)(=O)CCC(=O)NC1CCCOC1 240690a_100000719290_100000737202 [0,1,0,0,0,1|2,0,0]=4 2600 B15R1.9108 NS(=O)(=O)CCC(=O)NC1CCOCC1 240690a_100000741149_100000737202 [0,1,0,0,0,1|2,0,0]=4 2601 B15R1.9108 NS(=O)(=O)CCC(=O)NC1CCSCC1 240690a_100000748639_100000737202 [0,1,0,0,0,1|2,0,0]=4 2602 B15R1.9108 O=C(CCS(=O)(=O)[O-])CC1CCCCC1 1458a_100000211666_100000762736 [0,1,0,0,0,1|1,0,1]=4 2603 B15R1.25839 CC1(CCCCC1)CNCCS(=O)(=O)C 2230a_100000706052_100000731031 [0,1,0,0,0,1|1,0,0]=3 2604 B15R1.25839 CC1(CCCCC1)CNCCS(=O)(=O)C 269862a_100000740961_100011935227 [0,1,0,0,0,1|1,0,0]=3 2605 B15R1.25839 CC1(CCCCC1)CNCCS(=O)(=O)C 34a_100000706052_100000731031 [0,1,0,0,0,1|1,0,0]=3 2606 B15R1.25839 CC1(CCCCC1)CNCCS(=O)(=O)N 269862a_100000738205_100011935227 [0,1,0,0,0,1|1,0,0]=3 2607 B15R1.25839 CC1(CCCCC1)CNCCS(=O)(=O)[O-] 2230a_100000706052_100000737633 [0,1,0,0,0,1|0,0,1]=3 2608 B15R1.25839 CC1(CCCCC1)CNCCS(=O)(=O)[O-] 34a_100000706052_100000762736 [0,1,0,0,0,1|0,0,1]=3 2609 B15R1.25839 CC1(CCCCC1)COCCS(=O)(=O)C 34a_100000688186_100000731031 [0,1,0,0,0,1|2,0,0]=4 2610 B15R1.25839 CC1(CCCCC1)COCCS(=O)(=O)C 7a_100000688186_100000230027 [0,1,0,0,0,1|2,0,0]=4 2611 B15R1.25839 CC1(CCCCC1)COCCS(=O)(=O)[O-] 34a_100000688186_100000762736 [0,1,0,0,0,1|1,0,1]=4 2612 B15R1.25839 CC1(CCCCC1)NCCCS(=O)(=O)C 2230a_100000741114_100000754308 [0,1,0,0,0,1|1,0,0]=3 2613 B15R1.25839 CC1(CCCCC1)NCCCS(=O)(=O)C 34a_100000741114_100000754308 [0,1,0,0,0,1|1,0,0]=3 2614 B15R1.25839 CC1(CCCCC1)NCCCS(=O)(=O)N 2230a_100000741114_100000750626 [0,1,0,0,0,1|1,0,0]=3 2615 B15R1.25839 CC1(CCCCC1)NCCCS(=O)(=O)N 34a_100000741114_100000750626 [0,1,0,0,0,1|1,0,0]=3 2616 B15R1.25839 CC1(CCCCC1)NCCCS(=O)(=O)[O-] 34a_100000741114_100009813499 [0,1,0,0,0,1|0,0,1]=3 2617 B15R1.25839 CC1(CCCCC1)NCCNS(=O)(=O)C 2230a_100000741114_100000754112 [0,1,0,0,0,1|1,0,0]=3 2618 B15R1.25839 CC1(CCCCC1)NCCOS(=O)(=O)C 2230a_100000741114_200000036756 [0,1,0,0,0,1|1,0,0]=3 2619 B15R1.25839 CC1(CCCCC1)NCCOS(=O)(=O)C 34a_100000741114_200000036756 [0,1,0,0,0,1|1,0,0]=3 2620 B15R1.25839 CC1(CCCCC1)OCCCS(=O)(=O)C 34a_100011215885_100000754308 [0,1,0,0,0,1|2,0,0]=4 2621 B15R1.25839 CC1(CCCCC1)OCCCS(=O)(=O)C 7a_100011215885_100000754308 [0,1,0,0,0,1|2,0,0]=4 2622 B15R1.25839 CC1(CCCCC1)OCCCS(=O)(=O)N 34a_100011215885_100000750626 [0,1,0,0,0,1|2,0,0]=4 2623 B15R1.25839 CC1(CCCCC1)OCCCS(=O)(=O)N 7a_100011215885_100000750626 [0,1,0,0,0,1|2,0,0]=4 2624 B15R1.25839 CC1(CCCCC1)OCCCS(=O)(=O)[O-] 34a_100011215885_100009813499 [0,1,0,0,0,1|1,0,1]=4 2625 B15R1.25839 CC1(CCCCC1)OCCNS(=O)(=O)C 7a_100011215885_100000754112 [0,1,0,0,0,1|2,0,0]=4 2626 B15R1.25839 CC1(CCCCC1)OCCOS(=O)(=O)C 34a_100011215885_200000036756 [0,1,0,0,0,1|2,0,0]=4 2627 B15R1.25839 CC1(CCCCC1)OCCOS(=O)(=O)C 7a_100011215885_200000036756 [0,1,0,0,0,1|2,0,0]=4 2628 B15R1.25839 CC1(CCOCC1)CNCCS(=O)(=O)C 2230a_100000695556_100000731031 [0,1,0,0,0,1|2,0,0]=4 2629 B15R1.25839 CC1(CCOCC1)CNCCS(=O)(=O)C 269862a_100000740961_100000701351 [0,1,0,0,0,1|2,0,0]=4 2630 B15R1.25839 CC1(CCOCC1)CNCCS(=O)(=O)C 34a_100000695556_100000731031 [0,1,0,0,0,1|2,0,0]=4 2631 B15R1.25839 CC1(CCOCC1)CNCCS(=O)(=O)N 269862a_100000738205_100000701351 [0,1,0,0,0,1|2,0,0]=4 2632 B15R1.25839 CC1(CCOCC1)CNCCS(=O)(=O)[O-] 2230a_100000695556_100000737633 [0,1,0,0,0,1|1,0,1]=4 2633 B15R1.25839 CC1(CCOCC1)CNCCS(=O)(=O)[O-] 34a_100000695556_100000762736 [0,1,0,0,0,1|1,0,1]=4 2634 B15R1.25839 CC1(CCOCC1)NCCCS(=O)(=O)C 2230a_100000692449_100000754308 [0,1,0,0,0,1|2,0,0]=4 2635 B15R1.25839 CC1(CCOCC1)NCCCS(=O)(=O)C 34a_100000692449_100000754308 [0,1,0,0,0,1|2,0,0]=4 2636 B15R1.25839 CC1(CCOCC1)NCCCS(=O)(=O)N 2230a_100000692449_100000750626 [0,1,0,0,0,1|2,0,0]=4 2637 B15R1.25839 CC1(CCOCC1)NCCCS(=O)(=O)N 34a_100000692449_100000750626 [0,1,0,0,0,1|2,0,0]=4 2638 B15R1.25839 CC1(CCOCC1)NCCCS(=O)(=O)[O-] 34a_100000692449_100009813499 [0,1,0,0,0,1|1,0,1]=4 2639 B15R1.25839 CC1(CCOCC1)NCCNS(=O)(=O)C 2230a_100000692449_100000754112 [0,1,0,0,0,1|2,0,0]=4 2640 B15R1.25839 CC1(CCOCC1)NCCOS(=O)(=O)C 2230a_100000692449_200000036756 [0,1,0,0,0,1|2,0,0]=4 2641 B15R1.25839 CC1(CCOCC1)NCCOS(=O)(=O)C 34a_100000692449_200000036756 [0,1,0,0,0,1|2,0,0]=4 2642 B15R1.25839 CS(=O)(=O)CCNCC1(CCCCC1)O 2230a_100000748649_100000731031 [0,1,0,0,0,1|1,0,0]=3 2643 B15R1.25839 CS(=O)(=O)CCNCC1(CCCCC1)O 34a_100000748649_100000731031 [0,1,0,0,0,1|1,0,0]=3 2644 B15R1.25839 CS(=O)(=O)CCNCC1(CCOCC1)F 2230a_100016991512_100000731031 [0,1,0,0,0,1|2,0,0]=4 2645 B15R1.25839 CS(=O)(=O)CCNCC1(CCOCC1)F 34a_100016991512_100000731031 [0,1,0,0,0,1|2,0,0]=4 2646 B15R1.25839 CS(=O)(=O)CCNCC1(CCOCC1)O 2230a_100000704115_100000731031 [0,1,0,0,0,1|2,0,0]=4 2647 B15R1.25839 CS(=O)(=O)CCNCC1(CCOCC1)O 34a_100000704115_100000731031 [0,1,0,0,0,1|2,0,0]=4 2648 B15R1.25839 CS(=O)(=O)CCNCC1(CCSCC1)O 2230a_100000758141_100000731031 [0,1,0,0,0,1|2,0,0]=4 2649 B15R1.25839 CS(=O)(=O)CCOCC1(CCCCC1)F 34a_100000090305_100000731031 [0,1,0,0,0,1|2,0,0]=4 2650 B15R1.25839 CS(=O)(=O)CCOCC1(CCCCC1)F 7a_100000090305_100000230027 [0,1,0,0,0,1|2,0,0]=4 2651 B15R1.25839 CS(=O)(=O)CCOCC1(CCCCC1)N 34a_100000740034_100000731031 [0,1,0,0,0,1|2,0,0]=4 2652 B15R1.25839 NC1(CCCCC1)COCCS(=O)(=O)[O-] 34a_100000740034_100000762736 [0,1,0,0,0,1|1,0,1]=4 2653 B15R1.25839 O=S(=O)([O-])CCNCC1(CCCCC1)O 2230a_100000748649_100000737633 [0,1,0,0,0,1|0,0,1]=3 2654 B15R1.25839 O=S(=O)([O-])CCNCC1(CCCCC1)O 34a_100000748649_100000762736 [0,1,0,0,0,1|0,0,1]=3 2655 B15R1.25839 O=S(=O)([O-])CCNCC1(CCOCC1)F 2230a_100016991512_100000737633 [0,1,0,0,0,1|1,0,1]=4 2656 B15R1.25839 O=S(=O)([O-])CCNCC1(CCOCC1)F 34a_100016991512_100000762736 [0,1,0,0,0,1|1,0,1]=4 2657 B15R1.25839 O=S(=O)([O-])CCNCC1(CCOCC1)O 2230a_100000704115_100000737633 [0,1,0,0,0,1|1,0,1]=4 2658 B15R1.25839 O=S(=O)([O-])CCNCC1(CCOCC1)O 34a_100000704115_100000762736 [0,1,0,0,0,1|1,0,1]=4 2659 B15R1.25839 O=S(=O)([O-])CCNCC1(CCSCC1)O 2230a_100000758141_100000737633 [0,1,0,0,0,1|1,0,1]=4 2660 B15R1.25839 O=S(=O)([O-])CCOCC1(CCCCC1)F 34a_100000090305_100000762736 [0,1,0,0,0,1|1,0,1]=4 2661 B15R1.25839 O=S(=O)([O-])CNCCC1(CCCCC1)O 34a_100102740465_100009817235 [0,1,0,0,0,1|1,0,1]=4 2662 B15R1.350 CS(=O)(=O)CCNC1CCCCNC1=O 2230a_100000698827_100000731031 [0,1,0,0,0,1|1,0,1]=4 2663 B15R1.350 CS(=O)(=O)CCNC1CCCCNC1=O 2230a_100000740961_100000735217 [0,1,0,0,0,1|1,0,1]=4 2664 B15R1.350 CS(=O)(=O)CCNC1CCCCNC1=O 34a_100000698827_100000731031 [0,1,0,0,0,1|1,0,1]=4 2665 B15R1.350 CS(=O)(=O)CCOC1CCCCCC1=O 7a_100000211924_100000243696 [0,1,0,0,0,1|2,0,0]=4 2666 B15R1.350 CS(=O)(=O)CCSC1CCCCCC1=O 62a_100000243696_100000230027 [0,1,0,0,0,1|2,0,0]=4 2667 B15R1.350 CS(=O)(=O)CCSC1CCCCCC1=O 62a_100000731031_100000243696 [0,1,0,0,0,1|2,0,0]=4 2668 B15R1.350 NS(=O)(=O)CCNC1CCCCNC1=O 2230a_100000738205_100000735217 [0,1,0,0,0,1|1,0,1]=4 2669 B15R1.350 O=C1CCCCCC1SCCS(=O)(=O)[O-] 62a_100000243696_100000762736 [0,1,0,0,0,1|1,0,1]=4 2670 B15R1.350 O=C1CCCCCC1SCCS(=O)(=O)[O-] 62a_100000762736_100000243696 [0,1,0,0,0,1|1,0,1]=4 2671 B15R1.350 O=C1NCCCCC1NCCS(=O)(=O)[O-] 2230a_100000698827_100000737633 [0,1,0,0,0,1|0,0,2]=4 2672 B15R1.350 O=C1NCCCCC1NCCS(=O)(=O)[O-] 34a_100000698827_100000762736 [0,1,0,0,0,1|0,0,2]=4 2673 B15R1.7883 CCS(=O)(=O)CCNC1CCCCCC1 2230a_100000210984_100000756660 [0,1,0,0,0,1|1,0,0]=3 2674 B15R1.7883 CCS(=O)(=O)CCNC1CCCCCC1 270004a_100000751051_100000210131 [0,1,0,0,0,1|1,0,0]=3 2675 B15R1.7883 CCS(=O)(=O)CCNC1CCCCCC1 34a_100000210984_100000756660 [0,1,0,0,0,1|1,0,0]=3 2676 B15R1.7883 CCS(=O)(=O)CCNC1CCCCCC1 34a_100000751051_100011217769 [0,1,0,0,0,1|1,0,0]=3 2677 B15R1.7883 CCS(=O)(=O)CCNC1CCCNCC1 270004a_100000751051_100015187895 [0,1,0,0,0,1|1,0,0]=3 2678 B15R1.7883 CCS(=O)(=O)CCNC1CSCCSC1 270004a_100000751051_100000068409 [0,1,0,0,0,1|2,0,0]=4 2679 B15R1.7883 CCS(=O)(=O)CCOC1CCCCCC1 34a_100000210887_100000756660 [0,1,0,0,0,1|2,0,0]=4 2680 B15R1.7883 CCS(=O)(=O)CCOC1CCCCCC1 34a_200011216379_100011217769 [0,1,0,0,0,1|2,0,0]=4 2681 B15R1.7883 CCS(=O)(=O)CCOC1CCCCCC1 7a_100000210887_100000756660 [0,1,0,0,0,1|2,0,0]=4 2682 B15R1.7883 CCS(=O)(=O)CCSC1CCCCCC1 62a_100000756660_100011217769 [0,1,0,0,0,1|2,0,0]=4 2683 B15R1.7883 CCS(=O)(=O)CCSC1CCCCCC1 62a_100011217769_100000756660 [0,1,0,0,0,1|2,0,0]=4 2684 B15R1.7883 CNS(=O)(=O)CCNC1CCCCCC1 270004a_100000710037_100000210131 [0,1,0,0,0,1|1,0,0]=3 2685 B15R1.7883 CNS(=O)(=O)CCNC1CCCCCC1 34a_100000710037_100011217769 [0,1,0,0,0,1|1,0,0]=3 2686 B15R1.7883 CNS(=O)(=O)CCNC1CCCNCC1 270004a_100000710037_100015187895 [0,1,0,0,0,1|1,0,0]=3 2687 B15R1.7883 CNS(=O)(=O)CCNC1CSCCSC1 270004a_100000710037_100000068409 [0,1,0,0,0,1|2,0,0]=4 2688 B15R1.25130 CC1(CCCCCC1)NCCS(=O)(=O)C 2230a_100000704638_100000731031 [0,1,0,0,0,1|1,0,0]=3 2689 B15R1.25130 CC1(CCCCCC1)NCCS(=O)(=O)C 34a_100000704638_100000731031 [0,1,0,0,0,1|1,0,0]=3 2690 B15R1.25130 CC1(CCCCCC1)NCCS(=O)(=O)[O-] 2230a_100000704638_100000737633 [0,1,0,0,0,1|0,0,1]=3 2691 B15R1.25130 CC1(CCCCCC1)NCCS(=O)(=O)[O-] 34a_100000704638_100000762736 [0,1,0,0,0,1|0,0,1]=3 2692 B15R1.25130 CC1(CCCCCC1)OCCS(=O)(=O)C 34a_100000708895_100000731031 [0,1,0,0,0,1|2,0,0]=4 2693 B15R1.25130 CC1(CCCCCC1)OCCS(=O)(=O)C 7a_100000708895_100000230027 [0,1,0,0,0,1|2,0,0]=4 2694 B15R1.25130 CC1(CCCCCC1)OCCS(=O)(=O)[O-] 34a_100000708895_100000762736 [0,1,0,0,0,1|1,0,1]=4 2695 B15R1.25130 CC1(CCCNCC1)OCCS(=O)(=O)C 34a_100000723723_100000731031 [0,1,0,0,0,1|2,0,0]=4 2696 B15R1.25130 CC1(CCCNCC1)OCCS(=O)(=O)[O-] 34a_100000723723_100000762736 [0,1,0,0,0,1|1,0,1]=4 2697 B15R1.31838 CS(=O)(=O)CC(=O)NC1CCCCCC1 11a_100000210984_100000744497 [0,1,0,0,0,1|1,0,1]=4 2698 B15R1.31838 CS(=O)(=O)CC(=O)NC1CCCCCC1 240690a_100000210984_100000744497 [0,1,0,0,0,1|1,0,1]=4 2699 B15R1.31838 CS(=O)(=O)CC(=O)NC1CCCCCC1 527a_100000210984_100000744497 [0,1,0,0,0,1|1,0,1]=4 2700 B15R1.31964 O=S(=O)([O-])C(O)CSC1CCCCCC1 62a_100011217769_200000035551 [0,1,0,0,0,1|1,0,1]=4 2701 B15R1.31964 O=S(=O)([O-])C(O)CSC1CCCCCC1 62a_200000035551_100011217769 [0,1,0,0,0,1|1,0,1]=4 2702 B15R1.67737 CN(CCS(=O)(=O)C)C1CCCCCC1 2230a_100015185097_100000731031 [0,1,0,0,0,1|1,0,0]=3 2703 B15R1.67737 CN(CCS(=O)(=O)C)C1CCCCCC1 269982a_100000750128_100011217769 [0,1,0,0,0,1|1,0,0]=3 2704 B15R1.67737 CN(CCS(=O)(=O)C)C1CCCCCC1 269982a_100015185097_100000731031 [0,1,0,0,0,1|1,0,0]=3 2705 B15R1.67737 CN(CCS(=O)(=O)C)C1CCCCCC1 270004a_100000750128_100000210131 [0,1,0,0,0,1|1,0,0]=3 2706 B15R1.67737 CN(CCS(=O)(=O)C)C1CCCCCC1 34a_100000750128_100011217769 [0,1,0,0,0,1|1,0,0]=3 2707 B15R1.67737 CN(CCS(=O)(=O)C)C1CCCCCC1 34a_100015185097_100000731031 [0,1,0,0,0,1|1,0,0]=3 2708 B15R1.67737 CN(CCS(=O)(=O)C)C1CCCNCC1 270004a_100000750128_100015187895 [0,1,0,0,0,1|1,0,0]=3 2709 B15R1.67737 CN(CCS(=O)(=O)C)C1CSCCSC1 270004a_100000750128_100000068409 [0,1,0,0,0,1|2,0,0]=4 2710 B15R1.67737 CN(CCS(=O)(=O)[O-])C1CCCCCC1 2230a_100015185097_100000737633 [0,1,0,0,0,1|0,0,1]=3 2711 B15R1.67737 CN(CCS(=O)(=O)[O-])C1CCCCCC1 34a_100015185097_100000762736 [0,1,0,0,0,1|0,0,1]=3 2712 B15R1.67737 CS(=O)(=O)CCC(=O)C1CCCCCC1 1458a_100000737124_100011217769 [0,1,0,0,0,1|2,0,0]=4 2713 B15R1.67737 CS(=O)(=O)CCC(=O)C1CCCCCC1 1458a_100000749507_100000731031 [0,1,0,0,0,1|2,0,0]=4 2714 B15R1.67737 NS(=O)(=O)CCC(=O)C1CCCCCC1 1458a_100000737202_100011217769 [0,1,0,0,0,1|2,0,0]=4 2715 B15R1.67737 O=C(CCS(=O)(=O)[O-])C1CCCCCC1 1458a_100000749507_100000762736 [0,1,0,0,0,1|1,0,1]=4 2716 B15R1.1 C#CC1CCC(CC1)NCCS(=O)(=O)C 270004a_100000740961_100000722563 [0,2,0,0,0,0|1,0,0]=3 2717 B15R1.1 C#CC1CCC(CC1)NCCS(=O)(=O)N 270004a_100000738205_100000722563 [0,2,0,0,0,0|1,0,0]=3 2718 B15R1.1 CCC1CCC(CC1)NCCS(=O)(=O)C 2230a_100011194317_100000731031 [0,2,0,0,0,0|1,0,0]=3 2719 B15R1.1 CCC1CCC(CC1)NCCS(=O)(=O)C 270004a_100000740961_100000210631 [0,2,0,0,0,0|1,0,0]=3 2720 B15R1.1 CCC1CCC(CC1)NCCS(=O)(=O)C 34a_100011194317_100000731031 [0,2,0,0,0,0|1,0,0]=3 2721 B15R1.1 CCC1CCC(CC1)NCCS(=O)(=O)N 270004a_100000738205_100000210631 [0,2,0,0,0,0|1,0,0]=3 2722 B15R1.1 CCC1CCC(CC1)NCCS(=O)(=O)[O-] 2230a_100011194317_100000737633 [0,2,0,0,0,0|0,0,1]=3 2723 B15R1.1 CCC1CCC(CC1)NCCS(=O)(=O)[O-] 34a_100011194317_100000762736 [0,2,0,0,0,0|0,0,1]=3 2724 B15R1.1 CCC1CCC(CC1)OCCS(=O)(=O)C 34a_100011215326_100000731031 [0,2,0,0,0,0|2,0,0]=4 2725 B15R1.1 CCC1CCC(CC1)OCCS(=O)(=O)C 7a_100011215326_100000230027 [0,2,0,0,0,0|2,0,0]=4 2726 B15R1.1 CCC1CCC(CC1)OCCS(=O)(=O)[O-] 34a_100011215326_100000762736 [0,2,0,0,0,0|1,0,1]=4 2727 B15R1.1 CCN1CCC(CC1)NCCS(=O)(=O)C 2230a_100000199033_100000731031 [0,2,0,0,0,0|2,0,0]=4 2728 B15R1.1 CCN1CCC(CC1)NCCS(=O)(=O)C 270004a_100000740961_100000211075 [0,2,0,0,0,0|2,0,0]=4 2729 B15R1.1 CCN1CCC(CC1)NCCS(=O)(=O)N 270004a_100000738205_100000211075 [0,2,0,0,0,0|2,0,0]=4 2730 B15R1.1 CCN1CCC(CC1)NCCS(=O)(=O)[O-] 2230a_100000199033_100000737633 [0,2,0,0,0,0|1,0,1]=4 2731 B15R1.1 CNC1CCC(CC1)NCCS(=O)(=O)C 270004a_100000740961_200016988011 [0,2,0,0,0,0|1,0,0]=3 2732 B15R1.1 CNC1CCC(CC1)NCCS(=O)(=O)N 270004a_100000738205_200016988011 [0,2,0,0,0,0|1,0,0]=3 2733 B15R1.1 CN[C@H]1CC[C@H](CC1)OCCS(=O)(=O)C 34a_100020636401_100000731031 [0,2,0,0,0,0|2,0,0]=4 2734 B15R1.1 CN[C@H]1CC[C@H](CC1)OCCS(=O)(=O)[O-] 34a_100020636401_100000762736 [0,2,0,0,0,0|1,0,1]=4 2735 B15R1.1 COC1CCC(CC1)NCCS(=O)(=O)C 270004a_100000740961_100000747084 [0,2,0,0,0,0|1,0,0]=3 2736 B15R1.1 COC1CCC(CC1)NCCS(=O)(=O)C 34a_100015205214_100000731031 [0,2,0,0,0,0|1,0,0]=3 2737 B15R1.1 COC1CCC(CC1)NCCS(=O)(=O)N 270004a_100000738205_100000747084 [0,2,0,0,0,0|1,0,0]=3 2738 B15R1.1 COC1CCC(CC1)NCCS(=O)(=O)[O-] 34a_100015205214_100000762736 [0,2,0,0,0,0|0,0,1]=3 2739 B15R1.1 COC1CCC(CC1)OCCS(=O)(=O)C 34a_100011581665_100000731031 [0,2,0,0,0,0|2,0,0]=4 2740 B15R1.1 COC1CCC(CC1)OCCS(=O)(=O)C 7a_100011581665_100000230027 [0,2,0,0,0,0|2,0,0]=4 2741 B15R1.1 COC1CCC(CC1)OCCS(=O)(=O)[O-] 34a_100011581665_100000762736 [0,2,0,0,0,0|1,0,1]=4 2742 B15R1.1 CS(=O)(=O)CCNC1CCC(CC1)C#N 2230a_100102422146_100000731031 [0,2,0,0,0,0|1,0,0]=3 2743 B15R1.1 CS(=O)(=O)CCNC1CCC(CC1)C#N 270004a_100000740961_100009880307 [0,2,0,0,0,0|1,0,0]=3 2744 B15R1.1 CS(=O)(=O)CCNC1CCC(CC1)C#N 34a_100102422146_100000731031 [0,2,0,0,0,0|1,0,0]=3 2745 B15R1.1 CS(=O)(=O)CCNC1CCC(CC1)CO 270004a_100000740961_100000062911 [0,2,0,0,0,0|1,0,0]=3 2746 B15R1.1 CS(=O)(=O)CCN[C@H]1CC[C@@H](CC1)CO 34a_100009821084_100000731031 [0,2,0,0,0,0|1,0,0]=3 2747 B15R1.1 CS(=O)(=O)CCOC1CCC(CC1)C#N 34a_100009859913_100000731031 [0,2,0,0,0,0|2,0,0]=4 2748 B15R1.1 CS(=O)(=O)CCOC1CCC(CC1)C#N 7a_100009859913_100000230027 [0,2,0,0,0,0|2,0,0]=4 2749 B15R1.1 N#CC1CCC(CC1)NCCS(=O)(=O)N 270004a_100000738205_100009880307 [0,2,0,0,0,0|1,0,0]=3 2750 B15R1.1 N#CC1CCC(CC1)NCCS(=O)(=O)[O-] 2230a_100102422146_100000737633 [0,2,0,0,0,0|0,0,1]=3 2751 B15R1.1 N#CC1CCC(CC1)NCCS(=O)(=O)[O-] 34a_100102422146_100000762736 [0,2,0,0,0,0|0,0,1]=3 2752 B15R1.1 N#CC1CCC(CC1)OCCS(=O)(=O)[O-] 34a_100009859913_100000762736 [0,2,0,0,0,0|1,0,1]=4 2753 B15R1.1 NS(=O)(=O)CCNC1CCC(CC1)CO 270004a_100000738205_100000062911 [0,2,0,0,0,0|1,0,0]=3 2754 B15R1.1 O=S(=O)([O-])CCN[C@H]1CC[C@@H](CC1)CO 34a_100009821084_100000762736 [0,2,0,0,0,0|0,0,1]=3 2755 B15R1.8 C=C1CCC(CC1)NCCS(=O)(=O)CC 270004a_100000751051_100010272673 [0,2,0,0,0,0|1,0,1]=4 2756 B15R1.8 C=C1CCC(CC1)NCCS(=O)(=O)NC 270004a_100000710037_100010272673 [0,2,0,0,0,0|1,0,1]=4 2757 B15R1.8 CCS(=O)(=O)CCNC1CCC(CC1)C 270004a_100000751051_100000185489 [0,2,0,0,0,0|1,0,0]=3 2758 B15R1.8 CCS(=O)(=O)CCNC1CCC(CC1)C 34a_100000751051_200011216234 [0,2,0,0,0,0|1,0,0]=3 2759 B15R1.8 CCS(=O)(=O)CCNC1CCC(CC1)O 270004a_100000751051_100000764474 [0,2,0,0,0,0|1,0,0]=3 2760 B15R1.8 CCS(=O)(=O)CCNC1CCN(CC1)C 270004a_100000751051_100000210137 [0,2,0,0,0,0|2,0,0]=4 2761 B15R1.8 CCS(=O)(=O)CCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000756660 [0,2,0,0,0,0|1,0,0]=3 2762 B15R1.8 CCS(=O)(=O)CCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000756660 [0,2,0,0,0,0|1,0,0]=3 2763 B15R1.8 CCS(=O)(=O)CCOC1CCC(CC1)C 34a_100000210714_100000756660 [0,2,0,0,0,0|2,0,0]=4 2764 B15R1.8 CCS(=O)(=O)CCOC1CCC(CC1)C 34a_200011216379_200011216234 [0,2,0,0,0,0|2,0,0]=4 2765 B15R1.8 CCS(=O)(=O)CCOC1CCC(CC1)C 7a_100000210714_100000756660 [0,2,0,0,0,0|2,0,0]=4 2766 B15R1.8 CCS(=O)(=O)CCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000756660 [0,2,0,0,0,0|2,0,0]=4 2767 B15R1.8 CCS(=O)(=O)CCSC1CCC(CC1)C 62a_100000756660_200011216234 [0,2,0,0,0,0|2,0,0]=4 2768 B15R1.8 CNS(=O)(=O)CCNC1CCC(CC1)C 270004a_100000710037_100000185489 [0,2,0,0,0,0|1,0,0]=3 2769 B15R1.8 CNS(=O)(=O)CCNC1CCC(CC1)C 34a_100000710037_200011216234 [0,2,0,0,0,0|1,0,0]=3 2770 B15R1.8 CNS(=O)(=O)CCNC1CCC(CC1)O 270004a_100000710037_100000764474 [0,2,0,0,0,0|1,0,0]=3 2771 B15R1.8 CNS(=O)(=O)CCNC1CCN(CC1)C 270004a_100000710037_100000210137 [0,2,0,0,0,0|2,0,0]=4 2772 B15R1.887 CC1CCC(CC1C)NCCS(=O)(=O)C 270004a_100000740961_100000759390 [0,2,0,0,0,0|1,0,0]=3 2773 B15R1.887 CC1CCC(CC1C)NCCS(=O)(=O)N 270004a_100000738205_100000759390 [0,2,0,0,0,0|1,0,0]=3 2774 B15R1.887 CC1CCC(CC1C)OCCS(=O)(=O)C 34a_100011215933_100000731031 [0,2,0,0,0,0|2,0,0]=4 2775 B15R1.887 CC1CCC(CC1C)OCCS(=O)(=O)C 7a_100011215933_100000230027 [0,2,0,0,0,0|2,0,0]=4 2776 B15R1.887 CC1CCC(CC1C)OCCS(=O)(=O)[O-] 34a_100011215933_100000762736 [0,2,0,0,0,0|1,0,1]=4 2777 B15R1.892 C=C1CCC(CC1)N(C)CCS(=O)(=O)C 270004a_100000750128_100010272673 [0,2,0,0,0,0|1,0,1]=4 2778 B15R1.892 CC1CCC(CC1)C(=O)CCS(=O)(=O)C 1458a_100000737124_200011216234 [0,2,0,0,0,0|2,0,0]=4 2779 B15R1.892 CC1CCC(CC1)C(=O)CCS(=O)(=O)N 1458a_100000737202_200011216234 [0,2,0,0,0,0|2,0,0]=4 2780 B15R1.892 CC1CCC(CC1)N(C)CCS(=O)(=O)C 269982a_100000750128_200011216234 [0,2,0,0,0,0|1,0,0]=3 2781 B15R1.892 CC1CCC(CC1)N(C)CCS(=O)(=O)C 270004a_100000750128_100000185489 [0,2,0,0,0,0|1,0,0]=3 2782 B15R1.892 CC1CCC(CC1)N(C)CCS(=O)(=O)C 34a_100000750128_200011216234 [0,2,0,0,0,0|1,0,0]=3 2783 B15R1.892 CN(CCS(=O)(=O)C)C1CCC(CC1)O 270004a_100000750128_100000764474 [0,2,0,0,0,0|1,0,0]=3 2784 B15R1.892 CN(CCS(=O)(=O)C)[C@H]1CC[C@H](CC1)O 2230a_100020636401_100000731031 [0,2,0,0,0,0|1,0,0]=3 2785 B15R1.892 CN(CCS(=O)(=O)C)[C@H]1CC[C@H](CC1)O 269982a_100020636401_100000731031 [0,2,0,0,0,0|1,0,0]=3 2786 B15R1.892 CN(CCS(=O)(=O)[O-])[C@H]1CC[C@H](CC1)O 2230a_100020636401_100000737633 [0,2,0,0,0,0|0,0,1]=3 2787 B15R1.892 CN1CCC(CC1)N(C)CCS(=O)(=O)C 2230a_100025768347_100000731031 [0,2,0,0,0,0|2,0,0]=4 2788 B15R1.892 CN1CCC(CC1)N(C)CCS(=O)(=O)C 269982a_100000750128_100011215917 [0,2,0,0,0,0|2,0,0]=4 2789 B15R1.892 CN1CCC(CC1)N(C)CCS(=O)(=O)C 269982a_100025768347_100000731031 [0,2,0,0,0,0|2,0,0]=4 2790 B15R1.892 CN1CCC(CC1)N(C)CCS(=O)(=O)C 270004a_100000750128_100000210137 [0,2,0,0,0,0|2,0,0]=4 2791 B15R1.892 CN1CCC(CC1)N(C)CCS(=O)(=O)[O-] 2230a_100025768347_100000737633 [0,2,0,0,0,0|1,0,1]=4 2792 B15R1.892 CS(=O)(=O)CCC(=O)C1CCC(CC1)O 1458a_100000743365_100000731031 [0,2,0,0,0,0|2,0,0]=4 2793 B15R1.892 CS(=O)(=O)CCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000731031 [0,2,0,0,0,0|2,0,0]=4 2794 B15R1.892 C[C@H]1CC[C@@H](CC1)C(=O)CCS(=O)(=O)[O-] 1458a_100009815934_100000762736 [0,2,0,0,0,0|1,0,1]=4 2795 B15R1.892 O=C(CCS(=O)(=O)[O-])C1CCC(CC1)O 1458a_100000743365_100000762736 [0,2,0,0,0,0|1,0,1]=4 2796 B15R1.894 CC1CCC(CC1)SCC(O)S(=O)(=O)[O-] 62a_200000035551_200011216234 [0,2,0,0,0,0|1,0,1]=4 2797 B15R1.895 CS(=O)(=O)CCO[C@@]1(CC[C@H](CC1)N)C 34a_202125554758_100000731031 [0,2,0,0,0,0|2,0,0]=4 2798 B15R1.895 C[C@@]1(CC[C@@H](CC1)N)OCCS(=O)(=O)[O-] 34a_202125554758_100000762736 [0,2,0,0,0,0|1,0,1]=4 2799 B15R1.913 CS(=O)(=O)CC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_100000744497 [0,2,0,0,0,0|1,0,1]=4 2800 B15R1.913 CS(=O)(=O)CC(=O)N[C@H]1CC[C@@H](CC1)C 527a_100020625639_100000744497 [0,2,0,0,0,0|1,0,1]=4 2801 B15R1.913 CS(=O)(=O)CC(=O)N[C@H]1CC[C@H](CC1)O 240690a_100020628982_100000744497 [0,2,0,0,0,0|1,0,1]=4 2802 B15R1.8410 CC1CCC(C(C1)C)OCCS(=O)(=O)C 34a_100011539931_100000731031 [0,2,0,0,0,0|2,0,0]=4 2803 B15R1.8410 CC1CCC(C(C1)C)OCCS(=O)(=O)C 7a_100011539931_100000230027 [0,2,0,0,0,0|2,0,0]=4 2804 B15R1.8410 CC1CCC(C(C1)C)OCCS(=O)(=O)[O-] 34a_100011539931_100000762736 [0,2,0,0,0,0|1,0,1]=4 2805 B15R1.25183 CC1(CCC(CC1)NCCS(=O)(=O)C)C 2230a_100000757809_100000731031 [0,2,0,0,0,0|1,0,0]=3 2806 B15R1.25183 CC1(CCC(CC1)NCCS(=O)(=O)C)C 270004a_100000740961_100000061838 [0,2,0,0,0,0|1,0,0]=3 2807 B15R1.25183 CC1(CCC(CC1)NCCS(=O)(=O)C)C 34a_100000757809_100000731031 [0,2,0,0,0,0|1,0,0]=3 2808 B15R1.25183 CC1(CCC(CC1)NCCS(=O)(=O)C)O 270004a_100000740961_100012184276 [0,2,0,0,0,0|1,0,0]=3 2809 B15R1.25183 CC1(CCC(CC1)NCCS(=O)(=O)N)C 270004a_100000738205_100000061838 [0,2,0,0,0,0|1,0,0]=3 2810 B15R1.25183 CC1(CCC(CC1)NCCS(=O)(=O)N)O 270004a_100000738205_100012184276 [0,2,0,0,0,0|1,0,0]=3 2811 B15R1.25183 CC1(CCC(CC1)NCCS(=O)(=O)[O-])C 2230a_100000757809_100000737633 [0,2,0,0,0,0|0,0,1]=3 2812 B15R1.25183 CC1(CCC(CC1)NCCS(=O)(=O)[O-])C 34a_100000757809_100000762736 [0,2,0,0,0,0|0,0,1]=3 2813 B15R1.25183 CC1(CCC(CC1)OCCS(=O)(=O)C)C 34a_100000703974_100000731031 [0,2,0,0,0,0|2,0,0]=4 2814 B15R1.25183 CC1(CCC(CC1)OCCS(=O)(=O)C)C 7a_100000703974_100000230027 [0,2,0,0,0,0|2,0,0]=4 2815 B15R1.25183 CC1(CCC(CC1)OCCS(=O)(=O)[O-])C 34a_100000703974_100000762736 [0,2,0,0,0,0|1,0,1]=4 2816 B15R1.25183 CS(=O)(=O)CCNC1CCC(CC1)(F)F 2230a_100000694335_100000731031 [0,2,0,0,0,0|1,0,0]=3 2817 B15R1.25183 CS(=O)(=O)CCNC1CCC(CC1)(F)F 270004a_100000740961_100000052966 [0,2,0,0,0,0|1,0,0]=3 2818 B15R1.25183 CS(=O)(=O)CCNC1CCC(CC1)(F)F 34a_100000694335_100000731031 [0,2,0,0,0,0|1,0,0]=3 2819 B15R1.25183 CS(=O)(=O)CCNC1CCC(CC1)(F)F 34a_100000740961_100009865109 [0,2,0,0,0,0|1,0,0]=3 2820 B15R1.25183 CS(=O)(=O)CCNC1CCS(=O)(=O)CC1 2230a_100000739226_100000731031 [0,2,0,0,0,0|2,0,0]=4 2821 B15R1.25183 CS(=O)(=O)CCNC1CCS(=O)(=O)CC1 270004a_100000740961_100000015219 [0,2,0,0,0,0|2,0,0]=4 2822 B15R1.25183 CS(=O)(=O)CCNC1CCS(=O)(=O)CC1 34a_100000739226_100000731031 [0,2,0,0,0,0|2,0,0]=4 2823 B15R1.25183 CS(=O)(=O)CCN[C@H]1CC[C@](CC1)(C)O 2230a_202125554758_100000731031 [0,2,0,0,0,0|1,0,0]=3 2824 B15R1.25183 CS(=O)(=O)CCN[C@H]1CC[C@](CC1)(C)O 34a_202125554758_100000731031 [0,2,0,0,0,0|1,0,0]=3 2825 B15R1.25183 CS(=O)(=O)CCOC1CCC(CC1)(F)F 34a_100000098475_100000731031 [0,2,0,0,0,0|2,0,0]=4 2826 B15R1.25183 CS(=O)(=O)CCOC1CCC(CC1)(F)F 34a_100000211924_100009865109 [0,2,0,0,0,0|2,0,0]=4 2827 B15R1.25183 CS(=O)(=O)CCOC1CCC(CC1)(F)F 7a_100000098475_100000230027 [0,2,0,0,0,0|2,0,0]=4 2828 B15R1.25183 CS(=O)(=O)CCOC1CCC(CC1)(F)F 7a_100000211924_100009865109 [0,2,0,0,0,0|2,0,0]=4 2829 B15R1.25183 CS(=O)(=O)CCSC1CCC(CC1)(F)F 62a_100000731031_100009865109 [0,2,0,0,0,0|2,0,0]=4 2830 B15R1.25183 CS(=O)(=O)CCSC1CCC(CC1)(F)F 62a_100009865109_100000230027 [0,2,0,0,0,0|2,0,0]=4 2831 B15R1.25183 C[C@@]1(CC[C@@H](CC1)NCCS(=O)(=O)[O-])O 2230a_202125554758_100000737633 [0,2,0,0,0,0|0,0,1]=3 2832 B15R1.25183 C[C@@]1(CC[C@@H](CC1)NCCS(=O)(=O)[O-])O 34a_202125554758_100000762736 [0,2,0,0,0,0|0,0,1]=3 2833 B15R1.25183 C[N+]1(CCC(CC1)NCCS(=O)(=O)C)C 270004a_100000740961_100016991686 [0,2,0,0,0,0|2,0,0]=4 2834 B15R1.25183 C[N+]1(CCC(CC1)NCCS(=O)(=O)N)C 270004a_100000738205_100016991686 [0,2,0,0,0,0|2,0,0]=4 2835 B15R1.25183 NS(=O)(=O)CCNC1CCC(CC1)(F)F 270004a_100000738205_100000052966 [0,2,0,0,0,0|1,0,0]=3 2836 B15R1.25183 NS(=O)(=O)CCNC1CCC(CC1)(F)F 34a_100000738205_100009865109 [0,2,0,0,0,0|1,0,0]=3 2837 B15R1.25183 NS(=O)(=O)CCNC1CCS(=O)(=O)CC1 270004a_100000738205_100000015219 [0,2,0,0,0,0|2,0,0]=4 2838 B15R1.25183 NS(=O)(=O)CCOC1CCC(CC1)(F)F 34a_100012334274_100009865109 [0,2,0,0,0,0|2,0,0]=4 2839 B15R1.25183 O=S(=O)([O-])CCNC1CCC(CC1)(F)F 2230a_100000694335_100000737633 [0,2,0,0,0,0|0,0,1]=3 2840 B15R1.25183 O=S(=O)([O-])CCNC1CCC(CC1)(F)F 34a_100000694335_100000762736 [0,2,0,0,0,0|0,0,1]=3 2841 B15R1.25183 O=S(=O)([O-])CCNC1CCS(=O)(=O)CC1 2230a_100000739226_100000737633 [0,2,0,0,0,0|1,0,1]=4 2842 B15R1.25183 O=S(=O)([O-])CCNC1CCS(=O)(=O)CC1 34a_100000739226_100000762736 [0,2,0,0,0,0|1,0,1]=4 2843 B15R1.25183 O=S(=O)([O-])CCOC1CCC(CC1)(F)F 34a_100000098475_100000762736 [0,2,0,0,0,0|1,0,1]=4 2844 B15R1.25183 O=S(=O)([O-])CCSC1CCC(CC1)(F)F 62a_100000762736_100009865109 [0,2,0,0,0,0|1,0,1]=4 2845 B15R1.25183 O=S(=O)([O-])CCSC1CCC(CC1)(F)F 62a_100009865109_100000762736 [0,2,0,0,0,0|1,0,1]=4 2846 B15R1.61 CCC1CCCC(C1)NCCS(=O)(=O)C 270004a_100000740961_100000756783 [0,2,0,0,0,0|1,0,0]=3 2847 B15R1.61 CCC1CCCC(C1)NCCS(=O)(=O)N 270004a_100000738205_100000756783 [0,2,0,0,0,0|1,0,0]=3 2848 B15R1.61 CCC1CCCC(C1)OCCS(=O)(=O)C 7a_100011985506_100000230027 [0,2,0,0,0,0|2,0,0]=4 2849 B15R1.61 CCN1CCC[C@H](C1)NCCS(=O)(=O)C 2230a_100025775482_100000731031 [0,2,0,0,0,0|2,0,0]=4 2850 B15R1.61 CCN1CCC[C@H](C1)NCCS(=O)(=O)[O-] 2230a_100025775482_100000737633 [0,2,0,0,0,0|1,0,1]=4 2851 B15R1.61 CS(=O)(=O)CCNC1CCCC(C1)C#N 270004a_100000740961_100000747296 [0,2,0,0,0,0|1,0,0]=3 2852 B15R1.61 CS(=O)(=O)CCOC1CCCC(C1)CN 34a_100011254705_100000731031 [0,2,0,0,0,0|2,0,0]=4 2853 B15R1.61 CSC1CCCC(C1)NCCS(=O)(=O)C 270004a_100000740961_100012138059 [0,2,0,0,0,0|1,0,0]=3 2854 B15R1.61 CSC1CCCC(C1)NCCS(=O)(=O)N 270004a_100000738205_100012138059 [0,2,0,0,0,0|1,0,0]=3 2855 B15R1.61 N#CC1CCCC(C1)NCCS(=O)(=O)N 270004a_100000738205_100000747296 [0,2,0,0,0,0|1,0,0]=3 2856 B15R1.61 NCC1CCCC(C1)OCCS(=O)(=O)[O-] 34a_100011254705_100000762736 [0,2,0,0,0,0|1,0,1]=4 2857 B15R1.122 CC1CCCC(C1C)NCCS(=O)(=O)C 2230a_100000211273_100000731031 [0,2,0,0,0,0|1,0,0]=3 2858 B15R1.122 CC1CCCC(C1C)NCCS(=O)(=O)C 34a_100000211273_100000731031 [0,2,0,0,0,0|1,0,0]=3 2859 B15R1.122 CC1CCCC(C1C)NCCS(=O)(=O)[O-] 2230a_100000211273_100000737633 [0,2,0,0,0,0|0,0,1]=3 2860 B15R1.122 CC1CCCC(C1C)NCCS(=O)(=O)[O-] 34a_100000211273_100000762736 [0,2,0,0,0,0|0,0,1]=3 2861 B15R1.122 CC1CCCC(C1C)OCCS(=O)(=O)C 34a_100011217532_100000731031 [0,2,0,0,0,0|2,0,0]=4 2862 B15R1.122 CC1CCCC(C1C)OCCS(=O)(=O)C 7a_100011217532_100000230027 [0,2,0,0,0,0|2,0,0]=4 2863 B15R1.122 CC1CCCC(C1C)OCCS(=O)(=O)[O-] 34a_100011217532_100000762736 [0,2,0,0,0,0|1,0,1]=4 2864 B15R1.301 CCS(=O)(=O)CCNC1CCCC(C1)C 2230a_100011194320_100000756660 [0,2,0,0,0,0|1,0,0]=3 2865 B15R1.301 CCS(=O)(=O)CCNC1CCCC(C1)C 270004a_100000751051_100000183594 [0,2,0,0,0,0|1,0,0]=3 2866 B15R1.301 CCS(=O)(=O)CCNC1CCCC(C1)C 34a_100011194320_100000756660 [0,2,0,0,0,0|1,0,0]=3 2867 B15R1.301 CCS(=O)(=O)CCNC1CCCC(C1)O 2230a_100015190357_100000756660 [0,2,0,0,0,0|1,0,0]=3 2868 B15R1.301 CCS(=O)(=O)CCNC1CCCC(C1)O 270004a_100000751051_100012613340 [0,2,0,0,0,0|1,0,0]=3 2869 B15R1.301 CCS(=O)(=O)CCNC1CCN[C@@H](C1)C 270004a_100000751051_100016994030 [0,2,0,0,0,0|2,0,0]=4 2870 B15R1.301 CCS(=O)(=O)CCNC1CCOC(C1)C 270004a_100000751051_100000755752 [0,2,0,0,0,0|2,0,0]=4 2871 B15R1.301 CCS(=O)(=O)CCOC1CCCC(C1)C 34a_100000211399_100000756660 [0,2,0,0,0,0|2,0,0]=4 2872 B15R1.301 CNS(=O)(=O)CCNC1CCCC(C1)C 270004a_100000710037_100000183594 [0,2,0,0,0,0|1,0,0]=3 2873 B15R1.301 CNS(=O)(=O)CCNC1CCCC(C1)O 270004a_100000710037_100012613340 [0,2,0,0,0,0|1,0,0]=3 2874 B15R1.301 CNS(=O)(=O)CCNC1CCN[C@@H](C1)C 270004a_100000710037_100016994030 [0,2,0,0,0,0|2,0,0]=4 2875 B15R1.301 CNS(=O)(=O)CCNC1CCOC(C1)C 270004a_100000710037_100000755752 [0,2,0,0,0,0|2,0,0]=4 2876 B15R1.5449 CC1CC(CC(C1)NCCS(=O)(=O)C)C 270004a_100000740961_100000753413 [0,2,0,0,0,0|1,0,0]=3 2877 B15R1.5449 CC1CC(CC(C1)NCCS(=O)(=O)N)C 270004a_100000738205_100000753413 [0,2,0,0,0,0|1,0,0]=3 2878 B15R1.5449 CC1CC(CC(O1)C)NCCS(=O)(=O)C 270004a_100000740961_200102525066 [0,2,0,0,0,0|2,0,0]=4 2879 B15R1.5449 CC1CC(CC(O1)C)NCCS(=O)(=O)N 270004a_100000738205_200102525066 [0,2,0,0,0,0|2,0,0]=4 2880 B15R1.8277 CC1CC(CCO1)N(C)CCS(=O)(=O)C 270004a_100000750128_100000755752 [0,2,0,0,0,0|2,0,0]=4 2881 B15R1.8277 CC1CCCC(C1)C(=O)CCS(=O)(=O)C 1458a_100011215569_100000731031 [0,2,0,0,0,0|2,0,0]=4 2882 B15R1.8277 CC1CCCC(C1)C(=O)CCS(=O)(=O)[O-] 1458a_100011215569_100000762736 [0,2,0,0,0,0|1,0,1]=4 2883 B15R1.8277 CC1CCCC(C1)N(C)CCS(=O)(=O)C 270004a_100000750128_100000183594 [0,2,0,0,0,0|1,0,0]=3 2884 B15R1.8277 CN(CCS(=O)(=O)C)C1CCCC(C1)O 270004a_100000750128_100012613340 [0,2,0,0,0,0|1,0,0]=3 2885 B15R1.8277 CS(=O)(=O)CCC(=O)C1CCCC(C1)O 1458a_100000707227_100000731031 [0,2,0,0,0,0|2,0,0]=4 2886 B15R1.8277 C[C@@H]1CC(CCN1)N(C)CCS(=O)(=O)C 270004a_100000750128_100016994030 [0,2,0,0,0,0|2,0,0]=4 2887 B15R1.8277 O=C(CCS(=O)(=O)[O-])C1CCCC(C1)O 1458a_100000707227_100000762736 [0,2,0,0,0,0|1,0,1]=4 2888 B15R1.8303 CC1CCCC(C1)NC(=O)CS(=O)(=O)C 11a_100011194320_100000744497 [0,2,0,0,0,0|1,0,1]=4 2889 B15R1.8303 CC1CCCC(C1)NC(=O)CS(=O)(=O)C 240690a_100011194320_100000744497 [0,2,0,0,0,0|1,0,1]=4 2890 B15R1.8303 CC1CCCC(C1)NC(=O)CS(=O)(=O)C 527a_100011194320_100000744497 [0,2,0,0,0,0|1,0,1]=4 2891 B15R1.8303 CS(=O)(=O)CC(=O)NC1CCCC(C1)O 240690a_100015190357_100000744497 [0,2,0,0,0,0|1,0,1]=4 2892 B15R1.8449 CC1CCC(C(C1)NCCS(=O)(=O)C)C 269862a_100000740961_100000034887 [0,2,0,0,0,0|1,0,0]=3 2893 B15R1.8449 CC1CCC(C(C1)NCCS(=O)(=O)C)C 270004a_100000740961_100000034887 [0,2,0,0,0,0|1,0,0]=3 2894 B15R1.8449 CC1CCC(C(C1)NCCS(=O)(=O)N)C 269862a_100000738205_100000034887 [0,2,0,0,0,0|1,0,0]=3 2895 B15R1.8449 CC1CCC(C(C1)NCCS(=O)(=O)N)C 270004a_100000738205_100000034887 [0,2,0,0,0,0|1,0,0]=3 2896 B15R1.8449 CC1CCC(C(C1)OCCS(=O)(=O)C)C 34a_100011217446_100000731031 [0,2,0,0,0,0|2,0,0]=4 2897 B15R1.8449 CC1CCC(C(C1)OCCS(=O)(=O)C)C 7a_100011217446_100000230027 [0,2,0,0,0,0|2,0,0]=4 2898 B15R1.8449 CC1CCC(C(C1)OCCS(=O)(=O)[O-])C 34a_100011217446_100000762736 [0,2,0,0,0,0|1,0,1]=4 2899 B15R1.25799 CC1(CC(CCN1)NCCS(=O)(=O)C)C 270004a_100000740961_100015191244 [0,2,0,0,0,0|2,0,0]=4 2900 B15R1.25799 CC1(CC(CCN1)NCCS(=O)(=O)N)C 270004a_100000738205_100015191244 [0,2,0,0,0,0|2,0,0]=4 2901 B15R1.25799 CC1(CC(CCO1)NCCS(=O)(=O)C)C 2230a_100000696200_100000731031 [0,2,0,0,0,0|2,0,0]=4 2902 B15R1.25799 CC1(CC(CCO1)NCCS(=O)(=O)C)C 270004a_100000740961_100000755756 [0,2,0,0,0,0|2,0,0]=4 2903 B15R1.25799 CC1(CC(CCO1)NCCS(=O)(=O)C)C 34a_100000740961_100010191092 [0,2,0,0,0,0|2,0,0]=4 2904 B15R1.25799 CC1(CC(CCO1)NCCS(=O)(=O)N)C 270004a_100000738205_100000755756 [0,2,0,0,0,0|2,0,0]=4 2905 B15R1.25799 CC1(CC(CCO1)NCCS(=O)(=O)N)C 34a_100000738205_100010191092 [0,2,0,0,0,0|2,0,0]=4 2906 B15R1.25799 CC1(CC(CCO1)NCCS(=O)(=O)[O-])C 2230a_100000696200_100000737633 [0,2,0,0,0,0|1,0,1]=4 2907 B15R1.25799 CC1(CCCC(C1)NCCS(=O)(=O)C)C 270004a_100000740961_100000031663 [0,2,0,0,0,0|1,0,0]=3 2908 B15R1.25799 CC1(CCCC(C1)NCCS(=O)(=O)N)C 270004a_100000738205_100000031663 [0,2,0,0,0,0|1,0,0]=3 2909 B15R1.25799 CC1(CCCC(C1)OCCS(=O)(=O)C)C 7a_100011995757_100000230027 [0,2,0,0,0,0|2,0,0]=4 2910 B15R1.3531 CCC1CCCCC1NCCS(=O)(=O)C 269862a_100000740961_100000757040 [0,2,0,0,0,0|1,0,0]=3 2911 B15R1.3531 CCC1CCCCC1NCCS(=O)(=O)C 270004a_100000740961_100000757040 [0,2,0,0,0,0|1,0,0]=3 2912 B15R1.3531 CCC1CCCCC1NCCS(=O)(=O)N 269862a_100000738205_100000757040 [0,2,0,0,0,0|1,0,0]=3 2913 B15R1.3531 CCC1CCCCC1NCCS(=O)(=O)N 270004a_100000738205_100000757040 [0,2,0,0,0,0|1,0,0]=3 2914 B15R1.3531 CCC1CCCCC1OCCS(=O)(=O)C 34a_100000210738_100000731031 [0,2,0,0,0,0|2,0,0]=4 2915 B15R1.3531 CCC1CCCCC1OCCS(=O)(=O)C 7a_100000210738_100000230027 [0,2,0,0,0,0|2,0,0]=4 2916 B15R1.3531 CCC1CCCCC1OCCS(=O)(=O)[O-] 34a_100000210738_100000762736 [0,2,0,0,0,0|1,0,1]=4 2917 B15R1.3531 CN[C@@H]1CCCC[C@H]1OCCS(=O)(=O)C 34a_100000708425_100000731031 [0,2,0,0,0,0|2,0,0]=4 2918 B15R1.3531 CN[C@@H]1CCCC[C@H]1OCCS(=O)(=O)[O-] 34a_100000708425_100000762736 [0,2,0,0,0,0|1,0,1]=4 2919 B15R1.3531 COC1CCCCC1NCCS(=O)(=O)C 270004a_100000740961_100000740605 [0,2,0,0,0,0|1,0,0]=3 2920 B15R1.3531 COC1CCCCC1NCCS(=O)(=O)C 34a_100011208099_100000731031 [0,2,0,0,0,0|1,0,0]=3 2921 B15R1.3531 COC1CCCCC1NCCS(=O)(=O)N 270004a_100000738205_100000740605 [0,2,0,0,0,0|1,0,0]=3 2922 B15R1.3531 COC1CCCCC1NCCS(=O)(=O)[O-] 34a_100011208099_100000762736 [0,2,0,0,0,0|0,0,1]=3 2923 B15R1.3531 COC1COCCC1NCCS(=O)(=O)C 270004a_100000740961_100000095984 [0,2,0,0,0,0|2,0,0]=4 2924 B15R1.3531 COC1COCCC1NCCS(=O)(=O)N 270004a_100000738205_100000095984 [0,2,0,0,0,0|2,0,0]=4 2925 B15R1.3531 CO[C@H]1CCCC[C@@H]1OCCS(=O)(=O)C 34a_200009815850_100000731031 [0,2,0,0,0,0|2,0,0]=4 2926 B15R1.3531 CO[C@H]1CCCC[C@@H]1OCCS(=O)(=O)C 7a_200009815850_100000230027 [0,2,0,0,0,0|2,0,0]=4 2927 B15R1.3531 CO[C@H]1CCCC[C@@H]1OCCS(=O)(=O)[O-] 34a_200009815850_100000762736 [0,2,0,0,0,0|1,0,1]=4 2928 B15R1.3531 CS(=O)(=O)CCNC1CCCCC1CO 270004a_100000740961_100009861125 [0,2,0,0,0,0|1,0,0]=3 2929 B15R1.3531 CS(=O)(=O)CCNC1CCOCC1CO 2230a_214813039666_100000731031 [0,2,0,0,0,0|2,0,0]=4 2930 B15R1.3531 CS(=O)(=O)CCNC1CCOCC1CO 34a_214813039666_100000731031 [0,2,0,0,0,0|2,0,0]=4 2931 B15R1.3531 CS(=O)(=O)CCOC1CCCCC1CN 34a_100011216029_100000731031 [0,2,0,0,0,0|2,0,0]=4 2932 B15R1.3531 NCC1CCCCC1OCCS(=O)(=O)[O-] 34a_100011216029_100000762736 [0,2,0,0,0,0|1,0,1]=4 2933 B15R1.3531 NS(=O)(=O)CCNC1CCCCC1CO 270004a_100000738205_100009861125 [0,2,0,0,0,0|1,0,0]=3 2934 B15R1.3531 O=S(=O)([O-])CCNC1CCOCC1CO 2230a_214813039666_100000737633 [0,2,0,0,0,0|1,0,1]=4 2935 B15R1.3531 O=S(=O)([O-])CCNC1CCOCC1CO 34a_214813039666_100000762736 [0,2,0,0,0,0|1,0,1]=4 2936 B15R1.5802 CC1CCCCC1NC(=O)CS(=O)(=O)C 11a_100000211402_100000744497 [0,2,0,0,0,0|1,0,1]=4 2937 B15R1.5802 CC1CCCCC1NC(=O)CS(=O)(=O)C 240690a_100000211402_100000744497 [0,2,0,0,0,0|1,0,1]=4 2938 B15R1.5802 CC1CCCCC1NC(=O)CS(=O)(=O)C 527a_100000211402_100000744497 [0,2,0,0,0,0|1,0,1]=4 2939 B15R1.5802 CS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100000744497 [0,2,0,0,0,0|1,0,1]=4 2940 B15R1.5802 CS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100000744497 [0,2,0,0,0,0|1,0,1]=4 2941 B15R1.5802 CS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1F 11a_100015195156_100000744497 [0,2,0,0,0,0|1,0,1]=4 2942 B15R1.5802 CS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100000744497 [0,2,0,0,0,0|1,0,1]=4 2943 B15R1.5802 CS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1F 527a_100015195156_100000744497 [0,2,0,0,0,0|1,0,1]=4 2944 B15R1.6638 O=S(=O)([O-])C(O)CSC1CCCCC1F 62a_100015423560_200000035551 [0,2,0,0,0,0|1,0,1]=4 2945 B15R1.6638 O=S(=O)([O-])C(O)CSC1CCCCC1F 62a_200000035551_100015423560 [0,2,0,0,0,0|1,0,1]=4 2946 B15R1.6638 O=S(=O)([O-])C(O)CSC1CCCCC1O 62a_100000038908_200000035551 [0,2,0,0,0,0|1,0,1]=4 2947 B15R1.6638 O=S(=O)([O-])C(O)CSC1CCCCC1O 62a_200000035551_100000038908 [0,2,0,0,0,0|1,0,1]=4 2948 B15R1.7696 CCS(=O)(=O)CCNC1CCCCC1=O 34a_100000751051_100000754470 [0,2,0,0,0,0|1,0,1]=4 2949 B15R1.7696 CCS(=O)(=O)CCNC1CCCCC1C 2230a_100000211402_100000756660 [0,2,0,0,0,0|1,0,0]=3 2950 B15R1.7696 CCS(=O)(=O)CCNC1CCCCC1C 269862a_100000751051_100000210921 [0,2,0,0,0,0|1,0,0]=3 2951 B15R1.7696 CCS(=O)(=O)CCNC1CCCCC1C 270004a_100000751051_100000210921 [0,2,0,0,0,0|1,0,0]=3 2952 B15R1.7696 CCS(=O)(=O)CCNC1CCCCC1C 34a_100000211402_100000756660 [0,2,0,0,0,0|1,0,0]=3 2953 B15R1.7696 CCS(=O)(=O)CCNC1CCCCC1F 34a_100000751051_100015423560 [0,2,0,0,0,0|1,0,0]=3 2954 B15R1.7696 CCS(=O)(=O)CCNC1CCCCC1O 34a_100000751051_100000038908 [0,2,0,0,0,0|1,0,0]=3 2955 B15R1.7696 CCS(=O)(=O)CCNC1CCNCC1C 270004a_100000751051_100000703950 [0,2,0,0,0,0|2,0,0]=4 2956 B15R1.7696 CCS(=O)(=O)CCNC1CCOCC1C 270004a_100000751051_100000755695 [0,2,0,0,0,0|2,0,0]=4 2957 B15R1.7696 CCS(=O)(=O)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000756660 [0,2,0,0,0,0|1,0,0]=3 2958 B15R1.7696 CCS(=O)(=O)CCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000756660 [0,2,0,0,0,0|1,0,0]=3 2959 B15R1.7696 CCS(=O)(=O)CCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000756660 [0,2,0,0,0,0|2,0,0]=4 2960 B15R1.7696 CCS(=O)(=O)CCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000756660 [0,2,0,0,0,0|2,0,0]=4 2961 B15R1.7696 CCS(=O)(=O)CCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000756660 [0,2,0,0,0,0|2,0,0]=4 2962 B15R1.7696 CCS(=O)(=O)CCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000756660 [0,2,0,0,0,0|2,0,0]=4 2963 B15R1.7696 CCS(=O)(=O)CCOC1CCCCC1C 34a_100000211207_100000756660 [0,2,0,0,0,0|2,0,0]=4 2964 B15R1.7696 CCS(=O)(=O)CCOC1CCCCC1C 7a_100000211207_100000756660 [0,2,0,0,0,0|2,0,0]=4 2965 B15R1.7696 CCS(=O)(=O)CCOC1CCCCC1Cl 34a_100000038908_100000756660 [0,2,0,0,0,0|2,0,0]=4 2966 B15R1.7696 CCS(=O)(=O)CCOC1CCCCC1Cl 7a_100000038908_100000756660 [0,2,0,0,0,0|2,0,0]=4 2967 B15R1.7696 CCS(=O)(=O)CCOC1CCCCC1F 34a_200011216379_100015423560 [0,2,0,0,0,0|2,0,0]=4 2968 B15R1.7696 CCS(=O)(=O)CCOC1CCCCC1O 34a_200011216379_100000038908 [0,2,0,0,0,0|2,0,0]=4 2969 B15R1.7696 CCS(=O)(=O)CCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000756660 [0,2,0,0,0,0|2,0,0]=4 2970 B15R1.7696 CCS(=O)(=O)CCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000756660 [0,2,0,0,0,0|2,0,0]=4 2971 B15R1.7696 CCS(=O)(=O)CCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000756660 [0,2,0,0,0,0|2,0,0]=4 2972 B15R1.7696 CCS(=O)(=O)CCSC1CCCCC1F 62a_100000756660_100015423560 [0,2,0,0,0,0|2,0,0]=4 2973 B15R1.7696 CCS(=O)(=O)CCSC1CCCCC1F 62a_100015423560_100000756660 [0,2,0,0,0,0|2,0,0]=4 2974 B15R1.7696 CCS(=O)(=O)CCSC1CCCCC1O 62a_100000038908_100000756660 [0,2,0,0,0,0|2,0,0]=4 2975 B15R1.7696 CCS(=O)(=O)CCSC1CCCCC1O 62a_100000756660_100000038908 [0,2,0,0,0,0|2,0,0]=4 2976 B15R1.7696 CNS(=O)(=O)CCNC1CCCCC1=O 34a_100000710037_100000754470 [0,2,0,0,0,0|1,0,1]=4 2977 B15R1.7696 CNS(=O)(=O)CCNC1CCCCC1C 269862a_100000710037_100000210921 [0,2,0,0,0,0|1,0,0]=3 2978 B15R1.7696 CNS(=O)(=O)CCNC1CCCCC1C 270004a_100000710037_100000210921 [0,2,0,0,0,0|1,0,0]=3 2979 B15R1.7696 CNS(=O)(=O)CCNC1CCCCC1F 34a_100000710037_100015423560 [0,2,0,0,0,0|1,0,0]=3 2980 B15R1.7696 CNS(=O)(=O)CCNC1CCCCC1O 34a_100000710037_100000038908 [0,2,0,0,0,0|1,0,0]=3 2981 B15R1.7696 CNS(=O)(=O)CCNC1CCNCC1C 270004a_100000710037_100000703950 [0,2,0,0,0,0|2,0,0]=4 2982 B15R1.7696 CNS(=O)(=O)CCNC1CCOCC1C 270004a_100000710037_100000755695 [0,2,0,0,0,0|2,0,0]=4 2983 B15R1.8018 CC1CCCCC1C(=O)CCS(=O)(=O)C 1458a_100011215568_100000731031 [0,2,0,0,0,0|2,0,0]=4 2984 B15R1.8018 CC1CCCCC1C(=O)CCS(=O)(=O)[O-] 1458a_100011215568_100000762736 [0,2,0,0,0,0|1,0,1]=4 2985 B15R1.8018 CC1CCCCC1N(C)CCS(=O)(=O)C 270004a_100000750128_100000210921 [0,2,0,0,0,0|1,0,0]=3 2986 B15R1.8018 CC1CNCCC1N(C)CCS(=O)(=O)C 270004a_100000750128_100000703950 [0,2,0,0,0,0|2,0,0]=4 2987 B15R1.8018 CC1COCCC1N(C)CCS(=O)(=O)C 270004a_100000750128_100000755695 [0,2,0,0,0,0|2,0,0]=4 2988 B15R1.8018 CN(CCS(=O)(=O)C)C1CCCCC1=O 269982a_100000750128_100000204591 [0,2,0,0,0,0|1,0,1]=4 2989 B15R1.8018 CN(CCS(=O)(=O)C)C1CCCCC1=O 34a_100000750128_100000754470 [0,2,0,0,0,0|1,0,1]=4 2990 B15R1.8018 CN(CCS(=O)(=O)C)C1CCCCC1F 269982a_100000750128_100015423560 [0,2,0,0,0,0|1,0,0]=3 2991 B15R1.8018 CN(CCS(=O)(=O)C)C1CCCCC1F 34a_100000750128_100015423560 [0,2,0,0,0,0|1,0,0]=3 2992 B15R1.8018 CN(CCS(=O)(=O)C)C1CCCCC1O 269982a_100000750128_100000038908 [0,2,0,0,0,0|1,0,0]=3 2993 B15R1.8018 CN(CCS(=O)(=O)C)C1CCCCC1O 34a_100000750128_100000038908 [0,2,0,0,0,0|1,0,0]=3 2994 B15R1.8018 CN(CCS(=O)(=O)C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000731031 [0,2,0,0,0,0|1,0,0]=3 2995 B15R1.8018 CS(=O)(=O)CCC(=O)C1CCCCC1O 1458a_100011803323_100000731031 [0,2,0,0,0,0|2,0,0]=4 2996 B15R1.8018 O=C(CCS(=O)(=O)[O-])C1CCCCC1O 1458a_100011803323_100000762736 [0,2,0,0,0,0|1,0,1]=4 2997 B15R1.8291 CC1CCCC(C1NCCS(=O)(=O)C)C 269862a_100000740961_100000211995 [0,2,0,0,0,0|1,0,0]=3 2998 B15R1.8291 CC1CCCC(C1NCCS(=O)(=O)N)C 269862a_100000738205_100000211995 [0,2,0,0,0,0|1,0,0]=3 2999 B15R1.8291 CC1CCCC(C1OCCS(=O)(=O)C)C 34a_100011218088_100000731031 [0,2,0,0,0,0|2,0,0]=4 3000 B15R1.8291 CC1CCCC(C1OCCS(=O)(=O)C)C 7a_100011218088_100000230027 [0,2,0,0,0,0|2,0,0]=4 3001 B15R1.8291 CC1CCCC(C1OCCS(=O)(=O)[O-])C 34a_100011218088_100000762736 [0,2,0,0,0,0|1,0,1]=4 3002 B15R1.25837 CC1(CCCCC1NCCS(=O)(=O)C)C 269862a_100000740961_100000031690 [0,2,0,0,0,0|1,0,0]=3 3003 B15R1.25837 CC1(CCCCC1NCCS(=O)(=O)N)C 269862a_100000738205_100000031690 [0,2,0,0,0,0|1,0,0]=3 3004 B15R1.25837 CC1(CNCCC1NCCS(=O)(=O)C)C 269862a_100000740961_100015191249 [0,2,0,0,0,0|2,0,0]=4 3005 B15R1.25837 CC1(CNCCC1NCCS(=O)(=O)N)C 269862a_100000738205_100015191249 [0,2,0,0,0,0|2,0,0]=4 3006 B15R1.25837 CS(=O)(=O)CCNC1CCCCC1(F)F 2230a_100000686509_100000731031 [0,2,0,0,0,0|1,0,0]=3 3007 B15R1.25837 CS(=O)(=O)CCNC1CCCCC1(F)F 34a_100000686509_100000731031 [0,2,0,0,0,0|1,0,0]=3 3008 B15R1.25837 CS(=O)(=O)CCNC1CCCCC1(F)F 34a_100000740961_200009832135 [0,2,0,0,0,0|1,0,0]=3 3009 B15R1.25837 CS(=O)(=O)CCOC1CCCCC1(F)F 34a_100000211924_200009832135 [0,2,0,0,0,0|2,0,0]=4 3010 B15R1.25837 CS(=O)(=O)CCSC1CCCCC1(F)F 62a_100000731031_200009832135 [0,2,0,0,0,0|2,0,0]=4 3011 B15R1.25837 CS(=O)(=O)CCSC1CCCCC1(F)F 62a_200009832135_100000230027 [0,2,0,0,0,0|2,0,0]=4 3012 B15R1.25837 NS(=O)(=O)CCNC1CCCCC1(F)F 34a_100000738205_200009832135 [0,2,0,0,0,0|1,0,0]=3 3013 B15R1.25837 NS(=O)(=O)CCOC1CCCCC1(F)F 34a_100012334274_200009832135 [0,2,0,0,0,0|2,0,0]=4 3014 B15R1.25837 O=S(=O)([O-])CCNC1CCCCC1(F)F 2230a_100000686509_100000737633 [0,2,0,0,0,0|0,0,1]=3 3015 B15R1.25837 O=S(=O)([O-])CCNC1CCCCC1(F)F 34a_100000686509_100000762736 [0,2,0,0,0,0|0,0,1]=3 3016 B15R1.25837 O=S(=O)([O-])CCSC1CCCCC1(F)F 62a_100000762736_200009832135 [0,2,0,0,0,0|1,0,1]=4 3017 B15R1.25837 O=S(=O)([O-])CCSC1CCCCC1(F)F 62a_200009832135_100000762736 [0,2,0,0,0,0|1,0,1]=4 3018 B15R1.311 CCS(=O)(=O)CCC(=O)C1CCCCC1 1458a_100000210647_100000756660 [0,2,0,0,0,0|2,0,0]=4 3019 B15R1.311 CCS(=O)(=O)CCN(C)C1CCCCC1 2230a_100000207522_100000756660 [0,2,0,0,0,0|1,0,0]=3 3020 B15R1.311 CCS(=O)(=O)CCN(C)C1CCCCC1 269982a_100000207522_100000756660 [0,2,0,0,0,0|1,0,0]=3 3021 B15R1.311 CCS(=O)(=O)CCN(C)C1CCCCC1 269982a_100000694288_100000210327 [0,2,0,0,0,0|1,0,0]=3 3022 B15R1.311 CCS(=O)(=O)CCN(C)C1CCCCC1 270004a_100000694288_100000210434 [0,2,0,0,0,0|1,0,0]=3 3023 B15R1.311 CCS(=O)(=O)CCN(C)C1CCCCC1 34a_100000207522_100000756660 [0,2,0,0,0,0|1,0,0]=3 3024 B15R1.311 CCS(=O)(=O)CCN(C)C1CCCCC1 34a_100000694288_100000210327 [0,2,0,0,0,0|1,0,0]=3 3025 B15R1.311 CCS(=O)(=O)CCN(C)C1CCCOC1 269982a_100000694288_100000693364 [0,2,0,0,0,0|2,0,0]=4 3026 B15R1.311 CCS(=O)(=O)CCN(C)C1CCCOC1 270004a_100000694288_100000753404 [0,2,0,0,0,0|2,0,0]=4 3027 B15R1.311 CCS(=O)(=O)CCN(C)C1CCCOC1 34a_100000694288_100000693364 [0,2,0,0,0,0|2,0,0]=4 3028 B15R1.311 CCS(=O)(=O)CCN(C)C1CCCSC1 270004a_100000694288_100000057913 [0,2,0,0,0,0|2,0,0]=4 3029 B15R1.311 CCS(=O)(=O)CCN(C)C1CCNCC1 270004a_100000694288_100015192401 [0,2,0,0,0,0|2,0,0]=4 3030 B15R1.311 CCS(=O)(=O)CCN(C)C1CCOCC1 2230a_100020587155_100000756660 [0,2,0,0,0,0|2,0,0]=4 3031 B15R1.311 CCS(=O)(=O)CCN(C)C1CCOCC1 269982a_100000694288_100011324220 [0,2,0,0,0,0|2,0,0]=4 3032 B15R1.311 CCS(=O)(=O)CCN(C)C1CCOCC1 269982a_100020587155_100000756660 [0,2,0,0,0,0|2,0,0]=4 3033 B15R1.311 CCS(=O)(=O)CCN(C)C1CCOCC1 270004a_100000694288_100011217826 [0,2,0,0,0,0|2,0,0]=4 3034 B15R1.311 CCS(=O)(=O)CCN(C)C1CCOCC1 34a_100020587155_100000756660 [0,2,0,0,0,0|2,0,0]=4 3035 B15R1.311 CCS(=O)(=O)CCN(C)C1CCSCC1 2230a_100015184757_100000756660 [0,2,0,0,0,0|2,0,0]=4 3036 B15R1.311 CCS(=O)(=O)CCN(C)C1CCSCC1 269982a_100000694288_100000069128 [0,2,0,0,0,0|2,0,0]=4 3037 B15R1.311 CCS(=O)(=O)CCN(C)C1CCSCC1 269982a_100015184757_100000756660 [0,2,0,0,0,0|2,0,0]=4 3038 B15R1.311 CCS(=O)(=O)CCN(C)C1CCSCC1 270004a_100000694288_100000203788 [0,2,0,0,0,0|2,0,0]=4 3039 B15R1.311 CCS(=O)(=O)CCN(C)C1CCSCC1 34a_100000694288_100000069128 [0,2,0,0,0,0|2,0,0]=4 3040 B15R1.311 CCS(=O)(=O)CCN(C)C1CCSCC1 34a_100015184757_100000756660 [0,2,0,0,0,0|2,0,0]=4 3041 B15R1.339 CCS(=O)(=O)CC(=O)NC1CCCCC1 11a_100000182618_100000744335 [0,2,0,0,0,0|1,0,1]=4 3042 B15R1.339 CCS(=O)(=O)CC(=O)NC1CCCCC1 1626a_100000182618_100000744335 [0,2,0,0,0,0|1,0,1]=4 3043 B15R1.339 CCS(=O)(=O)CC(=O)NC1CCCCC1 240690a_100000182618_100000744335 [0,2,0,0,0,0|1,0,1]=4 3044 B15R1.339 CCS(=O)(=O)CC(=O)NC1CCCCC1 527a_100000182618_100000744335 [0,2,0,0,0,0|1,0,1]=4 3045 B15R1.9012 CC(C)S(=O)(=O)CCNC1CCCCC1 270004a_100000732177_100000210434 [0,2,0,0,0,0|1,0,0]=3 3046 B15R1.9012 CC(C)S(=O)(=O)CCNC1CCCCC1 34a_100000732177_100000210327 [0,2,0,0,0,0|1,0,0]=3 3047 B15R1.9012 CC(C)S(=O)(=O)CCNC1CCCOC1 270004a_100000732177_100000753404 [0,2,0,0,0,0|2,0,0]=4 3048 B15R1.9012 CC(C)S(=O)(=O)CCNC1CCCOC1 34a_100000732177_100000693364 [0,2,0,0,0,0|2,0,0]=4 3049 B15R1.9012 CC(C)S(=O)(=O)CCNC1CCCSC1 270004a_100000732177_100000057913 [0,2,0,0,0,0|2,0,0]=4 3050 B15R1.9012 CC(C)S(=O)(=O)CCNC1CCNCC1 270004a_100000732177_100015192401 [0,2,0,0,0,0|2,0,0]=4 3051 B15R1.9012 CC(C)S(=O)(=O)CCNC1CCOCC1 270004a_100000732177_100011217826 [0,2,0,0,0,0|2,0,0]=4 3052 B15R1.9012 CC(C)S(=O)(=O)CCNC1CCSCC1 270004a_100000732177_100000203788 [0,2,0,0,0,0|2,0,0]=4 3053 B15R1.9012 CC(C)S(=O)(=O)CCNC1CCSCC1 34a_100000732177_100000069128 [0,2,0,0,0,0|2,0,0]=4 3054 B15R1.9012 CN(C)S(=O)(=O)CCNC1CCCCC1 270004a_100000733455_100000210434 [0,2,0,0,0,0|1,0,0]=3 3055 B15R1.9012 CN(C)S(=O)(=O)CCNC1CCCCC1 34a_100000733455_100000210327 [0,2,0,0,0,0|1,0,0]=3 3056 B15R1.9012 CN(C)S(=O)(=O)CCNC1CCCOC1 270004a_100000733455_100000753404 [0,2,0,0,0,0|2,0,0]=4 3057 B15R1.9012 CN(C)S(=O)(=O)CCNC1CCCOC1 34a_100000733455_100000693364 [0,2,0,0,0,0|2,0,0]=4 3058 B15R1.9012 CN(C)S(=O)(=O)CCNC1CCCSC1 270004a_100000733455_100000057913 [0,2,0,0,0,0|2,0,0]=4 3059 B15R1.9012 CN(C)S(=O)(=O)CCNC1CCNCC1 270004a_100000733455_100015192401 [0,2,0,0,0,0|2,0,0]=4 3060 B15R1.9012 CN(C)S(=O)(=O)CCNC1CCOCC1 270004a_100000733455_100011217826 [0,2,0,0,0,0|2,0,0]=4 3061 B15R1.9012 CN(C)S(=O)(=O)CCNC1CCSCC1 270004a_100000733455_100000203788 [0,2,0,0,0,0|2,0,0]=4 3062 B15R1.9012 CN(C)S(=O)(=O)CCNC1CCSCC1 34a_100000733455_100000069128 [0,2,0,0,0,0|2,0,0]=4 3063 B15R1.28172 CCS(=O)(=O)CCNC1(CCCCC1)C 2230a_100000741114_100000756660 [0,2,0,0,0,0|1,0,0]=3 3064 B15R1.28172 CCS(=O)(=O)CCNC1(CCCCC1)C 34a_100000741114_100000756660 [0,2,0,0,0,0|1,0,0]=3 3065 B15R1.28172 CCS(=O)(=O)CCNC1(CCOCC1)C 2230a_100000692449_100000756660 [0,2,0,0,0,0|2,0,0]=4 3066 B15R1.28172 CCS(=O)(=O)CCNC1(CCOCC1)C 34a_100000692449_100000756660 [0,2,0,0,0,0|2,0,0]=4 3067 B15R1.28172 CCS(=O)(=O)CCOC1(CCCCC1)C 34a_100011215885_100000756660 [0,2,0,0,0,0|2,0,0]=4 3068 B15R1.28172 CCS(=O)(=O)CCOC1(CCCCC1)C 7a_100011215885_100000756660 [0,2,0,0,0,0|2,0,0]=4 3069 B15R1.3977 CN(C(=O)CS(=O)(=O)C)C1CCCCC1 11a_100000207522_100000744497 [0,2,0,0,0,0|1,0,1]=4 3070 B15R1.3977 CN(C(=O)CS(=O)(=O)C)C1CCCCC1 240690a_100000207522_100000744497 [0,2,0,0,0,0|1,0,1]=4 3071 B15R1.3977 CN(C(=O)CS(=O)(=O)C)C1CCCCC1 527a_100000207522_100000744497 [0,2,0,0,0,0|1,0,1]=4 3072 B15R1.16622 CS(=O)(=O)CS(=O)(=O)NC1CCCCC1 274078a_100000182618_100000037191 [0,2,0,0,0,0|2,0,0]=4 3073 B15R1.67617 CC1(CCCCC1)NC(=O)CS(=O)(=O)C 11a_100000741114_100000744497 [0,2,0,0,0,0|1,0,1]=4 3074 B15R1.67617 CC1(CCCCC1)NC(=O)CS(=O)(=O)C 240690a_100000741114_100000744497 [0,2,0,0,0,0|1,0,1]=4 3075 B15R1.67617 CC1(CCCCC1)NC(=O)CS(=O)(=O)C 527a_100000741114_100000744497 [0,2,0,0,0,0|1,0,1]=4 3076 B15R1.5334 CCN(CCS(=O)(=O)C)C1CCCCC1 2230a_100000201195_100000731031 [0,2,0,0,0,0|1,0,0]=3 3077 B15R1.5334 CCN(CCS(=O)(=O)C)C1CCCCC1 269982a_100000201195_100000731031 [0,2,0,0,0,0|1,0,0]=3 3078 B15R1.5334 CCN(CCS(=O)(=O)C)C1CCCCC1 34a_100000201195_100000731031 [0,2,0,0,0,0|1,0,0]=3 3079 B15R1.5334 CCN(CCS(=O)(=O)C)C1CCOCC1 2230a_100011324086_100000731031 [0,2,0,0,0,0|2,0,0]=4 3080 B15R1.5334 CCN(CCS(=O)(=O)C)C1CCOCC1 269982a_100011324086_100000731031 [0,2,0,0,0,0|2,0,0]=4 3081 B15R1.5334 CCN(CCS(=O)(=O)C)C1CCOCC1 34a_100011324086_100000731031 [0,2,0,0,0,0|2,0,0]=4 3082 B15R1.5334 CCN(CCS(=O)(=O)[O-])C1CCCCC1 2230a_100000201195_100000737633 [0,2,0,0,0,0|0,0,1]=3 3083 B15R1.5334 CCN(CCS(=O)(=O)[O-])C1CCCCC1 34a_100000201195_100000762736 [0,2,0,0,0,0|0,0,1]=3 3084 B15R1.5334 CCN(CCS(=O)(=O)[O-])C1CCOCC1 2230a_100011324086_100000737633 [0,2,0,0,0,0|1,0,1]=4 3085 B15R1.5334 CCN(CCS(=O)(=O)[O-])C1CCOCC1 34a_100011324086_100000762736 [0,2,0,0,0,0|1,0,1]=4 3086 B15R1.48207 CC1(CCCCC1)C(=O)CCS(=O)(=O)C 1458a_100000762840_100000731031 [0,2,0,0,0,0|2,0,0]=4 3087 B15R1.48207 CC1(CCCCC1)C(=O)CCS(=O)(=O)[O-] 1458a_100000762840_100000762736 [0,2,0,0,0,0|1,0,1]=4 3088 B15R1.48207 CS(=O)(=O)CCC(=O)C1(CCCCC1)F 1458a_100000069003_100000731031 [0,2,0,0,0,0|2,0,0]=4 3089 B15R1.48207 CS(=O)(=O)CCC(=O)C1(CCCCC1)O 1458a_100000242742_100000731031 [0,2,0,0,0,0|2,0,0]=4 3090 B15R1.48207 O=C(CCS(=O)(=O)[O-])C1(CCCCC1)F 1458a_100000069003_100000762736 [0,2,0,0,0,0|1,0,1]=4 3091 B15R1.48207 O=C(CCS(=O)(=O)[O-])C1(CCCCC1)O 1458a_100000242742_100000762736 [0,2,0,0,0,0|1,0,1]=4 3092 B15R1.19031 C#CC1(CCCCC1)NCCS(=O)(=O)C 2230a_100132314160_100000731031 [0,2,0,0,0,0|1,0,0]=3 3093 B15R1.19031 C#CC1(CCCCC1)NCCS(=O)(=O)C 34a_100132314160_100000731031 [0,2,0,0,0,0|1,0,0]=3 3094 B15R1.19031 C#CC1(CCCCC1)NCCS(=O)(=O)[O-] 2230a_100132314160_100000737633 [0,2,0,0,0,0|0,0,1]=3 3095 B15R1.19031 C#CC1(CCCCC1)NCCS(=O)(=O)[O-] 34a_100132314160_100000762736 [0,2,0,0,0,0|0,0,1]=3 3096 B15R1.19031 C#CC1(CCCCC1)OCCS(=O)(=O)C 34a_100011215672_100000731031 [0,2,0,0,0,0|2,0,0]=4 3097 B15R1.19031 C#CC1(CCCCC1)OCCS(=O)(=O)C 7a_100011215672_100000230027 [0,2,0,0,0,0|2,0,0]=4 3098 B15R1.19031 C#CC1(CCCCC1)OCCS(=O)(=O)[O-] 34a_100011215672_100000762736 [0,2,0,0,0,0|1,0,1]=4 3099 B15R1.19031 C=CC1(CCCCC1)OCCS(=O)(=O)C 34a_200011934219_100000731031 [0,2,0,0,0,0|2,0,0]=4 3100 B15R1.19031 C=CC1(CCCCC1)OCCS(=O)(=O)C 7a_200011934219_100000230027 [0,2,0,0,0,0|2,0,0]=4 3101 B15R1.19031 C=CC1(CCCCC1)OCCS(=O)(=O)[O-] 34a_200011934219_100000762736 [0,2,0,0,0,0|1,0,1]=4 3102 B15R1.19031 CCC1(CCCCC1)OCCS(=O)(=O)C 34a_100011216009_100000731031 [0,2,0,0,0,0|2,0,0]=4 3103 B15R1.19031 CCC1(CCCCC1)OCCS(=O)(=O)C 7a_100011216009_100000230027 [0,2,0,0,0,0|2,0,0]=4 3104 B15R1.19031 CCC1(CCCCC1)OCCS(=O)(=O)[O-] 34a_100011216009_100000762736 [0,2,0,0,0,0|1,0,1]=4 3105 B15R1.19031 CS(=O)(=O)CCNC1(CCCCC1)C#N 34a_100000184641_100000731031 [0,2,0,0,0,0|1,0,0]=3 3106 B15R1.19031 CS(=O)(=O)CCNC1(CCCCC1)CO 2230a_100000740034_100000731031 [0,2,0,0,0,0|1,0,0]=3 3107 B15R1.19031 CS(=O)(=O)CCNC1(CCCCC1)CO 34a_100000740034_100000731031 [0,2,0,0,0,0|1,0,0]=3 3108 B15R1.19031 CS(=O)(=O)CCNC1(CCOCC1)C#N 2230a_100000754898_100000731031 [0,2,0,0,0,0|2,0,0]=4 3109 B15R1.19031 CS(=O)(=O)CCNC1(CCOCC1)C#N 34a_100000754898_100000731031 [0,2,0,0,0,0|2,0,0]=4 3110 B15R1.19031 CS(=O)(=O)CCNC1(CCOCC1)CO 2230a_100000751404_100000731031 [0,2,0,0,0,0|2,0,0]=4 3111 B15R1.19031 CS(=O)(=O)CCNC1(CCOCC1)CO 34a_100000751404_100000731031 [0,2,0,0,0,0|2,0,0]=4 3112 B15R1.19031 CS(=O)(=O)CCOC1(CCCCC1)CN 34a_100000748649_100000731031 [0,2,0,0,0,0|2,0,0]=4 3113 B15R1.19031 N#CC1(CCCCC1)NCCS(=O)(=O)[O-] 34a_100000184641_100000762736 [0,2,0,0,0,0|0,0,1]=3 3114 B15R1.19031 N#CC1(CCOCC1)NCCS(=O)(=O)[O-] 2230a_100000754898_100000737633 [0,2,0,0,0,0|1,0,1]=4 3115 B15R1.19031 N#CC1(CCOCC1)NCCS(=O)(=O)[O-] 34a_100000754898_100000762736 [0,2,0,0,0,0|1,0,1]=4 3116 B15R1.19031 NCC1(CCCCC1)OCCS(=O)(=O)[O-] 34a_100000748649_100000762736 [0,2,0,0,0,0|1,0,1]=4 3117 B15R1.19031 O=S(=O)([O-])CCNC1(CCCCC1)CO 2230a_100000740034_100000737633 [0,2,0,0,0,0|0,0,1]=3 3118 B15R1.19031 O=S(=O)([O-])CCNC1(CCCCC1)CO 34a_100000740034_100000762736 [0,2,0,0,0,0|0,0,1]=3 3119 B15R1.19031 O=S(=O)([O-])CCNC1(CCOCC1)CO 2230a_100000751404_100000737633 [0,2,0,0,0,0|1,0,1]=4 3120 B15R1.19031 O=S(=O)([O-])CCNC1(CCOCC1)CO 34a_100000751404_100000762736 [0,2,0,0,0,0|1,0,1]=4 3121 B13R1.634 CCN1CC(C1)NCCS(=O)(=O)C 2230a_200015199589_100000731031 [0,0,1,1,0,0|2,0,0]=4 3122 B13R1.634 CCN1CC(C1)NCCS(=O)(=O)[O-] 2230a_200015199589_100000737633 [0,0,1,1,0,0|1,0,1]=4 3123 B13R1.634 CO[C@H]1C[C@@H](C1)NCCS(=O)(=O)C 2230a_100121570643_100000731031 [0,0,1,1,0,0|2,0,0]=4 3124 B13R1.634 CO[C@H]1C[C@@H](C1)NCCS(=O)(=O)[O-] 2230a_100121570643_100000737633 [0,0,1,1,0,0|1,0,1]=4 3125 B13R1.634 CS(=O)(=O)CCNC1CC(C1)CO 270004a_100000740961_100000101936 [0,0,1,1,0,0|2,0,0]=4 3126 B13R1.634 NS(=O)(=O)CCNC1CC(C1)CO 270004a_100000738205_100000101936 [0,0,1,1,0,0|2,0,0]=4 3127 B13R1.2549 CCCCC(C)NC1CS(=O)(=O)C1 2230a_100000695474_200011215066 [0,0,1,1,0,0|1,0,0]=3 3128 B13R1.2549 CCCCC(C)NC1CS(=O)(=O)C1 34a_100000695474_200011215066 [0,0,1,1,0,0|1,0,0]=3 3129 B13R1.2549 CCCCC(C)OC1CS(=O)(=O)C1 34a_100000072295_200011215066 [0,0,1,1,0,0|2,0,0]=4 3130 B13R1.2549 CCCCC(C)OC1CS(=O)(=O)C1 7a_100000072295_200011215066 [0,0,1,1,0,0|2,0,0]=4 3131 B13R1.3530 CC1CCC(N1CCS(=O)(=O)C)C 2230a_100000687148_100000731031 [0,0,1,1,0,0|1,0,0]=3 3132 B13R1.3530 CC1CCC(N1CCS(=O)(=O)C)C 269982a_100000687148_100000731031 [0,0,1,1,0,0|1,0,0]=3 3133 B13R1.3530 CC1CCC(N1CCS(=O)(=O)C)C 34a_100000687148_100000731031 [0,0,1,1,0,0|1,0,0]=3 3134 B13R1.3530 CC1CCC(N1CCS(=O)(=O)[O-])C 2230a_100000687148_100000737633 [0,0,1,1,0,0|0,0,1]=3 3135 B13R1.3530 CC1CCC(N1CCS(=O)(=O)[O-])C 34a_100000687148_100000762736 [0,0,1,1,0,0|0,0,1]=3 3136 B13R1.8868 CC(NCCS(=O)(=O)C)C1CCC1 2230a_100016994624_100000731031 [0,0,1,1,0,0|1,0,0]=3 3137 B13R1.8868 CC(NCCS(=O)(=O)C)C1CCC1 269862a_100000740961_100000760154 [0,0,1,1,0,0|1,0,0]=3 3138 B13R1.8868 CC(NCCS(=O)(=O)C)C1CCC1 34a_100016994624_100000731031 [0,0,1,1,0,0|1,0,0]=3 3139 B13R1.8868 CC(NCCS(=O)(=O)N)C1CCC1 269862a_100000738205_100000760154 [0,0,1,1,0,0|1,0,0]=3 3140 B13R1.8868 CC(NCCS(=O)(=O)[O-])C1CCC1 2230a_100016994624_100000737633 [0,0,1,1,0,0|0,0,1]=3 3141 B13R1.8868 CC(NCCS(=O)(=O)[O-])C1CCC1 34a_100016994624_100000762736 [0,0,1,1,0,0|0,0,1]=3 3142 B13R1.8868 CC(OCCS(=O)(=O)C)C1CCC1 34a_100000766398_100000731031 [0,0,1,1,0,0|2,0,0]=4 3143 B13R1.8868 CC(OCCS(=O)(=O)C)C1CCC1 7a_100000766398_100000230027 [0,0,1,1,0,0|2,0,0]=4 3144 B13R1.8868 CC(OCCS(=O)(=O)[O-])C1CCC1 34a_100000766398_100000762736 [0,0,1,1,0,0|1,0,1]=4 3145 B13R1.8870 CC(CC1CC1)NCCS(=O)(=O)C 270004a_100000740961_200000686933 [0,0,1,1,0,0|1,0,0]=3 3146 B13R1.8870 CC(CC1CC1)NCCS(=O)(=O)N 270004a_100000738205_200000686933 [0,0,1,1,0,0|1,0,0]=3 3147 B13R1.100 CCC1CCCN1CCS(=O)(=O)C 2230a_100000754278_100000731031 [0,0,1,1,0,0|1,0,0]=3 3148 B13R1.100 CCC1CCCN1CCS(=O)(=O)C 269982a_100000754278_100000731031 [0,0,1,1,0,0|1,0,0]=3 3149 B13R1.100 CCC1CCCN1CCS(=O)(=O)C 34a_100000754278_100000731031 [0,0,1,1,0,0|1,0,0]=3 3150 B13R1.100 CCC1CCCN1CCS(=O)(=O)[O-] 2230a_100000754278_100000737633 [0,0,1,1,0,0|0,0,1]=3 3151 B13R1.100 CCC1CCCN1CCS(=O)(=O)[O-] 34a_100000754278_100000762736 [0,0,1,1,0,0|0,0,1]=3 3152 B13R1.100 CS(=O)(=O)CCN1CCC[C@@H]1CO 2230a_100000745186_100000731031 [0,0,1,1,0,0|2,0,0]=4 3153 B13R1.100 CS(=O)(=O)CCN1CCC[C@@H]1CO 269982a_100000745186_100000731031 [0,0,1,1,0,0|2,0,0]=4 3154 B13R1.100 CS(=O)(=O)CCN1CCC[C@@H]1CO 34a_100000745186_100000731031 [0,0,1,1,0,0|2,0,0]=4 3155 B13R1.100 O=S(=O)([O-])CCN1CCC[C@@H]1CO 2230a_100000745186_100000737633 [0,0,1,1,0,0|1,0,1]=4 3156 B13R1.100 O=S(=O)([O-])CCN1CCC[C@@H]1CO 34a_100000745186_100000762736 [0,0,1,1,0,0|1,0,1]=4 3157 B13R1.215 COCC1CCN1CCS(=O)(=O)C 2230a_100015195929_100000731031 [0,0,1,1,0,0|2,0,0]=4 3158 B13R1.215 COCC1CCN1CCS(=O)(=O)C 269982a_100015195929_100000731031 [0,0,1,1,0,0|2,0,0]=4 3159 B13R1.215 COCC1CCN1CCS(=O)(=O)C 34a_100015195929_100000731031 [0,0,1,1,0,0|2,0,0]=4 3160 B13R1.215 COCC1CCN1CCS(=O)(=O)[O-] 2230a_100015195929_100000737633 [0,0,1,1,0,0|1,0,1]=4 3161 B13R1.215 COCC1CCN1CCS(=O)(=O)[O-] 34a_100015195929_100000762736 [0,0,1,1,0,0|1,0,1]=4 3162 B13R1.2438 CCCCCCNC1CS(=O)(=O)C1 2230a_100000695474_100000210314 [0,0,1,1,0,0|1,0,0]=3 3163 B13R1.2438 CCCCCCNC1CS(=O)(=O)C1 34a_100000695474_100000210314 [0,0,1,1,0,0|1,0,0]=3 3164 B13R1.2438 CCCCCCOC1CS(=O)(=O)C1 34a_100000072295_100000210314 [0,0,1,1,0,0|2,0,0]=4 3165 B13R1.2438 CCCCCCOC1CS(=O)(=O)C1 7a_100000072295_100000210314 [0,0,1,1,0,0|2,0,0]=4 3166 B13R1.2438 CCCCOCNC1CS(=O)(=O)C1 2230a_100000695474_100011995733 [0,0,1,1,0,0|2,0,0]=4 3167 B13R1.2438 CCCCOCNC1CS(=O)(=O)C1 34a_100000695474_100011995733 [0,0,1,1,0,0|2,0,0]=4 3168 B13R1.2438 CCCOCCNC1CS(=O)(=O)C1 2230a_100000695474_100011215938 [0,0,1,1,0,0|2,0,0]=4 3169 B13R1.2438 CCCOCCNC1CS(=O)(=O)C1 34a_100000695474_100011215938 [0,0,1,1,0,0|2,0,0]=4 3170 B13R1.2438 CCOCCCNC1CS(=O)(=O)C1 2230a_100000695474_100012232248 [0,0,1,1,0,0|2,0,0]=4 3171 B13R1.2438 CCOCCCNC1CS(=O)(=O)C1 34a_100000695474_100012232248 [0,0,1,1,0,0|2,0,0]=4 3172 B13R1.2438 COCCCCNC1CS(=O)(=O)C1 2230a_100000695474_100000730899 [0,0,1,1,0,0|2,0,0]=4 3173 B13R1.2438 COCCCCNC1CS(=O)(=O)C1 34a_100000695474_100000755781 [0,0,1,1,0,0|2,0,0]=4 3174 B13R1.2438 O=S1(=O)CC(C1)NCCCCCF 2230a_100000695474_100000729378 [0,0,1,1,0,0|2,0,0]=4 3175 B13R1.2438 O=S1(=O)CC(C1)NCCCCCF 34a_100000695474_100000729378 [0,0,1,1,0,0|2,0,0]=4 3176 B13R1.2438 O=S1(=O)CC(C1)NCCCCCO 2230a_100000695474_100000746330 [0,0,1,1,0,0|2,0,0]=4 3177 B13R1.2438 O=S1(=O)CC(C1)NCCCCCO 34a_100000695474_100000746330 [0,0,1,1,0,0|2,0,0]=4 3178 B13R1.2904 CS(=O)(=O)CCNCC1CCCC1 2230a_100000737975_100000731031 [0,0,1,1,0,0|1,0,0]=3 3179 B13R1.2904 CS(=O)(=O)CCNCC1CCCC1 2230a_100000740961_100000740388 [0,0,1,1,0,0|1,0,0]=3 3180 B13R1.2904 CS(=O)(=O)CCNCC1CCCC1 269862a_100000740961_100000746403 [0,0,1,1,0,0|1,0,0]=3 3181 B13R1.2904 CS(=O)(=O)CCNCC1CCCC1 34a_100000737975_100000731031 [0,0,1,1,0,0|1,0,0]=3 3182 B13R1.2904 CS(=O)(=O)CCNCC1CCCC1 34a_100000740961_100000740388 [0,0,1,1,0,0|1,0,0]=3 3183 B13R1.2904 CS(=O)(=O)CCNCC1CCCO1 2230a_100000740961_100000203698 [0,0,1,1,0,0|2,0,0]=4 3184 B13R1.2904 CS(=O)(=O)CCNCC1CCOC1 2230a_100000737293_100000731031 [0,0,1,1,0,0|2,0,0]=4 3185 B13R1.2904 CS(=O)(=O)CCNCC1CCOC1 2230a_100000740961_100000702531 [0,0,1,1,0,0|2,0,0]=4 3186 B13R1.2904 CS(=O)(=O)CCNCC1CCOC1 34a_100000737293_100000731031 [0,0,1,1,0,0|2,0,0]=4 3187 B13R1.2904 CS(=O)(=O)CCNCC1CCOC1 34a_100000740961_100011261433 [0,0,1,1,0,0|2,0,0]=4 3188 B13R1.2904 CS(=O)(=O)CCNC[C@@H]1CCCO1 2230a_100020590478_100000731031 [0,0,1,1,0,0|2,0,0]=4 3189 B13R1.2904 CS(=O)(=O)CCNC[C@@H]1CCCO1 34a_100020590478_100000731031 [0,0,1,1,0,0|2,0,0]=4 3190 B13R1.2904 CS(=O)(=O)CCOCC1CCCC1 34a_100000211924_100000740388 [0,0,1,1,0,0|2,0,0]=4 3191 B13R1.2904 CS(=O)(=O)CCOCC1CCCC1 34a_100000742336_100000731031 [0,0,1,1,0,0|2,0,0]=4 3192 B13R1.2904 CS(=O)(=O)CCOCC1CCCC1 7a_100000211924_100000740388 [0,0,1,1,0,0|2,0,0]=4 3193 B13R1.2904 CS(=O)(=O)CCOCC1CCCC1 7a_100000742336_100000230027 [0,0,1,1,0,0|2,0,0]=4 3194 B13R1.2904 CS(=O)(=O)CCSCC1CCCC1 62a_100000731031_100000740388 [0,0,1,1,0,0|2,0,0]=4 3195 B13R1.2904 CS(=O)(=O)CCSCC1CCCC1 62a_100000740388_100000230027 [0,0,1,1,0,0|2,0,0]=4 3196 B13R1.2904 NS(=O)(=O)CCNCC1CCCC1 2230a_100000738205_100000740388 [0,0,1,1,0,0|1,0,0]=3 3197 B13R1.2904 NS(=O)(=O)CCNCC1CCCC1 269862a_100000738205_100000746403 [0,0,1,1,0,0|1,0,0]=3 3198 B13R1.2904 NS(=O)(=O)CCNCC1CCCC1 34a_100000738205_100000740388 [0,0,1,1,0,0|1,0,0]=3 3199 B13R1.2904 NS(=O)(=O)CCNCC1CCCO1 2230a_100000738205_100000203698 [0,0,1,1,0,0|2,0,0]=4 3200 B13R1.2904 NS(=O)(=O)CCNCC1CCOC1 2230a_100000738205_100000702531 [0,0,1,1,0,0|2,0,0]=4 3201 B13R1.2904 NS(=O)(=O)CCNCC1CCOC1 34a_100000738205_100011261433 [0,0,1,1,0,0|2,0,0]=4 3202 B13R1.2904 NS(=O)(=O)CCOCC1CCCC1 34a_100012334274_100000740388 [0,0,1,1,0,0|2,0,0]=4 3203 B13R1.2904 O=S(=O)([O-])CCNCC1CCCC1 2230a_100000737975_100000737633 [0,0,1,1,0,0|0,0,1]=3 3204 B13R1.2904 O=S(=O)([O-])CCNCC1CCCC1 34a_100000737975_100000762736 [0,0,1,1,0,0|0,0,1]=3 3205 B13R1.2904 O=S(=O)([O-])CCNCC1CCOC1 2230a_100000737293_100000737633 [0,0,1,1,0,0|1,0,1]=4 3206 B13R1.2904 O=S(=O)([O-])CCNCC1CCOC1 34a_100000737293_100000762736 [0,0,1,1,0,0|1,0,1]=4 3207 B13R1.2904 O=S(=O)([O-])CCNC[C@@H]1CCCO1 2230a_100020590478_100000737633 [0,0,1,1,0,0|1,0,1]=4 3208 B13R1.2904 O=S(=O)([O-])CCNC[C@@H]1CCCO1 34a_100020590478_100000762736 [0,0,1,1,0,0|1,0,1]=4 3209 B13R1.2904 O=S(=O)([O-])CCOCC1CCCC1 34a_100000742336_100000762736 [0,0,1,1,0,0|1,0,1]=4 3210 B13R1.2904 O=S(=O)([O-])CCSCC1CCCC1 62a_100000740388_100000762736 [0,0,1,1,0,0|1,0,1]=4 3211 B13R1.2904 O=S(=O)([O-])CCSCC1CCCC1 62a_100000762736_100000740388 [0,0,1,1,0,0|1,0,1]=4 3212 B13R1.6268 CS(=O)(=O)CCN1CCCCCC1 2230a_100000185865_100000731031 [0,0,1,1,0,0|1,0,0]=3 3213 B13R1.6268 CS(=O)(=O)CCN1CCCCCC1 269982a_100000185865_100000731031 [0,0,1,1,0,0|1,0,0]=3 3214 B13R1.6268 CS(=O)(=O)CCN1CCCCCC1 34a_100000185865_100000731031 [0,0,1,1,0,0|1,0,0]=3 3215 B13R1.6268 CS(=O)(=O)CCN1CCCOCC1 2230a_100000685342_100000731031 [0,0,1,1,0,0|2,0,0]=4 3216 B13R1.6268 CS(=O)(=O)CCN1CCCOCC1 269982a_100000685342_100000731031 [0,0,1,1,0,0|2,0,0]=4 3217 B13R1.6268 CS(=O)(=O)CCN1CCCOCC1 34a_100000685342_100000731031 [0,0,1,1,0,0|2,0,0]=4 3218 B13R1.6268 O=S(=O)([O-])CCN1CCCCCC1 2230a_100000185865_100000737633 [0,0,1,1,0,0|0,0,1]=3 3219 B13R1.6268 O=S(=O)([O-])CCN1CCCCCC1 34a_100000185865_100000762736 [0,0,1,1,0,0|0,0,1]=3 3220 B13R1.6268 O=S(=O)([O-])CCN1CCCOCC1 2230a_100000685342_100000737633 [0,0,1,1,0,0|1,0,1]=4 3221 B13R1.6268 O=S(=O)([O-])CCN1CCCOCC1 34a_100000685342_100000762736 [0,0,1,1,0,0|1,0,1]=4 3222 B13R1.6271 CS(=O)(=O)CCNCCCC1CO1 2230a_100000740961_100000733510 [0,0,1,1,0,0|2,0,0]=4 3223 B13R1.6271 CS(=O)(=O)CCNCCCC1CO1 34a_100000740961_100000733510 [0,0,1,1,0,0|2,0,0]=4 3224 B13R1.6271 NS(=O)(=O)CCNCCCC1CO1 2230a_100000738205_100000733510 [0,0,1,1,0,0|2,0,0]=4 3225 B13R1.6271 NS(=O)(=O)CCNCCCC1CO1 34a_100000738205_100000733510 [0,0,1,1,0,0|2,0,0]=4 3226 B13R1.1281 CCCC1(CC1)NCCS(=O)(=O)C 2230a_100015185929_100000731031 [0,0,1,1,0,0|1,0,0]=3 3227 B13R1.1281 CCCC1(CC1)NCCS(=O)(=O)[O-] 2230a_100015185929_100000737633 [0,0,1,1,0,0|0,0,1]=3 3228 B13R1.3670 CCCC(CC)OC1CS(=O)(=O)C1 7a_100000072295_100011219200 [0,0,1,1,0,0|2,0,0]=4 3229 B13R1.5665 CCC(NCCS(=O)(=O)C)C1CC1 2230a_100025715781_100000731031 [0,0,1,1,0,0|1,0,0]=3 3230 B13R1.5665 CCC(NCCS(=O)(=O)C)C1CC1 269862a_100000740961_100000759681 [0,0,1,1,0,0|1,0,0]=3 3231 B13R1.5665 CCC(NCCS(=O)(=O)C)C1CC1 34a_100025715781_100000731031 [0,0,1,1,0,0|1,0,0]=3 3232 B13R1.5665 CCC(NCCS(=O)(=O)N)C1CC1 269862a_100000738205_100000759681 [0,0,1,1,0,0|1,0,0]=3 3233 B13R1.5665 CCC(NCCS(=O)(=O)[O-])C1CC1 2230a_100025715781_100000737633 [0,0,1,1,0,0|0,0,1]=3 3234 B13R1.5665 CCC(NCCS(=O)(=O)[O-])C1CC1 34a_100025715781_100000762736 [0,0,1,1,0,0|0,0,1]=3 3235 B13R1.5665 CCC(OCCS(=O)(=O)C)C1CC1 34a_100011351122_100000731031 [0,0,1,1,0,0|2,0,0]=4 3236 B13R1.5665 CCC(OCCS(=O)(=O)C)C1CC1 7a_100011351122_100000230027 [0,0,1,1,0,0|2,0,0]=4 3237 B13R1.5665 CCC(OCCS(=O)(=O)[O-])C1CC1 34a_100011351122_100000762736 [0,0,1,1,0,0|1,0,1]=4 3238 B13R1.5665 CS(=O)(=O)CCN[C@@H](CO)C1CC1 2230a_100020623730_100000731031 [0,0,1,1,0,0|2,0,0]=4 3239 B13R1.5665 CS(=O)(=O)CCN[C@@H](CO)C1CC1 34a_100020623730_100000731031 [0,0,1,1,0,0|2,0,0]=4 3240 B13R1.5665 O=S(=O)([O-])CCN[C@@H](CO)C1CC1 2230a_100020623730_100000737633 [0,0,1,1,0,0|1,0,1]=4 3241 B13R1.5665 O=S(=O)([O-])CCN[C@@H](CO)C1CC1 34a_100020623730_100000762736 [0,0,1,1,0,0|1,0,1]=4 3242 B13R1.5983 CS(=O)(=O)CCNC1(CCC1)CO 2230a_100016993734_100000731031 [0,0,1,1,0,0|2,0,0]=4 3243 B13R1.5983 O=S(=O)([O-])CCNC1(CCC1)CO 2230a_100016993734_100000737633 [0,0,1,1,0,0|1,0,1]=4 3244 B13R2.10 OC1CCN(C1)C2CCCCC2 269982a_100011215560_100000210327 [1,0,0,1,0,0|2,0,0]=4 3245 B13R2.10 OC1CCN(C1)C2CCCCC2 270004a_100011215560_100000210434 [1,0,0,1,0,0|2,0,0]=4 3246 B13R2.31 O[C@H]1C[C@@H](C1)NC2CCCCC2 270004a_100020629032_100000210434 [1,0,0,1,0,0|2,0,0]=4 3247 B13R2.1264 CC(=O)CCN1C2CCC1CC2 269982a_100000735658_100000053229 [1,0,0,1,0,0|2,0,0]=4 3248 B13R2.1264 CC(O)CCN1C2CCC1CC2 2230a_100000735658_100012276601 [1,0,0,1,0,0|2,0,0]=4 3249 B13R2.1264 CC(O)CCN1C2CCC1CC2 269982a_100000735658_100012276601 [1,0,0,1,0,0|2,0,0]=4 3250 B13R2.1264 CC(O)CCN1C2CCC1CC2 34a_100000735658_100012276601 [1,0,0,1,0,0|2,0,0]=4 3251 B13R2.1264 NC(=O)CCN1C2CCC1CC2 2230a_100000735658_100000744528 [1,0,0,1,0,0|2,0,0]=4 3252 B13R2.1264 NC(=O)CCN1C2CCC1CC2 269982a_100000735658_100000744528 [1,0,0,1,0,0|2,0,0]=4 3253 B13R2.1264 NC(=O)CCN1C2CCC1CC2 34a_100000735658_100000731001 [1,0,0,1,0,0|2,0,0]=4 3254 B13R2.2382 C1CCC(CC1)NCCC2CO2 2230a_100000182618_100000732470 [1,0,0,1,0,0|2,0,0]=4 3255 B13R2.2382 C1CCC(CC1)NCCC2CO2 34a_100000182618_100000732470 [1,0,0,1,0,0|2,0,0]=4 3256 B13R2.5565 CC(O)CCNC1CC2CC2C1 270004a_200000755665_100010340937 [1,0,0,1,0,0|2,0,0]=4 3257 B13R2.13806 CC(O)CCNC1CCC2C1C2 269862a_200000755665_100000692480 [1,0,0,1,0,0|2,0,0]=4 3258 B13R2.13806 CC(O)CCNC1CCC2C1C2 270004a_200000755665_100000692480 [1,0,0,1,0,0|2,0,0]=4 3259 B13R2.13806 NC(=O)CCNC1CCC2C1C2 269862a_100000740010_100000692480 [1,0,0,1,0,0|2,0,0]=4 3260 B13R2.10514 O=S1(=O)CC(C1)NC2CCCC2 2230a_100000695474_100000179811 [0,0,0,1,1,0|1,0,0]=3 3261 B13R2.10514 O=S1(=O)CC(C1)NC2CCCC2 34a_100000695474_100000179811 [0,0,0,1,1,0|1,0,0]=3 3262 B13R2.10514 O=S1(=O)CC(C1)NC2CCOC2 2230a_100000695474_100000731011 [0,0,0,1,1,0|2,0,0]=4 3263 B13R2.10514 O=S1(=O)CC(C1)NC2CCOC2 34a_100000695474_100000690089 [0,0,0,1,1,0|2,0,0]=4 3264 B13R2.10514 O=S1(=O)CC(C1)OC2CCCC2 34a_100000072295_100000179811 [0,0,0,1,1,0|2,0,0]=4 3265 B13R2.10514 O=S1(=O)CC(C1)OC2CCCC2 7a_100000072295_100000179811 [0,0,0,1,1,0|2,0,0]=4 3266 B13R2.8058 O=S(=O)([O-])CN1C2CCC1CC2 34a_100000735658_100009817235 [0,0,0,1,1,0|0,0,1]=3 3267 B13R2.8067 CS(=O)(=O)CCN1CC2CC2C1 2230a_100000741873_100000731031 [0,0,0,1,1,0|2,0,0]=4 3268 B13R2.8067 CS(=O)(=O)CCN1CC2CC2C1 269982a_100000741873_100000731031 [0,0,0,1,1,0|2,0,0]=4 3269 B13R2.8067 CS(=O)(=O)CCN1CC2CC2C1 34a_100000741873_100000731031 [0,0,0,1,1,0|2,0,0]=4 3270 B13R2.8067 O=S(=O)([O-])CCN1CC2CC2C1 2230a_100000741873_100000737633 [0,0,0,1,1,0|1,0,1]=4 3271 B13R2.8067 O=S(=O)([O-])CCN1CC2CC2C1 34a_100000741873_100000762736 [0,0,0,1,1,0|1,0,1]=4 3272 B13R2.8076 CS(=O)(=O)N1CC2CCC1CC2 40a_100000750499_100000738038 [0,0,0,1,1,0|2,0,0]=4 3273 B13R2.20752 O=S(=O)([O-])COC1CCC2C1C2 34a_200012295571_100009817235 [0,0,0,1,1,0|1,0,1]=4 3274 B15R2.4430 CS(=O)(=O)NCC1CC12CCCCC2 40a_100015185624_100000738038 [0,0,0,1,0,1|2,0,0]=4 3275 B15R2.7532 O=S1(=O)C=CC(C1)NC2CCCCC2 2230a_100000182618_100000702656 [0,0,0,1,0,1|1,0,1]=4 3276 B15R2.7532 O=S1(=O)C=CC(C1)NC2CCCCC2 270004a_100000687631_100000210434 [0,0,0,1,0,1|1,0,1]=4 3277 B15R2.7532 O=S1(=O)C=CC(C1)NC2CCCCC2 34a_100000687631_100000210327 [0,0,0,1,0,1|1,0,1]=4 3278 B15R2.7532 O=S1(=O)CCC(C1)NC2CCCCC2 270004a_100000683523_100000210434 [0,0,0,1,0,1|1,0,0]=3 3279 B15R2.7532 O=S1(=O)CCC(C1)NC2CCCCC2 34a_100000683523_100000210327 [0,0,0,1,0,1|1,0,0]=3 3280 B15R2.7532 O=S1(=O)CCC(C1)NC2CCCOC2 270004a_100000683523_100000753404 [0,0,0,1,0,1|2,0,0]=4 3281 B15R2.7532 O=S1(=O)CCC(C1)NC2CCCOC2 34a_100000683523_100000693364 [0,0,0,1,0,1|2,0,0]=4 3282 B15R2.7532 O=S1(=O)CCC(C1)NC2CCCSC2 270004a_100000683523_100000057913 [0,0,0,1,0,1|2,0,0]=4 3283 B15R2.7532 O=S1(=O)CCC(C1)NC2CCNCC2 270004a_100000683523_100015192401 [0,0,0,1,0,1|2,0,0]=4 3284 B15R2.7532 O=S1(=O)CCC(C1)NC2CCOCC2 270004a_100000683523_100011217826 [0,0,0,1,0,1|2,0,0]=4 3285 B15R2.7532 O=S1(=O)CCC(C1)NC2CCSCC2 270004a_100000683523_100000203788 [0,0,0,1,0,1|2,0,0]=4 3286 B15R2.7532 O=S1(=O)CCC(C1)NC2CCSCC2 34a_100000683523_100000069128 [0,0,0,1,0,1|2,0,0]=4 3287 B15R2.7532 O=S1(=O)CCC(C1)OC2CCCCC2 34a_100000186101_100000210327 [0,0,0,1,0,1|2,0,0]=4 3288 B15R2.7532 O=S1(=O)CCC(C1)OC2CCCCC2 7a_100000186101_100000210327 [0,0,0,1,0,1|2,0,0]=4 3289 B15R2.7966 O=S1(=O)CC(C1)NCC2CCCCC2 2230a_100000695474_100000211423 [0,0,0,1,0,1|1,0,0]=3 3290 B15R2.7966 O=S1(=O)CC(C1)NCC2CCCCC2 34a_100000695474_100000211423 [0,0,0,1,0,1|1,0,0]=3 3291 B15R2.7966 O=S1(=O)CC(C1)NCC2CCCCO2 2230a_100000695474_100000211543 [0,0,0,1,0,1|2,0,0]=4 3292 B15R2.7966 O=S1(=O)CC(C1)NCC2CCCCO2 34a_100000695474_100000211543 [0,0,0,1,0,1|2,0,0]=4 3293 B15R2.7966 O=S1(=O)CC(C1)NCC2CCCOC2 2230a_100000695474_100000741521 [0,0,0,1,0,1|2,0,0]=4 3294 B15R2.7966 O=S1(=O)CC(C1)NCC2CCCOC2 34a_100000695474_100000741521 [0,0,0,1,0,1|2,0,0]=4 3295 B15R2.7966 O=S1(=O)CC(C1)NCC2CCOCC2 2230a_100000695474_100000754603 [0,0,0,1,0,1|2,0,0]=4 3296 B15R2.7966 O=S1(=O)CC(C1)NCC2CCOCC2 34a_100000695474_100000754603 [0,0,0,1,0,1|2,0,0]=4 3297 B15R2.7966 O=S1(=O)CC(C1)OCC2CCCCC2 34a_100000072295_100000211423 [0,0,0,1,0,1|2,0,0]=4 3298 B15R2.7966 O=S1(=O)CC(C1)OCC2CCCCC2 7a_100000072295_100000211423 [0,0,0,1,0,1|2,0,0]=4 3299 B15R2.29037 CS(=O)(=O)CCCNC1CC2CC2C1 270004a_100000742409_100010340937 [0,0,0,1,0,1|1,0,0]=3 3300 B15R2.29037 CS(=O)(=O)NCCNC1CC2CC2C1 270004a_100000752411_100010340937 [0,0,0,1,0,1|1,0,0]=3 3301 B15R2.29039 CS(=O)(=O)CCN1CC2CCC1CC2 2230a_100000750499_100000731031 [0,0,0,1,0,1|1,0,0]=3 3302 B15R2.29039 CS(=O)(=O)CCN1CC2CCC1CC2 269982a_100000750499_100000731031 [0,0,0,1,0,1|1,0,0]=3 3303 B15R2.29039 CS(=O)(=O)CCN1CC2CCC1CC2 34a_100000750499_100000731031 [0,0,0,1,0,1|1,0,0]=3 3304 B15R2.29039 O=S(=O)([O-])CCN1CC2CCC1CC2 2230a_100000750499_100000737633 [0,0,0,1,0,1|0,0,1]=3 3305 B15R2.29039 O=S(=O)([O-])CCN1CC2CCC1CC2 34a_100000750499_100000762736 [0,0,0,1,0,1|0,0,1]=3 3306 B15R2.109415 CS(=O)(=O)CCCNC1CCC2C1C2 269862a_100000742409_100000692480 [0,0,0,1,0,1|1,0,0]=3 3307 B15R2.109415 CS(=O)(=O)CCCNC1CCC2C1C2 270004a_100000742409_100000692480 [0,0,0,1,0,1|1,0,0]=3 3308 B15R2.109415 CS(=O)(=O)CCCOC1CCC2C1C2 34a_200012295571_100000754308 [0,0,0,1,0,1|2,0,0]=4 3309 B15R2.109415 CS(=O)(=O)NCCNC1CCC2C1C2 269862a_100000752411_100000692480 [0,0,0,1,0,1|1,0,0]=3 3310 B15R2.109415 CS(=O)(=O)NCCNC1CCC2C1C2 270004a_100000752411_100000692480 [0,0,0,1,0,1|1,0,0]=3 3311 B15R2.109415 CS(=O)(=O)OCCOC1CCC2C1C2 34a_200012295571_200000036756 [0,0,0,1,0,1|2,0,0]=4 3312 B15R2.109415 NS(=O)(=O)CCCOC1CCC2C1C2 34a_200012295571_100000750626 [0,0,0,1,0,1|2,0,0]=4 3313 B15R2.109415 O=S(=O)([O-])CCCOC1CCC2C1C2 34a_200012295571_100009813499 [0,0,0,1,0,1|1,0,1]=4 3314 B15R2.109477 CS(=O)(=O)N1CCCC2C1CCCC2 40a_100000211887_100000738038 [0,0,0,1,0,1|2,0,0]=4 3315 B15R2.109477 CS(=O)(=O)N1CCOC2C1CCCC2 40a_200000741227_100000738038 [0,0,0,1,0,1|2,0,0]=4 3316 B15R2.135129 CS(=O)(=O)CCCN1C2CCC1CC2 2230a_100000735658_100000754308 [0,0,0,1,0,1|1,0,0]=3 3317 B15R2.135129 CS(=O)(=O)CCCN1C2CCC1CC2 269982a_100000735658_100000754308 [0,0,0,1,0,1|1,0,0]=3 3318 B15R2.135129 CS(=O)(=O)CCCN1C2CCC1CC2 34a_100000735658_100000754308 [0,0,0,1,0,1|1,0,0]=3 3319 B15R2.135129 CS(=O)(=O)CCNC1C2CCC1CC2 34a_100000740961_100009813300 [0,0,0,1,0,1|1,0,0]=3 3320 B15R2.135129 CS(=O)(=O)CCOC1C2CCC1CC2 34a_100000211924_100009813300 [0,0,0,1,0,1|2,0,0]=4 3321 B15R2.135129 CS(=O)(=O)CCSC1C2CCC1CC2 62a_100000731031_100009813300 [0,0,0,1,0,1|2,0,0]=4 3322 B15R2.135129 CS(=O)(=O)CCSC1C2CCC1CC2 62a_100009813300_100000230027 [0,0,0,1,0,1|2,0,0]=4 3323 B15R2.135129 CS(=O)(=O)NCCN1C2CCC1CC2 2230a_100000735658_100000754112 [0,0,0,1,0,1|1,0,0]=3 3324 B15R2.135129 CS(=O)(=O)NCCN1C2CCC1CC2 269982a_100000735658_100000754112 [0,0,0,1,0,1|1,0,0]=3 3325 B15R2.135129 CS(=O)(=O)OCCN1C2CCC1CC2 2230a_100000735658_200000036756 [0,0,0,1,0,1|1,0,0]=3 3326 B15R2.135129 CS(=O)(=O)OCCN1C2CCC1CC2 269982a_100000735658_200000036756 [0,0,0,1,0,1|1,0,0]=3 3327 B15R2.135129 CS(=O)(=O)OCCN1C2CCC1CC2 34a_100000735658_200000036756 [0,0,0,1,0,1|1,0,0]=3 3328 B15R2.135129 NS(=O)(=O)CCCN1C2CCC1CC2 2230a_100000735658_100000750626 [0,0,0,1,0,1|1,0,0]=3 3329 B15R2.135129 NS(=O)(=O)CCCN1C2CCC1CC2 269982a_100000735658_100000750626 [0,0,0,1,0,1|1,0,0]=3 3330 B15R2.135129 NS(=O)(=O)CCCN1C2CCC1CC2 34a_100000735658_100000750626 [0,0,0,1,0,1|1,0,0]=3 3331 B15R2.135129 NS(=O)(=O)CCNC1C2CCC1CC2 34a_100000738205_100009813300 [0,0,0,1,0,1|1,0,0]=3 3332 B15R2.135129 NS(=O)(=O)CCOC1C2CCC1CC2 34a_100012334274_100009813300 [0,0,0,1,0,1|2,0,0]=4 3333 B15R2.135129 O=S(=O)([O-])CCCN1C2CCC1CC2 269982a_100000735658_100009813499 [0,0,0,1,0,1|0,0,1]=3 3334 B15R2.135129 O=S(=O)([O-])CCCN1C2CCC1CC2 34a_100000735658_100009813499 [0,0,0,1,0,1|0,0,1]=3 3335 B15R2.135129 O=S(=O)([O-])CCSC1C2CCC1CC2 62a_100000762736_100009813300 [0,0,0,1,0,1|1,0,1]=4 3336 B15R2.135129 O=S(=O)([O-])CCSC1C2CCC1CC2 62a_100009813300_100000762736 [0,0,0,1,0,1|1,0,1]=4 3337 B15R2.135234 CS(=O)(=O)CCCNC1C2C1COC2 2230a_100000702821_100000754308 [0,0,0,1,0,1|2,0,0]=4 3338 B15R2.135234 CS(=O)(=O)CCCNC1C2C1COC2 34a_100000702821_100000754308 [0,0,0,1,0,1|2,0,0]=4 3339 B15R2.135234 CS(=O)(=O)NCCNC1C2C1COC2 2230a_100000702821_100000754112 [0,0,0,1,0,1|2,0,0]=4 3340 B15R2.135234 CS(=O)(=O)OCCNC1C2C1COC2 2230a_100000702821_200000036756 [0,0,0,1,0,1|2,0,0]=4 3341 B15R2.135234 CS(=O)(=O)OCCNC1C2C1COC2 34a_100000702821_200000036756 [0,0,0,1,0,1|2,0,0]=4 3342 B15R2.135234 NS(=O)(=O)CCCNC1C2C1COC2 2230a_100000702821_100000750626 [0,0,0,1,0,1|2,0,0]=4 3343 B15R2.135234 NS(=O)(=O)CCCNC1C2C1COC2 34a_100000702821_100000750626 [0,0,0,1,0,1|2,0,0]=4 3344 B15R2.135234 O=S(=O)([O-])CCCNC1C2C1COC2 34a_100000702821_100009813499 [0,0,0,1,0,1|1,0,1]=4 3345 B15R2.29031 CS(=O)(=O)CCN1C2CCC1COC2 2230a_100015205251_100000731031 [0,0,0,1,0,1|1,0,0]=3 3346 B15R2.29031 CS(=O)(=O)CCN1C2CCC1COC2 269982a_100015205251_100000731031 [0,0,0,1,0,1|1,0,0]=3 3347 B15R2.29031 CS(=O)(=O)CCN1C2CCC1COC2 34a_100015205251_100000731031 [0,0,0,1,0,1|1,0,0]=3 3348 B15R2.29031 O=S(=O)([O-])CCN1C2CCC1COC2 2230a_100015205251_100000737633 [0,0,0,1,0,1|0,0,1]=3 3349 B15R2.29031 O=S(=O)([O-])CCN1C2CCC1COC2 34a_100015205251_100000762736 [0,0,0,1,0,1|0,0,1]=3 3350 B15R2.43716 O=S1(=O)CC(C1)NC2CCCCCC2 34a_100000695474_100011217769 [0,0,0,1,0,1|1,0,0]=3 3351 B15R2.43716 O=S1(=O)CC(C1)OC2CCCCCC2 34a_100000072295_100011217769 [0,0,0,1,0,1|2,0,0]=4 3352 B15R2.109447 CS(=O)(=O)CCNC1CCCC2C1C2 269862a_100000740961_100000697651 [0,0,0,1,0,1|1,0,0]=3 3353 B15R2.109447 NS(=O)(=O)CCNC1CCCC2C1C2 269862a_100000738205_100000697651 [0,0,0,1,0,1|1,0,0]=3 3354 B15R2.19016 CC1CCC(CC1)NC2CS(=O)(=O)C2 34a_100000695474_200011216234 [0,1,0,1,0,0|1,0,0]=3 3355 B15R2.19016 CC1CCC(CC1)OC2CS(=O)(=O)C2 34a_100000072295_200011216234 [0,1,0,1,0,0|2,0,0]=4 3356 B15R2.29057 CS(=O)(=O)CCNC1CC2CCC1C2 2230a_100000758229_100000731031 [0,1,0,1,0,0|1,0,0]=3 3357 B15R2.29057 CS(=O)(=O)CCNC1CC2CCC1C2 269862a_100000740961_100000223372 [0,1,0,1,0,0|1,0,0]=3 3358 B15R2.29057 CS(=O)(=O)CCNC1CC2CCC1C2 270004a_100000740961_100000223372 [0,1,0,1,0,0|1,0,0]=3 3359 B15R2.29057 CS(=O)(=O)CCNC1CC2CCC1C2 34a_100000740961_100000727232 [0,1,0,1,0,0|1,0,0]=3 3360 B15R2.29057 CS(=O)(=O)CCNC1CC2CCC1C2 34a_100000758229_100000731031 [0,1,0,1,0,0|1,0,0]=3 3361 B15R2.29057 CS(=O)(=O)CCOC1CC2CCC1C2 34a_100000211339_100000731031 [0,1,0,1,0,0|2,0,0]=4 3362 B15R2.29057 CS(=O)(=O)CCOC1CC2CCC1C2 34a_100000211924_100000727232 [0,1,0,1,0,0|2,0,0]=4 3363 B15R2.29057 CS(=O)(=O)CCSC1CC2CCC1C2 62a_100000727232_100000230027 [0,1,0,1,0,0|2,0,0]=4 3364 B15R2.29057 CS(=O)(=O)CCSC1CC2CCC1C2 62a_100000731031_100000727232 [0,1,0,1,0,0|2,0,0]=4 3365 B15R2.29057 NS(=O)(=O)CCNC1CC2CCC1C2 269862a_100000738205_100000223372 [0,1,0,1,0,0|1,0,0]=3 3366 B15R2.29057 NS(=O)(=O)CCNC1CC2CCC1C2 270004a_100000738205_100000223372 [0,1,0,1,0,0|1,0,0]=3 3367 B15R2.29057 NS(=O)(=O)CCNC1CC2CCC1C2 34a_100000738205_100000727232 [0,1,0,1,0,0|1,0,0]=3 3368 B15R2.29057 NS(=O)(=O)CCOC1CC2CCC1C2 34a_100012334274_100000727232 [0,1,0,1,0,0|2,0,0]=4 3369 B15R2.29057 O=S(=O)([O-])CCNC1CC2CCC1C2 2230a_100000758229_100000737633 [0,1,0,1,0,0|0,0,1]=3 3370 B15R2.29057 O=S(=O)([O-])CCNC1CC2CCC1C2 34a_100000758229_100000762736 [0,1,0,1,0,0|0,0,1]=3 3371 B15R2.29057 O=S(=O)([O-])CCOC1CC2CCC1C2 34a_100000211339_100000762736 [0,1,0,1,0,0|1,0,1]=4 3372 B15R2.29057 O=S(=O)([O-])CCSC1CC2CCC1C2 62a_100000727232_100000762736 [0,1,0,1,0,0|1,0,1]=4 3373 B15R2.29057 O=S(=O)([O-])CCSC1CC2CCC1C2 62a_100000762736_100000727232 [0,1,0,1,0,0|1,0,1]=4 3374 B15R2.14895 O=C1CCCCC1NC2CS(=O)(=O)C2 34a_100000695474_100000754470 [0,1,0,1,0,0|1,0,1]=4 3375 B15R2.14895 O=S1(=O)CC(C1)NC2CCCCC2F 34a_100000695474_100015423560 [0,1,0,1,0,0|1,0,0]=3 3376 B15R2.14895 O=S1(=O)CC(C1)NC2CCCCC2O 34a_100000695474_100000038908 [0,1,0,1,0,0|1,0,0]=3 3377 B15R2.14895 O=S1(=O)CC(C1)OC2CCCCC2F 34a_100000072295_100015423560 [0,1,0,1,0,0|2,0,0]=4 3378 B15R2.14895 O=S1(=O)CC(C1)OC2CCCCC2O 34a_100000072295_100000038908 [0,1,0,1,0,0|2,0,0]=4 3379 B15R2.467 O=S1(=O)CCN(CC1)C2CCCCC2 269982a_100000750940_100000210327 [0,1,0,1,0,0|1,0,0]=3 3380 B15R2.467 O=S1(=O)CCN(CC1)C2CCCCC2 270004a_100000750940_100000210434 [0,1,0,1,0,0|1,0,0]=3 3381 B15R2.467 O=S1(=O)CCN(CC1)C2CCCCC2 34a_100000750940_100000210327 [0,1,0,1,0,0|1,0,0]=3 3382 B15R2.467 O=S1(=O)CCN(CC1)C2CCCOC2 269982a_100000750940_100000693364 [0,1,0,1,0,0|2,0,0]=4 3383 B15R2.467 O=S1(=O)CCN(CC1)C2CCCOC2 270004a_100000750940_100000753404 [0,1,0,1,0,0|2,0,0]=4 3384 B15R2.467 O=S1(=O)CCN(CC1)C2CCCOC2 34a_100000750940_100000693364 [0,1,0,1,0,0|2,0,0]=4 3385 B15R2.467 O=S1(=O)CCN(CC1)C2CCCSC2 270004a_100000750940_100000057913 [0,1,0,1,0,0|2,0,0]=4 3386 B15R2.467 O=S1(=O)CCN(CC1)C2CCNCC2 270004a_100000750940_100015192401 [0,1,0,1,0,0|2,0,0]=4 3387 B15R2.467 O=S1(=O)CCN(CC1)C2CCOCC2 269982a_100000750940_100011324220 [0,1,0,1,0,0|2,0,0]=4 3388 B15R2.467 O=S1(=O)CCN(CC1)C2CCOCC2 270004a_100000750940_100011217826 [0,1,0,1,0,0|2,0,0]=4 3389 B15R2.467 O=S1(=O)CCN(CC1)C2CCSCC2 269982a_100000750940_100000069128 [0,1,0,1,0,0|2,0,0]=4 3390 B15R2.467 O=S1(=O)CCN(CC1)C2CCSCC2 270004a_100000750940_100000203788 [0,1,0,1,0,0|2,0,0]=4 3391 B15R2.467 O=S1(=O)CCN(CC1)C2CCSCC2 34a_100000750940_100000069128 [0,1,0,1,0,0|2,0,0]=4 3392 B15R2.12962 CCS(=O)(=O)CCN1C2CCC1CC2 2230a_100000735658_100000756660 [0,1,0,1,0,0|1,0,0]=3 3393 B15R2.12962 CCS(=O)(=O)CCN1C2CCC1CC2 269982a_100000735658_100000756660 [0,1,0,1,0,0|1,0,0]=3 3394 B15R2.12962 CCS(=O)(=O)CCN1C2CCC1CC2 34a_100000735658_100000756660 [0,1,0,1,0,0|1,0,0]=3 3395 B15R2.13016 CCS(=O)(=O)CCNC1CC2CC2C1 270004a_100000751051_100010340937 [0,1,0,1,0,0|1,0,0]=3 3396 B15R2.13016 CNS(=O)(=O)CCNC1CC2CC2C1 270004a_100000710037_100010340937 [0,1,0,1,0,0|1,0,0]=3 3397 B15R2.58252 CCS(=O)(=O)CCNC1C2C1COC2 2230a_100000702821_100000756660 [0,1,0,1,0,0|2,0,0]=4 3398 B15R2.58252 CCS(=O)(=O)CCNC1C2C1COC2 34a_100000702821_100000756660 [0,1,0,1,0,0|2,0,0]=4 3399 B15R2.58756 CCS(=O)(=O)CCNC1CCC2C1C2 269862a_100000751051_100000692480 [0,1,0,1,0,0|1,0,0]=3 3400 B15R2.58756 CCS(=O)(=O)CCNC1CCC2C1C2 270004a_100000751051_100000692480 [0,1,0,1,0,0|1,0,0]=3 3401 B15R2.58756 CCS(=O)(=O)CCOC1CCC2C1C2 34a_200012295571_100000756660 [0,1,0,1,0,0|2,0,0]=4 3402 B15R2.58756 CNS(=O)(=O)CCNC1CCC2C1C2 269862a_100000710037_100000692480 [0,1,0,1,0,0|1,0,0]=3 3403 B15R2.58756 CNS(=O)(=O)CCNC1CCC2C1C2 270004a_100000710037_100000692480 [0,1,0,1,0,0|1,0,0]=3 3404 B15R2.70018 CS(=O)(=O)CC(=O)N1C2CCC1CC2 11a_100000735658_100000744497 [0,1,0,1,0,0|1,0,1]=4 3405 B15R2.70018 CS(=O)(=O)CC(=O)N1C2CCC1CC2 240690a_100000735658_100000744497 [0,1,0,1,0,0|1,0,1]=4 3406 B15R2.70018 CS(=O)(=O)CC(=O)N1C2CCC1CC2 527a_100000735658_100000744497 [0,1,0,1,0,0|1,0,1]=4 3407 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCCCC2 269982a_100000695683_100000210327 [0,1,0,1,0,0|1,0,0]=3 3408 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCCCC2 270004a_100000695683_100000210434 [0,1,0,1,0,0|1,0,0]=3 3409 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCCCC2 34a_100000695683_100000210327 [0,1,0,1,0,0|1,0,0]=3 3410 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCCOC2 269982a_100000695683_100000693364 [0,1,0,1,0,0|2,0,0]=4 3411 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCCOC2 270004a_100000695683_100000753404 [0,1,0,1,0,0|2,0,0]=4 3412 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCCOC2 34a_100000695683_100000693364 [0,1,0,1,0,0|2,0,0]=4 3413 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCCSC2 270004a_100000695683_100000057913 [0,1,0,1,0,0|2,0,0]=4 3414 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCNCC2 270004a_100000695683_100015192401 [0,1,0,1,0,0|2,0,0]=4 3415 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCOCC2 269982a_100000695683_100011324220 [0,1,0,1,0,0|2,0,0]=4 3416 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCOCC2 270004a_100000695683_100011217826 [0,1,0,1,0,0|2,0,0]=4 3417 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCSCC2 269982a_100000695683_100000069128 [0,1,0,1,0,0|2,0,0]=4 3418 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCSCC2 270004a_100000695683_100000203788 [0,1,0,1,0,0|2,0,0]=4 3419 B15R2.4439 CS(=O)(=O)C1CN(C1)C2CCSCC2 34a_100000695683_100000069128 [0,1,0,1,0,0|2,0,0]=4 3420 B15R2.95170 CN(CCS(=O)(=O)C)C1CCC2C1C2 270004a_100000750128_100000692480 [0,1,0,1,0,0|1,0,0]=3 3421 B15R2.95172 CN(CCS(=O)(=O)C)C1CC2CC2C1 270004a_100000750128_100010340937 [0,1,0,1,0,0|1,0,0]=3 3422 B11R0.82 CCCCC(C)OCS(=O)(=O)[O-] 34a_100000687866_100009817235 [0,0,1,0,1,0|1,0,1]=4 3423 B11R0.82 CCCCC(C)SCS(=O)(=O)N 62a_100000741382_200011215066 [0,0,1,0,1,0|2,0,0]=4 3424 B11R0.82 CCCCC(C)SCS(=O)(=O)N 62a_200011215066_100000741382 [0,0,1,0,1,0|2,0,0]=4 3425 B11R0.82 CCCCC(C)SCS(=O)(=O)[O-] 62a_100009817235_200011215066 [0,0,1,0,1,0|1,0,1]=4 3426 B11R0.82 CCCCC(C)SCS(=O)(=O)[O-] 62a_200011215066_100009817235 [0,0,1,0,1,0|1,0,1]=4 3427 B11R0.82 CCCCN(C)CCS(=O)(=O)C 2230a_100000207549_100000731031 [0,0,1,0,1,0|2,0,0]=4 3428 B11R0.82 CCCCN(C)CCS(=O)(=O)C 2230a_100000750128_100000210211 [0,0,1,0,1,0|2,0,0]=4 3429 B11R0.82 CCCCN(C)CCS(=O)(=O)C 269982a_100000207549_100000731031 [0,0,1,0,1,0|2,0,0]=4 3430 B11R0.82 CCCCN(C)CCS(=O)(=O)C 269982a_100000750128_100000210211 [0,0,1,0,1,0|2,0,0]=4 3431 B11R0.82 CCCCN(C)CCS(=O)(=O)C 34a_100000750128_100000210210 [0,0,1,0,1,0|2,0,0]=4 3432 B11R0.82 CCCCN(C)CCS(=O)(=O)[O-] 2230a_100000207549_100000737633 [0,0,1,0,1,0|1,0,1]=4 3433 B11R0.196 CCCC(CC)OCS(=O)(=O)[O-] 34a_100000687864_100009817235 [0,0,1,0,1,0|1,0,1]=4 3434 B11R0.196 CCCC(CC)SCS(=O)(=O)N 62a_100000741382_100011219200 [0,0,1,0,1,0|2,0,0]=4 3435 B11R0.196 CCCC(CC)SCS(=O)(=O)N 62a_100011219200_100000741382 [0,0,1,0,1,0|2,0,0]=4 3436 B11R0.196 CCCC(CC)SCS(=O)(=O)[O-] 62a_100009817235_100011219200 [0,0,1,0,1,0|1,0,1]=4 3437 B11R0.196 CCCC(CC)SCS(=O)(=O)[O-] 62a_100011219200_100009817235 [0,0,1,0,1,0|1,0,1]=4 3438 B11R0.196 CCCN(CC)CCS(=O)(=O)C 2230a_100000226822_100000731031 [0,0,1,0,1,0|2,0,0]=4 3439 B11R0.196 CCCN(CC)CCS(=O)(=O)C 269982a_100000226822_100000731031 [0,0,1,0,1,0|2,0,0]=4 3440 B11R0.196 CCCN(CC)CCS(=O)(=O)[O-] 2230a_100000226822_100000737633 [0,0,1,0,1,0|1,0,1]=4 3441 B11R0.196 CCC[C@@H](CO)NCS(=O)(=O)[O-] 34a_100000732646_100009817235 [0,0,1,0,1,0|1,0,1]=4 3442 B11R1.91 CC(=O)CCC1CCCCC1 1458a_100000070787_100011273959 [1,0,0,0,1,0|2,0,0]=4 3443 B11R1.91 CC(=O)CCC1CCCCC1 1458a_100000211375_200000210301 [1,0,0,0,1,0|2,0,0]=4 3444 B11R1.91 CC(O)CNC1CCCCC1 2230a_100000182618_100011218427 [1,0,0,0,1,0|2,0,0]=4 3445 B11R1.91 CC(O)CNC1CCCCC1 270004a_100000210904_100000210434 [1,0,0,0,1,0|2,0,0]=4 3446 B11R1.91 CC(O)CNC1CCCCC1 34a_100000182618_100011218427 [1,0,0,0,1,0|2,0,0]=4 3447 B11R1.91 CC(O)CNC1CCCCC1 34a_100000210904_100000210327 [1,0,0,0,1,0|2,0,0]=4 3448 B11R1.91 C[C@@H](O)CNC1CCCCC1 2230a_100000182618_100009817552 [1,0,0,0,1,0|2,0,0]=4 3449 B11R1.91 C[C@@H](O)CNC1CCCCC1 34a_100000182618_100009817552 [1,0,0,0,1,0|2,0,0]=4 3450 B11R1.91 NC(=O)CNC1CCCCC1 2230a_100000182618_100000747473 [1,0,0,0,1,0|2,0,0]=4 3451 B11R1.91 NC(=O)CNC1CCCCC1 34a_100000182618_100000187820 [1,0,0,0,1,0|2,0,0]=4 3452 B11R1.91 O=C(O)CNC1CCCCC1 269956a_100016091260_100000210327 [1,0,0,0,1,0|1,0,0]=3 3453 B11R1.91 O=C(O)CNC1CCCOC1 269956a_100016091260_100000693364 [1,0,0,0,1,0|2,0,0]=4 3454 B11R1.91 O=C(O)CNC1CCOCC1 269956a_100016091260_100011324220 [1,0,0,0,1,0|2,0,0]=4 3455 B11R1.91 O=C(O)CNC1CCSCC1 269956a_100016091260_100000069128 [1,0,0,0,1,0|2,0,0]=4 3456 B11R1.91 O=C([O-])CNC1CCCCC1 34a_100000182618_100020667443 [1,0,0,0,1,0|1,0,1]=4 3457 B11R1.91 O=[N+]([O-])CNC1CCCCC1 34a_100000182618_100000761209 [1,0,0,0,1,0|1,0,1]=4 3458 B11R1.91 [13CH3]C(=O)CCC1CCCCC1 1458a_100000211375_200025704644 [1,0,0,0,1,0|2,0,0]=4 3459 B11R1.172 CC(O)CCNC1CCCC1 2230a_100000211070_100012276601 [1,0,0,0,1,0|2,0,0]=4 3460 B11R1.172 CC(O)CCNC1CCCC1 2230a_200000755665_100000179811 [1,0,0,0,1,0|2,0,0]=4 3461 B11R1.172 CC(O)CCNC1CCCC1 270004a_200000755665_100000210133 [1,0,0,0,1,0|2,0,0]=4 3462 B11R1.172 CC(O)CCNC1CCCC1 34a_100000211070_100012276601 [1,0,0,0,1,0|2,0,0]=4 3463 B11R1.172 NC(=O)CCNC1CCCC1 2230a_100000211070_100000744528 [1,0,0,0,1,0|2,0,0]=4 3464 B11R1.172 NC(=O)CCNC1CCCC1 34a_100000211070_100000731001 [1,0,0,0,1,0|2,0,0]=4 3465 B11R1.172 O=C(O)CONC1CCCC1 269956a_100000106656_100000179811 [1,0,0,0,1,0|2,0,0]=4 3466 B11R1.344 CS(=O)(=O)CCNC1CCC1 2230a_100000749019_100000731031 [0,0,0,0,2,0|1,0,0]=3 3467 B11R1.344 CS(=O)(=O)CCNC1CCC1 270004a_100000740961_100000241760 [0,0,0,0,2,0|1,0,0]=3 3468 B11R1.344 CS(=O)(=O)CCNC1CCC1 34a_100000740961_100000749161 [0,0,0,0,2,0|1,0,0]=3 3469 B11R1.344 CS(=O)(=O)CCNC1CCC1 34a_100000749019_100000731031 [0,0,0,0,2,0|1,0,0]=3 3470 B11R1.344 CS(=O)(=O)CCNC1COC1 2230a_100016991112_100000731031 [0,0,0,0,2,0|2,0,0]=4 3471 B11R1.344 CS(=O)(=O)CCNC1COC1 34a_100000740961_100009818527 [0,0,0,0,2,0|2,0,0]=4 3472 B11R1.344 CS(=O)(=O)CCOC1CCC1 34a_100000211924_100000749161 [0,0,0,0,2,0|2,0,0]=4 3473 B11R1.344 CS(=O)(=O)CCOC1CCC1 34a_100000748187_100000731031 [0,0,0,0,2,0|2,0,0]=4 3474 B11R1.344 CS(=O)(=O)CCSC1CCC1 62a_100000731031_100000749161 [0,0,0,0,2,0|2,0,0]=4 3475 B11R1.344 NS(=O)(=O)CCNC1CCC1 270004a_100000738205_100000241760 [0,0,0,0,2,0|1,0,0]=3 3476 B11R1.344 NS(=O)(=O)CCNC1CCC1 34a_100000738205_100000749161 [0,0,0,0,2,0|1,0,0]=3 3477 B11R1.344 NS(=O)(=O)CCNC1COC1 34a_100000738205_100009818527 [0,0,0,0,2,0|2,0,0]=4 3478 B11R1.344 NS(=O)(=O)CCOC1CCC1 34a_100012334274_100000749161 [0,0,0,0,2,0|2,0,0]=4 3479 B11R1.344 O=S(=O)([O-])CCNC1CCC1 2230a_100000749019_100000737633 [0,0,0,0,2,0|0,0,1]=3 3480 B11R1.344 O=S(=O)([O-])CCNC1CCC1 34a_100000749019_100000762736 [0,0,0,0,2,0|0,0,1]=3 3481 B11R1.344 O=S(=O)([O-])CCNC1COC1 2230a_100016991112_100000737633 [0,0,0,0,2,0|1,0,1]=4 3482 B11R1.344 O=S(=O)([O-])CCOC1CCC1 34a_100000748187_100000762736 [0,0,0,0,2,0|1,0,1]=4 3483 B11R1.344 O=S(=O)([O-])CCSC1CCC1 62a_100000762736_100000749161 [0,0,0,0,2,0|1,0,1]=4 3484 B11R1.510 CS(=O)(=O)CCN1CCCC1 2230a_100000188435_100000731031 [0,0,0,0,2,0|2,0,0]=4 3485 B11R1.510 CS(=O)(=O)CCN1CCCC1 269982a_100000188435_100000731031 [0,0,0,0,2,0|2,0,0]=4 3486 B11R1.510 CS(=O)(=O)NCC1CCCC1 40a_100000737975_100000738038 [0,0,0,0,2,0|2,0,0]=4 3487 B11R1.510 CS(=O)(=O)NNC1CCCC1 40a_100000737850_100000738038 [0,0,0,0,2,0|2,0,0]=4 3488 B11R1.510 NS(=O)(=O)CSC1CCCC1 62a_100000741382_100000179811 [0,0,0,0,2,0|2,0,0]=4 3489 B11R1.510 NS(=O)(=O)CSC1CCCC1 62a_100011217020_100000741382 [0,0,0,0,2,0|2,0,0]=4 3490 B11R1.510 O=S(=O)([O-])CCN1CCCC1 2230a_100000188435_100000737633 [0,0,0,0,2,0|1,0,1]=4 3491 B11R1.510 O=S(=O)([O-])CNC1CCCC1 34a_100000211070_100009817235 [0,0,0,0,2,0|0,0,1]=3 3492 B11R1.510 O=S(=O)([O-])CN[C@H]1CCOC1 34a_100015188467_100009817235 [0,0,0,0,2,0|1,0,1]=4 3493 B11R1.510 O=S(=O)([O-])COC1CCCC1 34a_100000210269_100009817235 [0,0,0,0,2,0|1,0,1]=4 3494 B11R1.510 O=S(=O)([O-])CSC1CCCC1 62a_100009817235_100000179811 [0,0,0,0,2,0|1,0,1]=4 3495 B11R1.510 O=S(=O)([O-])CSC1CCCC1 62a_100011217020_100009817235 [0,0,0,0,2,0|1,0,1]=4 3496 B11R1.509 CS(=O)(=O)NC1CCCCC1 40a_100000182618_100000738038 [0,0,0,0,2,0|1,0,0]=3 3497 B11R1.509 CS(=O)(=O)NC1CCCOC1 40a_100000719290_100000738038 [0,0,0,0,2,0|2,0,0]=4 3498 B11R1.509 CS(=O)(=O)NC1CCOCC1 40a_100000741149_100000738038 [0,0,0,0,2,0|2,0,0]=4 3499 B11R1.509 CS(=O)(=O)NC1CCSCC1 40a_100000748639_100000738038 [0,0,0,0,2,0|2,0,0]=4 3500 B13R0.316 CCC(COC)NCCCS(=O)(=O)C 2230a_100000757820_100000754308 [0,0,1,0,0,1|2,0,0]=4 3501 B13R0.316 CCC(COC)NCCCS(=O)(=O)C 270004a_100000742409_100000757811 [0,0,1,0,0,1|2,0,0]=4 3502 B13R0.316 CCC(COC)NCCCS(=O)(=O)N 2230a_100000757820_100000750626 [0,0,1,0,0,1|2,0,0]=4 3503 B13R0.316 CCC(COC)NCCNS(=O)(=O)C 2230a_100000757820_100000754112 [0,0,1,0,0,1|2,0,0]=4 3504 B13R0.316 CCC(COC)NCCNS(=O)(=O)C 270004a_100000752411_100000757811 [0,0,1,0,0,1|2,0,0]=4 3505 B13R0.316 CCC(COC)NCCOS(=O)(=O)C 2230a_100000757820_200000036756 [0,0,1,0,0,1|2,0,0]=4 3506 B13R0.316 CCCC(CC)NCCCS(=O)(=O)C 2230a_100000747048_100000754308 [0,0,1,0,0,1|1,0,0]=3 3507 B13R0.316 CCCC(CC)NCCCS(=O)(=O)C 270004a_100000742409_100000687865 [0,0,1,0,0,1|1,0,0]=3 3508 B13R0.316 CCCC(CC)NCCCS(=O)(=O)N 2230a_100000747048_100000750626 [0,0,1,0,0,1|1,0,0]=3 3509 B13R0.316 CCCC(CC)NCCNS(=O)(=O)C 2230a_100000747048_100000754112 [0,0,1,0,0,1|1,0,0]=3 3510 B13R0.316 CCCC(CC)NCCNS(=O)(=O)C 270004a_100000752411_100000687865 [0,0,1,0,0,1|1,0,0]=3 3511 B13R0.316 CCCC(CC)NCCOS(=O)(=O)C 2230a_100000747048_200000036756 [0,0,1,0,0,1|1,0,0]=3 3512 B13R0.316 CCCC(CC)OCCCS(=O)(=O)C 34a_100000687864_100000754308 [0,0,1,0,0,1|2,0,0]=4 3513 B13R0.316 CCCC(CC)OCCCS(=O)(=O)C 7a_100000687864_100000754308 [0,0,1,0,0,1|2,0,0]=4 3514 B13R0.316 CCCC(CC)OCCCS(=O)(=O)C 7a_100000689940_100011219200 [0,0,1,0,0,1|2,0,0]=4 3515 B13R0.316 CCCC(CC)OCCCS(=O)(=O)N 34a_100000687864_100000750626 [0,0,1,0,0,1|2,0,0]=4 3516 B13R0.316 CCCC(CC)OCCCS(=O)(=O)N 7a_100000687864_100000750626 [0,0,1,0,0,1|2,0,0]=4 3517 B13R0.316 CCCC(CC)OCCCS(=O)(=O)[O-] 34a_100000687864_100009813499 [0,0,1,0,0,1|1,0,1]=4 3518 B13R0.316 CCCC(CC)OCCNS(=O)(=O)C 7a_100000687864_100000754112 [0,0,1,0,0,1|2,0,0]=4 3519 B13R0.316 CCCC(CC)OCCOS(=O)(=O)C 34a_100000687864_200000036756 [0,0,1,0,0,1|2,0,0]=4 3520 B13R0.316 CCCC(CC)OCCOS(=O)(=O)C 7a_100000687864_200000036756 [0,0,1,0,0,1|2,0,0]=4 3521 B13R0.316 CCCC(CC)SCCCS(=O)(=O)C 62a_100000754308_100011219200 [0,0,1,0,0,1|2,0,0]=4 3522 B13R0.316 CCCC(CC)SCCCS(=O)(=O)C 62a_100011219200_100000754308 [0,0,1,0,0,1|2,0,0]=4 3523 B13R0.316 CCCC(CC)SCCCS(=O)(=O)N 62a_100000750626_100011219200 [0,0,1,0,0,1|2,0,0]=4 3524 B13R0.316 CCCC(CC)SCCCS(=O)(=O)N 62a_100011219200_100000750626 [0,0,1,0,0,1|2,0,0]=4 3525 B13R0.316 CCCC(CC)SCCCS(=O)(=O)[O-] 62a_100009813499_100011219200 [0,0,1,0,0,1|1,0,1]=4 3526 B13R0.316 CCCC(CC)SCCCS(=O)(=O)[O-] 62a_100011219200_100009813499 [0,0,1,0,0,1|1,0,1]=4 3527 B13R0.316 CCCC(CC)SCCNS(=O)(=O)C 62a_100000754112_100011219200 [0,0,1,0,0,1|2,0,0]=4 3528 B13R0.316 CCCC(CC)SCCNS(=O)(=O)C 62a_100011219200_100000754112 [0,0,1,0,0,1|2,0,0]=4 3529 B13R0.316 CCCC(CC)SCCOS(=O)(=O)C 62a_100011219200_200000036756 [0,0,1,0,0,1|2,0,0]=4 3530 B13R0.316 CCCC(CC)SCCOS(=O)(=O)C 62a_200000036756_100011219200 [0,0,1,0,0,1|2,0,0]=4 3531 B13R0.316 CCC[C@@H](CO)NCCCS(=O)(=O)C 2230a_100000732646_100000754308 [0,0,1,0,0,1|2,0,0]=4 3532 B13R0.316 CCC[C@@H](CO)NCCCS(=O)(=O)C 34a_100000732646_100000754308 [0,0,1,0,0,1|2,0,0]=4 3533 B13R0.316 CCC[C@@H](CO)NCCCS(=O)(=O)N 2230a_100000732646_100000750626 [0,0,1,0,0,1|2,0,0]=4 3534 B13R0.316 CCC[C@@H](CO)NCCCS(=O)(=O)N 34a_100000732646_100000750626 [0,0,1,0,0,1|2,0,0]=4 3535 B13R0.316 CCC[C@@H](CO)NCCCS(=O)(=O)[O-] 34a_100000732646_100009813499 [0,0,1,0,0,1|1,0,1]=4 3536 B13R0.316 CCC[C@@H](CO)NCCNS(=O)(=O)C 2230a_100000732646_100000754112 [0,0,1,0,0,1|2,0,0]=4 3537 B13R0.316 CCC[C@@H](CO)NCCOS(=O)(=O)C 2230a_100000732646_200000036756 [0,0,1,0,0,1|2,0,0]=4 3538 B13R0.316 CCC[C@@H](CO)NCCOS(=O)(=O)C 34a_100000732646_200000036756 [0,0,1,0,0,1|2,0,0]=4 3539 B13R0.316 CCOC(CC)CNCCS(=O)(=O)C 2230a_100015183923_100000731031 [0,0,1,0,0,1|2,0,0]=4 3540 B13R0.316 CCOC(CC)CNCCS(=O)(=O)C 34a_100015183923_100000731031 [0,0,1,0,0,1|2,0,0]=4 3541 B13R0.316 CCOC(CC)CNCCS(=O)(=O)[O-] 2230a_100015183923_100000737633 [0,0,1,0,0,1|1,0,1]=4 3542 B13R0.316 CCOC(CC)CNCCS(=O)(=O)[O-] 34a_100015183923_100000762736 [0,0,1,0,0,1|1,0,1]=4 3543 B13R1.337 CC(=O)CCCNC1CCCCC1 34a_100000182618_100000685027 [1,0,0,0,0,1|2,0,0]=4 3544 B13R1.337 CC(=O)NCCNC1CCCCC1 2230a_100000182618_100000189650 [1,0,0,0,0,1|2,0,0]=4 3545 B13R1.337 CC(=O)OCCNC1CCCCC1 34a_100000182618_100009814007 [1,0,0,0,0,1|2,0,0]=4 3546 B13R1.337 CC(O)CCCNC1CCCCC1 2230a_100000182618_200000718107 [1,0,0,0,0,1|2,0,0]=4 3547 B13R1.337 CC(O)CCCNC1CCCCC1 34a_100000182618_200000718107 [1,0,0,0,0,1|2,0,0]=4 3548 B13R1.337 CC(O)CCNCC1CCCCC1 2230a_100000210473_100012276601 [1,0,0,0,0,1|2,0,0]=4 3549 B13R1.337 CC(O)CCNCC1CCCCC1 2230a_200000755665_100000211423 [1,0,0,0,0,1|2,0,0]=4 3550 B13R1.337 CC(O)CCNCC1CCCCC1 269862a_200000755665_100000211278 [1,0,0,0,0,1|2,0,0]=4 3551 B13R1.337 CC(O)CCNCC1CCCCC1 34a_100000210473_100012276601 [1,0,0,0,0,1|2,0,0]=4 3552 B13R1.337 CS(=O)CCCNC1CCCCC1 270004a_200000753449_100000210434 [1,0,0,0,0,1|1,0,1]=4 3553 B13R1.337 NC(=O)CCCNC1CCCCC1 34a_100000182618_100102525003 [1,0,0,0,0,1|2,0,0]=4 3554 B13R1.337 NC(=O)CCCNC1CCCCC1 34a_100000739312_100000210327 [1,0,0,0,0,1|2,0,0]=4 3555 B13R1.337 NC(=O)CCNCC1CCCCC1 2230a_100000210473_100000744528 [1,0,0,0,0,1|2,0,0]=4 3556 B13R1.337 NC(=O)CCNCC1CCCCC1 269862a_100000740010_100000211278 [1,0,0,0,0,1|2,0,0]=4 3557 B13R1.337 NC(=O)CCNCC1CCCCC1 34a_100000210473_100000731001 [1,0,0,0,0,1|2,0,0]=4 3558 B13R1.337 NC(=O)NCCNC1CCCCC1 2230a_100000182618_200000034859 [1,0,0,0,0,1|2,0,0]=4 3559 B13R1.337 NC(=O)NCCNC1CCCCC1 34a_100020590234_100000210327 [1,0,0,0,0,1|2,0,0]=4 3560 B13R1.337 NC(=O)OCCNC1CCCCC1 34a_100000182618_200011214921 [1,0,0,0,0,1|2,0,0]=4 3561 B13R1.337 O=C(O)CNCCC1CCCCC1 269956a_100016091260_100011273959 [1,0,0,0,0,1|2,0,0]=4 3562 B13R1.337 O=C(O)CNCOC1CCCCC1 269956a_100016091260_100011935260 [1,0,0,0,0,1|2,0,0]=4 3563 B13R1.337 O=C(O)CONCC1CCCCC1 269956a_100000106656_100000211423 [1,0,0,0,0,1|2,0,0]=4 3564 B13R1.1988 CC(O)CCNC1CCCCCC1 2230a_100000210984_100012276601 [1,0,0,0,0,1|2,0,0]=4 3565 B13R1.1988 CC(O)CCNC1CCCCCC1 270004a_200000755665_100000210131 [1,0,0,0,0,1|2,0,0]=4 3566 B13R1.1988 CC(O)CCNC1CCCCCC1 34a_100000210984_100012276601 [1,0,0,0,0,1|2,0,0]=4 3567 B13R1.1988 CC(O)CCNC1CCCNCC1 270004a_200000755665_100015187895 [1,0,0,0,0,1|2,0,0]=4 3568 B13R1.1988 NC(=O)CCNC1CCCCCC1 2230a_100000210984_100000744528 [1,0,0,0,0,1|2,0,0]=4 3569 B13R1.1988 NC(=O)CCNC1CCCCCC1 34a_100000210984_100000731001 [1,0,0,0,0,1|2,0,0]=4 3570 B13R1.1988 O=C(O)CONC1CCCCCC1 269956a_100000106656_100011217769 [1,0,0,0,0,1|2,0,0]=4 3571 B15R1.3890 CS(=O)(=O)CCCNCC1CCCCC1 2230a_100000210473_100000754308 [0,0,0,0,0,2|1,0,0]=3 3572 B15R1.3890 CS(=O)(=O)CCCNCC1CCCCC1 2230a_100000742409_100000211423 [0,0,0,0,0,2|1,0,0]=3 3573 B15R1.3890 CS(=O)(=O)CCCNCC1CCCCC1 269862a_100000742409_100000211278 [0,0,0,0,0,2|1,0,0]=3 3574 B15R1.3890 CS(=O)(=O)CCCNCC1CCCCC1 34a_100000210473_100000754308 [0,0,0,0,0,2|1,0,0]=3 3575 B15R1.3890 CS(=O)(=O)CCCNCC1CCCCC1 34a_100000742409_100000211423 [0,0,0,0,0,2|1,0,0]=3 3576 B15R1.3890 CS(=O)(=O)CCCNCC1CCCCO1 2230a_100000174945_100000754308 [0,0,0,0,0,2|2,0,0]=4 3577 B15R1.3890 CS(=O)(=O)CCCNCC1CCCCO1 2230a_100000742409_100000211543 [0,0,0,0,0,2|2,0,0]=4 3578 B15R1.3890 CS(=O)(=O)CCCNCC1CCCCO1 34a_100000174945_100000754308 [0,0,0,0,0,2|2,0,0]=4 3579 B15R1.3890 CS(=O)(=O)CCCNCC1CCCCO1 34a_100000742409_100000211543 [0,0,0,0,0,2|2,0,0]=4 3580 B15R1.3890 CS(=O)(=O)CCCNCC1CCCOC1 2230a_100000720124_100000754308 [0,0,0,0,0,2|2,0,0]=4 3581 B15R1.3890 CS(=O)(=O)CCCNCC1CCCOC1 2230a_100000742409_100000741521 [0,0,0,0,0,2|2,0,0]=4 3582 B15R1.3890 CS(=O)(=O)CCCNCC1CCCOC1 34a_100000720124_100000754308 [0,0,0,0,0,2|2,0,0]=4 3583 B15R1.3890 CS(=O)(=O)CCCNCC1CCCOC1 34a_100000742409_100000741521 [0,0,0,0,0,2|2,0,0]=4 3584 B15R1.3890 CS(=O)(=O)CCCNCC1CCOCC1 2230a_100000742409_100000754603 [0,0,0,0,0,2|2,0,0]=4 3585 B15R1.3890 CS(=O)(=O)CCCNCC1CCOCC1 2230a_100000746373_100000754308 [0,0,0,0,0,2|2,0,0]=4 3586 B15R1.3890 CS(=O)(=O)CCCNCC1CCOCC1 269862a_100000742409_100000749017 [0,0,0,0,0,2|2,0,0]=4 3587 B15R1.3890 CS(=O)(=O)CCCNCC1CCOCC1 34a_100000742409_100000754603 [0,0,0,0,0,2|2,0,0]=4 3588 B15R1.3890 CS(=O)(=O)CCCNCC1CCOCC1 34a_100000746373_100000754308 [0,0,0,0,0,2|2,0,0]=4 3589 B15R1.3890 CS(=O)(=O)CCCNCC1CCSCC1 2230a_100015188806_100000754308 [0,0,0,0,0,2|2,0,0]=4 3590 B15R1.3890 CS(=O)(=O)CCCNCC1CCSCC1 269862a_100000742409_100000067145 [0,0,0,0,0,2|2,0,0]=4 3591 B15R1.3890 CS(=O)(=O)CCCNCC1CCSCC1 270004a_100000742409_100000067145 [0,0,0,0,0,2|2,0,0]=4 3592 B15R1.3890 CS(=O)(=O)CCCNCC1CCSCC1 34a_100015188806_100000754308 [0,0,0,0,0,2|2,0,0]=4 3593 B15R1.3890 CS(=O)(=O)CCCOCC1CCCCC1 34a_100000212181_100000754308 [0,0,0,0,0,2|2,0,0]=4 3594 B15R1.3890 CS(=O)(=O)CCCOCC1CCCCC1 34a_100000689940_100000211423 [0,0,0,0,0,2|2,0,0]=4 3595 B15R1.3890 CS(=O)(=O)CCCOCC1CCCCC1 7a_100000212181_100000754308 [0,0,0,0,0,2|2,0,0]=4 3596 B15R1.3890 CS(=O)(=O)CCCOCC1CCCCC1 7a_100000689940_100000211423 [0,0,0,0,0,2|2,0,0]=4 3597 B15R1.3890 CS(=O)(=O)CCCSCC1CCCCC1 62a_100000211423_100000754308 [0,0,0,0,0,2|2,0,0]=4 3598 B15R1.3890 CS(=O)(=O)CCCSCC1CCCCC1 62a_100000754308_100000211423 [0,0,0,0,0,2|2,0,0]=4 3599 B15R1.3890 CS(=O)(=O)CCNCCC1CCCCC1 2230a_100000738074_100000731031 [0,0,0,0,0,2|1,0,0]=3 3600 B15R1.3890 CS(=O)(=O)CCNCCC1CCCCC1 2230a_100000740961_100012355289 [0,0,0,0,0,2|1,0,0]=3 3601 B15R1.3890 CS(=O)(=O)CCNCCC1CCCCC1 270004a_100000740961_100011713444 [0,0,0,0,0,2|1,0,0]=3 3602 B15R1.3890 CS(=O)(=O)CCNCCC1CCCCC1 34a_100000738074_100000731031 [0,0,0,0,0,2|1,0,0]=3 3603 B15R1.3890 CS(=O)(=O)CCNCCC1CCCCC1 34a_100000740961_100011209188 [0,0,0,0,0,2|1,0,0]=3 3604 B15R1.3890 CS(=O)(=O)CCNCCC1CCCCO1 2230a_100015183643_100000731031 [0,0,0,0,0,2|2,0,0]=4 3605 B15R1.3890 CS(=O)(=O)CCNCCC1CCCCO1 34a_100015183643_100000731031 [0,0,0,0,0,2|2,0,0]=4 3606 B15R1.3890 CS(=O)(=O)CCNCCC1CCOCC1 2230a_100000740961_100011934994 [0,0,0,0,0,2|2,0,0]=4 3607 B15R1.3890 CS(=O)(=O)CCNCCC1CCOCC1 2230a_100000755988_100000731031 [0,0,0,0,0,2|2,0,0]=4 3608 B15R1.3890 CS(=O)(=O)CCNCCC1CCOCC1 34a_100000740961_100011934994 [0,0,0,0,0,2|2,0,0]=4 3609 B15R1.3890 CS(=O)(=O)CCNCCC1CCOCC1 34a_100000755988_100000731031 [0,0,0,0,0,2|2,0,0]=4 3610 B15R1.3890 CS(=O)(=O)CCNCCN1CCCCC1 2230a_100000740961_100000739454 [0,0,0,0,0,2|2,0,0]=4 3611 B15R1.3890 CS(=O)(=O)CCNCCN1CCCCC1 34a_100000740961_100000739454 [0,0,0,0,0,2|2,0,0]=4 3612 B15R1.3890 CS(=O)(=O)CCNCOC1CCCCC1 2230a_100000740961_100011935260 [0,0,0,0,0,2|1,0,0]=3 3613 B15R1.3890 CS(=O)(=O)CCNCOC1CCCCC1 34a_100000740961_100011935260 [0,0,0,0,0,2|1,0,0]=3 3614 B15R1.3890 CS(=O)(=O)CCOCCC1CCCCC1 34a_100000211924_100011209188 [0,0,0,0,0,2|2,0,0]=4 3615 B15R1.3890 CS(=O)(=O)CCOCCC1CCCCC1 34a_100011217863_100000731031 [0,0,0,0,0,2|2,0,0]=4 3616 B15R1.3890 CS(=O)(=O)CCOCCC1CCCCC1 7a_100000211924_100011273959 [0,0,0,0,0,2|2,0,0]=4 3617 B15R1.3890 CS(=O)(=O)CCOCCC1CCCCC1 7a_100011217863_100000230027 [0,0,0,0,0,2|2,0,0]=4 3618 B15R1.3890 CS(=O)(=O)CCOCOC1CCCCC1 34a_100000211924_100011935260 [0,0,0,0,0,2|2,0,0]=4 3619 B15R1.3890 CS(=O)(=O)CCOCOC1CCCCC1 7a_100000211924_100011935260 [0,0,0,0,0,2|2,0,0]=4 3620 B15R1.3890 CS(=O)(=O)CCSCCC1CCCCC1 62a_100000731031_100012355289 [0,0,0,0,0,2|2,0,0]=4 3621 B15R1.3890 CS(=O)(=O)CCSCCC1CCCCC1 62a_100012355289_100000230027 [0,0,0,0,0,2|2,0,0]=4 3622 B15R1.3890 CS(=O)(=O)CCSCOC1CCCCC1 62a_100000731031_100011935260 [0,0,0,0,0,2|2,0,0]=4 3623 B15R1.3890 CS(=O)(=O)CCSCOC1CCCCC1 62a_100011935260_100000230027 [0,0,0,0,0,2|2,0,0]=4 3624 B15R1.3890 CS(=O)(=O)NCCCNC1CCCCC1 270004a_100000736790_100000210434 [0,0,0,0,0,2|1,0,0]=3 3625 B15R1.3890 CS(=O)(=O)NCCCNC1CCCCC1 34a_100000736790_100000210327 [0,0,0,0,0,2|1,0,0]=3 3626 B15R1.3890 CS(=O)(=O)NCCCNC1CCCOC1 270004a_100000736790_100000753404 [0,0,0,0,0,2|2,0,0]=4 3627 B15R1.3890 CS(=O)(=O)NCCCNC1CCCOC1 34a_100000736790_100000693364 [0,0,0,0,0,2|2,0,0]=4 3628 B15R1.3890 CS(=O)(=O)NCCCNC1CCCSC1 270004a_100000736790_100000057913 [0,0,0,0,0,2|2,0,0]=4 3629 B15R1.3890 CS(=O)(=O)NCCCNC1CCNCC1 270004a_100000736790_100015192401 [0,0,0,0,0,2|2,0,0]=4 3630 B15R1.3890 CS(=O)(=O)NCCCNC1CCOCC1 270004a_100000736790_100011217826 [0,0,0,0,0,2|2,0,0]=4 3631 B15R1.3890 CS(=O)(=O)NCCCNC1CCSCC1 270004a_100000736790_100000203788 [0,0,0,0,0,2|2,0,0]=4 3632 B15R1.3890 CS(=O)(=O)NCCCNC1CCSCC1 34a_100000736790_100000069128 [0,0,0,0,0,2|2,0,0]=4 3633 B15R1.3890 CS(=O)(=O)NCCCOC1CCCCC1 40a_100000205933_100000738038 [0,0,0,0,0,2|2,0,0]=4 3634 B15R1.3890 CS(=O)(=O)NCCNCC1CCCCC1 2230a_100000210473_100000754112 [0,0,0,0,0,2|1,0,0]=3 3635 B15R1.3890 CS(=O)(=O)NCCNCC1CCCCC1 269862a_100000752411_100000211278 [0,0,0,0,0,2|1,0,0]=3 3636 B15R1.3890 CS(=O)(=O)NCCNCC1CCCCC1 34a_100000752411_100000211423 [0,0,0,0,0,2|1,0,0]=3 3637 B15R1.3890 CS(=O)(=O)NCCNCC1CCCCO1 2230a_100000174945_100000754112 [0,0,0,0,0,2|2,0,0]=4 3638 B15R1.3890 CS(=O)(=O)NCCNCC1CCCCO1 34a_100000752411_100000211543 [0,0,0,0,0,2|2,0,0]=4 3639 B15R1.3890 CS(=O)(=O)NCCNCC1CCCOC1 2230a_100000720124_100000754112 [0,0,0,0,0,2|2,0,0]=4 3640 B15R1.3890 CS(=O)(=O)NCCNCC1CCCOC1 34a_100000752411_100000741521 [0,0,0,0,0,2|2,0,0]=4 3641 B15R1.3890 CS(=O)(=O)NCCNCC1CCOCC1 2230a_100000746373_100000754112 [0,0,0,0,0,2|2,0,0]=4 3642 B15R1.3890 CS(=O)(=O)NCCNCC1CCOCC1 269862a_100000752411_100000749017 [0,0,0,0,0,2|2,0,0]=4 3643 B15R1.3890 CS(=O)(=O)NCCNCC1CCOCC1 34a_100000752411_100000754603 [0,0,0,0,0,2|2,0,0]=4 3644 B15R1.3890 CS(=O)(=O)NCCNCC1CCSCC1 2230a_100015188806_100000754112 [0,0,0,0,0,2|2,0,0]=4 3645 B15R1.3890 CS(=O)(=O)NCCNCC1CCSCC1 269862a_100000752411_100000067145 [0,0,0,0,0,2|2,0,0]=4 3646 B15R1.3890 CS(=O)(=O)NCCNCC1CCSCC1 270004a_100000752411_100000067145 [0,0,0,0,0,2|2,0,0]=4 3647 B15R1.3890 CS(=O)(=O)NCCOCC1CCCCC1 7a_100000212181_100000754112 [0,0,0,0,0,2|2,0,0]=4 3648 B15R1.3890 CS(=O)(=O)NCCSCC1CCCCC1 62a_100000211423_100000754112 [0,0,0,0,0,2|2,0,0]=4 3649 B15R1.3890 CS(=O)(=O)NCCSCC1CCCCC1 62a_100000754112_100000211423 [0,0,0,0,0,2|2,0,0]=4 3650 B15R1.3890 CS(=O)(=O)OCCNCC1CCCCC1 2230a_100000210473_200000036756 [0,0,0,0,0,2|1,0,0]=3 3651 B15R1.3890 CS(=O)(=O)OCCNCC1CCCCC1 34a_100000210473_200000036756 [0,0,0,0,0,2|1,0,0]=3 3652 B15R1.3890 CS(=O)(=O)OCCNCC1CCCCO1 2230a_100000174945_200000036756 [0,0,0,0,0,2|2,0,0]=4 3653 B15R1.3890 CS(=O)(=O)OCCNCC1CCCCO1 34a_100000174945_200000036756 [0,0,0,0,0,2|2,0,0]=4 3654 B15R1.3890 CS(=O)(=O)OCCNCC1CCCOC1 2230a_100000720124_200000036756 [0,0,0,0,0,2|2,0,0]=4 3655 B15R1.3890 CS(=O)(=O)OCCNCC1CCCOC1 34a_100000720124_200000036756 [0,0,0,0,0,2|2,0,0]=4 3656 B15R1.3890 CS(=O)(=O)OCCNCC1CCOCC1 2230a_100000746373_200000036756 [0,0,0,0,0,2|2,0,0]=4 3657 B15R1.3890 CS(=O)(=O)OCCNCC1CCOCC1 34a_100000746373_200000036756 [0,0,0,0,0,2|2,0,0]=4 3658 B15R1.3890 CS(=O)(=O)OCCNCC1CCSCC1 2230a_100015188806_200000036756 [0,0,0,0,0,2|2,0,0]=4 3659 B15R1.3890 CS(=O)(=O)OCCNCC1CCSCC1 34a_100015188806_200000036756 [0,0,0,0,0,2|2,0,0]=4 3660 B15R1.3890 CS(=O)(=O)OCCOCC1CCCCC1 34a_100000212181_200000036756 [0,0,0,0,0,2|2,0,0]=4 3661 B15R1.3890 CS(=O)(=O)OCCOCC1CCCCC1 7a_100000212181_200000036756 [0,0,0,0,0,2|2,0,0]=4 3662 B15R1.3890 CS(=O)(=O)OCCSCC1CCCCC1 62a_100000211423_200000036756 [0,0,0,0,0,2|2,0,0]=4 3663 B15R1.3890 CS(=O)(=O)OCCSCC1CCCCC1 62a_200000036756_100000211423 [0,0,0,0,0,2|2,0,0]=4 3664 B15R1.3890 NS(=O)(=O)CCCNCC1CCCCC1 2230a_100000210473_100000750626 [0,0,0,0,0,2|1,0,0]=3 3665 B15R1.3890 NS(=O)(=O)CCCNCC1CCCCC1 34a_100000210473_100000750626 [0,0,0,0,0,2|1,0,0]=3 3666 B15R1.3890 NS(=O)(=O)CCCNCC1CCCCO1 2230a_100000174945_100000750626 [0,0,0,0,0,2|2,0,0]=4 3667 B15R1.3890 NS(=O)(=O)CCCNCC1CCCCO1 34a_100000174945_100000750626 [0,0,0,0,0,2|2,0,0]=4 3668 B15R1.3890 NS(=O)(=O)CCCNCC1CCCOC1 2230a_100000720124_100000750626 [0,0,0,0,0,2|2,0,0]=4 3669 B15R1.3890 NS(=O)(=O)CCCNCC1CCCOC1 34a_100000720124_100000750626 [0,0,0,0,0,2|2,0,0]=4 3670 B15R1.3890 NS(=O)(=O)CCCNCC1CCOCC1 2230a_100000746373_100000750626 [0,0,0,0,0,2|2,0,0]=4 3671 B15R1.3890 NS(=O)(=O)CCCNCC1CCOCC1 34a_100000746373_100000750626 [0,0,0,0,0,2|2,0,0]=4 3672 B15R1.3890 NS(=O)(=O)CCCNCC1CCSCC1 2230a_100015188806_100000750626 [0,0,0,0,0,2|2,0,0]=4 3673 B15R1.3890 NS(=O)(=O)CCCNCC1CCSCC1 34a_100015188806_100000750626 [0,0,0,0,0,2|2,0,0]=4 3674 B15R1.3890 NS(=O)(=O)CCCOCC1CCCCC1 34a_100000212181_100000750626 [0,0,0,0,0,2|2,0,0]=4 3675 B15R1.3890 NS(=O)(=O)CCCOCC1CCCCC1 7a_100000212181_100000750626 [0,0,0,0,0,2|2,0,0]=4 3676 B15R1.3890 NS(=O)(=O)CCCSCC1CCCCC1 62a_100000211423_100000750626 [0,0,0,0,0,2|2,0,0]=4 3677 B15R1.3890 NS(=O)(=O)CCCSCC1CCCCC1 62a_100000750626_100000211423 [0,0,0,0,0,2|2,0,0]=4 3678 B15R1.3890 NS(=O)(=O)CCNCCC1CCCCC1 2230a_100000738205_100012355289 [0,0,0,0,0,2|1,0,0]=3 3679 B15R1.3890 NS(=O)(=O)CCNCCC1CCCCC1 270004a_100000738205_100011713444 [0,0,0,0,0,2|1,0,0]=3 3680 B15R1.3890 NS(=O)(=O)CCNCCC1CCCCC1 34a_100000738205_100011209188 [0,0,0,0,0,2|1,0,0]=3 3681 B15R1.3890 NS(=O)(=O)CCNCCC1CCOCC1 2230a_100000738205_100011934994 [0,0,0,0,0,2|2,0,0]=4 3682 B15R1.3890 NS(=O)(=O)CCNCCC1CCOCC1 34a_100000738205_100011934994 [0,0,0,0,0,2|2,0,0]=4 3683 B15R1.3890 NS(=O)(=O)CCNCCN1CCCCC1 2230a_100000738205_100000739454 [0,0,0,0,0,2|2,0,0]=4 3684 B15R1.3890 NS(=O)(=O)CCNCCN1CCCCC1 34a_100000738205_100000739454 [0,0,0,0,0,2|2,0,0]=4 3685 B15R1.3890 NS(=O)(=O)CCNCOC1CCCCC1 2230a_100000738205_100011935260 [0,0,0,0,0,2|1,0,0]=3 3686 B15R1.3890 NS(=O)(=O)CCNCOC1CCCCC1 34a_100000738205_100011935260 [0,0,0,0,0,2|1,0,0]=3 3687 B15R1.3890 NS(=O)(=O)CCOCCC1CCCCC1 34a_100012334274_100011209188 [0,0,0,0,0,2|2,0,0]=4 3688 B15R1.3890 NS(=O)(=O)CCOCOC1CCCCC1 34a_100012334274_100011935260 [0,0,0,0,0,2|2,0,0]=4 3689 B15R1.3890 NS(=O)(=O)CSCCCC1CCCCC1 62a_100000741382_100011713725 [0,0,0,0,0,2|2,0,0]=4 3690 B15R1.3890 NS(=O)(=O)CSCCCC1CCCCC1 62a_100011713725_100000741382 [0,0,0,0,0,2|2,0,0]=4 3691 B15R1.3890 NS(=O)(=O)CSCCOC1CCCCC1 62a_100000741382_100011211530 [0,0,0,0,0,2|2,0,0]=4 3692 B15R1.3890 NS(=O)(=O)CSCCOC1CCCCC1 62a_100011211530_100000741382 [0,0,0,0,0,2|2,0,0]=4 3693 B15R1.3890 O=S(=O)([O-])CCCNCC1CCCCC1 34a_100000210473_100009813499 [0,0,0,0,0,2|0,0,1]=3 3694 B15R1.3890 O=S(=O)([O-])CCCNCC1CCCCO1 34a_100000174945_100009813499 [0,0,0,0,0,2|1,0,1]=4 3695 B15R1.3890 O=S(=O)([O-])CCCNCC1CCCOC1 34a_100000720124_100009813499 [0,0,0,0,0,2|1,0,1]=4 3696 B15R1.3890 O=S(=O)([O-])CCCNCC1CCOCC1 34a_100000746373_100009813499 [0,0,0,0,0,2|1,0,1]=4 3697 B15R1.3890 O=S(=O)([O-])CCCNCC1CCSCC1 34a_100015188806_100009813499 [0,0,0,0,0,2|1,0,1]=4 3698 B15R1.3890 O=S(=O)([O-])CCCOCC1CCCCC1 34a_100000212181_100009813499 [0,0,0,0,0,2|1,0,1]=4 3699 B15R1.3890 O=S(=O)([O-])CCCSCC1CCCCC1 62a_100000211423_100009813499 [0,0,0,0,0,2|1,0,1]=4 3700 B15R1.3890 O=S(=O)([O-])CCCSCC1CCCCC1 62a_100009813499_100000211423 [0,0,0,0,0,2|1,0,1]=4 3701 B15R1.3890 O=S(=O)([O-])CCNCCC1CCCCC1 2230a_100000738074_100000737633 [0,0,0,0,0,2|0,0,1]=3 3702 B15R1.3890 O=S(=O)([O-])CCNCCC1CCCCC1 34a_100000738074_100000762736 [0,0,0,0,0,2|0,0,1]=3 3703 B15R1.3890 O=S(=O)([O-])CCNCCC1CCCCO1 2230a_100015183643_100000737633 [0,0,0,0,0,2|1,0,1]=4 3704 B15R1.3890 O=S(=O)([O-])CCNCCC1CCCCO1 34a_100015183643_100000762736 [0,0,0,0,0,2|1,0,1]=4 3705 B15R1.3890 O=S(=O)([O-])CCNCCC1CCOCC1 2230a_100000755988_100000737633 [0,0,0,0,0,2|1,0,1]=4 3706 B15R1.3890 O=S(=O)([O-])CCNCCC1CCOCC1 34a_100000755988_100000762736 [0,0,0,0,0,2|1,0,1]=4 3707 B15R1.3890 O=S(=O)([O-])CCOCCC1CCCCC1 34a_100011217863_100000762736 [0,0,0,0,0,2|1,0,1]=4 3708 B15R1.3890 O=S(=O)([O-])CCSCCC1CCCCC1 62a_100000762736_100012355289 [0,0,0,0,0,2|1,0,1]=4 3709 B15R1.3890 O=S(=O)([O-])CCSCCC1CCCCC1 62a_100012355289_100000762736 [0,0,0,0,0,2|1,0,1]=4 3710 B15R1.3890 O=S(=O)([O-])CCSCOC1CCCCC1 62a_100000762736_100011935260 [0,0,0,0,0,2|1,0,1]=4 3711 B15R1.3890 O=S(=O)([O-])CCSCOC1CCCCC1 62a_100011935260_100000762736 [0,0,0,0,0,2|1,0,1]=4 3712 B15R1.3890 O=S(=O)([O-])CNCCCC1CCCCC1 34a_100011211642_100009817235 [0,0,0,0,0,2|1,0,1]=4 3713 B15R1.3890 O=S(=O)([O-])CNCCOC1CCCCC1 34a_100015206981_100009817235 [0,0,0,0,0,2|1,0,1]=4 3714 B15R1.3890 O=S(=O)([O-])COCCCC1CCCCC1 34a_100000198086_100009817235 [0,0,0,0,0,2|1,0,1]=4 3715 B15R1.3890 O=S(=O)([O-])COCCNC1CCCCC1 34a_100000200466_100009817235 [0,0,0,0,0,2|0,0,1]=3 3716 B15R1.3890 O=S(=O)([O-])COCCNC1CCOCC1 34a_100000708129_100009817235 [0,0,0,0,0,2|1,0,1]=4 3717 B15R1.3890 O=S(=O)([O-])COCCOC1CCCCC1 34a_100011249652_100009817235 [0,0,0,0,0,2|1,0,1]=4 3718 B15R1.3890 O=S(=O)([O-])CSCCCC1CCCCC1 62a_100009817235_100011713725 [0,0,0,0,0,2|1,0,1]=4 3719 B15R1.3890 O=S(=O)([O-])CSCCCC1CCCCC1 62a_100011713725_100009817235 [0,0,0,0,0,2|1,0,1]=4 3720 B15R1.3890 O=S(=O)([O-])CSCCOC1CCCCC1 62a_100009817235_100011211530 [0,0,0,0,0,2|1,0,1]=4 3721 B15R1.3890 O=S(=O)([O-])CSCCOC1CCCCC1 62a_100011211530_100009817235 [0,0,0,0,0,2|1,0,1]=4 3722 B15R1.16600 CS(=O)(=O)CCCNC1CCCCCC1 2230a_100000210984_100000754308 [0,0,0,0,0,2|1,0,0]=3 3723 B15R1.16600 CS(=O)(=O)CCCNC1CCCCCC1 270004a_100000742409_100000210131 [0,0,0,0,0,2|1,0,0]=3 3724 B15R1.16600 CS(=O)(=O)CCCNC1CCCCCC1 34a_100000210984_100000754308 [0,0,0,0,0,2|1,0,0]=3 3725 B15R1.16600 CS(=O)(=O)CCCNC1CCCCCC1 34a_100000742409_100011217769 [0,0,0,0,0,2|1,0,0]=3 3726 B15R1.16600 CS(=O)(=O)CCCNC1CCCNCC1 270004a_100000742409_100015187895 [0,0,0,0,0,2|1,0,0]=3 3727 B15R1.16600 CS(=O)(=O)CCCNC1CSCCSC1 270004a_100000742409_100000068409 [0,0,0,0,0,2|2,0,0]=4 3728 B15R1.16600 CS(=O)(=O)CCCOC1CCCCCC1 34a_100000210887_100000754308 [0,0,0,0,0,2|2,0,0]=4 3729 B15R1.16600 CS(=O)(=O)CCCOC1CCCCCC1 34a_100000689940_100011217769 [0,0,0,0,0,2|2,0,0]=4 3730 B15R1.16600 CS(=O)(=O)CCCOC1CCCCCC1 7a_100000210887_100000754308 [0,0,0,0,0,2|2,0,0]=4 3731 B15R1.16600 CS(=O)(=O)CCCSC1CCCCCC1 62a_100000754308_100011217769 [0,0,0,0,0,2|2,0,0]=4 3732 B15R1.16600 CS(=O)(=O)CCCSC1CCCCCC1 62a_100011217769_100000754308 [0,0,0,0,0,2|2,0,0]=4 3733 B15R1.16600 CS(=O)(=O)CCNCC1CCCCCC1 2230a_100000740961_200000696569 [0,0,0,0,0,2|1,0,0]=3 3734 B15R1.16600 CS(=O)(=O)CCNCC1CCCCCC1 2230a_100015204231_100000731031 [0,0,0,0,0,2|1,0,0]=3 3735 B15R1.16600 CS(=O)(=O)CCNCC1CCCCCC1 269862a_100000740961_200000763224 [0,0,0,0,0,2|1,0,0]=3 3736 B15R1.16600 CS(=O)(=O)CCNCC1CCCCCC1 34a_100000740961_200000696569 [0,0,0,0,0,2|1,0,0]=3 3737 B15R1.16600 CS(=O)(=O)CCNCC1CCCCCC1 34a_100015204231_100000731031 [0,0,0,0,0,2|1,0,0]=3 3738 B15R1.16600 CS(=O)(=O)CCOCC1CCCCCC1 34a_100000211924_200000696569 [0,0,0,0,0,2|2,0,0]=4 3739 B15R1.16600 CS(=O)(=O)CCOCC1CCCCCC1 34a_100000699130_100000731031 [0,0,0,0,0,2|2,0,0]=4 3740 B15R1.16600 CS(=O)(=O)CCOCC1CCCCCC1 7a_100000211924_200000696569 [0,0,0,0,0,2|2,0,0]=4 3741 B15R1.16600 CS(=O)(=O)CCOCC1CCCCCC1 7a_100000699130_100000230027 [0,0,0,0,0,2|2,0,0]=4 3742 B15R1.16600 CS(=O)(=O)CCSCC1CCCCCC1 62a_100000731031_200000696569 [0,0,0,0,0,2|2,0,0]=4 3743 B15R1.16600 CS(=O)(=O)CCSCC1CCCCCC1 62a_200000696569_100000230027 [0,0,0,0,0,2|2,0,0]=4 3744 B15R1.16600 CS(=O)(=O)NCCNC1CCCCCC1 2230a_100000210984_100000754112 [0,0,0,0,0,2|1,0,0]=3 3745 B15R1.16600 CS(=O)(=O)NCCNC1CCCCCC1 270004a_100000752411_100000210131 [0,0,0,0,0,2|1,0,0]=3 3746 B15R1.16600 CS(=O)(=O)NCCNC1CCCCCC1 34a_100000752411_100011217769 [0,0,0,0,0,2|1,0,0]=3 3747 B15R1.16600 CS(=O)(=O)NCCNC1CCCNCC1 270004a_100000752411_100015187895 [0,0,0,0,0,2|1,0,0]=3 3748 B15R1.16600 CS(=O)(=O)NCCNC1CSCCSC1 270004a_100000752411_100000068409 [0,0,0,0,0,2|2,0,0]=4 3749 B15R1.16600 CS(=O)(=O)NCCOC1CCCCCC1 7a_100000210887_100000754112 [0,0,0,0,0,2|2,0,0]=4 3750 B15R1.16600 CS(=O)(=O)NCCSC1CCCCCC1 62a_100000754112_100011217769 [0,0,0,0,0,2|2,0,0]=4 3751 B15R1.16600 CS(=O)(=O)NCCSC1CCCCCC1 62a_100011217769_100000754112 [0,0,0,0,0,2|2,0,0]=4 3752 B15R1.16600 CS(=O)(=O)OCCNC1CCCCCC1 2230a_100000210984_200000036756 [0,0,0,0,0,2|1,0,0]=3 3753 B15R1.16600 CS(=O)(=O)OCCNC1CCCCCC1 34a_100000210984_200000036756 [0,0,0,0,0,2|1,0,0]=3 3754 B15R1.16600 CS(=O)(=O)OCCOC1CCCCCC1 34a_100000210887_200000036756 [0,0,0,0,0,2|2,0,0]=4 3755 B15R1.16600 CS(=O)(=O)OCCOC1CCCCCC1 7a_100000210887_200000036756 [0,0,0,0,0,2|2,0,0]=4 3756 B15R1.16600 CS(=O)(=O)OCCSC1CCCCCC1 62a_100011217769_200000036756 [0,0,0,0,0,2|2,0,0]=4 3757 B15R1.16600 CS(=O)(=O)OCCSC1CCCCCC1 62a_200000036756_100011217769 [0,0,0,0,0,2|2,0,0]=4 3758 B15R1.16600 NS(=O)(=O)CCCNC1CCCCCC1 2230a_100000210984_100000750626 [0,0,0,0,0,2|1,0,0]=3 3759 B15R1.16600 NS(=O)(=O)CCCNC1CCCCCC1 34a_100000210984_100000750626 [0,0,0,0,0,2|1,0,0]=3 3760 B15R1.16600 NS(=O)(=O)CCCOC1CCCCCC1 34a_100000210887_100000750626 [0,0,0,0,0,2|2,0,0]=4 3761 B15R1.16600 NS(=O)(=O)CCCOC1CCCCCC1 7a_100000210887_100000750626 [0,0,0,0,0,2|2,0,0]=4 3762 B15R1.16600 NS(=O)(=O)CCCSC1CCCCCC1 62a_100000750626_100011217769 [0,0,0,0,0,2|2,0,0]=4 3763 B15R1.16600 NS(=O)(=O)CCCSC1CCCCCC1 62a_100011217769_100000750626 [0,0,0,0,0,2|2,0,0]=4 3764 B15R1.16600 NS(=O)(=O)CCNCC1CCCCCC1 2230a_100000738205_200000696569 [0,0,0,0,0,2|1,0,0]=3 3765 B15R1.16600 NS(=O)(=O)CCNCC1CCCCCC1 269862a_100000738205_200000763224 [0,0,0,0,0,2|1,0,0]=3 3766 B15R1.16600 NS(=O)(=O)CCNCC1CCCCCC1 34a_100000738205_200000696569 [0,0,0,0,0,2|1,0,0]=3 3767 B15R1.16600 NS(=O)(=O)CCOCC1CCCCCC1 34a_100012334274_200000696569 [0,0,0,0,0,2|2,0,0]=4 3768 B15R1.16600 O=S(=O)([O-])CCCNC1CCCCCC1 34a_100000210984_100009813499 [0,0,0,0,0,2|0,0,1]=3 3769 B15R1.16600 O=S(=O)([O-])CCCOC1CCCCCC1 34a_100000210887_100009813499 [0,0,0,0,0,2|1,0,1]=4 3770 B15R1.16600 O=S(=O)([O-])CCCSC1CCCCCC1 62a_100009813499_100011217769 [0,0,0,0,0,2|1,0,1]=4 3771 B15R1.16600 O=S(=O)([O-])CCCSC1CCCCCC1 62a_100011217769_100009813499 [0,0,0,0,0,2|1,0,1]=4 3772 B15R1.16600 O=S(=O)([O-])CCNCC1CCCCCC1 2230a_100015204231_100000737633 [0,0,0,0,0,2|0,0,1]=3 3773 B15R1.16600 O=S(=O)([O-])CCNCC1CCCCCC1 34a_100015204231_100000762736 [0,0,0,0,0,2|0,0,1]=3 3774 B15R1.16600 O=S(=O)([O-])CCOCC1CCCCCC1 34a_100000699130_100000762736 [0,0,0,0,0,2|1,0,1]=4 3775 B15R1.16600 O=S(=O)([O-])CCSCC1CCCCCC1 62a_100000762736_200000696569 [0,0,0,0,0,2|1,0,1]=4 3776 B15R1.16600 O=S(=O)([O-])CCSCC1CCCCCC1 62a_200000696569_100000762736 [0,0,0,0,0,2|1,0,1]=4 3777 B15R1.16600 O=S(=O)([O-])CNCCC1CCCCCC1 34a_100011532351_100009817235 [0,0,0,0,0,2|1,0,1]=4 3778 B15R1.16614 CS(=O)(=O)CCNC1CC/C=C\CCC1 34a_100000740961_100021000466 [0,0,0,0,0,2|1,0,0]=3 3779 B15R1.16614 CS(=O)(=O)CCNC1CCCCCCC1 2230a_100000211152_100000731031 [0,0,0,0,0,2|1,0,0]=3 3780 B15R1.16614 CS(=O)(=O)CCNC1CCCCCCC1 270004a_100000740961_100000210524 [0,0,0,0,0,2|1,0,0]=3 3781 B15R1.16614 CS(=O)(=O)CCNC1CCCCCCC1 34a_100000211152_100000731031 [0,0,0,0,0,2|1,0,0]=3 3782 B15R1.16614 CS(=O)(=O)CCOC1C=CCCCCC1 34a_100000688657_100000731031 [0,0,0,0,0,2|2,0,0]=4 3783 B15R1.16614 CS(=O)(=O)CCOC1CC/C=C\CCC1 34a_100000211924_100021000466 [0,0,0,0,0,2|2,0,0]=4 3784 B15R1.16614 CS(=O)(=O)CCOC1CC/C=C\CCC1 34a_100016989180_100000731031 [0,0,0,0,0,2|2,0,0]=4 3785 B15R1.16614 CS(=O)(=O)CCOC1CC/C=C\CCC1 7a_100000211924_100021000466 [0,0,0,0,0,2|2,0,0]=4 3786 B15R1.16614 CS(=O)(=O)CCOC1CCCCCCC1 34a_100000210054_100000731031 [0,0,0,0,0,2|2,0,0]=4 3787 B15R1.16614 CS(=O)(=O)CCOC1CCCCCCC1 7a_100000210054_100000230027 [0,0,0,0,0,2|2,0,0]=4 3788 B15R1.16614 CS(=O)(=O)CCSC1CC/C=C\CCC1 62a_100000731031_100021000466 [0,0,0,0,0,2|2,0,0]=4 3789 B15R1.16614 CS(=O)(=O)CCSC1CC/C=C\CCC1 62a_100021000466_100000230027 [0,0,0,0,0,2|2,0,0]=4 3790 B15R1.16614 NS(=O)(=O)CCNC1CC/C=C\CCC1 34a_100000738205_100021000466 [0,0,0,0,0,2|1,0,0]=3 3791 B15R1.16614 NS(=O)(=O)CCNC1CCCCCCC1 270004a_100000738205_100000210524 [0,0,0,0,0,2|1,0,0]=3 3792 B15R1.16614 NS(=O)(=O)CCOC1CC/C=C\CCC1 34a_100012334274_100021000466 [0,0,0,0,0,2|2,0,0]=4 3793 B15R1.16614 O=S(=O)([O-])CCNC1CCCCCCC1 2230a_100000211152_100000737633 [0,0,0,0,0,2|0,0,1]=3 3794 B15R1.16614 O=S(=O)([O-])CCNC1CCCCCCC1 34a_100000211152_100000762736 [0,0,0,0,0,2|0,0,1]=3 3795 B15R1.16614 O=S(=O)([O-])CCOC1C=CCCCCC1 34a_100000688657_100000762736 [0,0,0,0,0,2|1,0,1]=4 3796 B15R1.16614 O=S(=O)([O-])CCOC1CC/C=C\CCC1 34a_100016989180_100000762736 [0,0,0,0,0,2|1,0,1]=4 3797 B15R1.16614 O=S(=O)([O-])CCOC1CCCCCCC1 34a_100000210054_100000762736 [0,0,0,0,0,2|1,0,1]=4 3798 B15R1.16614 O=S(=O)([O-])CCSC1CC/C=C\CCC1 62a_100000762736_100021000466 [0,0,0,0,0,2|1,0,1]=4 3799 B15R1.16614 O=S(=O)([O-])CCSC1CC/C=C\CCC1 62a_100021000466_100000762736 [0,0,0,0,0,2|1,0,1]=4