0 B10R0.97 C=C(Br)CCOCCC(C)C 34a_100009813270_100000210312 [0,0,0,0,0,0|2,0,2]=4 1 B10R0.97 C=C(Br)CCOCCC(C)O 34a_100009813270_100012276601 [0,0,0,0,0,0|1,0,2]=3 2 B10R0.97 C=C(C)CCNCCC(C)O 2230a_200000755665_100000730704 [0,0,0,0,0,0|2,0,1]=3 3 B10R0.97 C=C(C)CCOCCC(=C)C 34a_100000764851_100000730704 [0,0,0,0,0,0|2,0,2]=4 4 B10R0.97 C=C(C)CCOCCC(=O)C 34a_100000759926_100000730704 [0,0,0,0,0,0|1,0,3]=4 5 B10R0.97 C=C(C)CCOCCC(=O)C 7a_100000759926_100000730704 [0,0,0,0,0,0|1,0,3]=4 6 B10R0.97 C=C(C)CCOCCC(C)Br 34a_100009893172_100000730704 [0,0,0,0,0,0|2,0,1]=3 7 B10R0.97 C=C(C)CCOCCC(C)C 34a_100000210254_100000730704 [0,0,0,0,0,0|2,0,1]=3 8 B10R0.97 C=C(C)CCOCCC(C)C 34a_100000764851_100000210312 [0,0,0,0,0,0|2,0,1]=3 9 B10R0.97 C=C(C)CCOCCC(C)C 7a_100000210254_100000730704 [0,0,0,0,0,0|2,0,1]=3 10 B10R0.97 C=C(C)CCOCCC(C)O 34a_100000764851_100012276601 [0,0,0,0,0,0|1,0,1]=2 11 B10R0.97 C=C(C)CCOCCC(F)F 34a_100103093639_100000730704 [0,0,0,0,0,0|3,0,1]=4 12 B10R0.97 C=C(C)CCOCC[C@@H](C)N 34a_100000706166_100000730704 [0,0,0,0,0,0|2,0,1]=3 13 B10R0.97 C=C(C)CCOCOC(C)C 34a_100000764851_100000709892 [0,0,0,0,0,0|3,0,1]=4 14 B10R0.97 C=C(C)CCSCCC(C)C 62a_100000210312_100000730704 [0,0,0,0,0,0|2,1,1]=4 15 B10R0.97 C=C(C)CCSCCC(C)C 62a_100000730704_100000210312 [0,0,0,0,0,0|2,1,1]=4 16 B10R0.97 C=C(C)CCSCCC(C)O 62a_100000730704_100012276601 [0,0,0,0,0,0|1,1,1]=3 17 B10R0.97 C=C(C)CCSCCC(C)O 62a_100012276601_100000730704 [0,0,0,0,0,0|1,1,1]=3 18 B10R0.97 C=C(C)COCCCC(C)O 34a_100000210245_200000718107 [0,0,0,0,0,0|3,0,1]=4 19 B10R0.97 C=C(C)CSCCCC(C)O 62a_100000748629_200000718107 [0,0,0,0,0,0|3,0,1]=4 20 B10R0.97 C=C(C)CSCCCC(C)O 62a_200000718107_100000211660 [0,0,0,0,0,0|3,0,1]=4 21 B10R0.97 CC(=CCNCCC(C)O)C 2230a_200000755665_100000761012 [0,0,0,0,0,0|2,0,2]=4 22 B10R0.97 CC(=CCNCCC(C)O)C 34a_100000718196_100012276601 [0,0,0,0,0,0|2,0,2]=4 23 B10R0.97 CC(=CCOCCC(C)Br)C 34a_100009893172_100000761012 [0,0,0,0,0,0|2,0,2]=4 24 B10R0.97 CC(=CCOCCC(C)C)C 34a_100000210254_100000761012 [0,0,0,0,0,0|2,0,2]=4 25 B10R0.97 CC(=CCOCCC(C)C)C 34a_100000753907_100000210312 [0,0,0,0,0,0|2,0,2]=4 26 B10R0.97 CC(=CCOCCC(C)C)C 7a_100000210254_100000761012 [0,0,0,0,0,0|2,0,2]=4 27 B10R0.97 CC(=CCOCCC(C)O)C 34a_100000753907_100012276601 [0,0,0,0,0,0|1,0,2]=3 28 B10R0.97 CC(=CCOCC[C@@H](C)N)C 34a_100000706166_100000761012 [0,0,0,0,0,0|2,0,2]=4 29 B10R0.97 CC(=CCSCCC(C)O)C 62a_100000761012_100012276601 [0,0,0,0,0,0|1,1,2]=4 30 B10R0.97 CC(=CCSCCC(C)O)C 62a_100012276601_100000761012 [0,0,0,0,0,0|1,1,2]=4 31 B10R0.97 CC(=O)CCCCCC(C)C 1458a_100000070787_100000210682 [0,0,0,0,0,0|2,0,2]=4 32 B10R0.97 CC(=O)CCCCCC(C)C 1458a_100000766313_200000210301 [0,0,0,0,0,0|2,0,2]=4 33 B10R0.97 CC(=O)CCCNCC(C)O 34a_100000210904_100000685027 [0,0,0,0,0,0|2,0,2]=4 34 B10R0.97 CC(=O)CCCOCC(C)O 34a_100000759063_100011218427 [0,0,0,0,0,0|2,0,2]=4 35 B10R0.97 CC(=O)CCCOCC(C)O 7a_100000759063_100011218427 [0,0,0,0,0,0|2,0,2]=4 36 B10R0.97 CC(=O)CCCOC[C@@H](C)O 34a_100000759063_100009817552 [0,0,0,0,0,0|2,0,2]=4 37 B10R0.97 CC(=O)CCCOC[C@@H](C)O 7a_100000759063_100009817552 [0,0,0,0,0,0|2,0,2]=4 38 B10R0.97 CC(=O)CCCSCC(C)O 62a_100011215641_100011218427 [0,0,0,0,0,0|2,0,2]=4 39 B10R0.97 CC(=O)CCCSCC(C)O 62a_100011218427_100011215641 [0,0,0,0,0,0|2,0,2]=4 40 B10R0.97 CC(=O)CCCSC[C@@H](C)O 62a_100009817552_100011215641 [0,0,0,0,0,0|2,0,2]=4 41 B10R0.97 CC(=O)CCCSC[C@@H](C)O 62a_100011215641_100009817552 [0,0,0,0,0,0|2,0,2]=4 42 B10R0.97 CC(=O)CCOCCC(=O)C 7a_100000759926_100000053229 [0,0,0,0,0,0|0,0,4]=4 43 B10R0.97 CC(=O)CCOCCC(C)C 34a_100000759926_100000210312 [0,0,0,0,0,0|1,0,2]=3 44 B10R0.97 CC(=O)CCOCCC(C)C 7a_100000210254_100000053229 [0,0,0,0,0,0|1,0,2]=3 45 B10R0.97 CC(=O)CCOCCC(C)C 7a_100000759926_100000210626 [0,0,0,0,0,0|1,0,2]=3 46 B10R0.97 CC(=O)CCOCCC(C)O 34a_100000759926_100012276601 [0,0,0,0,0,0|0,0,2]=2 47 B10R0.97 CC(=O)CCOCCC(C)O 7a_100000759926_100012276601 [0,0,0,0,0,0|0,0,2]=2 48 B10R0.97 CC(=O)CCOCCN(C)C 7a_100000759926_100000755713 [0,0,0,0,0,0|2,0,2]=4 49 B10R0.97 CC(=O)CCOCOC(C)C 34a_100000759926_100000709892 [0,0,0,0,0,0|2,0,2]=4 50 B10R0.97 CC(=O)CCSCCC(C)C 62a_100000053229_100000210312 [0,0,0,0,0,0|1,1,2]=4 51 B10R0.97 CC(=O)CCSCCC(C)C 62a_100000210312_100000053229 [0,0,0,0,0,0|1,1,2]=4 52 B10R0.97 CC(=O)CCSCCC(C)O 62a_100000053229_100012276601 [0,0,0,0,0,0|0,1,2]=3 53 B10R0.97 CC(=O)CCSCCC(C)O 62a_100012276601_100000053229 [0,0,0,0,0,0|0,1,2]=3 54 B10R0.97 CC(=O)COCCCC(C)O 34a_100000211253_200000718107 [0,0,0,0,0,0|2,0,2]=4 55 B10R0.97 CC(=O)OCOCCC(C)Br 34a_100009893172_100009813279 [0,0,0,0,0,0|2,0,2]=4 56 B10R0.97 CC(=O)OCOCCC(C)C 34a_100000210254_100009813279 [0,0,0,0,0,0|2,0,2]=4 57 B10R0.97 CC(=O)OCOCC[C@@H](C)N 34a_100000706166_100009813279 [0,0,0,0,0,0|2,0,2]=4 58 B10R0.97 CC(=O)OCSCCC(C)O 62a_100000076356_100012276601 [0,0,0,0,0,0|1,1,2]=4 59 B10R0.97 CC(=O)OCSCCC(C)O 62a_100012276601_100000076356 [0,0,0,0,0,0|1,1,2]=4 60 B10R0.97 CC(Br)CCOCCC(=O)N 34a_100009893172_100000731001 [0,0,0,0,0,0|2,0,2]=4 61 B10R0.97 CC(Br)CCOCOC(C)C 34a_100009893172_100000709892 [0,0,0,0,0,0|3,0,0]=3 62 B10R0.97 CC(C)CC=NNCC(C)O 4a_200000730056_100000185833 [0,0,0,0,0,0|3,0,1]=4 63 B10R0.97 CC(C)CCCCCC(=O)[13CH3] 1458a_100000766313_200025704644 [0,0,0,0,0,0|2,0,2]=4 64 B10R0.97 CC(C)CCCCCN(C)C 2230a_100102631434_100000210682 [0,0,0,0,0,0|4,0,0]=4 65 B10R0.97 CC(C)CCCCCN(C)C 269982a_100102631434_100000210682 [0,0,0,0,0,0|4,0,0]=4 66 B10R0.97 CC(C)CCCCNC(C)C 2230a_100138425928_100011216152 [0,0,0,0,0,0|4,0,0]=4 67 B10R0.97 CC(C)CCCCNC(C)C 34a_100138425928_100011216152 [0,0,0,0,0,0|4,0,0]=4 68 B10R0.97 CC(C)CCCCOC(C)C 34a_100000212225_100011216152 [0,0,0,0,0,0|4,0,0]=4 69 B10R0.97 CC(C)CCCCOC(C)C 34a_100011214890_100000210206 [0,0,0,0,0,0|4,0,0]=4 70 B10R0.97 CC(C)CCCCOC(C)C 7a_100011214890_100000210206 [0,0,0,0,0,0|4,0,0]=4 71 B10R0.97 CC(C)CCCCSC(C)C 62a_100000210206_100011216152 [0,0,0,0,0,0|4,0,0]=4 72 B10R0.97 CC(C)CCCCSC(C)C 62a_100011216152_100000210206 [0,0,0,0,0,0|4,0,0]=4 73 B10R0.97 CC(C)CCCNCC(C)C 2230a_100000210953_100011214892 [0,0,0,0,0,0|4,0,0]=4 74 B10R0.97 CC(C)CCCNCC(C)C 2230a_200000737386_100000210760 [0,0,0,0,0,0|4,0,0]=4 75 B10R0.97 CC(C)CCCNCC(C)C 270004a_200000737386_100000210432 [0,0,0,0,0,0|4,0,0]=4 76 B10R0.97 CC(C)CCCNCC(C)C 34a_100000210953_100011214892 [0,0,0,0,0,0|4,0,0]=4 77 B10R0.97 CC(C)CCCNCC(C)C 34a_200000737386_100000210624 [0,0,0,0,0,0|4,0,0]=4 78 B10R0.97 CC(C)CCCNCC(C)O 2230a_100000210904_100011214892 [0,0,0,0,0,0|3,0,0]=3 79 B10R0.97 CC(C)CCCNCC(C)O 2230a_200000737386_100011218427 [0,0,0,0,0,0|3,0,0]=3 80 B10R0.97 CC(C)CCCNCC(C)O 34a_100000210904_100011214892 [0,0,0,0,0,0|3,0,0]=3 81 B10R0.97 CC(C)CCCNCC(C)O 34a_200000737386_100011218427 [0,0,0,0,0,0|3,0,0]=3 82 B10R0.97 CC(C)CCCNC[C@@H](C)O 2230a_200000737386_100009817552 [0,0,0,0,0,0|3,0,0]=3 83 B10R0.97 CC(C)CCCNC[C@@H](C)O 34a_200000737386_100009817552 [0,0,0,0,0,0|3,0,0]=3 84 B10R0.97 CC(C)CCCOCC(C)Br 34a_100012180447_100011214892 [0,0,0,0,0,0|4,0,0]=4 85 B10R0.97 CC(C)CCCOCC(C)C 34a_100000210257_100011214892 [0,0,0,0,0,0|4,0,0]=4 86 B10R0.97 CC(C)CCCOCC(C)C 34a_100000210774_100000210624 [0,0,0,0,0,0|4,0,0]=4 87 B10R0.97 CC(C)CCCOCC(C)C 7a_100000210774_100000210760 [0,0,0,0,0,0|4,0,0]=4 88 B10R0.97 CC(C)CCCOCC(C)F 34a_100015925927_100011214892 [0,0,0,0,0,0|4,0,0]=4 89 B10R0.97 CC(C)CCCOCC(C)O 34a_100000210774_100011218427 [0,0,0,0,0,0|3,0,0]=3 90 B10R0.97 CC(C)CCCOCC(C)O 7a_100000210774_100011218427 [0,0,0,0,0,0|3,0,0]=3 91 B10R0.97 CC(C)CCCOC[C@@H](C)Cl 34a_100016084084_100011214892 [0,0,0,0,0,0|4,0,0]=4 92 B10R0.97 CC(C)CCCOC[C@@H](C)N 34a_100000737577_100011214892 [0,0,0,0,0,0|4,0,0]=4 93 B10R0.97 CC(C)CCCOC[C@@H](C)O 34a_100000210774_100009817552 [0,0,0,0,0,0|3,0,0]=3 94 B10R0.97 CC(C)CCCOC[C@@H](C)O 7a_100000210774_100009817552 [0,0,0,0,0,0|3,0,0]=3 95 B10R0.97 CC(C)CCCSCC(C)C 62a_100000210624_100011214892 [0,0,0,0,0,0|4,0,0]=4 96 B10R0.97 CC(C)CCCSCC(C)C 62a_100011214892_100000210760 [0,0,0,0,0,0|4,0,0]=4 97 B10R0.97 CC(C)CCCSCC(C)O 62a_100011214892_100011218427 [0,0,0,0,0,0|3,0,0]=3 98 B10R0.97 CC(C)CCCSCC(C)O 62a_100011218427_100011214892 [0,0,0,0,0,0|3,0,0]=3 99 B10R0.97 CC(C)CCCSC[C@@H](C)O 62a_100009817552_100011214892 [0,0,0,0,0,0|3,0,0]=3 100 B10R0.97 CC(C)CCCSC[C@@H](C)O 62a_100011214892_100009817552 [0,0,0,0,0,0|3,0,0]=3 101 B10R0.97 CC(C)CCNCCC(C)C 269862a_100000210545_100000185833 [0,0,0,0,0,0|3,0,0]=3 102 B10R0.97 CC(C)CCNCCC(C)O 2230a_200000755665_100000210312 [0,0,0,0,0,0|2,0,0]=2 103 B10R0.97 CC(C)CCNCCC(C)O 269862a_200000755665_100000185833 [0,0,0,0,0,0|2,0,0]=2 104 B10R0.97 CC(C)CCNCCN(C)C 269862a_100000210585_100000185833 [0,0,0,0,0,0|4,0,0]=4 105 B10R0.97 CC(C)CCOCCC(=O)N 34a_100000210254_100000731001 [0,0,0,0,0,0|2,0,2]=4 106 B10R0.97 CC(C)CCOCCC(=O)N 34a_100000757172_100000210312 [0,0,0,0,0,0|2,0,2]=4 107 B10R0.97 CC(C)CCOCCC(=O)N 7a_100000210254_100000744528 [0,0,0,0,0,0|2,0,2]=4 108 B10R0.97 CC(C)CCOCCC(=O)N 7a_100000757172_100000210626 [0,0,0,0,0,0|2,0,2]=4 109 B10R0.97 CC(C)CCOCCC(C)Br 34a_100009893172_100000210312 [0,0,0,0,0,0|2,0,0]=2 110 B10R0.97 CC(C)CCOCCC(C)C 34a_100000210254_100000210312 [0,0,0,0,0,0|2,0,0]=2 111 B10R0.97 CC(C)CCOCCC(C)C 7a_100000210254_100000210626 [0,0,0,0,0,0|2,0,0]=2 112 B10R0.97 CC(C)CCOCCC(C)O 34a_100000210254_100012276601 [0,0,0,0,0,0|1,0,0]=1 113 B10R0.97 CC(C)CCOCCC(C)O 7a_100000210254_100012276601 [0,0,0,0,0,0|1,0,0]=1 114 B10R0.97 CC(C)CCOCCC(F)F 34a_100103093639_100000210312 [0,0,0,0,0,0|3,0,0]=3 115 B10R0.97 CC(C)CCOCCN(C)C 7a_100000210254_100000755713 [0,0,0,0,0,0|3,0,0]=3 116 B10R0.97 CC(C)CCOCC[C@@H](C)N 34a_100000706166_100000210312 [0,0,0,0,0,0|2,0,0]=2 117 B10R0.97 CC(C)CCOCOC(C)C 34a_100000210254_100000709892 [0,0,0,0,0,0|3,0,0]=3 118 B10R0.97 CC(C)CCSCCC(C)C 62a_100000210312_100000210312 [0,0,0,0,0,0|2,1,0]=3 119 B10R0.97 CC(C)CCSCCC(C)O 62a_100000210312_100012276601 [0,0,0,0,0,0|1,1,0]=2 120 B10R0.97 CC(C)CCSCCC(C)O 62a_100012276601_100000210312 [0,0,0,0,0,0|1,1,0]=2 121 B10R0.97 CC(C)CCSCCN(C)C 62a_100000210312_100000755713 [0,0,0,0,0,0|3,1,0]=4 122 B10R0.97 CC(C)CCSCOC(C)C 62a_100000210312_100000709892 [0,0,0,0,0,0|3,1,0]=4 123 B10R0.97 CC(C)CCSCOC(C)C 62a_100000709892_100000210312 [0,0,0,0,0,0|3,1,0]=4 124 B10R0.97 CC(C)CNCCCC(C)O 2230a_100000210953_200000718107 [0,0,0,0,0,0|3,0,0]=3 125 B10R0.97 CC(C)CNCCCC(C)O 34a_100000210953_200000718107 [0,0,0,0,0,0|3,0,0]=3 126 B10R0.97 CC(C)COCCCC(C)O 34a_100000210257_200000718107 [0,0,0,0,0,0|3,0,0]=3 127 B10R0.97 CC(C)CSCCCC(C)O 62a_100000210624_200000718107 [0,0,0,0,0,0|3,0,0]=3 128 B10R0.97 CC(C)CSCCCC(C)O 62a_200000718107_100000210760 [0,0,0,0,0,0|3,0,0]=3 129 B10R0.97 CC(C)NCCOC[C@@H](C)O 34a_100000224655_100009817552 [0,0,0,0,0,0|4,0,0]=4 130 B10R0.97 CC(C)OCCNC[C@@H](C)O 2230a_100000701111_100009817552 [0,0,0,0,0,0|4,0,0]=4 131 B10R0.97 CC(C)OCCNC[C@@H](C)O 34a_100000701111_100009817552 [0,0,0,0,0,0|4,0,0]=4 132 B10R0.97 CC(C)OCCOC[C@@H](C)O 34a_100000211219_100009817552 [0,0,0,0,0,0|4,0,0]=4 133 B10R0.97 CC(C)OCCOC[C@@H](C)O 7a_100000211219_100009817552 [0,0,0,0,0,0|4,0,0]=4 134 B10R0.97 CC(C)OCCSC[C@@H](C)O 62a_100000211751_100009817552 [0,0,0,0,0,0|4,0,0]=4 135 B10R0.97 CC(C)OCCSC[C@@H](C)O 62a_100009817552_100000211751 [0,0,0,0,0,0|4,0,0]=4 136 B10R0.97 CC(C)OCOCCC(F)F 34a_100103093639_100000709892 [0,0,0,0,0,0|4,0,0]=4 137 B10R0.97 CC(C)OCOCC[C@@H](C)N 34a_100000706166_100000709892 [0,0,0,0,0,0|3,0,0]=3 138 B10R0.97 CC(C)SCCNC[C@@H](C)O 2230a_100000731138_100009817552 [0,0,0,0,0,0|4,0,0]=4 139 B10R0.97 CC(C)SCCNC[C@@H](C)O 34a_100000731138_100009817552 [0,0,0,0,0,0|4,0,0]=4 140 B10R0.97 CC(C)SCCOC[C@@H](C)O 34a_200011212901_100009817552 [0,0,0,0,0,0|4,0,0]=4 141 B10R0.97 CC(C)SCCOC[C@@H](C)O 7a_200011212901_100009817552 [0,0,0,0,0,0|4,0,0]=4 142 B10R0.97 CC(C)SCCSC[C@@H](C)O 62a_100000730970_100009817552 [0,0,0,0,0,0|4,0,0]=4 143 B10R0.97 CC(C)SCCSC[C@@H](C)O 62a_100009817552_100000730970 [0,0,0,0,0,0|4,0,0]=4 144 B10R0.97 CC(O)CCCNCC(=O)O 269956a_100016091260_200000718107 [0,0,0,0,0,0|3,0,1]=4 145 B10R0.97 CC(O)CCCNCC(C)O 2230a_100000210904_200000718107 [0,0,0,0,0,0|2,0,0]=2 146 B10R0.97 CC(O)CCCNCC(C)O 34a_100000210904_200000718107 [0,0,0,0,0,0|2,0,0]=2 147 B10R0.97 CC(O)CCCNCC(F)F 34a_100000765723_200000718107 [0,0,0,0,0,0|4,0,0]=4 148 B10R0.97 CC(O)CCCOCC(C)Br 34a_100012180447_200000718107 [0,0,0,0,0,0|3,0,0]=3 149 B10R0.97 CC(O)CCCOCC(C)F 34a_100015925927_200000718107 [0,0,0,0,0,0|3,0,0]=3 150 B10R0.97 CC(O)CCCOCC(F)F 34a_100000743014_200000718107 [0,0,0,0,0,0|4,0,0]=4 151 B10R0.97 CC(O)CCCOC[C@@H](C)Cl 34a_100016084084_200000718107 [0,0,0,0,0,0|3,0,0]=3 152 B10R0.97 CC(O)CCCOC[C@@H](C)N 34a_100000737577_200000718107 [0,0,0,0,0,0|3,0,0]=3 153 B10R0.97 CC(O)CCCSCC(C)O 62a_100011218427_200000718107 [0,0,0,0,0,0|2,0,0]=2 154 B10R0.97 CC(O)CCCSCC(C)O 62a_200000718107_100011218427 [0,0,0,0,0,0|2,0,0]=2 155 B10R0.97 CC(O)CCCSCC(F)F 62a_100011934356_200000718107 [0,0,0,0,0,0|4,0,0]=4 156 B10R0.97 CC(O)CCCSCC(F)F 62a_200000718107_100011934356 [0,0,0,0,0,0|4,0,0]=4 157 B10R0.97 CC(O)CCCSC[C@@H](C)O 62a_100009817552_200000718107 [0,0,0,0,0,0|2,0,0]=2 158 B10R0.97 CC(O)CCCSC[C@@H](C)O 62a_200000718107_100009817552 [0,0,0,0,0,0|2,0,0]=2 159 B10R0.97 CC(O)CCNCCC(=O)N 2230a_200000755665_100000744528 [0,0,0,0,0,0|2,0,2]=4 160 B10R0.97 CC(O)CCNCCC(C)O 2230a_200000755665_100012276601 [0,0,0,0,0,0|1,0,0]=1 161 B10R0.97 CC(O)CCNCOC(C)C 2230a_200000755665_100000709892 [0,0,0,0,0,0|3,0,0]=3 162 B10R0.97 CC(O)CCNOCC(=O)O 269956a_100000106656_100012276601 [0,0,0,0,0,0|3,0,1]=4 163 B10R0.97 CC(O)CCOCCC(=O)N 34a_100000757172_100012276601 [0,0,0,0,0,0|1,0,2]=3 164 B10R0.97 CC(O)CCOCCC(=O)N 7a_100000757172_100012276601 [0,0,0,0,0,0|1,0,2]=3 165 B10R0.97 CC(O)CCOCCC(C)Br 34a_100009893172_100012276601 [0,0,0,0,0,0|1,0,0]=1 166 B10R0.97 CC(O)CCOCCC(F)F 34a_100103093639_100012276601 [0,0,0,0,0,0|2,0,0]=2 167 B10R0.97 CC(O)CCOCC[C@@H](C)N 34a_100000706166_100012276601 [0,0,0,0,0,0|1,0,0]=1 168 B10R0.97 CC(O)CCSCCC(=O)N 62a_100000744528_100012276601 [0,0,0,0,0,0|1,1,2]=4 169 B10R0.97 CC(O)CCSCCC(=O)N 62a_100012276601_100000744528 [0,0,0,0,0,0|1,1,2]=4 170 B10R0.97 CC(O)CCSCCC(C)O 62a_100012276601_100012276601 [0,0,0,0,0,0|0,1,0]=1 171 B10R0.97 CC(O)CCSCCN(C)C 62a_100012276601_100000755713 [0,0,0,0,0,0|2,1,0]=3 172 B10R0.97 CC(O)CCSCOC(C)C 62a_100000709892_100012276601 [0,0,0,0,0,0|2,1,0]=3 173 B10R0.97 CC(O)CCSCOC(C)C 62a_100012276601_100000709892 [0,0,0,0,0,0|2,1,0]=3 174 B10R0.97 CC(O)CNCCCS(=O)C 2230a_200000753449_100011218427 [0,0,0,0,0,0|3,0,1]=4 175 B10R0.97 CC(O)CNCCOC(C)C 2230a_100000210904_100000211751 [0,0,0,0,0,0|4,0,0]=4 176 B10R0.97 CC(O)CNCCOC(C)C 2230a_100000701111_100011218427 [0,0,0,0,0,0|4,0,0]=4 177 B10R0.97 CC(O)CNCCOC(C)C 34a_100000210904_100000211751 [0,0,0,0,0,0|4,0,0]=4 178 B10R0.97 CC(O)CNCCOC(C)C 34a_100000701111_100011218427 [0,0,0,0,0,0|4,0,0]=4 179 B10R0.97 CC(O)CNCCSC(C)C 2230a_100000210904_100000730970 [0,0,0,0,0,0|4,0,0]=4 180 B10R0.97 CC(O)CNCCSC(C)C 2230a_100000731138_100011218427 [0,0,0,0,0,0|4,0,0]=4 181 B10R0.97 CC(O)CNCCSC(C)C 34a_100000210904_100000730970 [0,0,0,0,0,0|4,0,0]=4 182 B10R0.97 CC(O)CNCCSC(C)C 34a_100000731138_100011218427 [0,0,0,0,0,0|4,0,0]=4 183 B10R0.97 CC(O)COCCNC(C)C 34a_100000224655_100011218427 [0,0,0,0,0,0|4,0,0]=4 184 B10R0.97 CC(O)COCCOC(C)C 34a_100000211219_100011218427 [0,0,0,0,0,0|4,0,0]=4 185 B10R0.97 CC(O)COCCOC(C)C 7a_100000211219_100011218427 [0,0,0,0,0,0|4,0,0]=4 186 B10R0.97 CC(O)COCCSC(C)C 34a_200011212901_100011218427 [0,0,0,0,0,0|4,0,0]=4 187 B10R0.97 CC(O)COCCSC(C)C 7a_200011212901_100011218427 [0,0,0,0,0,0|4,0,0]=4 188 B10R0.97 CC(O)CSCCCN(C)C 62a_100011218427_100000757444 [0,0,0,0,0,0|4,0,0]=4 189 B10R0.97 CC(O)CSCCOC(C)C 62a_100000211751_100011218427 [0,0,0,0,0,0|4,0,0]=4 190 B10R0.97 CC(O)CSCCOC(C)C 62a_100011218427_100000211751 [0,0,0,0,0,0|4,0,0]=4 191 B10R0.97 CC(O)CSCCSC(C)C 62a_100000730970_100011218427 [0,0,0,0,0,0|4,0,0]=4 192 B10R0.97 CC(O)CSCCSC(C)C 62a_100011218427_100000730970 [0,0,0,0,0,0|4,0,0]=4 193 B10R0.97 C[C@@H](N)CCOCCC(=O)N 34a_100000706166_100000731001 [0,0,0,0,0,0|2,0,2]=4 194 B10R0.97 C[C@@H](O)CNCCCS(=O)C 2230a_200000753449_100009817552 [0,0,0,0,0,0|3,0,1]=4 195 B10R0.97 C[C@@H](O)CSCCCN(C)C 62a_100009817552_100000757444 [0,0,0,0,0,0|4,0,0]=4 196 B9R0.2 C#CCCNCCC(C)O 2230a_200000755665_100000688953 [1,0,0,0,0,0|1,0,2]=4 197 B9R0.2 C#CCCNCCC(C)O 34a_100000755551_100012276601 [1,0,0,0,0,0|1,0,2]=4 198 B9R0.2 C#CCCOCCC(C)Br 34a_100009893172_100000688953 [1,0,0,0,0,0|1,0,2]=4 199 B9R0.2 C#CCCOCCC(C)C 34a_100000210254_100000688953 [1,0,0,0,0,0|1,0,2]=4 200 B9R0.2 C#CCCOCCC(C)C 34a_100011215631_100000210312 [1,0,0,0,0,0|1,0,2]=4 201 B9R0.2 C#CCCOCCC(C)C 7a_100000210254_100000688953 [1,0,0,0,0,0|1,0,2]=4 202 B9R0.2 C#CCCOCCC(C)O 34a_100011215631_100012276601 [1,0,0,0,0,0|0,0,2]=3 203 B9R0.2 C#CCCOCC[C@@H](C)N 34a_100000706166_100000688953 [1,0,0,0,0,0|1,0,2]=4 204 B9R0.2 C#CCCSCCC(C)O 62a_100000688953_100012276601 [1,0,0,0,0,0|0,1,2]=4 205 B9R0.2 C#CCCSCCC(C)O 62a_100012276601_100000688953 [1,0,0,0,0,0|0,1,2]=4 206 B9R0.2 C/C=C/COCCC(C)Br 34a_100009893172_100102629194 [1,0,0,0,0,0|1,0,2]=4 207 B9R0.2 C/C=C/COCCC(C)C 34a_100000210254_100102629194 [1,0,0,0,0,0|1,0,2]=4 208 B9R0.2 C/C=C/COCCC(C)C 34a_100016270725_100000210312 [1,0,0,0,0,0|1,0,2]=4 209 B9R0.2 C/C=C/COCCC(C)C 7a_100000210254_100102629194 [1,0,0,0,0,0|1,0,2]=4 210 B9R0.2 C/C=C/COCCC(C)O 34a_100016270725_100012276601 [1,0,0,0,0,0|0,0,2]=3 211 B9R0.2 C/C=C/COCC[C@@H](C)N 34a_100000706166_100102629194 [1,0,0,0,0,0|1,0,2]=4 212 B9R0.2 C/C=C/CSCCC(C)O 62a_100012276601_100102629194 [1,0,0,0,0,0|0,1,2]=4 213 B9R0.2 C/C=C/CSCCC(C)O 62a_100102629194_100012276601 [1,0,0,0,0,0|0,1,2]=4 214 B9R0.2 C=C(Br)CCOCCCC 34a_100009813270_100000210210 [1,0,0,0,0,0|1,0,2]=4 215 B9R0.2 C=C(Br)CCOCCCO 34a_100009813270_100000230001 [1,0,0,0,0,0|1,0,2]=4 216 B9R0.2 C=C(C)CCNCCCC 2230a_100000102301_100000730704 [1,0,0,0,0,0|2,0,1]=4 217 B9R0.2 C=C(C)CCNCCCC 7a_106832991798_100000730704 [1,0,0,0,0,0|2,0,1]=4 218 B9R0.2 C=C(C)CCOCCCBr 34a_100011217188_100000730704 [1,0,0,0,0,0|2,0,1]=4 219 B9R0.2 C=C(C)CCOCCCC 34a_100000210227_100000730704 [1,0,0,0,0,0|1,0,1]=3 220 B9R0.2 C=C(C)CCOCCCC 34a_100000764851_100000210210 [1,0,0,0,0,0|1,0,1]=3 221 B9R0.2 C=C(C)CCOCCCC 7a_100000210227_100000730704 [1,0,0,0,0,0|1,0,1]=3 222 B9R0.2 C=C(C)CCOCCCCl 34a_100000230001_100000730704 [1,0,0,0,0,0|2,0,1]=4 223 B9R0.2 C=C(C)CCOCCCF 34a_100000759539_100000730704 [1,0,0,0,0,0|2,0,1]=4 224 B9R0.2 C=C(C)CCOCCCF 34a_100000764851_100011934791 [1,0,0,0,0,0|2,0,1]=4 225 B9R0.2 C=C(C)CCOCCCN 34a_100000182051_100000730704 [1,0,0,0,0,0|2,0,1]=4 226 B9R0.2 C=C(C)CCOCCCO 34a_100000764851_100000230001 [1,0,0,0,0,0|1,0,1]=3 227 B9R0.2 C=C(C)CCOCCOC 34a_100000210237_100000730704 [1,0,0,0,0,0|2,0,1]=4 228 B9R0.2 C=C(C)CCOCCOC 34a_100000764851_100011201679 [1,0,0,0,0,0|2,0,1]=4 229 B9R0.2 C=C(C)CCOCCSC 34a_100000230434_100000730704 [1,0,0,0,0,0|2,0,1]=4 230 B9R0.2 C=C(C)CCOCCSC 34a_100000764851_100000212216 [1,0,0,0,0,0|2,0,1]=4 231 B9R0.2 C=C(C)CCOCCSC 7a_100000230434_100000730704 [1,0,0,0,0,0|2,0,1]=4 232 B9R0.2 C=C(C)CCSCCCC 62a_100000210211_100000730704 [1,0,0,0,0,0|1,1,1]=4 233 B9R0.2 C=C(C)CCSCCCC 62a_100000730704_100000210210 [1,0,0,0,0,0|1,1,1]=4 234 B9R0.2 C=C(C)CCSCCCO 62a_100000730704_100011215043 [1,0,0,0,0,0|1,1,1]=4 235 B9R0.2 C=C(C)CCSCCCO 62a_100011215043_100000730704 [1,0,0,0,0,0|1,1,1]=4 236 B9R0.2 C=CCCNCCC(C)O 2230a_100015191253_100012276601 [1,0,0,0,0,0|1,0,2]=4 237 B9R0.2 C=CCCNCCC(C)O 2230a_200000755665_100000754431 [1,0,0,0,0,0|1,0,2]=4 238 B9R0.2 C=CCCOCCC(C)Br 34a_100009893172_100000754431 [1,0,0,0,0,0|1,0,2]=4 239 B9R0.2 C=CCCOCCC(C)C 34a_100000210254_100000754431 [1,0,0,0,0,0|1,0,2]=4 240 B9R0.2 C=CCCOCCC(C)C 34a_100011205117_100000210312 [1,0,0,0,0,0|1,0,2]=4 241 B9R0.2 C=CCCOCCC(C)C 7a_100000210254_100000754431 [1,0,0,0,0,0|1,0,2]=4 242 B9R0.2 C=CCCOCCC(C)O 34a_100011205117_100012276601 [1,0,0,0,0,0|0,0,2]=3 243 B9R0.2 C=CCCOCC[C@@H](C)N 34a_100000706166_100000754431 [1,0,0,0,0,0|1,0,2]=4 244 B9R0.2 C=CCCSCCC(C)O 62a_100000754431_100012276601 [1,0,0,0,0,0|0,1,2]=4 245 B9R0.2 C=CCCSCCC(C)O 62a_100012276601_100000754431 [1,0,0,0,0,0|0,1,2]=4 246 B9R0.2 CC#CCNCCC(C)O 2230a_100000685387_100012276601 [1,0,0,0,0,0|1,0,2]=4 247 B9R0.2 CC#CCNCCC(C)O 2230a_200000755665_100000748600 [1,0,0,0,0,0|1,0,2]=4 248 B9R0.2 CC#CCNCCC(C)O 34a_100000685387_100012276601 [1,0,0,0,0,0|1,0,2]=4 249 B9R0.2 CC#CCOCCC(C)Br 34a_100009893172_100000748600 [1,0,0,0,0,0|1,0,2]=4 250 B9R0.2 CC#CCOCCC(C)C 34a_100000210254_100000748600 [1,0,0,0,0,0|1,0,2]=4 251 B9R0.2 CC#CCOCCC(C)C 34a_100000761923_100000210312 [1,0,0,0,0,0|1,0,2]=4 252 B9R0.2 CC#CCOCCC(C)C 7a_100000210254_100000748600 [1,0,0,0,0,0|1,0,2]=4 253 B9R0.2 CC#CCOCCC(C)O 34a_100000761923_100012276601 [1,0,0,0,0,0|0,0,2]=3 254 B9R0.2 CC#CCOCC[C@@H](C)N 34a_100000706166_100000748600 [1,0,0,0,0,0|1,0,2]=4 255 B9R0.2 CC#CCSCCC(C)O 62a_100000748600_100012276601 [1,0,0,0,0,0|0,1,2]=4 256 B9R0.2 CC#CCSCCC(C)O 62a_100012276601_100000748600 [1,0,0,0,0,0|0,1,2]=4 257 B9R0.2 CC(=CCOCCCO)C 34a_100000753907_100000230001 [1,0,0,0,0,0|1,0,2]=4 258 B9R0.2 CC(=O)CCCCCCO 1458a_100000070787_100000766143 [1,0,0,0,0,0|1,0,2]=4 259 B9R0.2 CC(=O)CCCCCCO 1458a_100011996774_200000210301 [1,0,0,0,0,0|1,0,2]=4 260 B9R0.2 CC(=O)CCOCCCF 34a_100000759926_100011934791 [1,0,0,0,0,0|1,0,2]=4 261 B9R0.2 CC(=O)CCOCCCF 7a_100000759926_100011934791 [1,0,0,0,0,0|1,0,2]=4 262 B9R0.2 CC(=O)CCOCCCO 34a_100000759926_100000230001 [1,0,0,0,0,0|0,0,2]=3 263 B9R0.2 CC(=O)CCOCCCO 7a_100000759926_100011215043 [1,0,0,0,0,0|0,0,2]=3 264 B9R0.2 CC(=O)CCSCCCO 62a_100000053229_100011215043 [1,0,0,0,0,0|0,1,2]=4 265 B9R0.2 CC(=O)CCSCCCO 62a_100011215043_100000053229 [1,0,0,0,0,0|0,1,2]=4 266 B9R0.2 CC(Br)CCOCCCF 34a_100009893172_100011934791 [1,0,0,0,0,0|2,0,0]=3 267 B9R0.2 CC(Br)CCOCCCO 34a_100009893172_100000230001 [1,0,0,0,0,0|1,0,0]=2 268 B9R0.2 CC(Br)COCCCCO 34a_100012180447_100011216708 [1,0,0,0,0,0|3,0,0]=4 269 B9R0.2 CC(C)CCCCCN[13CH3] 2230a_100011290863_200025704644 [1,0,0,0,0,0|3,0,0]=4 270 B9R0.2 CC(C)CCCCCN[13CH3] 34a_100011290863_200025704644 [1,0,0,0,0,0|3,0,0]=4 271 B9R0.2 CC(C)CCCCCO[13CH3] 34a_100011995859_200025704644 [1,0,0,0,0,0|3,0,0]=4 272 B9R0.2 CC(C)CCCCCO[13CH3] 7a_100011995859_200025704644 [1,0,0,0,0,0|3,0,0]=4 273 B9R0.2 CC(C)CCCCCS[13CH3] 62a_100000210682_200025704644 [1,0,0,0,0,0|3,0,0]=4 274 B9R0.2 CC(C)CCCCCS[13CH3] 62a_200025704644_100000210682 [1,0,0,0,0,0|3,0,0]=4 275 B9R0.2 CC(C)CCCNCCO 2230a_100016997473_100011214892 [1,0,0,0,0,0|3,0,0]=4 276 B9R0.2 CC(C)CCCNCCO 2230a_200000737386_100000211926 [1,0,0,0,0,0|3,0,0]=4 277 B9R0.2 CC(C)CCCNCCO 34a_100016990907_100011214892 [1,0,0,0,0,0|3,0,0]=4 278 B9R0.2 CC(C)CCCNCCO 34a_200000737386_100000211926 [1,0,0,0,0,0|3,0,0]=4 279 B9R0.2 CC(C)CCCOCCO 34a_100000210774_100000211926 [1,0,0,0,0,0|3,0,0]=4 280 B9R0.2 CC(C)CCCOCCO 7a_100000210774_100000211926 [1,0,0,0,0,0|3,0,0]=4 281 B9R0.2 CC(C)CCCSCCO 62a_100000211926_100011214892 [1,0,0,0,0,0|3,0,0]=4 282 B9R0.2 CC(C)CCCSCCO 62a_100011214892_100000211926 [1,0,0,0,0,0|3,0,0]=4 283 B9R0.2 CC(C)CCNCCCF 2230a_100015189416_100000210312 [1,0,0,0,0,0|3,0,0]=4 284 B9R0.2 CC(C)CCNCCCF 269862a_100015189416_100000185833 [1,0,0,0,0,0|3,0,0]=4 285 B9R0.2 CC(C)CCNCCCF 34a_100015189416_100000210312 [1,0,0,0,0,0|3,0,0]=4 286 B9R0.2 CC(C)CCNCCCO 269862a_100000182051_100000185833 [1,0,0,0,0,0|2,0,0]=3 287 B9R0.2 CC(C)CCOCCC#N 7a_100000210254_100000184422 [1,0,0,0,0,0|2,0,1]=4 288 B9R0.2 CC(C)CCOCCCBr 34a_100011217188_100000210312 [1,0,0,0,0,0|2,0,0]=3 289 B9R0.2 CC(C)CCOCCCCl 34a_100000230001_100000210312 [1,0,0,0,0,0|2,0,0]=3 290 B9R0.2 CC(C)CCOCCCF 34a_100000210254_100011934791 [1,0,0,0,0,0|2,0,0]=3 291 B9R0.2 CC(C)CCOCCCF 34a_100000759539_100000210312 [1,0,0,0,0,0|2,0,0]=3 292 B9R0.2 CC(C)CCOCCCF 7a_100000210254_100011934791 [1,0,0,0,0,0|2,0,0]=3 293 B9R0.2 CC(C)CCOCCCN 34a_100000182051_100000210312 [1,0,0,0,0,0|2,0,0]=3 294 B9R0.2 CC(C)CCOCCCO 34a_100000210254_100000230001 [1,0,0,0,0,0|1,0,0]=2 295 B9R0.2 CC(C)CCOCCCO 7a_100000210254_100011215043 [1,0,0,0,0,0|1,0,0]=2 296 B9R0.2 CC(C)CCOCCON 34a_100000700252_100000210312 [1,0,0,0,0,0|3,0,0]=4 297 B9R0.2 CC(C)CCSCCCF 62a_100000210312_100011934791 [1,0,0,0,0,0|2,1,0]=4 298 B9R0.2 CC(C)CCSCCCF 62a_100011934791_100000210312 [1,0,0,0,0,0|2,1,0]=4 299 B9R0.2 CC(C)CCSCCCO 62a_100000210312_100011215043 [1,0,0,0,0,0|1,1,0]=3 300 B9R0.2 CC(C)CCSCCCO 62a_100011215043_100000210312 [1,0,0,0,0,0|1,1,0]=3 301 B9R0.2 CC(C)CNCCCCO 2230a_100000210953_100000210776 [1,0,0,0,0,0|3,0,0]=4 302 B9R0.2 CC(C)CNCCCCO 2230a_100000750430_100000210760 [1,0,0,0,0,0|3,0,0]=4 303 B9R0.2 CC(C)CNCCCCO 270004a_100000750430_100000210432 [1,0,0,0,0,0|3,0,0]=4 304 B9R0.2 CC(C)CNCCCCO 34a_100000210953_100011216708 [1,0,0,0,0,0|3,0,0]=4 305 B9R0.2 CC(C)CNCCCCO 34a_100000750430_100000210624 [1,0,0,0,0,0|3,0,0]=4 306 B9R0.2 CC(C)COCCCCO 34a_100000210257_100011216708 [1,0,0,0,0,0|3,0,0]=4 307 B9R0.2 CC(C)CSCCCCO 62a_100000210624_100000210776 [1,0,0,0,0,0|3,0,0]=4 308 B9R0.2 CC(C)CSCCCCO 62a_100000210776_100000210760 [1,0,0,0,0,0|3,0,0]=4 309 B9R0.2 CC(C)NCCCCCO 2230a_100000762737_100000210206 [1,0,0,0,0,0|3,0,0]=4 310 B9R0.2 CC(C)NCCCCCO 2230a_100138425928_100000746330 [1,0,0,0,0,0|3,0,0]=4 311 B9R0.2 CC(C)NCCCCCO 34a_100000762737_100000210206 [1,0,0,0,0,0|3,0,0]=4 312 B9R0.2 CC(C)NCCCCCO 34a_100138425928_100000746330 [1,0,0,0,0,0|3,0,0]=4 313 B9R0.2 CC(C)OCCCCCO 34a_100000212225_100000746330 [1,0,0,0,0,0|3,0,0]=4 314 B9R0.2 CC(C)OCOCCCBr 34a_100011217188_100000709892 [1,0,0,0,0,0|3,0,0]=4 315 B9R0.2 CC(C)OCOCCCCl 34a_100000230001_100000709892 [1,0,0,0,0,0|3,0,0]=4 316 B9R0.2 CC(C)OCOCCCF 34a_100000759539_100000709892 [1,0,0,0,0,0|3,0,0]=4 317 B9R0.2 CC(C)OCOCCCN 34a_100000182051_100000709892 [1,0,0,0,0,0|3,0,0]=4 318 B9R0.2 CC(C)OCSCCCO 62a_100000709892_100011215043 [1,0,0,0,0,0|2,1,0]=4 319 B9R0.2 CC(C)OCSCCCO 62a_100011215043_100000709892 [1,0,0,0,0,0|2,1,0]=4 320 B9R0.2 CC(C)SCCCCCO 62a_100000210206_100000746330 [1,0,0,0,0,0|3,0,0]=4 321 B9R0.2 CC(C)SCCCCCO 62a_100000746330_100000210206 [1,0,0,0,0,0|3,0,0]=4 322 B9R0.2 CC(F)COCCCCO 34a_100015925927_100011216708 [1,0,0,0,0,0|3,0,0]=4 323 B9R0.2 CC(O)CCCNCCF 34a_100000724931_200000718107 [1,0,0,0,0,0|3,0,0]=4 324 B9R0.2 CC(O)CCCNCCO 2230a_100016997473_200000718107 [1,0,0,0,0,0|2,0,0]=3 325 B9R0.2 CC(O)CCCNCCO 34a_100016990907_200000718107 [1,0,0,0,0,0|2,0,0]=3 326 B9R0.2 CC(O)CCCOCCBr 34a_100000211926_200000718107 [1,0,0,0,0,0|3,0,0]=4 327 B9R0.2 CC(O)CCCOCCN 34a_100000210304_200000718107 [1,0,0,0,0,0|3,0,0]=4 328 B9R0.2 CC(O)CCCSCCF 62a_100011217306_200000718107 [1,0,0,0,0,0|3,0,0]=4 329 B9R0.2 CC(O)CCCSCCF 62a_200000718107_100011217306 [1,0,0,0,0,0|3,0,0]=4 330 B9R0.2 CC(O)CCCSCCO 62a_100000211926_200000718107 [1,0,0,0,0,0|2,0,0]=3 331 B9R0.2 CC(O)CCCSCCO 62a_200000718107_100000211926 [1,0,0,0,0,0|2,0,0]=3 332 B9R0.2 CC(O)CCNCCC#N 2230a_200000755665_100011215226 [1,0,0,0,0,0|2,0,1]=4 333 B9R0.2 CC(O)CCNCCCF 2230a_100015189416_100012276601 [1,0,0,0,0,0|2,0,0]=3 334 B9R0.2 CC(O)CCNCCCF 2230a_200000755665_100011934791 [1,0,0,0,0,0|2,0,0]=3 335 B9R0.2 CC(O)CCNCCCF 34a_100015189416_100012276601 [1,0,0,0,0,0|2,0,0]=3 336 B9R0.2 CC(O)CCNCCCO 2230a_200000755665_100000230001 [1,0,0,0,0,0|1,0,0]=2 337 B9R0.2 CC(O)CCOCCCBr 34a_100011217188_100012276601 [1,0,0,0,0,0|1,0,0]=2 338 B9R0.2 CC(O)CCOCCCCl 34a_100000230001_100012276601 [1,0,0,0,0,0|1,0,0]=2 339 B9R0.2 CC(O)CCOCCCF 34a_100000759539_100012276601 [1,0,0,0,0,0|1,0,0]=2 340 B9R0.2 CC(O)CCOCCCN 34a_100000182051_100012276601 [1,0,0,0,0,0|1,0,0]=2 341 B9R0.2 CC(O)CCOCCON 34a_100000700252_100012276601 [1,0,0,0,0,0|2,0,0]=3 342 B9R0.2 CC(O)CCSCCC#N 62a_100011215226_100012276601 [1,0,0,0,0,0|1,1,1]=4 343 B9R0.2 CC(O)CCSCCC#N 62a_100012276601_100011215226 [1,0,0,0,0,0|1,1,1]=4 344 B9R0.2 CC(O)CCSCCCF 62a_100011934791_100012276601 [1,0,0,0,0,0|1,1,0]=3 345 B9R0.2 CC(O)CCSCCCF 62a_100012276601_100011934791 [1,0,0,0,0,0|1,1,0]=3 346 B9R0.2 CC(O)CCSCCCO 62a_100011215043_100012276601 [1,0,0,0,0,0|0,1,0]=2 347 B9R0.2 CC(O)CCSCCCO 62a_100012276601_100011215043 [1,0,0,0,0,0|0,1,0]=2 348 B9R0.2 CC(O)CNCCCCF 2230a_100000210904_100000729493 [1,0,0,0,0,0|3,0,0]=4 349 B9R0.2 CC(O)CNCCCCF 34a_100000210904_100000729493 [1,0,0,0,0,0|3,0,0]=4 350 B9R0.2 CC(O)CNCCCCO 2230a_100000210904_100000210776 [1,0,0,0,0,0|2,0,0]=3 351 B9R0.2 CC(O)CNCCCCO 2230a_100000750430_100011218427 [1,0,0,0,0,0|2,0,0]=3 352 B9R0.2 CC(O)CNCCCCO 34a_100000210904_100011216708 [1,0,0,0,0,0|2,0,0]=3 353 B9R0.2 CC(O)CNCCCCO 34a_100000750430_100011218427 [1,0,0,0,0,0|2,0,0]=3 354 B9R0.2 CC(O)COCCCCBr 34a_100011216708_100011218427 [1,0,0,0,0,0|3,0,0]=4 355 B9R0.2 CC(O)COCCCCCl 34a_100000210776_100011218427 [1,0,0,0,0,0|3,0,0]=4 356 B9R0.2 CC(O)COCCCCCl 7a_100000210776_100011218427 [1,0,0,0,0,0|3,0,0]=4 357 B9R0.2 CC(O)COCCCCF 34a_100011995726_100011218427 [1,0,0,0,0,0|3,0,0]=4 358 B9R0.2 CC(O)COCCCCF 7a_100011995726_100011218427 [1,0,0,0,0,0|3,0,0]=4 359 B9R0.2 CC(O)COCCCCI 34a_200012148704_100011218427 [1,0,0,0,0,0|3,0,0]=4 360 B9R0.2 CC(O)COCCCCN 34a_100000750430_100011218427 [1,0,0,0,0,0|3,0,0]=4 361 B9R0.2 CC(O)CSCCCCF 62a_100000729493_100011218427 [1,0,0,0,0,0|3,0,0]=4 362 B9R0.2 CC(O)CSCCCCF 62a_100011218427_100000729493 [1,0,0,0,0,0|3,0,0]=4 363 B9R0.2 CC(O)CSCCCCO 62a_100000210776_100011218427 [1,0,0,0,0,0|2,0,0]=3 364 B9R0.2 CC(O)CSCCCCO 62a_100011218427_100000210776 [1,0,0,0,0,0|2,0,0]=3 365 B9R0.2 CC=CCNCCC(C)O 2230a_200000755665_100000070051 [1,0,0,0,0,0|1,0,2]=4 366 B9R0.2 CC=CCOCCC(C)Br 34a_100009893172_100000070051 [1,0,0,0,0,0|1,0,2]=4 367 B9R0.2 CC=CCOCCC(C)C 34a_100000210254_100000070051 [1,0,0,0,0,0|1,0,2]=4 368 B9R0.2 CC=CCOCCC(C)C 7a_100000210254_100000070051 [1,0,0,0,0,0|1,0,2]=4 369 B9R0.2 CC=CCOCC[C@@H](C)N 34a_100000706166_100000070051 [1,0,0,0,0,0|1,0,2]=4 370 B9R0.2 CC=CCSCCC(C)O 62a_100000070051_100012276601 [1,0,0,0,0,0|0,1,2]=4 371 B9R0.2 CC=CCSCCC(C)O 62a_100012276601_100000070051 [1,0,0,0,0,0|0,1,2]=4 372 B9R0.2 CCCC=NNCC(C)O 4a_200000730056_100000185831 [1,0,0,0,0,0|2,0,1]=4 373 B9R0.2 CCCCCCCC(=O)C 1458a_100000070787_100000210614 [1,0,0,0,0,0|1,0,2]=4 374 B9R0.2 CCCCCCCC(=O)C 1458a_100000211969_200000210301 [1,0,0,0,0,0|1,0,2]=4 375 B9R0.2 CCCCCCCC(=O)[13CH3] 1458a_100000211969_200025704644 [1,0,0,0,0,0|1,0,2]=4 376 B9R0.2 CCCCCCCN(C)C 2230a_100000228206_200000210301 [1,0,0,0,0,0|3,0,0]=4 377 B9R0.2 CCCCCCCN(C)C 2230a_100102631434_100000210681 [1,0,0,0,0,0|3,0,0]=4 378 B9R0.2 CCCCCCCN(C)C 269982a_100000228206_200000210301 [1,0,0,0,0,0|3,0,0]=4 379 B9R0.2 CCCCCCCN(C)C 269982a_100102631434_100000210681 [1,0,0,0,0,0|3,0,0]=4 380 B9R0.2 CCCCCCCN(C)[13CH3] 2230a_100000228206_200025704644 [1,0,0,0,0,0|3,0,0]=4 381 B9R0.2 CCCCCCCN(C)[13CH3] 269982a_100000228206_200025704644 [1,0,0,0,0,0|3,0,0]=4 382 B9R0.2 CCCCCCNC(C)C 2230a_100000210581_100000210206 [1,0,0,0,0,0|3,0,0]=4 383 B9R0.2 CCCCCCNC(C)C 2230a_100138425928_100000210314 [1,0,0,0,0,0|3,0,0]=4 384 B9R0.2 CCCCCCNC(C)C 34a_100138425928_100000210314 [1,0,0,0,0,0|3,0,0]=4 385 B9R0.2 CCCCCCOC(C)C 34a_100000210259_100000210206 [1,0,0,0,0,0|3,0,0]=4 386 B9R0.2 CCCCCCOC(C)C 34a_100000212225_100000210314 [1,0,0,0,0,0|3,0,0]=4 387 B9R0.2 CCCCCCOC(C)C 7a_100000210259_100000210206 [1,0,0,0,0,0|3,0,0]=4 388 B9R0.2 CCCCCCSC(C)C 62a_100000210206_100000210757 [1,0,0,0,0,0|3,0,0]=4 389 B9R0.2 CCCCCCSC(C)C 62a_100000210314_100000210206 [1,0,0,0,0,0|3,0,0]=4 390 B9R0.2 CCCCCNCC(C)C 2230a_100000209983_100000210760 [1,0,0,0,0,0|3,0,0]=4 391 B9R0.2 CCCCCNCC(C)C 2230a_100000210953_100000210326 [1,0,0,0,0,0|3,0,0]=4 392 B9R0.2 CCCCCNCC(C)C 270004a_100000209983_100000210432 [1,0,0,0,0,0|3,0,0]=4 393 B9R0.2 CCCCCNCC(C)C 34a_100000210953_100000718602 [1,0,0,0,0,0|3,0,0]=4 394 B9R0.2 CCCCCNCC(C)O 2230a_100000209983_100011218427 [1,0,0,0,0,0|2,0,0]=3 395 B9R0.2 CCCCCNCC(C)O 2230a_100000210904_100000210326 [1,0,0,0,0,0|2,0,0]=3 396 B9R0.2 CCCCCNCC(C)O 34a_100000210904_100000718602 [1,0,0,0,0,0|2,0,0]=3 397 B9R0.2 CCCCCNC[C@@H](C)O 2230a_100000209983_100009817552 [1,0,0,0,0,0|2,0,0]=3 398 B9R0.2 CCCCCOCC(C)Br 34a_100012180447_100000718602 [1,0,0,0,0,0|3,0,0]=4 399 B9R0.2 CCCCCOCC(C)C 34a_100000210253_100000210624 [1,0,0,0,0,0|3,0,0]=4 400 B9R0.2 CCCCCOCC(C)C 34a_100000210257_100000718602 [1,0,0,0,0,0|3,0,0]=4 401 B9R0.2 CCCCCOCC(C)C 7a_100000210253_100000210760 [1,0,0,0,0,0|3,0,0]=4 402 B9R0.2 CCCCCOCC(C)F 34a_100015925927_100000718602 [1,0,0,0,0,0|3,0,0]=4 403 B9R0.2 CCCCCOCC(C)O 34a_100000210253_100011218427 [1,0,0,0,0,0|2,0,0]=3 404 B9R0.2 CCCCCOCC(C)O 7a_100000210253_100011218427 [1,0,0,0,0,0|2,0,0]=3 405 B9R0.2 CCCCCOC[C@@H](C)Cl 34a_100016084084_100000718602 [1,0,0,0,0,0|3,0,0]=4 406 B9R0.2 CCCCCOC[C@@H](C)N 34a_100000737577_100000718602 [1,0,0,0,0,0|3,0,0]=4 407 B9R0.2 CCCCCOC[C@@H](C)O 34a_100000210253_100009817552 [1,0,0,0,0,0|2,0,0]=3 408 B9R0.2 CCCCCOC[C@@H](C)O 7a_100000210253_100009817552 [1,0,0,0,0,0|2,0,0]=3 409 B9R0.2 CCCCCSCC(C)C 62a_100000210326_100000210760 [1,0,0,0,0,0|3,0,0]=4 410 B9R0.2 CCCCCSCC(C)C 62a_100000210624_100000210326 [1,0,0,0,0,0|3,0,0]=4 411 B9R0.2 CCCCCSCC(C)O 62a_100000210326_100011218427 [1,0,0,0,0,0|2,0,0]=3 412 B9R0.2 CCCCCSCC(C)O 62a_100011218427_100000210326 [1,0,0,0,0,0|2,0,0]=3 413 B9R0.2 CCCCCSC[C@@H](C)O 62a_100000210326_100009817552 [1,0,0,0,0,0|2,0,0]=3 414 B9R0.2 CCCCCSC[C@@H](C)O 62a_100009817552_100000210326 [1,0,0,0,0,0|2,0,0]=3 415 B9R0.2 CCCCNCCC(=O)C 7a_106832991798_100000053229 [1,0,0,0,0,0|1,0,2]=4 416 B9R0.2 CCCCNCCC(C)C 2230a_100000102301_100000210312 [1,0,0,0,0,0|2,0,0]=3 417 B9R0.2 CCCCNCCC(C)C 269862a_100000102301_100000185833 [1,0,0,0,0,0|2,0,0]=3 418 B9R0.2 CCCCNCCC(C)C 7a_106832991798_100000210626 [1,0,0,0,0,0|2,0,0]=3 419 B9R0.2 CCCCNCCC(C)O 2230a_100000102301_100012276601 [1,0,0,0,0,0|1,0,0]=2 420 B9R0.2 CCCCNCCC(C)O 2230a_200000755665_100000210211 [1,0,0,0,0,0|1,0,0]=2 421 B9R0.2 CCCCNCCC(C)O 7a_106832991798_100012276601 [1,0,0,0,0,0|1,0,0]=2 422 B9R0.2 CCCCNCCN(C)C 7a_106832991798_100000755713 [1,0,0,0,0,0|3,0,0]=4 423 B9R0.2 CCCCNCOC(C)C 2230a_100000102301_100000709892 [1,0,0,0,0,0|3,0,0]=4 424 B9R0.2 CCCCOCC=C(C)C 34a_100000210227_100000761012 [1,0,0,0,0,0|1,0,2]=4 425 B9R0.2 CCCCOCC=C(C)C 34a_100000753907_100000210210 [1,0,0,0,0,0|1,0,2]=4 426 B9R0.2 CCCCOCC=C(C)C 7a_100000210227_100000761012 [1,0,0,0,0,0|1,0,2]=4 427 B9R0.2 CCCCOCCC(=O)C 1458a_100000070787_100000743108 [1,0,0,0,0,0|0,0,2]=3 428 B9R0.2 CCCCOCCC(=O)C 34a_100000759926_100000210210 [1,0,0,0,0,0|0,0,2]=3 429 B9R0.2 CCCCOCCC(=O)C 7a_100000210227_100000053229 [1,0,0,0,0,0|0,0,2]=3 430 B9R0.2 CCCCOCCC(=O)C 7a_100000759926_100000210211 [1,0,0,0,0,0|0,0,2]=3 431 B9R0.2 CCCCOCCC(=O)N 34a_100000210227_100000731001 [1,0,0,0,0,0|1,0,2]=4 432 B9R0.2 CCCCOCCC(=O)N 34a_100000757172_100000210210 [1,0,0,0,0,0|1,0,2]=4 433 B9R0.2 CCCCOCCC(=O)N 7a_100000210227_100000744528 [1,0,0,0,0,0|1,0,2]=4 434 B9R0.2 CCCCOCCC(=O)N 7a_100000757172_100000210211 [1,0,0,0,0,0|1,0,2]=4 435 B9R0.2 CCCCOCCC(C)Br 34a_100009893172_100000210210 [1,0,0,0,0,0|1,0,0]=2 436 B9R0.2 CCCCOCCC(C)C 34a_100000210227_100000210312 [1,0,0,0,0,0|1,0,0]=2 437 B9R0.2 CCCCOCCC(C)C 34a_100000210254_100000210210 [1,0,0,0,0,0|1,0,0]=2 438 B9R0.2 CCCCOCCC(C)C 7a_100000210227_100000210626 [1,0,0,0,0,0|1,0,0]=2 439 B9R0.2 CCCCOCCC(C)C 7a_100000210254_100000210211 [1,0,0,0,0,0|1,0,0]=2 440 B9R0.2 CCCCOCCC(C)O 34a_100000210227_100012276601 [1,0,0,0,0,0|0,0,0]=1 441 B9R0.2 CCCCOCCC(C)O 7a_100000210227_100012276601 [1,0,0,0,0,0|0,0,0]=1 442 B9R0.2 CCCCOCCC(F)F 34a_100103093639_100000210210 [1,0,0,0,0,0|2,0,0]=3 443 B9R0.2 CCCCOCCN(C)C 2230a_100102631434_100000743108 [1,0,0,0,0,0|2,0,0]=3 444 B9R0.2 CCCCOCCN(C)C 269982a_100102631434_100000743108 [1,0,0,0,0,0|2,0,0]=3 445 B9R0.2 CCCCOCCN(C)C 7a_100000210227_100000755713 [1,0,0,0,0,0|2,0,0]=3 446 B9R0.2 CCCCOCC[C@@H](C)N 34a_100000706166_100000210210 [1,0,0,0,0,0|1,0,0]=2 447 B9R0.2 CCCCOCNC(C)C 2230a_100138425928_100011995733 [1,0,0,0,0,0|2,0,0]=3 448 B9R0.2 CCCCOCNC(C)C 34a_100138425928_100011995733 [1,0,0,0,0,0|2,0,0]=3 449 B9R0.2 CCCCOCOC(=O)C 34a_100000210227_100009813279 [1,0,0,0,0,0|1,0,2]=4 450 B9R0.2 CCCCOCOC(C)C 34a_100000210227_100000709892 [1,0,0,0,0,0|2,0,0]=3 451 B9R0.2 CCCCOCOC(C)C 34a_100000212225_100011995733 [1,0,0,0,0,0|2,0,0]=3 452 B9R0.2 CCCCOCSC(C)C 62a_100000210206_100011995733 [1,0,0,0,0,0|2,0,0]=3 453 B9R0.2 CCCCOCSC(C)C 62a_100011995733_100000210206 [1,0,0,0,0,0|2,0,0]=3 454 B9R0.2 CCCCSCCC(=O)C 62a_100000053229_100000210210 [1,0,0,0,0,0|0,1,2]=4 455 B9R0.2 CCCCSCCC(=O)C 62a_100000210211_100000053229 [1,0,0,0,0,0|0,1,2]=4 456 B9R0.2 CCCCSCCC(C)C 62a_100000210211_100000210312 [1,0,0,0,0,0|1,1,0]=3 457 B9R0.2 CCCCSCCC(C)C 62a_100000210312_100000210210 [1,0,0,0,0,0|1,1,0]=3 458 B9R0.2 CCCCSCCC(C)O 62a_100000210211_100012276601 [1,0,0,0,0,0|0,1,0]=2 459 B9R0.2 CCCCSCCC(C)O 62a_100012276601_100000210210 [1,0,0,0,0,0|0,1,0]=2 460 B9R0.2 CCCCSCCN(C)C 62a_100000210211_100000755713 [1,0,0,0,0,0|2,1,0]=4 461 B9R0.2 CCCCSCOC(C)C 62a_100000210211_100000709892 [1,0,0,0,0,0|2,1,0]=4 462 B9R0.2 CCCCSCOC(C)C 62a_100000709892_100000210210 [1,0,0,0,0,0|2,1,0]=4 463 B9R0.2 CCCNCCCC(C)C 2230a_200000737386_100000210303 [1,0,0,0,0,0|3,0,0]=4 464 B9R0.2 CCCNCCCC(C)C 34a_200000737386_100000210303 [1,0,0,0,0,0|3,0,0]=4 465 B9R0.2 CCCOCCCC(C)C 34a_100000210258_100011214892 [1,0,0,0,0,0|3,0,0]=4 466 B9R0.2 CCCOCCCC(C)C 34a_100000210774_100000210303 [1,0,0,0,0,0|3,0,0]=4 467 B9R0.2 CCCOCCCC(C)C 7a_100000210774_100000210303 [1,0,0,0,0,0|3,0,0]=4 468 B9R0.2 CCCOCCCC(C)O 34a_100000210258_200000718107 [1,0,0,0,0,0|2,0,0]=3 469 B9R0.2 CCCSCCCC(C)C 62a_100000210303_100011214892 [1,0,0,0,0,0|3,0,0]=4 470 B9R0.2 CCCSCCCC(C)C 62a_100011214892_100000210303 [1,0,0,0,0,0|3,0,0]=4 471 B9R0.2 CCCSCCCC(C)O 62a_100000210303_200000718107 [1,0,0,0,0,0|2,0,0]=3 472 B9R0.2 CCCSCCCC(C)O 62a_200000718107_100000210303 [1,0,0,0,0,0|2,0,0]=3 473 B9R0.2 CCNCCCCC(C)C 2230a_100015525214_100011216152 [1,0,0,0,0,0|3,0,0]=4 474 B9R0.2 CCOCCCCC(C)C 34a_100011214890_100000210202 [1,0,0,0,0,0|3,0,0]=4 475 B9R0.2 CCOCCCCC(C)C 34a_100121572206_100011216152 [1,0,0,0,0,0|3,0,0]=4 476 B9R0.2 CCOCCCCC(C)C 7a_100011214890_100000210202 [1,0,0,0,0,0|3,0,0]=4 477 B9R0.2 CCOCCNCC(C)O 2230a_100000210904_100011215890 [1,0,0,0,0,0|3,0,0]=4 478 B9R0.2 CCOCCNCC(C)O 2230a_102516460346_100011218427 [1,0,0,0,0,0|3,0,0]=4 479 B9R0.2 CCOCCNCC(C)O 34a_100000210904_100000210147 [1,0,0,0,0,0|3,0,0]=4 480 B9R0.2 CCOCCNCC(C)O 34a_102516460346_100011218427 [1,0,0,0,0,0|3,0,0]=4 481 B9R0.2 CCOCCNC[C@@H](C)O 2230a_102516460346_100009817552 [1,0,0,0,0,0|3,0,0]=4 482 B9R0.2 CCOCCNC[C@@H](C)O 34a_102516460346_100009817552 [1,0,0,0,0,0|3,0,0]=4 483 B9R0.2 CCOCCOCC(C)O 34a_100000210136_100011218427 [1,0,0,0,0,0|3,0,0]=4 484 B9R0.2 CCOCCOCC(C)O 7a_100000210136_100011218427 [1,0,0,0,0,0|3,0,0]=4 485 B9R0.2 CCOCCOC[C@@H](C)O 34a_100000210136_100009817552 [1,0,0,0,0,0|3,0,0]=4 486 B9R0.2 CCOCCOC[C@@H](C)O 7a_100000210136_100009817552 [1,0,0,0,0,0|3,0,0]=4 487 B9R0.2 CCOCCSCC(C)O 62a_100000210147_100011218427 [1,0,0,0,0,0|3,0,0]=4 488 B9R0.2 CCOCCSCC(C)O 62a_100011218427_100011215890 [1,0,0,0,0,0|3,0,0]=4 489 B9R0.2 CCOCCSC[C@@H](C)O 62a_100000210147_100009817552 [1,0,0,0,0,0|3,0,0]=4 490 B9R0.2 CCOCCSC[C@@H](C)O 62a_100009817552_100011215890 [1,0,0,0,0,0|3,0,0]=4 491 B9R0.2 CCOCSCCC(C)C 62a_100000210312_100000739092 [1,0,0,0,0,0|2,1,0]=4 492 B9R0.2 CCOCSCCC(C)C 62a_100000739092_100000210312 [1,0,0,0,0,0|2,1,0]=4 493 B9R0.2 CCOCSCCC(C)O 62a_100000739092_100012276601 [1,0,0,0,0,0|1,1,0]=3 494 B9R0.2 CCOCSCCC(C)O 62a_100012276601_100000739092 [1,0,0,0,0,0|1,1,0]=3 495 B9R0.2 CCSCCCCC(C)C 62a_100000210202_100011216152 [1,0,0,0,0,0|3,0,0]=4 496 B9R0.2 CCSCCCCC(C)C 62a_100011216152_100000210202 [1,0,0,0,0,0|3,0,0]=4 497 B9R0.2 CCSCCNCC(C)O 2230a_100000106463_100011218427 [1,0,0,0,0,0|3,0,0]=4 498 B9R0.2 CCSCCNCC(C)O 2230a_100000210904_100000757381 [1,0,0,0,0,0|3,0,0]=4 499 B9R0.2 CCSCCNCC(C)O 34a_100000210904_100000757381 [1,0,0,0,0,0|3,0,0]=4 500 B9R0.2 CCSCCNC[C@@H](C)O 2230a_100000106463_100009817552 [1,0,0,0,0,0|3,0,0]=4 501 B9R0.2 CCSCCOCC(C)O 34a_100000212035_100011218427 [1,0,0,0,0,0|3,0,0]=4 502 B9R0.2 CCSCCOCC(C)O 7a_100000212035_100011218427 [1,0,0,0,0,0|3,0,0]=4 503 B9R0.2 CCSCCOC[C@@H](C)O 34a_100000212035_100009817552 [1,0,0,0,0,0|3,0,0]=4 504 B9R0.2 CCSCCOC[C@@H](C)O 7a_100000212035_100009817552 [1,0,0,0,0,0|3,0,0]=4 505 B9R0.2 CCSCCSCC(C)O 62a_100000757381_100011218427 [1,0,0,0,0,0|3,0,0]=4 506 B9R0.2 CCSCCSCC(C)O 62a_100011218427_100000757381 [1,0,0,0,0,0|3,0,0]=4 507 B9R0.2 CCSCCSC[C@@H](C)O 62a_100000757381_100009817552 [1,0,0,0,0,0|3,0,0]=4 508 B9R0.2 CCSCCSC[C@@H](C)O 62a_100009817552_100000757381 [1,0,0,0,0,0|3,0,0]=4 509 B9R0.2 CN(C)CCCCCCO 2230a_100102631434_100000766143 [1,0,0,0,0,0|3,0,0]=4 510 B9R0.2 CN(C)CCCCCCO 269982a_100102631434_100000766143 [1,0,0,0,0,0|3,0,0]=4 511 B9R0.2 CN(C)CCSCCCO 62a_100011215043_100000755713 [1,0,0,0,0,0|2,1,0]=4 512 B9R0.2 CNCCCCCC(C)C 2230a_100011290863_200000210301 [1,0,0,0,0,0|3,0,0]=4 513 B9R0.2 CNCCCCCC(C)C 2230a_106832991635_100000210682 [1,0,0,0,0,0|3,0,0]=4 514 B9R0.2 CNCCCCCC(C)C 34a_100011290863_200000210301 [1,0,0,0,0,0|3,0,0]=4 515 B9R0.2 CNCCCCCC(C)C 34a_100102657272_100000210682 [1,0,0,0,0,0|3,0,0]=4 516 B9R0.2 CNCCCCCC(C)C 7a_106832991635_100000210682 [1,0,0,0,0,0|3,0,0]=4 517 B9R0.2 CNCCCOCC(C)O 34a_100000213112_100011218427 [1,0,0,0,0,0|3,0,0]=4 518 B9R0.2 CNCCCOC[C@@H](C)O 34a_100000213112_100009817552 [1,0,0,0,0,0|3,0,0]=4 519 B9R0.2 COCCCCCC(C)C 34a_100011995859_200000210301 [1,0,0,0,0,0|3,0,0]=4 520 B9R0.2 COCCCCCC(C)C 34a_100138415774_100000210682 [1,0,0,0,0,0|3,0,0]=4 521 B9R0.2 COCCCCCC(C)C 7a_100011995859_200000210301 [1,0,0,0,0,0|3,0,0]=4 522 B9R0.2 COCCCNCC(C)O 2230a_100000210904_100000740836 [1,0,0,0,0,0|3,0,0]=4 523 B9R0.2 COCCCNCC(C)O 34a_100000210904_100000740836 [1,0,0,0,0,0|3,0,0]=4 524 B9R0.2 COCCCNCC(C)O 34a_100150723488_100011218427 [1,0,0,0,0,0|3,0,0]=4 525 B9R0.2 COCCCNC[C@@H](C)O 34a_100150723488_100009817552 [1,0,0,0,0,0|3,0,0]=4 526 B9R0.2 COCCCOCC(C)O 34a_100000740835_100011218427 [1,0,0,0,0,0|3,0,0]=4 527 B9R0.2 COCCCOC[C@@H](C)O 34a_100000740835_100009817552 [1,0,0,0,0,0|3,0,0]=4 528 B9R0.2 COCCCSCC(C)O 62a_100000709357_100011218427 [1,0,0,0,0,0|3,0,0]=4 529 B9R0.2 COCCCSCC(C)O 62a_100011218427_100000709357 [1,0,0,0,0,0|3,0,0]=4 530 B9R0.2 COCCCSC[C@@H](C)O 62a_100000709357_100009817552 [1,0,0,0,0,0|3,0,0]=4 531 B9R0.2 COCCCSC[C@@H](C)O 62a_100009817552_100000709357 [1,0,0,0,0,0|3,0,0]=4 532 B9R0.2 COCCNCCC(C)C 2230a_100000209980_100000210312 [1,0,0,0,0,0|3,0,0]=4 533 B9R0.2 COCCNCCC(C)C 269862a_100000209980_100000185833 [1,0,0,0,0,0|3,0,0]=4 534 B9R0.2 COCCNCCC(C)O 2230a_100000209980_100012276601 [1,0,0,0,0,0|2,0,0]=3 535 B9R0.2 COCCNCCC(C)O 2230a_200000755665_100011201679 [1,0,0,0,0,0|2,0,0]=3 536 B9R0.2 COCCOCCC(=O)C 1458a_100000070787_100000695917 [1,0,0,0,0,0|1,0,2]=4 537 B9R0.2 COCCOCCC(=O)C 1458a_100000745395_200000210301 [1,0,0,0,0,0|1,0,2]=4 538 B9R0.2 COCCOCCC(=O)C 34a_100000759926_100011201679 [1,0,0,0,0,0|1,0,2]=4 539 B9R0.2 COCCOCCC(=O)C 7a_100000759926_100000233755 [1,0,0,0,0,0|1,0,2]=4 540 B9R0.2 COCCOCCC(=O)[13CH3] 1458a_100000745395_200025704644 [1,0,0,0,0,0|1,0,2]=4 541 B9R0.2 COCCOCCC(C)Br 34a_100009893172_100011201679 [1,0,0,0,0,0|2,0,0]=3 542 B9R0.2 COCCOCCC(C)C 34a_100000210237_100000210312 [1,0,0,0,0,0|2,0,0]=3 543 B9R0.2 COCCOCCC(C)C 34a_100000210254_100011201679 [1,0,0,0,0,0|2,0,0]=3 544 B9R0.2 COCCOCCC(C)C 7a_100000210254_100000233755 [1,0,0,0,0,0|2,0,0]=3 545 B9R0.2 COCCOCCC(C)O 34a_100000210237_100012276601 [1,0,0,0,0,0|1,0,0]=2 546 B9R0.2 COCCOCCC(F)F 34a_100103093639_100011201679 [1,0,0,0,0,0|3,0,0]=4 547 B9R0.2 COCCOCCN(C)C 2230a_100102631434_100000695917 [1,0,0,0,0,0|3,0,0]=4 548 B9R0.2 COCCOCCN(C)C 269982a_100102631434_100000695917 [1,0,0,0,0,0|3,0,0]=4 549 B9R0.2 COCCOCC[C@@H](C)N 34a_100000706166_100011201679 [1,0,0,0,0,0|2,0,0]=3 550 B9R0.2 COCCOCNC(C)C 2230a_100138425928_100000231047 [1,0,0,0,0,0|3,0,0]=4 551 B9R0.2 COCCOCOC(C)C 34a_100000210237_100000709892 [1,0,0,0,0,0|3,0,0]=4 552 B9R0.2 COCCOCSC(C)C 62a_100000210206_100000231047 [1,0,0,0,0,0|3,0,0]=4 553 B9R0.2 COCCOCSC(C)C 62a_100000231047_100000210206 [1,0,0,0,0,0|3,0,0]=4 554 B9R0.2 COCCSCCC(C)C 62a_100000210312_100000233755 [1,0,0,0,0,0|2,1,0]=4 555 B9R0.2 COCCSCCC(C)C 62a_100000233755_100000210312 [1,0,0,0,0,0|2,1,0]=4 556 B9R0.2 COCCSCCC(C)O 62a_100000233755_100012276601 [1,0,0,0,0,0|1,1,0]=3 557 B9R0.2 COCCSCCC(C)O 62a_100012276601_100000233755 [1,0,0,0,0,0|1,1,0]=3 558 B9R0.2 COCSCCCC(C)O 62a_100000766300_200000718107 [1,0,0,0,0,0|3,0,0]=4 559 B9R0.2 COCSCCCC(C)O 62a_200000718107_100000766300 [1,0,0,0,0,0|3,0,0]=4 560 B9R0.2 CSCCCCCC(C)C 62a_100000210682_200000210301 [1,0,0,0,0,0|3,0,0]=4 561 B9R0.2 CSCCCCCC(C)C 62a_200000210301_100000210682 [1,0,0,0,0,0|3,0,0]=4 562 B9R0.2 CSCCCNCC(C)O 2230a_100000749238_100011218427 [1,0,0,0,0,0|3,0,0]=4 563 B9R0.2 CSCCCNC[C@@H](C)O 2230a_100000749238_100009817552 [1,0,0,0,0,0|3,0,0]=4 564 B9R0.2 CSCCCOCC(C)O 34a_100000690336_100011218427 [1,0,0,0,0,0|3,0,0]=4 565 B9R0.2 CSCCCOCC(C)O 7a_100000690336_100011218427 [1,0,0,0,0,0|3,0,0]=4 566 B9R0.2 CSCCCOC[C@@H](C)O 34a_100000690336_100009817552 [1,0,0,0,0,0|3,0,0]=4 567 B9R0.2 CSCCCOC[C@@H](C)O 7a_100000690336_100009817552 [1,0,0,0,0,0|3,0,0]=4 568 B9R0.2 CSCCNCCC(C)C 2230a_100020590264_100000210312 [1,0,0,0,0,0|3,0,0]=4 569 B9R0.2 CSCCNCCC(C)C 269862a_100020590264_100000185833 [1,0,0,0,0,0|3,0,0]=4 570 B9R0.2 CSCCNCCC(C)O 2230a_100020590264_100012276601 [1,0,0,0,0,0|2,0,0]=3 571 B9R0.2 CSCCNCCC(C)O 2230a_200000755665_100000751147 [1,0,0,0,0,0|2,0,0]=3 572 B9R0.2 CSCCOCCC(=O)C 34a_100000759926_100000212216 [1,0,0,0,0,0|1,0,2]=4 573 B9R0.2 CSCCOCCC(=O)C 7a_100000230434_100000053229 [1,0,0,0,0,0|1,0,2]=4 574 B9R0.2 CSCCOCCC(=O)C 7a_100000759926_100000212216 [1,0,0,0,0,0|1,0,2]=4 575 B9R0.2 CSCCOCCC(C)Br 34a_100009893172_100000212216 [1,0,0,0,0,0|2,0,0]=3 576 B9R0.2 CSCCOCCC(C)C 34a_100000210254_100000212216 [1,0,0,0,0,0|2,0,0]=3 577 B9R0.2 CSCCOCCC(C)C 34a_100000230434_100000210312 [1,0,0,0,0,0|2,0,0]=3 578 B9R0.2 CSCCOCCC(C)C 7a_100000210254_100000212216 [1,0,0,0,0,0|2,0,0]=3 579 B9R0.2 CSCCOCCC(C)C 7a_100000230434_100000210626 [1,0,0,0,0,0|2,0,0]=3 580 B9R0.2 CSCCOCCC(C)O 34a_100000230434_100012276601 [1,0,0,0,0,0|1,0,0]=2 581 B9R0.2 CSCCOCCC(C)O 7a_100000230434_100012276601 [1,0,0,0,0,0|1,0,0]=2 582 B9R0.2 CSCCOCCC(F)F 34a_100103093639_100000212216 [1,0,0,0,0,0|3,0,0]=4 583 B9R0.2 CSCCOCCN(C)C 7a_100000230434_100000755713 [1,0,0,0,0,0|3,0,0]=4 584 B9R0.2 CSCCOCC[C@@H](C)N 34a_100000706166_100000212216 [1,0,0,0,0,0|2,0,0]=3 585 B9R0.2 CSCCOCOC(C)C 34a_100000230434_100000709892 [1,0,0,0,0,0|3,0,0]=4 586 B9R0.2 CSCCSCCC(C)C 62a_100000210312_100000751147 [1,0,0,0,0,0|2,1,0]=4 587 B9R0.2 CSCCSCCC(C)C 62a_100000212216_100000210312 [1,0,0,0,0,0|2,1,0]=4 588 B9R0.2 CSCCSCCC(C)O 62a_100000212216_100012276601 [1,0,0,0,0,0|1,1,0]=3 589 B9R0.2 CSCCSCCC(C)O 62a_100012276601_100000751147 [1,0,0,0,0,0|1,1,0]=3 590 B9R0.2 CSCSCCCC(C)O 62a_100011218213_200000718107 [1,0,0,0,0,0|3,0,0]=4 591 B9R0.2 CSCSCCCC(C)O 62a_200000718107_100011218213 [1,0,0,0,0,0|3,0,0]=4 592 B9R0.2 C[C@@H](Cl)COCCCCO 34a_100016084084_100011216708 [1,0,0,0,0,0|3,0,0]=4 593 B9R0.2 C[C@@H](N)CCOCCCF 34a_100000706166_100011934791 [1,0,0,0,0,0|2,0,0]=3 594 B9R0.2 C[C@@H](N)CCOCCCO 34a_100000706166_100000230001 [1,0,0,0,0,0|1,0,0]=2 595 B9R0.2 C[C@@H](N)COCCCCO 34a_100000737577_100011216708 [1,0,0,0,0,0|3,0,0]=4 596 B9R0.2 C[C@@H](O)CNCCCCO 2230a_100000750430_100009817552 [1,0,0,0,0,0|2,0,0]=3 597 B9R0.2 C[C@@H](O)CNCCCCO 34a_100000750430_100009817552 [1,0,0,0,0,0|2,0,0]=3 598 B9R0.2 C[C@@H](O)COCCCCBr 34a_100011216708_100009817552 [1,0,0,0,0,0|3,0,0]=4 599 B9R0.2 C[C@@H](O)COCCCCCl 34a_100000210776_100009817552 [1,0,0,0,0,0|3,0,0]=4 600 B9R0.2 C[C@@H](O)COCCCCCl 7a_100000210776_100009817552 [1,0,0,0,0,0|3,0,0]=4 601 B9R0.2 C[C@@H](O)COCCCCF 34a_100011995726_100009817552 [1,0,0,0,0,0|3,0,0]=4 602 B9R0.2 C[C@@H](O)COCCCCF 7a_100011995726_100009817552 [1,0,0,0,0,0|3,0,0]=4 603 B9R0.2 C[C@@H](O)COCCCCI 34a_200012148704_100009817552 [1,0,0,0,0,0|3,0,0]=4 604 B9R0.2 C[C@@H](O)COCCCCN 34a_100000750430_100009817552 [1,0,0,0,0,0|3,0,0]=4 605 B9R0.2 C[C@@H](O)CSCCCCF 62a_100000729493_100009817552 [1,0,0,0,0,0|3,0,0]=4 606 B9R0.2 C[C@@H](O)CSCCCCF 62a_100009817552_100000729493 [1,0,0,0,0,0|3,0,0]=4 607 B9R0.2 C[C@@H](O)CSCCCCO 62a_100000210776_100009817552 [1,0,0,0,0,0|2,0,0]=3 608 B9R0.2 C[C@@H](O)CSCCCCO 62a_100009817552_100000210776 [1,0,0,0,0,0|2,0,0]=3 609 B9R0.2 FCCCOCCC(F)F 34a_100103093639_100011934791 [1,0,0,0,0,0|3,0,0]=4 610 B9R0.2 NC(=O)CCOCCCO 34a_100000757172_100000230001 [1,0,0,0,0,0|1,0,2]=4 611 B9R0.2 NC(=O)CCOCCCO 7a_100000757172_100011215043 [1,0,0,0,0,0|1,0,2]=4 612 B9R0.2 OCCCOCCC(F)F 34a_100103093639_100000230001 [1,0,0,0,0,0|2,0,0]=3 613 B9R0.2 [13CH3]C(=O)CCCCCCO 1458a_100011996774_200025704644 [1,0,0,0,0,0|1,0,2]=4 614 B11R0.6 C=C(C)CCOC(C)CC(C)C 34a_100000211805_100000730704 [0,1,0,0,0,0|2,0,1]=4 615 B11R0.6 C=C(C)CCOC(C)CC(C)C 34a_100000764851_100000731052 [0,1,0,0,0,0|2,0,1]=4 616 B11R0.6 C=C(C)CCOC(C)CC(C)C 7a_100000211805_100000730704 [0,1,0,0,0,0|2,0,1]=4 617 B11R0.6 CC(=CC(C)OCCC(C)O)C 34a_100000717055_100012276601 [0,1,0,0,0,0|1,0,2]=4 618 B11R0.6 CC(=O)CCOC(C)CC(C)C 34a_100000759926_100000731052 [0,1,0,0,0,0|1,0,2]=4 619 B11R0.6 CC(=O)CCOC(C)CC(C)C 7a_100000211805_100000053229 [0,1,0,0,0,0|1,0,2]=4 620 B11R0.6 CC(=O)CCOC(C)CC(C)C 7a_100000759926_100000731052 [0,1,0,0,0,0|1,0,2]=4 621 B11R0.6 CC(C)CC(=O)CCCC(C)O 1458a_100000210554_200000718107 [0,1,0,0,0,0|2,0,1]=4 622 B11R0.6 CC(C)CC(=O)NCCC(C)O 240690a_200000755665_100000210554 [0,1,0,0,0,0|2,0,1]=4 623 B11R0.6 CC(C)CC(=O)NCCC(C)O 527a_200000755665_100000210554 [0,1,0,0,0,0|2,0,1]=4 624 B11R0.6 CC(C)CC(C)NCCC(C)O 2230a_100000692259_100012276601 [0,1,0,0,0,0|2,0,0]=3 625 B11R0.6 CC(C)CC(C)NCCC(C)O 2230a_200000755665_100000731052 [0,1,0,0,0,0|2,0,0]=3 626 B11R0.6 CC(C)CC(C)OCCC(C)Br 34a_100009893172_100000731052 [0,1,0,0,0,0|2,0,0]=3 627 B11R0.6 CC(C)CC(C)OCCC(C)O 34a_100000211805_100012276601 [0,1,0,0,0,0|1,0,0]=2 628 B11R0.6 CC(C)CC(C)OCCC(C)O 7a_100000211805_100012276601 [0,1,0,0,0,0|1,0,0]=2 629 B11R0.6 CC(C)CC(C)OCCC(F)F 34a_100103093639_100000731052 [0,1,0,0,0,0|3,0,0]=4 630 B11R0.6 CC(C)CC(C)OCCN(C)C 7a_100000211805_100000755713 [0,1,0,0,0,0|3,0,0]=4 631 B11R0.6 CC(C)CC(C)OCC[C@@H](C)N 34a_100000706166_100000731052 [0,1,0,0,0,0|2,0,0]=3 632 B11R0.6 CC(C)CC(C)OCOC(C)C 34a_100000211805_100000709892 [0,1,0,0,0,0|3,0,0]=4 633 B11R0.6 CC(C)CC(C)SCCC(C)O 62a_100000731052_100012276601 [0,1,0,0,0,0|1,1,0]=3 634 B11R0.6 CC(C)CC(C)SCCC(C)O 62a_100012276601_100000731052 [0,1,0,0,0,0|1,1,0]=3 635 B11R0.6 CC(C)CCCC(=O)CC(C)O 1458a_100011216857_100011218427 [0,1,0,0,0,0|2,0,1]=4 636 B11R0.6 CC(C)CCCC(=O)C[C@@H](C)O 1458a_100011933948_100011214892 [0,1,0,0,0,0|2,0,1]=4 637 B11R0.6 CC(C)CCCN(C)CC(C)O 2230a_100000227577_100011214892 [0,1,0,0,0,0|3,0,0]=4 638 B11R0.6 CC(C)CCCN(C)CC(C)O 269982a_100000227577_100011214892 [0,1,0,0,0,0|3,0,0]=4 639 B11R0.6 CC(C)CCNC(=O)C[C@@H](C)O 240690a_100000210545_100011933948 [0,1,0,0,0,0|2,0,1]=4 640 B11R0.6 CC(C)CCNC(C)CC(C)C 2230a_100000692259_100000210312 [0,1,0,0,0,0|3,0,0]=4 641 B11R0.6 CC(C)CCNC(C)CC(C)C 269862a_100000692259_100000185833 [0,1,0,0,0,0|3,0,0]=4 642 B11R0.6 CC(C)CCOC(C)CC(C)C 34a_100000210254_100000731052 [0,1,0,0,0,0|2,0,0]=3 643 B11R0.6 CC(C)CCOC(C)CC(C)C 34a_100000211805_100000210312 [0,1,0,0,0,0|2,0,0]=3 644 B11R0.6 CC(C)CCOC(C)CC(C)C 7a_100000210254_100000731052 [0,1,0,0,0,0|2,0,0]=3 645 B11R0.6 CC(C)CCOC(C)CC(C)C 7a_100000211805_100000210626 [0,1,0,0,0,0|2,0,0]=3 646 B11R0.6 CC(C)CCSC(C)CC(C)C 62a_100000210312_100000731052 [0,1,0,0,0,0|2,1,0]=4 647 B11R0.6 CC(C)CCSC(C)CC(C)C 62a_100000731052_100000210312 [0,1,0,0,0,0|2,1,0]=4 648 B11R0.6 CC(C)CN(C)CCCC(C)O 2230a_100000747067_200000718107 [0,1,0,0,0,0|3,0,0]=4 649 B11R0.6 CC(C)CN(C)CCCC(C)O 269982a_100000747067_200000718107 [0,1,0,0,0,0|3,0,0]=4 650 B11R0.6 CC(C)C[C@H](N)COCC(C)O 34a_100011830311_100011218427 [0,1,0,0,0,0|3,0,0]=4 651 B11R0.6 CC(C)C[C@H](N)COC[C@@H](C)O 34a_100011830311_100009817552 [0,1,0,0,0,0|3,0,0]=4 652 B11R0.6 CC(O)CCCC(=O)C[C@@H](C)O 1458a_100011933948_200000718107 [0,1,0,0,0,0|1,0,1]=3 653 B11R0.6 CC(O)CCCN(C)CC(C)O 2230a_100000227577_200000718107 [0,1,0,0,0,0|2,0,0]=3 654 B11R0.6 CC(O)CCCN(C)CC(C)O 269982a_100000227577_200000718107 [0,1,0,0,0,0|2,0,0]=3 655 B11R0.6 CC(O)CCNC(=O)C[C@@H](C)O 240690a_200000755665_100011933948 [0,1,0,0,0,0|1,0,1]=3 656 B11R0.6 CC(O)CCSC(C)CN(C)C 62a_100012276601_100020606517 [0,1,0,0,0,0|2,1,0]=4 657 B11R0.6 CC(O)CCSC(C)CN(C)C 62a_100020606517_100012276601 [0,1,0,0,0,0|2,1,0]=4 658 B11R0.6 CC(O)CNNC(=O)C[C@@H](C)O 22a_200000730056_100011933948 [0,1,0,0,0,0|2,0,1]=4 659 B11R0.29 C=C(C)CCOC[C@H](N)C(C)C 34a_100011830312_100000730704 [0,1,0,0,0,0|2,0,1]=4 660 B11R0.29 CC(=O)C(C)COCCC(C)C 34a_100000032740_100000210312 [0,1,0,0,0,0|1,0,2]=4 661 B11R0.29 CC(=O)C(C)COCCC(C)C 7a_100000032740_100000210626 [0,1,0,0,0,0|1,0,2]=4 662 B11R0.29 CC(=O)C(C)COCCC(C)O 34a_100000032740_100012276601 [0,1,0,0,0,0|0,0,2]=3 663 B11R0.29 CC(=O)C(C)COCCC(C)O 7a_100000032740_100012276601 [0,1,0,0,0,0|0,0,2]=3 664 B11R0.29 CC(Br)CCOCC(=O)C(C)C 34a_100009893172_100000753385 [0,1,0,0,0,0|2,0,1]=4 665 B11R0.29 CC(C)C(=O)COCC[C@@H](C)N 34a_100000706166_100000753385 [0,1,0,0,0,0|2,0,1]=4 666 B11R0.29 CC(C)C(N)CCOC[C@@H](C)O 34a_100161115045_100009817552 [0,1,0,0,0,0|3,0,0]=4 667 B11R0.29 CC(C)CCCCC(=O)[C@@H](C)O 1458a_100000717761_100011216152 [0,1,0,0,0,0|2,0,1]=4 668 B11R0.29 CC(C)CCCCC(=O)[C@H](C)O 1458a_217856618621_100011216152 [0,1,0,0,0,0|2,0,1]=4 669 B11R0.29 CC(C)CCNCC(O)C(C)C 2230a_100000759067_100000210312 [0,1,0,0,0,0|3,0,0]=4 670 B11R0.29 CC(C)CCNCC(O)C(C)C 269862a_100000759067_100000185833 [0,1,0,0,0,0|3,0,0]=4 671 B11R0.29 CC(C)CCNCC(O)C(C)C 34a_100000759067_100000210312 [0,1,0,0,0,0|3,0,0]=4 672 B11R0.29 CC(C)CCOCC(=O)C(C)C 34a_100000210254_100000753385 [0,1,0,0,0,0|2,0,1]=4 673 B11R0.29 CC(C)CCOCC(=O)C(C)C 7a_100000210254_100000753385 [0,1,0,0,0,0|2,0,1]=4 674 B11R0.29 CC(C)CCOC[C@H](N)C(C)C 34a_100011830312_100000210312 [0,1,0,0,0,0|2,0,0]=3 675 B11R0.29 CC(C)OCOC[C@H](N)C(C)C 34a_100011830312_100000709892 [0,1,0,0,0,0|3,0,0]=4 676 B11R0.29 CC(O)CCCNC(C)C(C)C 2230a_100000211541_200000718107 [0,1,0,0,0,0|3,0,0]=4 677 B11R0.29 CC(O)CCCOC(C)C(C)C 7a_100000748068_200000718107 [0,1,0,0,0,0|3,0,0]=4 678 B11R0.29 CC(O)CCNCC(=O)C(C)C 2230a_200000755665_100000753385 [0,1,0,0,0,0|2,0,1]=4 679 B11R0.29 CC(O)CCNCC(C)C(=O)O 269956a_100000749485_100012276601 [0,1,0,0,0,0|2,0,1]=4 680 B11R0.29 CC(O)CCNCC(F)C(=O)O 269956a_100000084737_100012276601 [0,1,0,0,0,0|2,0,1]=4 681 B11R0.29 CC(O)CCNCC(O)C(C)C 2230a_100000759067_100012276601 [0,1,0,0,0,0|2,0,0]=3 682 B11R0.29 CC(O)CCNCC(O)C(C)C 34a_100000759067_100012276601 [0,1,0,0,0,0|2,0,0]=3 683 B11R0.29 CC(O)CCOCC(C)[N+](=O)[O-] 34a_100000039676_100012276601 [0,1,0,0,0,0|2,0,1]=4 684 B11R0.29 CC(O)CCOCC(C)[N+](=O)[O-] 7a_100000039676_100012276601 [0,1,0,0,0,0|2,0,1]=4 685 B11R0.29 CC(O)CCOC[C@H](N)C(=O)N 34a_100000729942_100012276601 [0,1,0,0,0,0|1,0,2]=4 686 B11R0.29 CC(O)CCOC[C@H](N)C(C)C 34a_100011830312_100012276601 [0,1,0,0,0,0|1,0,0]=2 687 B11R0.29 CC(O)CCSCC(=O)C(C)C 62a_100000753385_100012276601 [0,1,0,0,0,0|1,1,1]=4 688 B11R0.29 CC(O)CCSCC(=O)C(C)C 62a_100012276601_100000753385 [0,1,0,0,0,0|1,1,1]=4 689 B11R0.29 CC(O)COCCC(N)C(C)C 34a_100161115045_100011218427 [0,1,0,0,0,0|3,0,0]=4 690 B11R0.31 C=C(Br)CCOCCC(C)(C)O 34a_100009813270_100000702414 [0,1,0,0,0,0|1,0,2]=4 691 B11R0.31 C=C(C)CCOCCC(C)(C)C 34a_100000764851_100000755188 [0,1,0,0,0,0|2,0,1]=4 692 B11R0.31 C=C(C)CCOCCC(C)(C)C 7a_100000765024_100000730704 [0,1,0,0,0,0|2,0,1]=4 693 B11R0.31 C=C(C)CCOCCC(C)(C)O 34a_100000764851_100000702414 [0,1,0,0,0,0|1,0,1]=3 694 B11R0.31 C=C(C)CCSCCC(C)(C)O 62a_100000702414_100000730704 [0,1,0,0,0,0|1,1,1]=4 695 B11R0.31 C=C(C)CCSCCC(C)(C)O 62a_100000730704_100000702414 [0,1,0,0,0,0|1,1,1]=4 696 B11R0.31 CC(=CCOCCC(C)(C)O)C 34a_100000753907_100000702414 [0,1,0,0,0,0|1,0,2]=4 697 B11R0.31 CC(=O)CCOCCC(C)(C)C 34a_100000759926_100000755188 [0,1,0,0,0,0|1,0,2]=4 698 B11R0.31 CC(=O)CCOCCC(C)(C)C 7a_100000759926_100000755188 [0,1,0,0,0,0|1,0,2]=4 699 B11R0.31 CC(=O)CCOCCC(C)(C)C 7a_100000765024_100000053229 [0,1,0,0,0,0|1,0,2]=4 700 B11R0.31 CC(=O)CCOCCC(C)(C)O 34a_100000759926_100000702414 [0,1,0,0,0,0|0,0,2]=3 701 B11R0.31 CC(=O)CCOCCC(C)(C)O 7a_100000759926_100000702414 [0,1,0,0,0,0|0,0,2]=3 702 B11R0.31 CC(=O)CCSCCC(C)(C)O 62a_100000053229_100000702414 [0,1,0,0,0,0|0,1,2]=4 703 B11R0.31 CC(=O)CCSCCC(C)(C)O 62a_100000702414_100000053229 [0,1,0,0,0,0|0,1,2]=4 704 B11R0.31 CC(Br)CCOCCC(C)(C)C 34a_100009893172_100000755188 [0,1,0,0,0,0|2,0,0]=3 705 B11R0.31 CC(Br)CCOCCC(C)(C)O 34a_100009893172_100000702414 [0,1,0,0,0,0|1,0,0]=2 706 B11R0.31 CC(Br)CCOCCC(F)(F)F 34a_100009893172_100011219754 [0,1,0,0,0,0|3,0,0]=4 707 B11R0.31 CC(Br)CCOCCS(=O)(=O)C 34a_100009893172_100000731031 [0,1,0,0,0,0|2,0,1]=4 708 B11R0.31 CC(Br)CCOCC[N+](C)(C)C 34a_100009893172_100000085578 [0,1,0,0,0,0|3,0,0]=4 709 B11R0.31 CC(Br)CCOCC[Si](C)(C)C 34a_100009893172_200000733723 [0,1,0,0,0,0|2,1,0]=4 710 B11R0.31 CC(Br)COCCCC(C)(C)O 34a_100012180447_100009888830 [0,1,0,0,0,0|3,0,0]=4 711 B11R0.31 CC(C)(C)CCOCCC(F)F 34a_100103093639_100000755188 [0,1,0,0,0,0|3,0,0]=4 712 B11R0.31 CC(C)(O)CCOCCC(=O)N 34a_100000757172_100000702414 [0,1,0,0,0,0|1,0,2]=4 713 B11R0.31 CC(C)(O)CCOCCC(=O)N 7a_100000757172_100000702414 [0,1,0,0,0,0|1,0,2]=4 714 B11R0.31 CC(C)(O)CCOCCC(F)F 34a_100103093639_100000702414 [0,1,0,0,0,0|2,0,0]=3 715 B11R0.31 CC(C)CCCNCC(C)(C)O 2230a_100000751335_100011214892 [0,1,0,0,0,0|3,0,0]=4 716 B11R0.31 CC(C)CCCNCC(C)(C)O 34a_200000737386_100000764493 [0,1,0,0,0,0|3,0,0]=4 717 B11R0.31 CC(C)CCCOCC(C)(C)O 34a_100000210774_100000764493 [0,1,0,0,0,0|3,0,0]=4 718 B11R0.31 CC(C)CCCOCC(C)(C)O 7a_100000210774_100000764493 [0,1,0,0,0,0|3,0,0]=4 719 B11R0.31 CC(C)CCCSCC(C)(C)O 62a_100000764493_100011214892 [0,1,0,0,0,0|3,0,0]=4 720 B11R0.31 CC(C)CCCSCC(C)(C)O 62a_100011214892_100000764493 [0,1,0,0,0,0|3,0,0]=4 721 B11R0.31 CC(C)CCNCCC(C)(C)C 2230a_100000738805_100000210312 [0,1,0,0,0,0|3,0,0]=4 722 B11R0.31 CC(C)CCNCCC(C)(C)C 269862a_100000738805_100000185833 [0,1,0,0,0,0|3,0,0]=4 723 B11R0.31 CC(C)CCNCCC(C)(C)F 2230a_100016253952_100000210312 [0,1,0,0,0,0|3,0,0]=4 724 B11R0.31 CC(C)CCNCCC(C)(C)F 269862a_100016253952_100000185833 [0,1,0,0,0,0|3,0,0]=4 725 B11R0.31 CC(C)CCNCCC(C)(C)O 269862a_100000707701_100000185833 [0,1,0,0,0,0|2,0,0]=3 726 B11R0.31 CC(C)CCOCCC(C)(C)C 34a_100000210254_100000755188 [0,1,0,0,0,0|2,0,0]=3 727 B11R0.31 CC(C)CCOCCC(C)(C)C 7a_100000210254_100000755188 [0,1,0,0,0,0|2,0,0]=3 728 B11R0.31 CC(C)CCOCCC(C)(C)C 7a_100000765024_100000210626 [0,1,0,0,0,0|2,0,0]=3 729 B11R0.31 CC(C)CCOCCC(C)(C)O 34a_100000210254_100000702414 [0,1,0,0,0,0|1,0,0]=2 730 B11R0.31 CC(C)CCOCCC(C)(C)O 7a_100000210254_100000702414 [0,1,0,0,0,0|1,0,0]=2 731 B11R0.31 CC(C)CCOCCC(F)(F)F 34a_100000210254_100011219754 [0,1,0,0,0,0|3,0,0]=4 732 B11R0.31 CC(C)CCOCCC(F)(F)F 34a_100000752437_100000210312 [0,1,0,0,0,0|3,0,0]=4 733 B11R0.31 CC(C)CCOCCC(F)(F)F 7a_100000210254_100011219754 [0,1,0,0,0,0|3,0,0]=4 734 B11R0.31 CC(C)CCOCCS(=O)(=O)C 34a_100000210254_100000731031 [0,1,0,0,0,0|2,0,1]=4 735 B11R0.31 CC(C)CCOCCS(=O)(=O)C 34a_100000211924_100000210312 [0,1,0,0,0,0|2,0,1]=4 736 B11R0.31 CC(C)CCOCCS(=O)(=O)C 7a_100000210254_100000230027 [0,1,0,0,0,0|2,0,1]=4 737 B11R0.31 CC(C)CCOCCS(=O)(=O)C 7a_100000211924_100000210626 [0,1,0,0,0,0|2,0,1]=4 738 B11R0.31 CC(C)CCOCC[N+](C)(C)C 34a_100000210254_100000085578 [0,1,0,0,0,0|3,0,0]=4 739 B11R0.31 CC(C)CCOCC[N+](C)(C)C 7a_100000210254_100000085578 [0,1,0,0,0,0|3,0,0]=4 740 B11R0.31 CC(C)CCOCC[N+](C)(C)C 7a_200020618287_100000210626 [0,1,0,0,0,0|3,0,0]=4 741 B11R0.31 CC(C)CCOCC[Si](C)(C)C 34a_100000210254_200000733723 [0,1,0,0,0,0|2,1,0]=4 742 B11R0.31 CC(C)CCOCC[Si](C)(C)C 7a_100000039746_100000210626 [0,1,0,0,0,0|2,1,0]=4 743 B11R0.31 CC(C)CCOCC[Si](C)(C)C 7a_100000210254_200000733723 [0,1,0,0,0,0|2,1,0]=4 744 B11R0.31 CC(C)CCSCCC(C)(C)C 62a_100000210312_100000755188 [0,1,0,0,0,0|2,1,0]=4 745 B11R0.31 CC(C)CCSCCC(C)(C)C 62a_100000755188_100000210312 [0,1,0,0,0,0|2,1,0]=4 746 B11R0.31 CC(C)CCSCCC(C)(C)O 62a_100000210312_100000702414 [0,1,0,0,0,0|1,1,0]=3 747 B11R0.31 CC(C)CCSCCC(C)(C)O 62a_100000702414_100000210312 [0,1,0,0,0,0|1,1,0]=3 748 B11R0.31 CC(C)CNCCCC(C)(C)O 2230a_100000210953_100009888830 [0,1,0,0,0,0|3,0,0]=4 749 B11R0.31 CC(C)CNCCCC(C)(C)O 34a_100000210953_100009888830 [0,1,0,0,0,0|3,0,0]=4 750 B11R0.31 CC(C)COCCCC(C)(C)O 34a_100000210257_100009888830 [0,1,0,0,0,0|3,0,0]=4 751 B11R0.31 CC(C)CSCCCC(C)(C)O 62a_100000210624_100009888830 [0,1,0,0,0,0|3,0,0]=4 752 B11R0.31 CC(C)CSCCCC(C)(C)O 62a_100009888830_100000210760 [0,1,0,0,0,0|3,0,0]=4 753 B11R0.31 CC(C)OCSCCC(C)(C)O 62a_100000702414_100000709892 [0,1,0,0,0,0|2,1,0]=4 754 B11R0.31 CC(C)OCSCCC(C)(C)O 62a_100000709892_100000702414 [0,1,0,0,0,0|2,1,0]=4 755 B11R0.31 CC(F)COCCCC(C)(C)O 34a_100015925927_100009888830 [0,1,0,0,0,0|3,0,0]=4 756 B11R0.31 CC(O)CCCNCC(C)(C)C 2230a_100000743828_200000718107 [0,1,0,0,0,0|3,0,0]=4 757 B11R0.31 CC(O)CCCNCC(C)(C)F 2230a_100020643315_200000718107 [0,1,0,0,0,0|3,0,0]=4 758 B11R0.31 CC(O)CCCNCC(C)(C)O 2230a_100000751335_200000718107 [0,1,0,0,0,0|2,0,0]=3 759 B11R0.31 CC(O)CCCOCC(C)(C)F 34a_100000716592_200000718107 [0,1,0,0,0,0|3,0,0]=4 760 B11R0.31 CC(O)CCCOCC(C)(F)F 34a_100000068830_200000718107 [0,1,0,0,0,0|3,0,0]=4 761 B11R0.31 CC(O)CCCSCC(C)(C)C 62a_100011219605_200000718107 [0,1,0,0,0,0|3,0,0]=4 762 B11R0.31 CC(O)CCCSCC(C)(C)C 62a_200000718107_100011219605 [0,1,0,0,0,0|3,0,0]=4 763 B11R0.31 CC(O)CCCSCC(C)(C)F 62a_100011997219_200000718107 [0,1,0,0,0,0|3,0,0]=4 764 B11R0.31 CC(O)CCCSCC(C)(C)F 62a_200000718107_100011997219 [0,1,0,0,0,0|3,0,0]=4 765 B11R0.31 CC(O)CCCSCC(C)(C)O 62a_100000764493_200000718107 [0,1,0,0,0,0|2,0,0]=3 766 B11R0.31 CC(O)CCCSCC(C)(C)O 62a_200000718107_100000764493 [0,1,0,0,0,0|2,0,0]=3 767 B11R0.31 CC(O)CCNCCC(C)(C)C 2230a_100000738805_100012276601 [0,1,0,0,0,0|2,0,0]=3 768 B11R0.31 CC(O)CCNCCC(C)(C)C 2230a_200000755665_100000755188 [0,1,0,0,0,0|2,0,0]=3 769 B11R0.31 CC(O)CCNCCC(C)(C)F 2230a_100016253952_100012276601 [0,1,0,0,0,0|2,0,0]=3 770 B11R0.31 CC(O)CCNCCC(C)(C)O 2230a_200000755665_100000702414 [0,1,0,0,0,0|1,0,0]=2 771 B11R0.31 CC(O)CCNCCC(F)(F)F 2230a_100000740434_100012276601 [0,1,0,0,0,0|3,0,0]=4 772 B11R0.31 CC(O)CCNCCC(F)(F)F 34a_100000740434_100012276601 [0,1,0,0,0,0|3,0,0]=4 773 B11R0.31 CC(O)CCNCCS(=O)(=O)C 2230a_100000740961_100012276601 [0,1,0,0,0,0|2,0,1]=4 774 B11R0.31 CC(O)CCNCCS(=O)(=O)C 2230a_200000755665_100000731031 [0,1,0,0,0,0|2,0,1]=4 775 B11R0.31 CC(O)CCNCCS(=O)(=O)C 34a_100000740961_100012276601 [0,1,0,0,0,0|2,0,1]=4 776 B11R0.31 CC(O)CCNCC[Si](C)(C)C 2230a_200000755665_200000733723 [0,1,0,0,0,0|2,1,0]=4 777 B11R0.31 CC(O)CCOCCC(C)(C)C 7a_100000765024_100012276601 [0,1,0,0,0,0|1,0,0]=2 778 B11R0.31 CC(O)CCOCCC(F)(F)F 34a_100000752437_100012276601 [0,1,0,0,0,0|2,0,0]=3 779 B11R0.31 CC(O)CCOCCS(=O)(=O)C 34a_100000211924_100012276601 [0,1,0,0,0,0|1,0,1]=3 780 B11R0.31 CC(O)CCOCCS(=O)(=O)C 7a_100000211924_100012276601 [0,1,0,0,0,0|1,0,1]=3 781 B11R0.31 CC(O)CCOCCS(=O)(=O)N 34a_100012334274_100012276601 [0,1,0,0,0,0|2,0,1]=4 782 B11R0.31 CC(O)CCOCC[N+](C)(C)C 7a_200020618287_100012276601 [0,1,0,0,0,0|2,0,0]=3 783 B11R0.31 CC(O)CCOCC[Si](C)(C)C 7a_100000039746_100012276601 [0,1,0,0,0,0|1,1,0]=3 784 B11R0.31 CC(O)CCSCCC(C)(C)C 62a_100000755188_100012276601 [0,1,0,0,0,0|1,1,0]=3 785 B11R0.31 CC(O)CCSCCC(C)(C)C 62a_100012276601_100000755188 [0,1,0,0,0,0|1,1,0]=3 786 B11R0.31 CC(O)CCSCCC(C)(C)O 62a_100000702414_100012276601 [0,1,0,0,0,0|0,1,0]=2 787 B11R0.31 CC(O)CCSCCC(C)(C)O 62a_100012276601_100000702414 [0,1,0,0,0,0|0,1,0]=2 788 B11R0.31 CC(O)CCSCCC(F)(F)F 62a_100011219754_100012276601 [0,1,0,0,0,0|2,1,0]=4 789 B11R0.31 CC(O)CCSCCC(F)(F)F 62a_100012276601_100011219754 [0,1,0,0,0,0|2,1,0]=4 790 B11R0.31 CC(O)CCSCCS(=O)(=O)C 62a_100000731031_100012276601 [0,1,0,0,0,0|1,1,1]=4 791 B11R0.31 CC(O)CCSCCS(=O)(=O)C 62a_100012276601_100000230027 [0,1,0,0,0,0|1,1,1]=4 792 B11R0.31 CC(O)CCSCC[N+](C)(C)C 62a_100000085578_100012276601 [0,1,0,0,0,0|2,1,0]=4 793 B11R0.31 CC(O)CCSCC[N+](C)(C)C 62a_100012276601_100000085578 [0,1,0,0,0,0|2,1,0]=4 794 B11R0.31 CC(O)CCSCC[Si](C)(C)C 62a_100012276601_200000733723 [0,1,0,0,0,0|1,2,0]=4 795 B11R0.31 CC(O)CCSCC[Si](C)(C)C 62a_200000733723_100012276601 [0,1,0,0,0,0|1,2,0]=4 796 B11R0.31 CC(O)CNCCCC(C)(C)O 2230a_100000210904_100009888830 [0,1,0,0,0,0|2,0,0]=3 797 B11R0.31 CC(O)CNCCCC(C)(C)O 34a_100000210904_100009888830 [0,1,0,0,0,0|2,0,0]=3 798 B11R0.31 CC(O)CSCCCC(C)(C)O 62a_100009888830_100011218427 [0,1,0,0,0,0|2,0,0]=3 799 B11R0.31 CC(O)CSCCCC(C)(C)O 62a_100011218427_100009888830 [0,1,0,0,0,0|2,0,0]=3 800 B11R0.31 CN(C)CCCCCC(C)(C)O 2230a_100102631434_100010402123 [0,1,0,0,0,0|3,0,0]=4 801 B11R0.31 CN(C)CCCCCC(C)(C)O 269982a_100102631434_100010402123 [0,1,0,0,0,0|3,0,0]=4 802 B11R0.31 CN(C)CCOCCC(C)(C)C 7a_100000765024_100000755713 [0,1,0,0,0,0|3,0,0]=4 803 B11R0.31 CN(C)CCSCCC(C)(C)O 62a_100000702414_100000755713 [0,1,0,0,0,0|2,1,0]=4 804 B11R0.31 C[C@@H](Cl)COCCCC(C)(C)O 34a_100016084084_100009888830 [0,1,0,0,0,0|3,0,0]=4 805 B11R0.31 C[C@@H](N)CCOCCC(C)(C)C 34a_100000706166_100000755188 [0,1,0,0,0,0|2,0,0]=3 806 B11R0.31 C[C@@H](N)CCOCCC(C)(C)O 34a_100000706166_100000702414 [0,1,0,0,0,0|1,0,0]=2 807 B11R0.31 C[C@@H](N)CCOCCC(F)(F)F 34a_100000706166_100011219754 [0,1,0,0,0,0|3,0,0]=4 808 B11R0.31 C[C@@H](N)CCOCCS(=O)(=O)C 34a_100000706166_100000731031 [0,1,0,0,0,0|2,0,1]=4 809 B11R0.31 C[C@@H](N)CCOCC[N+](C)(C)C 34a_100000706166_100000085578 [0,1,0,0,0,0|3,0,0]=4 810 B11R0.31 C[C@@H](N)CCOCC[Si](C)(C)C 34a_100000706166_200000733723 [0,1,0,0,0,0|2,1,0]=4 811 B11R0.31 C[C@@H](N)COCCCC(C)(C)O 34a_100000737577_100009888830 [0,1,0,0,0,0|3,0,0]=4 812 B11R0.31 C[C@@H](O)CSCCCC(C)(C)O 62a_100009817552_100009888830 [0,1,0,0,0,0|2,0,0]=3 813 B11R0.31 C[C@@H](O)CSCCCC(C)(C)O 62a_100009888830_100009817552 [0,1,0,0,0,0|2,0,0]=3 814 B11R0.85 C=C(C)CCC(=O)CCC(C)O 1458a_200000688413_100012276601 [0,1,0,0,0,0|2,0,1]=4 815 B11R0.85 CC(C)CCC(=O)CCC(C)C 1458a_100000181311_100000210312 [0,1,0,0,0,0|3,0,0]=4 816 B11R0.85 CC(C)CCC(=O)CCC(C)O 1458a_100000181311_100012276601 [0,1,0,0,0,0|2,0,0]=3 817 B11R0.85 CC(C)CCC(=O)NCC(C)O 11a_100000210904_100000181311 [0,1,0,0,0,0|3,0,0]=4 818 B11R0.85 CC(C)CCC(=O)NCC(C)O 240690a_100000210904_100000181311 [0,1,0,0,0,0|3,0,0]=4 819 B11R0.85 CC(C)CCC(=O)NCC(C)O 527a_100000210904_100000181311 [0,1,0,0,0,0|3,0,0]=4 820 B11R0.85 CC(C)CCC(C)NCC(C)O 2230a_100000210904_100011261404 [0,1,0,0,0,0|3,0,0]=4 821 B11R0.85 CC(C)CCC(C)NCC(C)O 2230a_100138410893_100011218427 [0,1,0,0,0,0|3,0,0]=4 822 B11R0.85 CC(C)CCC(C)NCC(C)O 270004a_100000210904_100000210476 [0,1,0,0,0,0|3,0,0]=4 823 B11R0.85 CC(C)CCC(C)NCC(C)O 34a_100000210904_100011261404 [0,1,0,0,0,0|3,0,0]=4 824 B11R0.85 CC(C)CCC(C)NC[C@@H](C)O 2230a_100138410893_100009817552 [0,1,0,0,0,0|3,0,0]=4 825 B11R0.85 CC(C)CCC(C)OCC(C)O 34a_100011215350_100011218427 [0,1,0,0,0,0|3,0,0]=4 826 B11R0.85 CC(C)CCC(C)OCC(C)O 7a_100011215350_100011218427 [0,1,0,0,0,0|3,0,0]=4 827 B11R0.85 CC(C)CCC(C)OC[C@@H](C)O 34a_100011215350_100009817552 [0,1,0,0,0,0|3,0,0]=4 828 B11R0.85 CC(C)CCC(C)OC[C@@H](C)O 7a_100011215350_100009817552 [0,1,0,0,0,0|3,0,0]=4 829 B11R0.85 CC(C)CCC(C)SCC(C)O 62a_100011218427_100011261404 [0,1,0,0,0,0|3,0,0]=4 830 B11R0.85 CC(C)CCC(C)SCC(C)O 62a_100011261404_100011218427 [0,1,0,0,0,0|3,0,0]=4 831 B11R0.85 CC(C)CCC(C)SC[C@@H](C)O 62a_100009817552_100011261404 [0,1,0,0,0,0|3,0,0]=4 832 B11R0.85 CC(C)CCC(C)SC[C@@H](C)O 62a_100011261404_100009817552 [0,1,0,0,0,0|3,0,0]=4 833 B11R0.85 CC(C)CCN(C)CCC(C)C 2230a_100000207472_200000210301 [0,1,0,0,0,0|3,0,0]=4 834 B11R0.85 CC(C)CCN(C)CCC(C)C 2230a_100000742789_100000210312 [0,1,0,0,0,0|3,0,0]=4 835 B11R0.85 CC(C)CCN(C)CCC(C)C 269982a_100000207472_200000210301 [0,1,0,0,0,0|3,0,0]=4 836 B11R0.85 CC(C)CCN(C)CCC(C)C 269982a_100000742789_100000210312 [0,1,0,0,0,0|3,0,0]=4 837 B11R0.85 CC(C)CCN(C)CCC(C)O 2230a_100000742789_100012276601 [0,1,0,0,0,0|2,0,0]=3 838 B11R0.85 CC(C)CCN(C)CCC(C)O 269982a_100000742789_100012276601 [0,1,0,0,0,0|2,0,0]=3 839 B11R0.85 CC(C)CCN([13CH3])CCC(C)C 2230a_100000207472_200025704644 [0,1,0,0,0,0|3,0,0]=4 840 B11R0.85 CC(C)CCN([13CH3])CCC(C)C 269982a_100000207472_200025704644 [0,1,0,0,0,0|3,0,0]=4 841 B11R0.85 CC(C)CNC(=O)CCC(C)O 1626a_100000210953_100000718519 [0,1,0,0,0,0|3,0,0]=4 842 B11R0.85 CC(O)CCC(=O)CC[S+](C)C 1458a_100009452791_100012276601 [0,1,0,0,0,0|3,0,0]=4 843 B11R0.85 CC(O)CCC(=O)COC(C)C 1458a_100000745533_100012276601 [0,1,0,0,0,0|3,0,0]=4 844 B11R0.85 CC(O)CCC(=O)CSC(C)C 1458a_100000241585_100012276601 [0,1,0,0,0,0|3,0,0]=4 845 B11R0.85 CC(O)CCN(C)CCN(C)C 269982a_100000225618_100012276601 [0,1,0,0,0,0|3,0,0]=4 846 B11R0.85 CC(O)CNC(=O)NCC(C)O 273464a_100000210904_100000210904 [0,1,0,0,0,0|3,0,0]=4 847 B11R0.85 CC(O)CNC(=O)NCC(C)O 512a_100000210904_100000210904 [0,1,0,0,0,0|3,0,0]=4 848 B11R0.111 C#C/C(=C\COCCC(C)O)/C 34a_100016990848_100012276601 [0,1,0,0,0,0|1,0,2]=4 849 B11R0.111 C=C(C)CCNCCC(C)CO 2230a_106354213184_100000730704 [0,1,0,0,0,0|2,0,1]=4 850 B11R0.111 C=C(C)CCNCCC(C)CO 34a_106354213184_100000730704 [0,1,0,0,0,0|2,0,1]=4 851 B11R0.111 C=C(C)CCOCCC(C)CC 7a_100011215188_100000730704 [0,1,0,0,0,0|2,0,1]=4 852 B11R0.111 C=C(C)CCOCCC(C)OC 7a_100000764861_100000730704 [0,1,0,0,0,0|1,0,1]=3 853 B11R0.111 C=CC(C)COCCCC(C)O 34a_100011215527_200000718107 [0,1,0,0,0,0|3,0,0]=4 854 B11R0.111 C=CC(C)COCCCC(C)O 7a_100011215527_200000718107 [0,1,0,0,0,0|3,0,0]=4 855 B11R0.111 C=CC(O)CSCCCC(C)O 62a_100000730141_200000718107 [0,1,0,0,0,0|2,0,1]=4 856 B11R0.111 C=CC(O)CSCCCC(C)O 62a_200000718107_100000730141 [0,1,0,0,0,0|2,0,1]=4 857 B11R0.111 CC(C)CCCCN[C@H](C)CO 2230a_100000737577_100011216152 [0,1,0,0,0,0|3,0,0]=4 858 B11R0.111 CC(C)CCCCOC(C)CO 34a_100011214890_100012180447 [0,1,0,0,0,0|3,0,0]=4 859 B11R0.111 CC(C)CCCCOC(C)CO 7a_100011214890_100012180447 [0,1,0,0,0,0|3,0,0]=4 860 B11R0.111 CC(C)CCCCSC(C)CO 62a_100012180447_100011216152 [0,1,0,0,0,0|3,0,0]=4 861 B11R0.111 CC(C)CCCCS[C@H](C)CO 62a_100011216152_100016084084 [0,1,0,0,0,0|3,0,0]=4 862 B11R0.111 CC(C)CCCCS[C@H](C)CO 62a_100016084084_100011216152 [0,1,0,0,0,0|3,0,0]=4 863 B11R0.111 CC(C)CCCNCC(C)CO 34a_100000744482_100011214892 [0,1,0,0,0,0|3,0,0]=4 864 B11R0.111 CC(C)CCCNCC(O)CO 2230a_200000737386_100011219619 [0,1,0,0,0,0|3,0,0]=4 865 B11R0.111 CC(C)CCCNCC(O)CO 34a_200000737386_100011219619 [0,1,0,0,0,0|3,0,0]=4 866 B11R0.111 CC(C)CCCNC[C@@H](C)CO 2230a_200000737386_100000059175 [0,1,0,0,0,0|3,0,0]=4 867 B11R0.111 CC(C)CCCNC[C@@H](C)CO 34a_200000737386_100000059175 [0,1,0,0,0,0|3,0,0]=4 868 B11R0.111 CC(C)CCCNC[C@@H](O)CF 2230a_200000737386_100015614560 [0,1,0,0,0,0|3,0,0]=4 869 B11R0.111 CC(C)CCCNC[C@@H](O)CF 34a_200000737386_100015614560 [0,1,0,0,0,0|3,0,0]=4 870 B11R0.111 CC(C)CCCNC[C@@H](O)CO 2230a_200000737386_100009815848 [0,1,0,0,0,0|3,0,0]=4 871 B11R0.111 CC(C)CCCNC[C@@H](O)CO 34a_200000737386_100009815848 [0,1,0,0,0,0|3,0,0]=4 872 B11R0.111 CC(C)CCCNC[C@H](O)CO 2230a_100020644852_100011214892 [0,1,0,0,0,0|3,0,0]=4 873 B11R0.111 CC(C)CCCOCC(O)CO 34a_100000210774_100011219619 [0,1,0,0,0,0|3,0,0]=4 874 B11R0.111 CC(C)CCCOCC(O)CO 7a_100000210774_100011219619 [0,1,0,0,0,0|3,0,0]=4 875 B11R0.111 CC(C)CCCOC[C@@H](C)CO 34a_100000210774_100000059175 [0,1,0,0,0,0|3,0,0]=4 876 B11R0.111 CC(C)CCCOC[C@@H](C)CO 7a_100000210774_100000059175 [0,1,0,0,0,0|3,0,0]=4 877 B11R0.111 CC(C)CCCOC[C@@H](O)CF 34a_100000210774_100015614560 [0,1,0,0,0,0|3,0,0]=4 878 B11R0.111 CC(C)CCCOC[C@@H](O)CF 7a_100000210774_100015614560 [0,1,0,0,0,0|3,0,0]=4 879 B11R0.111 CC(C)CCCOC[C@@H](O)CO 34a_100000210774_100009815848 [0,1,0,0,0,0|3,0,0]=4 880 B11R0.111 CC(C)CCCOC[C@@H](O)CO 7a_100000210774_100009815848 [0,1,0,0,0,0|3,0,0]=4 881 B11R0.111 CC(C)CCCSCC(O)CO 62a_100011214892_100011219619 [0,1,0,0,0,0|3,0,0]=4 882 B11R0.111 CC(C)CCCSCC(O)CO 62a_100011219619_100011214892 [0,1,0,0,0,0|3,0,0]=4 883 B11R0.111 CC(C)CCCSC[C@@H](C)CO 62a_100000059175_100011214892 [0,1,0,0,0,0|3,0,0]=4 884 B11R0.111 CC(C)CCCSC[C@@H](C)CO 62a_100011214892_100000059175 [0,1,0,0,0,0|3,0,0]=4 885 B11R0.111 CC(C)CCCSC[C@@H](O)CF 62a_100011214892_100015614560 [0,1,0,0,0,0|3,0,0]=4 886 B11R0.111 CC(C)CCCSC[C@@H](O)CF 62a_100015614560_100011214892 [0,1,0,0,0,0|3,0,0]=4 887 B11R0.111 CC(C)CCCSC[C@@H](O)CO 62a_100009815848_100011214892 [0,1,0,0,0,0|3,0,0]=4 888 B11R0.111 CC(C)CCCSC[C@@H](O)CO 62a_100011214892_100009815848 [0,1,0,0,0,0|3,0,0]=4 889 B11R0.111 CC(C)CCNCCC(C)CO 2230a_106354213184_100000210312 [0,1,0,0,0,0|2,0,0]=3 890 B11R0.111 CC(C)CCNCCC(C)CO 269862a_106354213184_100000185833 [0,1,0,0,0,0|2,0,0]=3 891 B11R0.111 CC(C)CCNCCC(C)CO 34a_106354213184_100000210312 [0,1,0,0,0,0|2,0,0]=3 892 B11R0.111 CC(C)CCOCCC(=NO)N 34a_100000749954_100000210312 [0,1,0,0,0,0|2,0,1]=4 893 B11R0.111 CC(CO)CCNCOC(C)C 2230a_106354213184_100000709892 [0,1,0,0,0,0|3,0,0]=4 894 B11R0.111 CC(CO)CCNCOC(C)C 34a_106354213184_100000709892 [0,1,0,0,0,0|3,0,0]=4 895 B11R0.111 CC(O)CCCNCC(C)CO 34a_100000744482_200000718107 [0,1,0,0,0,0|2,0,0]=3 896 B11R0.111 CC(O)CCCNC[C@@H](F)CO 34a_100015665980_200000718107 [0,1,0,0,0,0|3,0,0]=4 897 B11R0.111 CC(O)CCCNC[C@H](O)CO 2230a_100020644852_200000718107 [0,1,0,0,0,0|2,0,0]=3 898 B11R0.111 CC(O)CCCOCC(C)CN 34a_100000744482_200000718107 [0,1,0,0,0,0|3,0,0]=4 899 B11R0.111 CC(O)CCCOCC(Cl)CCl 34a_100000033668_200000718107 [0,1,0,0,0,0|3,0,0]=4 900 B11R0.111 CC(O)CCCOC[C@H](F)CN 34a_100015665980_200000718107 [0,1,0,0,0,0|3,0,0]=4 901 B11R0.111 CC(O)CCCSCC(O)CO 62a_100011219619_200000718107 [0,1,0,0,0,0|2,0,0]=3 902 B11R0.111 CC(O)CCCSCC(O)CO 62a_200000718107_100011219619 [0,1,0,0,0,0|2,0,0]=3 903 B11R0.111 CC(O)CCCSC[C@@H](C)CO 62a_100000059175_200000718107 [0,1,0,0,0,0|2,0,0]=3 904 B11R0.111 CC(O)CCCSC[C@@H](C)CO 62a_200000718107_100000059175 [0,1,0,0,0,0|2,0,0]=3 905 B11R0.111 CC(O)CCCSC[C@@H](O)CF 62a_100015614560_200000718107 [0,1,0,0,0,0|2,0,0]=3 906 B11R0.111 CC(O)CCCSC[C@@H](O)CF 62a_200000718107_100015614560 [0,1,0,0,0,0|2,0,0]=3 907 B11R0.111 CC(O)CCCSC[C@@H](O)CO 62a_100009815848_200000718107 [0,1,0,0,0,0|2,0,0]=3 908 B11R0.111 CC(O)CCCSC[C@@H](O)CO 62a_200000718107_100009815848 [0,1,0,0,0,0|2,0,0]=3 909 B11R0.111 CC(O)CCNCCC(C)CO 2230a_106354213184_100012276601 [0,1,0,0,0,0|1,0,0]=2 910 B11R0.111 CC(O)CCNCCC(C)CO 34a_106354213184_100012276601 [0,1,0,0,0,0|1,0,0]=2 911 B11R0.111 CC(O)CCOCCC(=NO)N 34a_100000749954_100012276601 [0,1,0,0,0,0|1,0,1]=3 912 B11R0.111 CC(O)COCCC[C@@H](C)CN 34a_100160569302_100011218427 [0,1,0,0,0,0|3,0,0]=4 913 B11R0.111 CCC(C)CCCOCC(C)O 7a_100011216074_100011218427 [0,1,0,0,0,0|3,0,0]=4 914 B11R0.111 CCC(C)CCCOC[C@@H](C)O 7a_100011216074_100009817552 [0,1,0,0,0,0|3,0,0]=4 915 B11R0.111 CCC(C)CCNCCC(C)C 2230a_100020591266_100000210312 [0,1,0,0,0,0|3,0,0]=4 916 B11R0.111 CCC(C)CCNCCC(C)C 269862a_100020591266_100000185833 [0,1,0,0,0,0|3,0,0]=4 917 B11R0.111 CCC(C)CCNCCC(C)O 2230a_100020591266_100012276601 [0,1,0,0,0,0|2,0,0]=3 918 B11R0.111 CCC(C)CCOCCC(=O)C 7a_100011215188_100000053229 [0,1,0,0,0,0|1,0,2]=4 919 B11R0.111 CCC(C)CCOCCC(C)C 7a_100011215188_100000210626 [0,1,0,0,0,0|2,0,0]=3 920 B11R0.111 CCC(C)CCOCCC(C)O 7a_100011215188_100012276601 [0,1,0,0,0,0|1,0,0]=2 921 B11R0.111 CCC(C)CCOCCN(C)C 7a_100011215188_100000755713 [0,1,0,0,0,0|3,0,0]=4 922 B11R0.111 CCC(C)CNCCCC(C)O 2230a_100020588543_200000718107 [0,1,0,0,0,0|3,0,0]=4 923 B11R0.111 CCC(C)CSCCCC(C)O 62a_100000748023_200000718107 [0,1,0,0,0,0|3,0,0]=4 924 B11R0.111 CCC(C)CSCCCC(C)O 62a_200000718107_100000748023 [0,1,0,0,0,0|3,0,0]=4 925 B11R0.111 CCC(O)CNCCCC(C)C 2230a_100011218483_100011214892 [0,1,0,0,0,0|3,0,0]=4 926 B11R0.111 CCC(O)CNCCCC(C)C 2230a_200000737386_100011218378 [0,1,0,0,0,0|3,0,0]=4 927 B11R0.111 CCC(O)CNCCCC(C)C 34a_200000737386_100011218378 [0,1,0,0,0,0|3,0,0]=4 928 B11R0.111 CCC(O)CNCCCC(C)O 2230a_100011218483_200000718107 [0,1,0,0,0,0|2,0,0]=3 929 B11R0.111 CCC(O)COCCCC(C)C 34a_100000210774_100011218378 [0,1,0,0,0,0|3,0,0]=4 930 B11R0.111 CCC(O)COCCCC(C)C 7a_100000210774_100011218378 [0,1,0,0,0,0|3,0,0]=4 931 B11R0.111 CCC(O)CSCCCC(C)C 62a_100011214892_100011218378 [0,1,0,0,0,0|3,0,0]=4 932 B11R0.111 CCC(O)CSCCCC(C)C 62a_100011218378_100011214892 [0,1,0,0,0,0|3,0,0]=4 933 B11R0.111 CCC(O)CSCCCC(C)O 62a_100011218378_200000718107 [0,1,0,0,0,0|2,0,0]=3 934 B11R0.111 CCC(O)CSCCCC(C)O 62a_200000718107_100011218378 [0,1,0,0,0,0|2,0,0]=3 935 B11R0.111 CC[C@H](C)COCCCC(C)O 7a_100009816381_200000718107 [0,1,0,0,0,0|3,0,0]=4 936 B11R0.111 CC[C@H](C)CSCCCC(C)O 62a_100009816398_200000718107 [0,1,0,0,0,0|3,0,0]=4 937 B11R0.111 CC[C@H](C)CSCCCC(C)O 62a_200000718107_100009816398 [0,1,0,0,0,0|3,0,0]=4 938 B11R0.111 CNC(=O)CCNCCC(C)O 2230a_100000738227_100012276601 [0,1,0,0,0,0|1,0,2]=4 939 B11R0.111 CNC(=O)CCNCCC(C)O 2230a_200000755665_100000737683 [0,1,0,0,0,0|1,0,2]=4 940 B11R0.111 CNC(=O)CCNCCC(C)O 34a_100000738227_100012276601 [0,1,0,0,0,0|1,0,2]=4 941 B11R0.111 CNC(=O)CCOCCC(C)Br 34a_100009893172_100012179268 [0,1,0,0,0,0|1,0,2]=4 942 B11R0.111 CNC(=O)CCOCCC(C)C 34a_100000210254_100012179268 [0,1,0,0,0,0|1,0,2]=4 943 B11R0.111 CNC(=O)CCOCCC(C)C 34a_100000754576_100000210312 [0,1,0,0,0,0|1,0,2]=4 944 B11R0.111 CNC(=O)CCOCCC(C)C 7a_100000210254_100000737683 [0,1,0,0,0,0|1,0,2]=4 945 B11R0.111 CNC(=O)CCOCCC(C)O 34a_100000754576_100012276601 [0,1,0,0,0,0|0,0,2]=3 946 B11R0.111 CNC(=O)CCOCC[C@@H](C)N 34a_100000706166_100012179268 [0,1,0,0,0,0|1,0,2]=4 947 B11R0.111 CNC(=O)CCSCCC(C)O 62a_100000737683_100012276601 [0,1,0,0,0,0|0,1,2]=4 948 B11R0.111 CNC(=O)CCSCCC(C)O 62a_100012276601_100000737683 [0,1,0,0,0,0|0,1,2]=4 949 B11R0.111 COC(=O)CCNCCC(C)O 2230a_200000755665_100000204255 [0,1,0,0,0,0|1,0,2]=4 950 B11R0.111 COC(=O)CCOCCC(C)Br 34a_100009893172_100000742370 [0,1,0,0,0,0|1,0,2]=4 951 B11R0.111 COC(=O)CCOCCC(C)C 34a_100000210254_100000742370 [0,1,0,0,0,0|1,0,2]=4 952 B11R0.111 COC(=O)CCOCCC(C)C 7a_100000210254_100000204255 [0,1,0,0,0,0|1,0,2]=4 953 B11R0.111 COC(=O)CCOCC[C@@H](C)N 34a_100000706166_100000742370 [0,1,0,0,0,0|1,0,2]=4 954 B11R0.111 COC(=O)CCSCCC(C)O 62a_100000204255_100012276601 [0,1,0,0,0,0|0,1,2]=4 955 B11R0.111 COC(=O)CCSCCC(C)O 62a_100012276601_100000204255 [0,1,0,0,0,0|0,1,2]=4 956 B11R0.111 COC(C)CCOCC=C(C)C 7a_100000764861_100000761012 [0,1,0,0,0,0|1,0,2]=4 957 B11R0.111 COC(C)CCOCCC(=O)C 7a_100000764861_100000053229 [0,1,0,0,0,0|0,0,2]=3 958 B11R0.111 COC(C)CCOCCC(=O)N 7a_100000764861_100000744528 [0,1,0,0,0,0|1,0,2]=4 959 B11R0.111 COC(C)CCOCCC(C)C 7a_100000764861_100000210626 [0,1,0,0,0,0|1,0,0]=2 960 B11R0.111 COC(C)CCOCCC(C)O 7a_100000764861_100012276601 [0,1,0,0,0,0|0,0,0]=1 961 B11R0.111 COC(C)CCOCCN(C)C 7a_100000764861_100000755713 [0,1,0,0,0,0|2,0,0]=3 962 B11R0.111 COC(C)COCCCC(C)C 34a_100000690652_100011214892 [0,1,0,0,0,0|3,0,0]=4 963 B11R0.111 COC(C)COCCCC(C)O 34a_100000690652_200000718107 [0,1,0,0,0,0|2,0,0]=3 964 B11R0.111 COC(C)SCCCCC(C)C 62a_100009879195_100011216152 [0,1,0,0,0,0|3,0,0]=4 965 B11R0.111 COC(C)SCCCCC(C)C 62a_100011216152_100009879195 [0,1,0,0,0,0|3,0,0]=4 966 B11R0.111 CO[C@H](C)CNCCCC(C)C 2230a_100020591295_100011214892 [0,1,0,0,0,0|3,0,0]=4 967 B11R0.111 CO[C@H](C)CNCCCC(C)O 2230a_100020591295_200000718107 [0,1,0,0,0,0|2,0,0]=3 968 B11R0.111 C[C@@H](CN)CCCOC[C@@H](C)O 34a_100160569302_100009817552 [0,1,0,0,0,0|3,0,0]=4 969 B11R1.75 C=C(C)CCN1CCC(C1)O 2230a_100011215560_100000730704 [0,0,0,1,0,0|2,0,1]=4 970 B11R1.75 C=C(C)CCN1CCC(C1)O 269982a_100011215560_100000730704 [0,0,0,1,0,0|2,0,1]=4 971 B11R1.75 CC(=O)CCN1CCC(C1)O 269982a_100011215560_100000053229 [0,0,0,1,0,0|1,0,2]=4 972 B11R1.75 CC(C)CCN1CCC(C1)O 2230a_100011215560_100000210312 [0,0,0,1,0,0|2,0,0]=3 973 B11R1.75 CC(C)CCN1CCC(C1)O 269982a_100011215560_100000210312 [0,0,0,1,0,0|2,0,0]=3 974 B11R1.75 CC(C)CCN1CC[C@@H](C1)F 2230a_100015203821_100000210312 [0,0,0,1,0,0|3,0,0]=4 975 B11R1.75 CC(C)CCN1CC[C@@H](C1)F 269982a_100015203821_100000210312 [0,0,0,1,0,0|3,0,0]=4 976 B11R1.75 CC(C)CCN1CC[C@@H](C1)F 34a_100015203821_100000210312 [0,0,0,1,0,0|3,0,0]=4 977 B11R1.75 CC(C)CCN1CC[C@H](C1)C 2230a_100016987628_100000210312 [0,0,0,1,0,0|3,0,0]=4 978 B11R1.75 CC(C)CCN1CC[C@H](C1)C 269982a_100016987628_100000210312 [0,0,0,1,0,0|3,0,0]=4 979 B11R1.75 CC(C)CCN1CC[C@H](C1)C 34a_100016987628_100000210312 [0,0,0,1,0,0|3,0,0]=4 980 B11R1.75 CC(C)CNC1CCC(C1)O 270004a_100000210953_100012614533 [0,0,0,1,0,0|3,0,0]=4 981 B11R1.75 CC(C)CN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000210760 [0,0,0,1,0,0|3,0,0]=4 982 B11R1.75 CC(C)CN[C@H]1CC[C@H](C1)O 270004a_100015195300_100000210432 [0,0,0,1,0,0|3,0,0]=4 983 B11R1.75 CC(C)OCN1CCC(C1)O 2230a_100011215560_100000709892 [0,0,0,1,0,0|3,0,0]=4 984 B11R1.75 CC(C)OCN1CCC(C1)O 269982a_100011215560_100000709892 [0,0,0,1,0,0|3,0,0]=4 985 B11R1.75 CC(O)CCN1CCC(C1)O 2230a_100011215560_100012276601 [0,0,0,1,0,0|1,0,0]=2 986 B11R1.75 CC(O)CCN1CCC(C1)O 269982a_100011215560_100012276601 [0,0,0,1,0,0|1,0,0]=2 987 B11R1.75 CC(O)CCN1CC[C@@H](C1)F 2230a_100015203821_100012276601 [0,0,0,1,0,0|2,0,0]=3 988 B11R1.75 CC(O)CCN1CC[C@@H](C1)F 269982a_100015203821_100012276601 [0,0,0,1,0,0|2,0,0]=3 989 B11R1.75 CC(O)CCN1CC[C@@H](C1)F 34a_100015203821_100012276601 [0,0,0,1,0,0|2,0,0]=3 990 B11R1.75 CC(O)CCN1CC[C@H](C1)C 2230a_100016987628_100012276601 [0,0,0,1,0,0|2,0,0]=3 991 B11R1.75 CC(O)CCN1CC[C@H](C1)C 269982a_100016987628_100012276601 [0,0,0,1,0,0|2,0,0]=3 992 B11R1.75 CC(O)CCN1CC[C@H](C1)C 34a_100016987628_100012276601 [0,0,0,1,0,0|2,0,0]=3 993 B11R1.75 CC(O)CNC1CCC(C1)C 270004a_100000210904_100011215218 [0,0,0,1,0,0|3,0,0]=4 994 B11R1.75 CC(O)CNC1CCC(C1)O 270004a_100000210904_100012614533 [0,0,0,1,0,0|2,0,0]=3 995 B11R1.75 CC(O)CN[C@H]1CC[C@H](C1)O 2230a_100015195300_100011218427 [0,0,0,1,0,0|2,0,0]=3 996 B11R1.75 CC(O)COC1CCC(C1)C 34a_100000698185_100011218427 [0,0,0,1,0,0|3,0,0]=4 997 B11R1.75 CC1CCC(C1)OC[C@@H](C)O 34a_100000698185_100009817552 [0,0,0,1,0,0|3,0,0]=4 998 B11R1.75 CN(C)CCN1CCC(C1)O 269982a_100011215560_100000755713 [0,0,0,1,0,0|3,0,0]=4 999 B11R1.75 C[C@@H](O)CN[C@H]1CC[C@H](C1)O 2230a_100015195300_100009817552 [0,0,0,1,0,0|2,0,0]=3 1000 B11R1.102 C=C(C)CCOCC1CC1C 34a_100000744939_100000730704 [0,0,0,1,0,0|2,0,1]=4 1001 B11R1.102 C=C(C)CCOCC1CC1C 7a_100000744939_100000730704 [0,0,0,1,0,0|2,0,1]=4 1002 B11R1.102 CC(=O)CCOCC1CC1C 7a_100000744939_100000053229 [0,0,0,1,0,0|1,0,2]=4 1003 B11R1.102 CC(C)CCOCC1CC1C 34a_100000744939_100000210312 [0,0,0,1,0,0|2,0,0]=3 1004 B11R1.102 CC(C)CCOCC1CC1C 7a_100000744939_100000210626 [0,0,0,1,0,0|2,0,0]=3 1005 B11R1.102 CC(C)OCOCC1CC1C 34a_100000744939_100000709892 [0,0,0,1,0,0|3,0,0]=4 1006 B11R1.102 CC(O)CCCN[C@@H]1C[C@@H]1F 2230a_100015190264_200000718107 [0,0,0,1,0,0|3,0,0]=4 1007 B11R1.102 CC(O)CCCN[C@@H]1C[C@H]1F 2230a_100025746932_200000718107 [0,0,0,1,0,0|3,0,0]=4 1008 B11R1.102 CC(O)CCCN[C@@H]1C[C@H]1F 34a_100025746932_200000718107 [0,0,0,1,0,0|3,0,0]=4 1009 B11R1.102 CC(O)CCOCC1CC1C 34a_100000744939_100012276601 [0,0,0,1,0,0|1,0,0]=2 1010 B11R1.102 CC(O)CCOCC1CC1C 7a_100000744939_100012276601 [0,0,0,1,0,0|1,0,0]=2 1011 B11R1.102 CC1CC1COCCN(C)C 7a_100000744939_100000755713 [0,0,0,1,0,0|3,0,0]=4 1012 B11R1.154 C=C(C)CCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000730704 [0,0,0,1,0,0|2,0,1]=4 1013 B11R1.154 C=C1CC(C1)NCCC(C)O 2230a_100132301982_100012276601 [0,0,0,1,0,0|2,0,1]=4 1014 B11R1.154 CC(C)CCCN1CC(C1)O 269982a_100000749847_100011214892 [0,0,0,1,0,0|3,0,0]=4 1015 B11R1.154 CC(C)CCNC1CC(C1)F 2230a_100016993743_100000210312 [0,0,0,1,0,0|3,0,0]=4 1016 B11R1.154 CC(C)CCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000210312 [0,0,0,1,0,0|2,0,0]=3 1017 B11R1.154 CC(C)CCN[C@H]1C[C@@H](C1)O 269862a_100020629032_100000185833 [0,0,0,1,0,0|2,0,0]=3 1018 B11R1.154 CC(C)CNCC1CC(C1)O 2230a_100016992100_100000210760 [0,0,0,1,0,0|3,0,0]=4 1019 B11R1.154 CC(C)CNCC1CC(C1)O 270004a_100016992100_100000210432 [0,0,0,1,0,0|3,0,0]=4 1020 B11R1.154 CC(C)OCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000709892 [0,0,0,1,0,0|3,0,0]=4 1021 B11R1.154 CC(O)CCCN1CC(C1)C 2230a_100000702820_200000718107 [0,0,0,1,0,0|3,0,0]=4 1022 B11R1.154 CC(O)CCCN1CC(C1)C 269982a_100000702820_200000718107 [0,0,0,1,0,0|3,0,0]=4 1023 B11R1.154 CC(O)CCCN1CC(C1)C 34a_100000702820_200000718107 [0,0,0,1,0,0|3,0,0]=4 1024 B11R1.154 CC(O)CCCN1CC(C1)F 2230a_100000690557_200000718107 [0,0,0,1,0,0|3,0,0]=4 1025 B11R1.154 CC(O)CCCN1CC(C1)F 269982a_100000690557_200000718107 [0,0,0,1,0,0|3,0,0]=4 1026 B11R1.154 CC(O)CCCN1CC(C1)F 34a_100000690557_200000718107 [0,0,0,1,0,0|3,0,0]=4 1027 B11R1.154 CC(O)CCCN1CC(C1)O 269982a_100000749847_200000718107 [0,0,0,1,0,0|2,0,0]=3 1028 B11R1.154 CC(O)CCNC1CC(C1)F 2230a_100016993743_100012276601 [0,0,0,1,0,0|2,0,0]=3 1029 B11R1.154 CC(O)CCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100012276601 [0,0,0,1,0,0|1,0,0]=2 1030 B11R1.154 CC(O)CCSC1CC(=O)C1 62a_100009894365_100012276601 [0,0,0,1,0,0|0,1,2]=4 1031 B11R1.154 CC(O)CNCC1CC(C1)O 2230a_100016992100_100011218427 [0,0,0,1,0,0|2,0,0]=3 1032 B11R1.154 CC(O)COCC1CC(C1)Cl 34a_100009874164_100011218427 [0,0,0,1,0,0|3,0,0]=4 1033 B11R1.154 C[C@@H](O)CNCC1CC(C1)O 2230a_100016992100_100009817552 [0,0,0,1,0,0|2,0,0]=3 1034 B11R1.154 C[C@@H](O)COCC1CC(C1)Cl 34a_100009874164_100009817552 [0,0,0,1,0,0|3,0,0]=4 1035 B11R1.157 CC(C)CN1CCCC(C1)O 2230a_100000211013_100000210760 [0,0,0,1,0,0|3,0,0]=4 1036 B11R1.157 CC(C)CN1CCCC(C1)O 269982a_100000211013_100000210624 [0,0,0,1,0,0|3,0,0]=4 1037 B11R1.157 CC(C)CN1CCCC(C1)O 270004a_100000211013_100000210432 [0,0,0,1,0,0|3,0,0]=4 1038 B11R1.157 CC(C)NC1CCCC(C1)O 2230a_100015190357_100000210206 [0,0,0,1,0,0|3,0,0]=4 1039 B11R1.157 CC(O)CN1CCCC(C1)F 2230a_100000697950_100011218427 [0,0,0,1,0,0|3,0,0]=4 1040 B11R1.157 CC(O)CN1CCCC(C1)F 269982a_100000697950_100011218427 [0,0,0,1,0,0|3,0,0]=4 1041 B11R1.157 CC(O)CN1CCCC(C1)F 34a_100000697950_100011218427 [0,0,0,1,0,0|3,0,0]=4 1042 B11R1.157 CC(O)CN1CCCC(C1)O 2230a_100000211013_100011218427 [0,0,0,1,0,0|2,0,0]=3 1043 B11R1.157 CC(O)CN1CCCC(C1)O 269982a_100000211013_100011218427 [0,0,0,1,0,0|2,0,0]=3 1044 B11R1.157 CC(O)CN1CCC[C@@H](C1)C 2230a_100000717927_100011218427 [0,0,0,1,0,0|3,0,0]=4 1045 B11R1.157 CC(O)CN1CCC[C@@H](C1)C 269982a_100000717927_100011218427 [0,0,0,1,0,0|3,0,0]=4 1046 B11R1.157 CC(O)CN1CCC[C@@H](C1)C 34a_100000717927_100011218427 [0,0,0,1,0,0|3,0,0]=4 1047 B11R1.157 CC(O)CN1CCOC(C1)O 2230a_100000688207_100011218427 [0,0,0,1,0,0|3,0,0]=4 1048 B11R1.157 CC(O)CN1CCOC(C1)O 269982a_100000688207_100011218427 [0,0,0,1,0,0|3,0,0]=4 1049 B11R1.157 C[C@@H](O)CN1CCCC(C1)F 2230a_100000697950_100009817552 [0,0,0,1,0,0|3,0,0]=4 1050 B11R1.157 C[C@@H](O)CN1CCCC(C1)F 269982a_100000697950_100009817552 [0,0,0,1,0,0|3,0,0]=4 1051 B11R1.157 C[C@@H](O)CN1CCCC(C1)F 34a_100000697950_100009817552 [0,0,0,1,0,0|3,0,0]=4 1052 B11R1.157 C[C@@H](O)CN1CCCC(C1)O 2230a_100000211013_100009817552 [0,0,0,1,0,0|2,0,0]=3 1053 B11R1.157 C[C@@H](O)CN1CCCC(C1)O 269982a_100000211013_100009817552 [0,0,0,1,0,0|2,0,0]=3 1054 B11R1.157 C[C@@H](O)CN1CCOC(C1)O 2230a_100000688207_100009817552 [0,0,0,1,0,0|3,0,0]=4 1055 B11R1.157 C[C@@H](O)CN1CCOC(C1)O 269982a_100000688207_100009817552 [0,0,0,1,0,0|3,0,0]=4 1056 B11R1.157 C[C@H]1CCCN(C1)C[C@@H](C)O 2230a_100000717927_100009817552 [0,0,0,1,0,0|3,0,0]=4 1057 B11R1.157 C[C@H]1CCCN(C1)C[C@@H](C)O 269982a_100000717927_100009817552 [0,0,0,1,0,0|3,0,0]=4 1058 B11R1.157 C[C@H]1CCCN(C1)C[C@@H](C)O 34a_100000717927_100009817552 [0,0,0,1,0,0|3,0,0]=4 1059 B11R1.176 C=C(Br)CCOCCC1CO1 34a_100009813270_100000732470 [0,0,0,1,0,0|1,0,2]=4 1060 B11R1.176 C=C(C)CCOCCC1CC1 34a_100000754188_100000730704 [0,0,0,1,0,0|2,0,1]=4 1061 B11R1.176 C=C(C)CCOCCC1CC1 34a_100000764851_100000694398 [0,0,0,1,0,0|2,0,1]=4 1062 B11R1.176 C=C(C)CCOCCC1CC1 7a_100000754188_100000730704 [0,0,0,1,0,0|2,0,1]=4 1063 B11R1.176 C=C(C)CCOCCC1CO1 34a_100000764851_100000732470 [0,0,0,1,0,0|1,0,1]=3 1064 B11R1.176 C=C(C)CCOCC[C@@H]1CO1 34a_100009820653_100000730704 [0,0,0,1,0,0|1,0,1]=3 1065 B11R1.176 C=C(C)CCSCCC1CO1 62a_100000730704_100000732470 [0,0,0,1,0,0|1,1,1]=4 1066 B11R1.176 C=C(C)CCSCCC1CO1 62a_100000732470_100000730704 [0,0,0,1,0,0|1,1,1]=4 1067 B11R1.176 CC(=CCOCCC1CO1)C 34a_100000753907_100000732470 [0,0,0,1,0,0|1,0,2]=4 1068 B11R1.176 CC(=CCOCC[C@@H]1CO1)C 34a_100009820653_100000761012 [0,0,0,1,0,0|1,0,2]=4 1069 B11R1.176 CC(=O)CCOCCC1CC1 34a_100000759926_100000694398 [0,0,0,1,0,0|1,0,2]=4 1070 B11R1.176 CC(=O)CCOCCC1CC1 7a_100000754188_100000053229 [0,0,0,1,0,0|1,0,2]=4 1071 B11R1.176 CC(=O)CCOCCC1CC1 7a_100000759926_100000764125 [0,0,0,1,0,0|1,0,2]=4 1072 B11R1.176 CC(=O)CCOCCC1CO1 34a_100000759926_100000732470 [0,0,0,1,0,0|0,0,2]=3 1073 B11R1.176 CC(=O)CCOCCC1CO1 7a_100000759926_100000732470 [0,0,0,1,0,0|0,0,2]=3 1074 B11R1.176 CC(=O)CCSCCC1CO1 62a_100000053229_100000732470 [0,0,0,1,0,0|0,1,2]=4 1075 B11R1.176 CC(=O)CCSCCC1CO1 62a_100000732470_100000053229 [0,0,0,1,0,0|0,1,2]=4 1076 B11R1.176 CC(=O)OCOCC[C@@H]1CO1 34a_100009820653_100009813279 [0,0,0,1,0,0|1,0,2]=4 1077 B11R1.176 CC(Br)CCOCCC1CC1 34a_100009893172_100000694398 [0,0,0,1,0,0|2,0,0]=3 1078 B11R1.176 CC(Br)CCOCCC1CO1 34a_100009893172_100000732470 [0,0,0,1,0,0|1,0,0]=2 1079 B11R1.176 CC(Br)COCCCC1CO1 34a_100012180447_100000733510 [0,0,0,1,0,0|3,0,0]=4 1080 B11R1.176 CC(C)CCCNCC1CO1 2230a_200000737386_100011216344 [0,0,0,1,0,0|3,0,0]=4 1081 B11R1.176 CC(C)CCCNCC1CO1 34a_200000737386_102125554688 [0,0,0,1,0,0|3,0,0]=4 1082 B11R1.176 CC(C)CCCOCC1CO1 34a_100000210774_102125554688 [0,0,0,1,0,0|3,0,0]=4 1083 B11R1.176 CC(C)CCCOCC1CO1 7a_100000210774_102125554688 [0,0,0,1,0,0|3,0,0]=4 1084 B11R1.176 CC(C)CCCOC[C@@H]1CO1 34a_100000757423_100011214892 [0,0,0,1,0,0|3,0,0]=4 1085 B11R1.176 CC(C)CCCOC[C@@H]1CO1 7a_100000210774_100000745022 [0,0,0,1,0,0|3,0,0]=4 1086 B11R1.176 CC(C)CCCSCC1CO1 62a_100011214892_102125554688 [0,0,0,1,0,0|3,0,0]=4 1087 B11R1.176 CC(C)CCCSCC1CO1 62a_102125554688_100011214892 [0,0,0,1,0,0|3,0,0]=4 1088 B11R1.176 CC(C)CCCSC[C@@H]1CO1 62a_100000745022_100011214892 [0,0,0,1,0,0|3,0,0]=4 1089 B11R1.176 CC(C)CCCSC[C@@H]1CO1 62a_100011214892_100000745022 [0,0,0,1,0,0|3,0,0]=4 1090 B11R1.176 CC(C)CCNCCC1CC1 269862a_100000764129_100000185833 [0,0,0,1,0,0|3,0,0]=4 1091 B11R1.176 CC(C)CCNCCC1CC1 34a_100000764129_100000210312 [0,0,0,1,0,0|3,0,0]=4 1092 B11R1.176 CC(C)CCOCCC1CC1 34a_100000210254_100000694398 [0,0,0,1,0,0|2,0,0]=3 1093 B11R1.176 CC(C)CCOCCC1CC1 34a_100000754188_100000210312 [0,0,0,1,0,0|2,0,0]=3 1094 B11R1.176 CC(C)CCOCCC1CC1 7a_100000210254_100000764125 [0,0,0,1,0,0|2,0,0]=3 1095 B11R1.176 CC(C)CCOCCC1CC1 7a_100000754188_100000210626 [0,0,0,1,0,0|2,0,0]=3 1096 B11R1.176 CC(C)CCOCCC1CO1 34a_100000210254_100000732470 [0,0,0,1,0,0|1,0,0]=2 1097 B11R1.176 CC(C)CCOCCC1CO1 7a_100000210254_100000732470 [0,0,0,1,0,0|1,0,0]=2 1098 B11R1.176 CC(C)CCOCC[C@@H]1CO1 34a_100009820653_100000210312 [0,0,0,1,0,0|1,0,0]=2 1099 B11R1.176 CC(C)CCSCCC1CC1 62a_100000210312_100000764125 [0,0,0,1,0,0|2,1,0]=4 1100 B11R1.176 CC(C)CCSCCC1CC1 62a_100000764125_100000210312 [0,0,0,1,0,0|2,1,0]=4 1101 B11R1.176 CC(C)CCSCCC1CO1 62a_100000210312_100000732470 [0,0,0,1,0,0|1,1,0]=3 1102 B11R1.176 CC(C)CCSCCC1CO1 62a_100000732470_100000210312 [0,0,0,1,0,0|1,1,0]=3 1103 B11R1.176 CC(C)CNCCCC1CO1 2230a_100000210953_100000733510 [0,0,0,1,0,0|3,0,0]=4 1104 B11R1.176 CC(C)CNCCCC1CO1 34a_100000210953_100000733510 [0,0,0,1,0,0|3,0,0]=4 1105 B11R1.176 CC(C)COCCCC1CO1 34a_100000210257_100000733510 [0,0,0,1,0,0|3,0,0]=4 1106 B11R1.176 CC(C)CSCCCC1CO1 62a_100000210624_100000733510 [0,0,0,1,0,0|3,0,0]=4 1107 B11R1.176 CC(C)CSCCCC1CO1 62a_100000733510_100000210760 [0,0,0,1,0,0|3,0,0]=4 1108 B11R1.176 CC(C)OCOCCC1CC1 34a_100000754188_100000709892 [0,0,0,1,0,0|3,0,0]=4 1109 B11R1.176 CC(C)OCOCC[C@@H]1CO1 34a_100009820653_100000709892 [0,0,0,1,0,0|2,0,0]=3 1110 B11R1.176 CC(C)OCSCCC1CO1 62a_100000709892_100000732470 [0,0,0,1,0,0|2,1,0]=4 1111 B11R1.176 CC(C)OCSCCC1CO1 62a_100000732470_100000709892 [0,0,0,1,0,0|2,1,0]=4 1112 B11R1.176 CC(F)COCCCC1CO1 34a_100015925927_100000733510 [0,0,0,1,0,0|3,0,0]=4 1113 B11R1.176 CC(O)CCCNCC1CC1 2230a_100000735609_200000718107 [0,0,0,1,0,0|3,0,0]=4 1114 B11R1.176 CC(O)CCCNCC1CC1 34a_100000735609_200000718107 [0,0,0,1,0,0|3,0,0]=4 1115 B11R1.176 CC(O)CCCOCC1CC1 34a_100000211283_200000718107 [0,0,0,1,0,0|3,0,0]=4 1116 B11R1.176 CC(O)CCCOC[C@@H]1CO1 34a_100000757423_200000718107 [0,0,0,1,0,0|2,0,0]=3 1117 B11R1.176 CC(O)CCCSCC1CC1 62a_100000756562_200000718107 [0,0,0,1,0,0|3,0,0]=4 1118 B11R1.176 CC(O)CCCSCC1CC1 62a_200000718107_100000742324 [0,0,0,1,0,0|3,0,0]=4 1119 B11R1.176 CC(O)CCCSCC1CO1 62a_102125554688_200000718107 [0,0,0,1,0,0|2,0,0]=3 1120 B11R1.176 CC(O)CCCSCC1CO1 62a_200000718107_102125554688 [0,0,0,1,0,0|2,0,0]=3 1121 B11R1.176 CC(O)CCCSCC1CS1 62a_100000031435_200000718107 [0,0,0,1,0,0|2,1,0]=4 1122 B11R1.176 CC(O)CCCSCC1CS1 62a_200000718107_100000031435 [0,0,0,1,0,0|2,1,0]=4 1123 B11R1.176 CC(O)CCCSC[C@@H]1CO1 62a_100000745022_200000718107 [0,0,0,1,0,0|2,0,0]=3 1124 B11R1.176 CC(O)CCCSC[C@@H]1CO1 62a_200000718107_100000745022 [0,0,0,1,0,0|2,0,0]=3 1125 B11R1.176 CC(O)CCNCCC1CC1 2230a_200000755665_100000694398 [0,0,0,1,0,0|2,0,0]=3 1126 B11R1.176 CC(O)CCNCCC1CC1 34a_100000764129_100012276601 [0,0,0,1,0,0|2,0,0]=3 1127 B11R1.176 CC(O)CCNCCC1CO1 2230a_200000755665_100000732470 [0,0,0,1,0,0|1,0,0]=2 1128 B11R1.176 CC(O)CCOCCC1CC1 34a_100000754188_100012276601 [0,0,0,1,0,0|1,0,0]=2 1129 B11R1.176 CC(O)CCOCCC1CC1 7a_100000754188_100012276601 [0,0,0,1,0,0|1,0,0]=2 1130 B11R1.176 CC(O)CCOCC[C@@H]1CO1 34a_100009820653_100012276601 [0,0,0,1,0,0|0,0,0]=1 1131 B11R1.176 CC(O)CCSCCC1CC1 62a_100000764125_100012276601 [0,0,0,1,0,0|1,1,0]=3 1132 B11R1.176 CC(O)CCSCCC1CC1 62a_100012276601_100000764125 [0,0,0,1,0,0|1,1,0]=3 1133 B11R1.176 CC(O)CCSCCC1CO1 62a_100000732470_100012276601 [0,0,0,1,0,0|0,1,0]=2 1134 B11R1.176 CC(O)CCSCCC1CO1 62a_100012276601_100000732470 [0,0,0,1,0,0|0,1,0]=2 1135 B11R1.176 CC(O)CNCCCC1CO1 2230a_100000210904_100000733510 [0,0,0,1,0,0|2,0,0]=3 1136 B11R1.176 CC(O)CNCCCC1CO1 34a_100000210904_100000733510 [0,0,0,1,0,0|2,0,0]=3 1137 B11R1.176 CC(O)CSCCCC1CO1 62a_100000733510_100011218427 [0,0,0,1,0,0|2,0,0]=3 1138 B11R1.176 CC(O)CSCCCC1CO1 62a_100011218427_100000733510 [0,0,0,1,0,0|2,0,0]=3 1139 B11R1.176 CN(C)CCOCCC1CC1 7a_100000754188_100000755713 [0,0,0,1,0,0|3,0,0]=4 1140 B11R1.176 CN(C)CCSCCC1CO1 62a_100000732470_100000755713 [0,0,0,1,0,0|2,1,0]=4 1141 B11R1.176 C[C@@H](Cl)COCCCC1CO1 34a_100016084084_100000733510 [0,0,0,1,0,0|3,0,0]=4 1142 B11R1.176 C[C@@H](N)CCOCCC1CC1 34a_100000706166_100000694398 [0,0,0,1,0,0|2,0,0]=3 1143 B11R1.176 C[C@@H](N)CCOCCC1CO1 34a_100000706166_100000732470 [0,0,0,1,0,0|1,0,0]=2 1144 B11R1.176 C[C@@H](N)COCCCC1CO1 34a_100000737577_100000733510 [0,0,0,1,0,0|3,0,0]=4 1145 B11R1.176 C[C@@H](O)CSCCCC1CO1 62a_100000733510_100009817552 [0,0,0,1,0,0|2,0,0]=3 1146 B11R1.176 C[C@@H](O)CSCCCC1CO1 62a_100009817552_100000733510 [0,0,0,1,0,0|2,0,0]=3 1147 B11R1.176 FC(F)CCOCCC1CC1 34a_100103093639_100000694398 [0,0,0,1,0,0|3,0,0]=4 1148 B11R1.176 FC(F)CCOCCC1CO1 34a_100103093639_100000732470 [0,0,0,1,0,0|2,0,0]=3 1149 B11R1.176 NC(=O)CCOCCC1CO1 34a_100000757172_100000732470 [0,0,0,1,0,0|1,0,2]=4 1150 B11R1.176 NC(=O)CCOCCC1CO1 7a_100000757172_100000732470 [0,0,0,1,0,0|1,0,2]=4 1151 B11R1.176 NC(=O)CCOCC[C@@H]1CO1 34a_100009820653_100000731001 [0,0,0,1,0,0|1,0,2]=4 1152 B11R1.234 CC(C)N[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100000210206 [0,0,0,1,0,0|3,0,0]=4 1153 B11R1.234 CC(C)N[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100000210206 [0,0,0,1,0,0|3,0,0]=4 1154 B11R1.234 CC(O)CN1CCCC1(C)C 2230a_100000761399_100011218427 [0,0,0,1,0,0|3,0,0]=4 1155 B11R1.234 CC(O)CN1CCCC1(C)C 269982a_100000761399_100011218427 [0,0,0,1,0,0|3,0,0]=4 1156 B11R1.234 CC(O)CN1CCCC1(C)C 34a_100000761399_100011218427 [0,0,0,1,0,0|3,0,0]=4 1157 B11R1.234 C[C@@H](O)CN1CCCC1(C)C 2230a_100000761399_100009817552 [0,0,0,1,0,0|3,0,0]=4 1158 B11R1.234 C[C@@H](O)CN1CCCC1(C)C 269982a_100000761399_100009817552 [0,0,0,1,0,0|3,0,0]=4 1159 B11R1.234 C[C@@H](O)CN1CCCC1(C)C 34a_100000761399_100009817552 [0,0,0,1,0,0|3,0,0]=4 1160 B11R1.497 CC(C)N1CCCCC(C1)O 2230a_100025706797_100000210206 [0,0,0,1,0,0|3,0,0]=4 1161 B11R1.497 CC(C)N1CCCCC(C1)O 269982a_100025706797_100000210206 [0,0,0,1,0,0|3,0,0]=4 1162 B11R1.923 CC(O)CCNC1CC1(F)F 2230a_100020610826_100012276601 [0,0,0,1,0,0|3,0,0]=4 1163 B11R1.923 CC(O)CCNC1CC1(F)F 34a_100020610826_100012276601 [0,0,0,1,0,0|3,0,0]=4 1164 B11R1.923 CC(O)COCC1CC1(C)C 34a_100000728257_100011218427 [0,0,0,1,0,0|3,0,0]=4 1165 B11R1.923 CC(O)COCC1CC1(C)C 7a_100000728257_100011218427 [0,0,0,1,0,0|3,0,0]=4 1166 B11R1.923 C[C@@H](O)COCC1CC1(C)C 34a_100000728257_100009817552 [0,0,0,1,0,0|3,0,0]=4 1167 B11R1.923 C[C@@H](O)COCC1CC1(C)C 7a_100000728257_100009817552 [0,0,0,1,0,0|3,0,0]=4 1168 B9R0.55 C=C(Br)CCOCC(C)O 34a_100009813270_100011218427 [0,0,0,0,1,0|1,0,2]=4 1169 B9R0.55 C=C(Br)CCOC[C@@H](C)O 34a_100009813270_100009817552 [0,0,0,0,1,0|1,0,2]=4 1170 B9R0.55 C=C(C)CCNCC(C)O 2230a_100000210904_100000730704 [0,0,0,0,1,0|2,0,1]=4 1171 B9R0.55 C=C(C)CCNCC(C)O 34a_100000210904_100000730704 [0,0,0,0,1,0|2,0,1]=4 1172 B9R0.55 C=C(C)CCOCC(C)Br 34a_100012180447_100000730704 [0,0,0,0,1,0|2,0,1]=4 1173 B9R0.55 C=C(C)CCOCC(C)C 34a_100000210257_100000730704 [0,0,0,0,1,0|2,0,1]=4 1174 B9R0.55 C=C(C)CCOCC(C)C 34a_100000764851_100000210624 [0,0,0,0,1,0|2,0,1]=4 1175 B9R0.55 C=C(C)CCOCC(C)F 34a_100015925927_100000730704 [0,0,0,0,1,0|2,0,1]=4 1176 B9R0.55 C=C(C)CCOCC(C)O 34a_100000764851_100011218427 [0,0,0,0,1,0|1,0,1]=3 1177 B9R0.55 C=C(C)CCOC[C@@H](C)Cl 34a_100016084084_100000730704 [0,0,0,0,1,0|2,0,1]=4 1178 B9R0.55 C=C(C)CCOC[C@@H](C)N 34a_100000737577_100000730704 [0,0,0,0,1,0|2,0,1]=4 1179 B9R0.55 C=C(C)CCOC[C@@H](C)O 34a_100000764851_100009817552 [0,0,0,0,1,0|1,0,1]=3 1180 B9R0.55 C=C(C)CCSCC(C)O 62a_100000730704_100011218427 [0,0,0,0,1,0|1,1,1]=4 1181 B9R0.55 C=C(C)CCSCC(C)O 62a_100011218427_100000730704 [0,0,0,0,1,0|1,1,1]=4 1182 B9R0.55 C=C(C)CCSC[C@@H](C)O 62a_100000730704_100009817552 [0,0,0,0,1,0|1,1,1]=4 1183 B9R0.55 C=C(C)CCSC[C@@H](C)O 62a_100009817552_100000730704 [0,0,0,0,1,0|1,1,1]=4 1184 B9R0.55 C=C(C)CNCCC(C)O 2230a_200000755665_100000748629 [0,0,0,0,1,0|2,0,1]=4 1185 B9R0.55 C=C(C)COCCC(C)Br 34a_100009893172_100000748629 [0,0,0,0,1,0|2,0,1]=4 1186 B9R0.55 C=C(C)COCCC(C)C 34a_100000210245_100000210312 [0,0,0,0,1,0|2,0,1]=4 1187 B9R0.55 C=C(C)COCCC(C)C 34a_100000210254_100000748629 [0,0,0,0,1,0|2,0,1]=4 1188 B9R0.55 C=C(C)COCCC(C)C 7a_100000210254_100000748629 [0,0,0,0,1,0|2,0,1]=4 1189 B9R0.55 C=C(C)COCCC(C)O 34a_100000210245_100012276601 [0,0,0,0,1,0|1,0,1]=3 1190 B9R0.55 C=C(C)COCC[C@@H](C)N 34a_100000706166_100000748629 [0,0,0,0,1,0|2,0,1]=4 1191 B9R0.55 C=C(C)CSCCC(C)O 62a_100000748629_100012276601 [0,0,0,0,1,0|1,1,1]=4 1192 B9R0.55 C=C(C)CSCCC(C)O 62a_100012276601_100000211660 [0,0,0,0,1,0|1,1,1]=4 1193 B9R0.55 C=C(F)COCCC(C)O 34a_200010262243_100012276601 [0,0,0,0,1,0|1,0,2]=4 1194 B9R0.55 CC(=CCOCC(C)O)C 34a_100000753907_100011218427 [0,0,0,0,1,0|1,0,2]=4 1195 B9R0.55 CC(=CCOC[C@@H](C)O)C 34a_100000753907_100009817552 [0,0,0,0,1,0|1,0,2]=4 1196 B9R0.55 CC(=O)CCCCC(C)C 1458a_100000070787_100011216152 [0,0,0,0,1,0|1,0,2]=4 1197 B9R0.55 CC(=O)CCCCC(C)C 1458a_100011933920_200000210301 [0,0,0,0,1,0|1,0,2]=4 1198 B9R0.55 CC(=O)CCOCC(C)C 34a_100000759926_100000210624 [0,0,0,0,1,0|1,0,2]=4 1199 B9R0.55 CC(=O)CCOCC(C)C 7a_100000759926_100000210760 [0,0,0,0,1,0|1,0,2]=4 1200 B9R0.55 CC(=O)CCOCC(C)O 34a_100000759926_100011218427 [0,0,0,0,1,0|0,0,2]=3 1201 B9R0.55 CC(=O)CCOCC(C)O 7a_100000759926_100011218427 [0,0,0,0,1,0|0,0,2]=3 1202 B9R0.55 CC(=O)CCOC[C@@H](C)O 34a_100000759926_100009817552 [0,0,0,0,1,0|0,0,2]=3 1203 B9R0.55 CC(=O)CCOC[C@@H](C)O 7a_100000759926_100009817552 [0,0,0,0,1,0|0,0,2]=3 1204 B9R0.55 CC(=O)CCSCC(C)O 62a_100000053229_100011218427 [0,0,0,0,1,0|0,1,2]=4 1205 B9R0.55 CC(=O)CCSCC(C)O 62a_100011218427_100000053229 [0,0,0,0,1,0|0,1,2]=4 1206 B9R0.55 CC(=O)CCSC[C@@H](C)O 62a_100000053229_100009817552 [0,0,0,0,1,0|0,1,2]=4 1207 B9R0.55 CC(=O)CCSC[C@@H](C)O 62a_100009817552_100000053229 [0,0,0,0,1,0|0,1,2]=4 1208 B9R0.55 CC(=O)COCCC(C)C 34a_100000211253_100000210312 [0,0,0,0,1,0|1,0,2]=4 1209 B9R0.55 CC(=O)COCCC(C)O 34a_100000211253_100012276601 [0,0,0,0,1,0|0,0,2]=3 1210 B9R0.55 CC(Br)CCOCC(F)F 34a_100009893172_100011934356 [0,0,0,0,1,0|3,0,0]=4 1211 B9R0.55 CC(Br)CCOC[C@@H](C)O 34a_100009893172_100009817552 [0,0,0,0,1,0|1,0,0]=2 1212 B9R0.55 CC(Br)COCOC(C)C 34a_100012180447_100000709892 [0,0,0,0,1,0|3,0,0]=4 1213 B9R0.55 CC(C)CCCCC(=O)[13CH3] 1458a_100011933920_200025704644 [0,0,0,0,1,0|1,0,2]=4 1214 B9R0.55 CC(C)CCCCN(C)C 2230a_100102631434_100011216152 [0,0,0,0,1,0|3,0,0]=4 1215 B9R0.55 CC(C)CCCCN(C)C 269982a_100102631434_100011216152 [0,0,0,0,1,0|3,0,0]=4 1216 B9R0.55 CC(C)CCCNC(C)C 2230a_100138425928_100011214892 [0,0,0,0,1,0|3,0,0]=4 1217 B9R0.55 CC(C)CCCNC(C)C 2230a_200000737386_100000210206 [0,0,0,0,1,0|3,0,0]=4 1218 B9R0.55 CC(C)CCCNC(C)C 34a_100138425928_100011214892 [0,0,0,0,1,0|3,0,0]=4 1219 B9R0.55 CC(C)CCCNC(C)C 34a_200000737386_100000210206 [0,0,0,0,1,0|3,0,0]=4 1220 B9R0.55 CC(C)CCCOC(C)C 34a_100000210774_100000210206 [0,0,0,0,1,0|3,0,0]=4 1221 B9R0.55 CC(C)CCCOC(C)C 34a_100000212225_100011214892 [0,0,0,0,1,0|3,0,0]=4 1222 B9R0.55 CC(C)CCCOC(C)C 7a_100000210774_100000210206 [0,0,0,0,1,0|3,0,0]=4 1223 B9R0.55 CC(C)CCCSC(C)C 62a_100000210206_100011214892 [0,0,0,0,1,0|3,0,0]=4 1224 B9R0.55 CC(C)CCCSC(C)C 62a_100011214892_100000210206 [0,0,0,0,1,0|3,0,0]=4 1225 B9R0.55 CC(C)CCNCC(C)C 2230a_100000210953_100000210312 [0,0,0,0,1,0|3,0,0]=4 1226 B9R0.55 CC(C)CCNCC(C)C 269862a_100000210953_100000185833 [0,0,0,0,1,0|3,0,0]=4 1227 B9R0.55 CC(C)CCNCC(C)C 270004a_100000210545_100000210432 [0,0,0,0,1,0|3,0,0]=4 1228 B9R0.55 CC(C)CCNCC(C)C 34a_100000210953_100000210312 [0,0,0,0,1,0|3,0,0]=4 1229 B9R0.55 CC(C)CCNCC(C)O 2230a_100000210904_100000210312 [0,0,0,0,1,0|2,0,0]=3 1230 B9R0.55 CC(C)CCNCC(C)O 269862a_100000210904_100000185833 [0,0,0,0,1,0|2,0,0]=3 1231 B9R0.55 CC(C)CCNCC(C)O 34a_100000210904_100000210312 [0,0,0,0,1,0|2,0,0]=3 1232 B9R0.55 CC(C)CCOCC(C)Br 34a_100012180447_100000210312 [0,0,0,0,1,0|2,0,0]=3 1233 B9R0.55 CC(C)CCOCC(C)C 34a_100000210254_100000210624 [0,0,0,0,1,0|2,0,0]=3 1234 B9R0.55 CC(C)CCOCC(C)C 34a_100000210257_100000210312 [0,0,0,0,1,0|2,0,0]=3 1235 B9R0.55 CC(C)CCOCC(C)C 7a_100000210254_100000210760 [0,0,0,0,1,0|2,0,0]=3 1236 B9R0.55 CC(C)CCOCC(C)F 34a_100015925927_100000210312 [0,0,0,0,1,0|2,0,0]=3 1237 B9R0.55 CC(C)CCOCC(C)O 34a_100000210254_100011218427 [0,0,0,0,1,0|1,0,0]=2 1238 B9R0.55 CC(C)CCOCC(C)O 7a_100000210254_100011218427 [0,0,0,0,1,0|1,0,0]=2 1239 B9R0.55 CC(C)CCOCC(F)F 34a_100000210254_100011934356 [0,0,0,0,1,0|3,0,0]=4 1240 B9R0.55 CC(C)CCOCC(F)F 34a_100000743014_100000210312 [0,0,0,0,1,0|3,0,0]=4 1241 B9R0.55 CC(C)CCOCC(F)F 7a_100000210254_100011934356 [0,0,0,0,1,0|3,0,0]=4 1242 B9R0.55 CC(C)CCOC[C@@H](C)Cl 34a_100016084084_100000210312 [0,0,0,0,1,0|2,0,0]=3 1243 B9R0.55 CC(C)CCOC[C@@H](C)N 34a_100000737577_100000210312 [0,0,0,0,1,0|2,0,0]=3 1244 B9R0.55 CC(C)CCOC[C@@H](C)O 34a_100000210254_100009817552 [0,0,0,0,1,0|1,0,0]=2 1245 B9R0.55 CC(C)CCOC[C@@H](C)O 7a_100000210254_100009817552 [0,0,0,0,1,0|1,0,0]=2 1246 B9R0.55 CC(C)CCSCC(C)C 62a_100000210312_100000210760 [0,0,0,0,1,0|2,1,0]=4 1247 B9R0.55 CC(C)CCSCC(C)C 62a_100000210624_100000210312 [0,0,0,0,1,0|2,1,0]=4 1248 B9R0.55 CC(C)CCSCC(C)O 62a_100000210312_100011218427 [0,0,0,0,1,0|1,1,0]=3 1249 B9R0.55 CC(C)CCSCC(C)O 62a_100011218427_100000210312 [0,0,0,0,1,0|1,1,0]=3 1250 B9R0.55 CC(C)CCSC[C@@H](C)O 62a_100000210312_100009817552 [0,0,0,0,1,0|1,1,0]=3 1251 B9R0.55 CC(C)CCSC[C@@H](C)O 62a_100009817552_100000210312 [0,0,0,0,1,0|1,1,0]=3 1252 B9R0.55 CC(C)CNCCC(C)O 2230a_100000210953_100012276601 [0,0,0,0,1,0|2,0,0]=3 1253 B9R0.55 CC(C)CNCCC(C)O 2230a_200000755665_100000210760 [0,0,0,0,1,0|2,0,0]=3 1254 B9R0.55 CC(C)CNCCC(C)O 270004a_200000755665_100000210432 [0,0,0,0,1,0|2,0,0]=3 1255 B9R0.55 CC(C)CNCCC(C)O 34a_100000210953_100012276601 [0,0,0,0,1,0|2,0,0]=3 1256 B9R0.55 CC(C)COCCC(C)Br 34a_100009893172_100000210624 [0,0,0,0,1,0|2,0,0]=3 1257 B9R0.55 CC(C)COCCC(C)O 34a_100000210257_100012276601 [0,0,0,0,1,0|1,0,0]=2 1258 B9R0.55 CC(C)COCCC(F)F 34a_100103093639_100000210624 [0,0,0,0,1,0|3,0,0]=4 1259 B9R0.55 CC(C)COCC[C@@H](C)N 34a_100000706166_100000210624 [0,0,0,0,1,0|2,0,0]=3 1260 B9R0.55 CC(C)COCOC(C)C 34a_100000210257_100000709892 [0,0,0,0,1,0|3,0,0]=4 1261 B9R0.55 CC(C)CSCCC(C)O 62a_100000210624_100012276601 [0,0,0,0,1,0|1,1,0]=3 1262 B9R0.55 CC(C)CSCCC(C)O 62a_100012276601_100000210760 [0,0,0,0,1,0|1,1,0]=3 1263 B9R0.55 CC(C)OCOC[C@@H](C)Cl 34a_100016084084_100000709892 [0,0,0,0,1,0|3,0,0]=4 1264 B9R0.55 CC(C)OCOC[C@@H](C)N 34a_100000737577_100000709892 [0,0,0,0,1,0|3,0,0]=4 1265 B9R0.55 CC(C)OCSC[C@@H](C)O 62a_100000709892_100009817552 [0,0,0,0,1,0|2,1,0]=4 1266 B9R0.55 CC(C)OCSC[C@@H](C)O 62a_100009817552_100000709892 [0,0,0,0,1,0|2,1,0]=4 1267 B9R0.55 CC(F)COCOC(C)C 34a_100015925927_100000709892 [0,0,0,0,1,0|3,0,0]=4 1268 B9R0.55 CC(O)CCCNC(C)C 2230a_100138425928_200000718107 [0,0,0,0,1,0|2,0,0]=3 1269 B9R0.55 CC(O)CCCNC(C)C 34a_100138425928_200000718107 [0,0,0,0,1,0|2,0,0]=3 1270 B9R0.55 CC(O)CCCOC(C)C 34a_100000212225_200000718107 [0,0,0,0,1,0|2,0,0]=3 1271 B9R0.55 CC(O)CCCSC(C)C 62a_100000210206_200000718107 [0,0,0,0,1,0|2,0,0]=3 1272 B9R0.55 CC(O)CCCSC(C)C 62a_200000718107_100000210206 [0,0,0,0,1,0|2,0,0]=3 1273 B9R0.55 CC(O)CCNCC(=O)O 269956a_100016091260_100012276601 [0,0,0,0,1,0|2,0,1]=4 1274 B9R0.55 CC(O)CCNCC(C)O 2230a_100000210904_100012276601 [0,0,0,0,1,0|1,0,0]=2 1275 B9R0.55 CC(O)CCNCC(C)O 2230a_200000755665_100011218427 [0,0,0,0,1,0|1,0,0]=2 1276 B9R0.55 CC(O)CCNCC(C)O 34a_100000210904_100012276601 [0,0,0,0,1,0|1,0,0]=2 1277 B9R0.55 CC(O)CCNCC(F)F 2230a_200000755665_100011934356 [0,0,0,0,1,0|3,0,0]=4 1278 B9R0.55 CC(O)CCNCC(F)F 34a_100000765723_100012276601 [0,0,0,0,1,0|3,0,0]=4 1279 B9R0.55 CC(O)CCNC[C@@H](C)O 2230a_200000755665_100009817552 [0,0,0,0,1,0|1,0,0]=2 1280 B9R0.55 CC(O)CCOCC(C)Br 34a_100012180447_100012276601 [0,0,0,0,1,0|1,0,0]=2 1281 B9R0.55 CC(O)CCOCC(C)F 34a_100015925927_100012276601 [0,0,0,0,1,0|1,0,0]=2 1282 B9R0.55 CC(O)CCOCC(F)F 34a_100000743014_100012276601 [0,0,0,0,1,0|2,0,0]=3 1283 B9R0.55 CC(O)CCOC[C@@H](C)Cl 34a_100016084084_100012276601 [0,0,0,0,1,0|1,0,0]=2 1284 B9R0.55 CC(O)CCOC[C@@H](C)N 34a_100000737577_100012276601 [0,0,0,0,1,0|1,0,0]=2 1285 B9R0.55 CC(O)CCSCC(C)O 62a_100011218427_100012276601 [0,0,0,0,1,0|0,1,0]=2 1286 B9R0.55 CC(O)CCSCC(C)O 62a_100012276601_100011218427 [0,0,0,0,1,0|0,1,0]=2 1287 B9R0.55 CC(O)CCSCC(F)F 62a_100011934356_100012276601 [0,0,0,0,1,0|2,1,0]=4 1288 B9R0.55 CC(O)CCSCC(F)F 62a_100012276601_100011934356 [0,0,0,0,1,0|2,1,0]=4 1289 B9R0.55 CC(O)CCSC[C@@H](C)O 62a_100009817552_100012276601 [0,0,0,0,1,0|0,1,0]=2 1290 B9R0.55 CC(O)CCSC[C@@H](C)O 62a_100012276601_100009817552 [0,0,0,0,1,0|0,1,0]=2 1291 B9R0.55 CC(O)CNCOC(C)C 2230a_100000210904_100000709892 [0,0,0,0,1,0|3,0,0]=4 1292 B9R0.55 CC(O)CNCOC(C)C 34a_100000210904_100000709892 [0,0,0,0,1,0|3,0,0]=4 1293 B9R0.55 CC(O)CNOCC(=O)O 269956a_100000106656_100011218427 [0,0,0,0,1,0|2,0,1]=4 1294 B9R0.55 CC(O)COCCC(=O)N 34a_100000757172_100011218427 [0,0,0,0,1,0|1,0,2]=4 1295 B9R0.55 CC(O)COCCC(=O)N 7a_100000757172_100011218427 [0,0,0,0,1,0|1,0,2]=4 1296 B9R0.55 CC(O)COCCC(C)Br 34a_100009893172_100011218427 [0,0,0,0,1,0|1,0,0]=2 1297 B9R0.55 CC(O)COCCC(F)F 34a_100103093639_100011218427 [0,0,0,0,1,0|2,0,0]=3 1298 B9R0.55 CC(O)COCC[C@@H](C)N 34a_100000706166_100011218427 [0,0,0,0,1,0|1,0,0]=2 1299 B9R0.55 CC(O)CSCCN(C)C 62a_100011218427_100000755713 [0,0,0,0,1,0|2,1,0]=4 1300 B9R0.55 CC(O)CSCOC(C)C 62a_100000709892_100011218427 [0,0,0,0,1,0|2,1,0]=4 1301 B9R0.55 CC(O)CSCOC(C)C 62a_100011218427_100000709892 [0,0,0,0,1,0|2,1,0]=4 1302 B9R0.55 C[C@@H](N)CCOCC(F)F 34a_100000706166_100011934356 [0,0,0,0,1,0|3,0,0]=4 1303 B9R0.55 C[C@@H](N)CCOC[C@@H](C)O 34a_100000706166_100009817552 [0,0,0,0,1,0|1,0,0]=2 1304 B9R0.55 C[C@@H](O)CNOCC(=O)O 269956a_100000106656_100009817552 [0,0,0,0,1,0|2,0,1]=4 1305 B9R0.55 C[C@@H](O)COCCC(=O)N 34a_100000757172_100009817552 [0,0,0,0,1,0|1,0,2]=4 1306 B9R0.55 C[C@@H](O)COCCC(=O)N 7a_100000757172_100009817552 [0,0,0,0,1,0|1,0,2]=4 1307 B9R0.55 C[C@@H](O)COCCC(F)F 34a_100103093639_100009817552 [0,0,0,0,1,0|2,0,0]=3 1308 B9R0.55 C[C@@H](O)CSCCN(C)C 62a_100009817552_100000755713 [0,0,0,0,1,0|2,1,0]=4 1309 B11R0.30 C=C(Br)CCOCCCC(C)O 34a_100009813270_200000718107 [0,0,0,0,0,1|1,0,2]=4 1310 B11R0.30 C=C(C)CCOCCCC(C)C 34a_100000210774_100000730704 [0,0,0,0,0,1|2,0,1]=4 1311 B11R0.30 C=C(C)CCOCCCC(C)C 34a_100000764851_100011214892 [0,0,0,0,0,1|2,0,1]=4 1312 B11R0.30 C=C(C)CCOCCCC(C)C 7a_100000210774_100000730704 [0,0,0,0,0,1|2,0,1]=4 1313 B11R0.30 C=C(C)CCOCCCC(C)O 34a_100000764851_200000718107 [0,0,0,0,0,1|1,0,1]=3 1314 B11R0.30 C=C(C)CCOCCNC(C)C 34a_100000224655_100000730704 [0,0,0,0,0,1|2,0,1]=4 1315 B11R0.30 C=C(C)CCOCCOC(C)C 34a_100000211219_100000730704 [0,0,0,0,0,1|2,0,1]=4 1316 B11R0.30 C=C(C)CCOCCOC(C)C 34a_100000764851_100000211751 [0,0,0,0,0,1|2,0,1]=4 1317 B11R0.30 C=C(C)CCOCCOC(C)C 7a_100000211219_100000730704 [0,0,0,0,0,1|2,0,1]=4 1318 B11R0.30 C=C(C)CCOCCSC(C)C 34a_100000764851_100000730970 [0,0,0,0,0,1|2,0,1]=4 1319 B11R0.30 C=C(C)CCOCCSC(C)C 34a_200011212901_100000730704 [0,0,0,0,0,1|2,0,1]=4 1320 B11R0.30 C=C(C)CCOCCSC(C)C 7a_200011212901_100000730704 [0,0,0,0,0,1|2,0,1]=4 1321 B11R0.30 C=C(C)CCSCCCC(C)O 62a_100000730704_200000718107 [0,0,0,0,0,1|1,1,1]=4 1322 B11R0.30 C=C(C)CCSCCCC(C)O 62a_200000718107_100000730704 [0,0,0,0,0,1|1,1,1]=4 1323 B11R0.30 CC(=CCCNCCC(C)O)C 2230a_200000755665_100011217483 [0,0,0,0,0,1|2,0,1]=4 1324 B11R0.30 CC(=CCCOCCC(C)Br)C 34a_100009893172_100011217483 [0,0,0,0,0,1|2,0,1]=4 1325 B11R0.30 CC(=CCCOCCC(C)C)C 34a_100000210254_100011217483 [0,0,0,0,0,1|2,0,1]=4 1326 B11R0.30 CC(=CCCOCCC(C)C)C 7a_100000210254_100011217483 [0,0,0,0,0,1|2,0,1]=4 1327 B11R0.30 CC(=CCCOCC[C@@H](C)N)C 34a_100000706166_100011217483 [0,0,0,0,0,1|2,0,1]=4 1328 B11R0.30 CC(=CCCSCCC(C)O)C 62a_100011217483_100012276601 [0,0,0,0,0,1|1,1,1]=4 1329 B11R0.30 CC(=CCCSCCC(C)O)C 62a_100012276601_100011217483 [0,0,0,0,0,1|1,1,1]=4 1330 B11R0.30 CC(=CCOCCCC(C)O)C 34a_100000753907_200000718107 [0,0,0,0,0,1|1,0,2]=4 1331 B11R0.30 CC(=O)CCCCNCC(C)O 34a_100000210904_100009817362 [0,0,0,0,0,1|1,0,2]=4 1332 B11R0.30 CC(=O)CCCCSCC(C)O 62a_100000735457_100011218427 [0,0,0,0,0,1|1,0,2]=4 1333 B11R0.30 CC(=O)CCCCSCC(C)O 62a_100011218427_100000735457 [0,0,0,0,0,1|1,0,2]=4 1334 B11R0.30 CC(=O)CCCCSC[C@@H](C)O 62a_100000735457_100009817552 [0,0,0,0,0,1|1,0,2]=4 1335 B11R0.30 CC(=O)CCCCSC[C@@H](C)O 62a_100009817552_100000735457 [0,0,0,0,0,1|1,0,2]=4 1336 B11R0.30 CC(=O)CCCOCCC(C)Br 34a_100009893172_100000685027 [0,0,0,0,0,1|1,0,2]=4 1337 B11R0.30 CC(=O)CCCOCCC(C)C 34a_100000210254_100000685027 [0,0,0,0,0,1|1,0,2]=4 1338 B11R0.30 CC(=O)CCCOCCC(C)C 34a_100000759063_100000210312 [0,0,0,0,0,1|1,0,2]=4 1339 B11R0.30 CC(=O)CCCOCCC(C)C 7a_100000210254_100011215641 [0,0,0,0,0,1|1,0,2]=4 1340 B11R0.30 CC(=O)CCCOCCC(C)C 7a_100000759063_100000210626 [0,0,0,0,0,1|1,0,2]=4 1341 B11R0.30 CC(=O)CCCOCCC(C)O 34a_100000759063_100012276601 [0,0,0,0,0,1|0,0,2]=3 1342 B11R0.30 CC(=O)CCCOCCC(C)O 7a_100000759063_100012276601 [0,0,0,0,0,1|0,0,2]=3 1343 B11R0.30 CC(=O)CCCOCC[C@@H](C)N 34a_100000706166_100000685027 [0,0,0,0,0,1|1,0,2]=4 1344 B11R0.30 CC(=O)CCCSCCC(C)O 62a_100011215641_100012276601 [0,0,0,0,0,1|0,1,2]=4 1345 B11R0.30 CC(=O)CCCSCCC(C)O 62a_100012276601_100011215641 [0,0,0,0,0,1|0,1,2]=4 1346 B11R0.30 CC(=O)CCOCCCC(C)C 34a_100000759926_100011214892 [0,0,0,0,0,1|1,0,2]=4 1347 B11R0.30 CC(=O)CCOCCCC(C)C 7a_100000210774_100000053229 [0,0,0,0,0,1|1,0,2]=4 1348 B11R0.30 CC(=O)CCOCCCC(C)C 7a_100000759926_100011214892 [0,0,0,0,0,1|1,0,2]=4 1349 B11R0.30 CC(=O)CCOCCCC(C)O 34a_100000759926_200000718107 [0,0,0,0,0,1|0,0,2]=3 1350 B11R0.30 CC(=O)CCOCCCC(C)O 7a_100000759926_200000718107 [0,0,0,0,0,1|0,0,2]=3 1351 B11R0.30 CC(=O)CCOCCOC(C)C 34a_100000759926_100000211751 [0,0,0,0,0,1|1,0,2]=4 1352 B11R0.30 CC(=O)CCOCCOC(C)C 7a_100000211219_100000053229 [0,0,0,0,0,1|1,0,2]=4 1353 B11R0.30 CC(=O)CCOCCOC(C)C 7a_100000759926_100000211751 [0,0,0,0,0,1|1,0,2]=4 1354 B11R0.30 CC(=O)CCOCCSC(C)C 34a_100000759926_100000730970 [0,0,0,0,0,1|1,0,2]=4 1355 B11R0.30 CC(=O)CCOCCSC(C)C 7a_100000759926_100000730970 [0,0,0,0,0,1|1,0,2]=4 1356 B11R0.30 CC(=O)CCOCCSC(C)C 7a_200011212901_100000053229 [0,0,0,0,0,1|1,0,2]=4 1357 B11R0.30 CC(=O)CCSCCCC(C)O 62a_100000053229_200000718107 [0,0,0,0,0,1|0,1,2]=4 1358 B11R0.30 CC(=O)CCSCCCC(C)O 62a_200000718107_100000053229 [0,0,0,0,0,1|0,1,2]=4 1359 B11R0.30 CC(=O)NCCNCCC(C)O 2230a_100000209853_100012276601 [0,0,0,0,0,1|1,0,2]=4 1360 B11R0.30 CC(=O)NCCNCCC(C)O 2230a_200000755665_100000189650 [0,0,0,0,0,1|1,0,2]=4 1361 B11R0.30 CC(=O)NCCOCCC(C)C 34a_100000158858_100000210312 [0,0,0,0,0,1|1,0,2]=4 1362 B11R0.30 CC(=O)NCCOCCC(C)C 7a_100000210254_100000189650 [0,0,0,0,0,1|1,0,2]=4 1363 B11R0.30 CC(=O)NCCOCCC(C)O 34a_100000158858_100012276601 [0,0,0,0,0,1|0,0,2]=3 1364 B11R0.30 CC(=O)NCCSCCC(C)O 62a_100000189650_100012276601 [0,0,0,0,0,1|0,1,2]=4 1365 B11R0.30 CC(=O)NCCSCCC(C)O 62a_100012276601_100000189650 [0,0,0,0,0,1|0,1,2]=4 1366 B11R0.30 CC(=O)OCCOCCC(C)Br 34a_100009893172_100009814007 [0,0,0,0,0,1|1,0,2]=4 1367 B11R0.30 CC(=O)OCCOCCC(C)C 34a_100000210254_100009814007 [0,0,0,0,0,1|1,0,2]=4 1368 B11R0.30 CC(=O)OCCOCCC(C)C 7a_100000210254_100009814007 [0,0,0,0,0,1|1,0,2]=4 1369 B11R0.30 CC(=O)OCCOCC[C@@H](C)N 34a_100000706166_100009814007 [0,0,0,0,0,1|1,0,2]=4 1370 B11R0.30 CC(=O)OCCSCCC(C)O 62a_100009814007_100012276601 [0,0,0,0,0,1|0,1,2]=4 1371 B11R0.30 CC(=O)OCCSCCC(C)O 62a_100012276601_100009814007 [0,0,0,0,0,1|0,1,2]=4 1372 B11R0.30 CC(Br)CCOCCOC(C)C 34a_100009893172_100000211751 [0,0,0,0,0,1|2,0,0]=3 1373 B11R0.30 CC(Br)CCOCCSC(C)C 34a_100009893172_100000730970 [0,0,0,0,0,1|2,0,0]=3 1374 B11R0.30 CC(C)CCCCCNC(C)C 2230a_100011290863_100000210206 [0,0,0,0,0,1|3,0,0]=4 1375 B11R0.30 CC(C)CCCCCNC(C)C 2230a_100138425928_100000210682 [0,0,0,0,0,1|3,0,0]=4 1376 B11R0.30 CC(C)CCCCCNC(C)C 34a_100011290863_100000210206 [0,0,0,0,0,1|3,0,0]=4 1377 B11R0.30 CC(C)CCCCCNC(C)C 34a_100138425928_100000210682 [0,0,0,0,0,1|3,0,0]=4 1378 B11R0.30 CC(C)CCCCCOC(C)C 34a_100000212225_100000210682 [0,0,0,0,0,1|3,0,0]=4 1379 B11R0.30 CC(C)CCCCCOC(C)C 34a_100011995859_100000210206 [0,0,0,0,0,1|3,0,0]=4 1380 B11R0.30 CC(C)CCCCCOC(C)C 7a_100011995859_100000210206 [0,0,0,0,0,1|3,0,0]=4 1381 B11R0.30 CC(C)CCCCCSC(C)C 62a_100000210206_100000210682 [0,0,0,0,0,1|3,0,0]=4 1382 B11R0.30 CC(C)CCCCCSC(C)C 62a_100000210682_100000210206 [0,0,0,0,0,1|3,0,0]=4 1383 B11R0.30 CC(C)CCCCNCC(C)C 2230a_100000210953_100011216152 [0,0,0,0,0,1|3,0,0]=4 1384 B11R0.30 CC(C)CCCCNCC(C)C 34a_100000210953_100011216152 [0,0,0,0,0,1|3,0,0]=4 1385 B11R0.30 CC(C)CCCCNCC(C)O 2230a_100000210904_100011216152 [0,0,0,0,0,1|2,0,0]=3 1386 B11R0.30 CC(C)CCCCNCC(C)O 34a_100000210904_100011216152 [0,0,0,0,0,1|2,0,0]=3 1387 B11R0.30 CC(C)CCCCOCC(C)Br 34a_100012180447_100011216152 [0,0,0,0,0,1|3,0,0]=4 1388 B11R0.30 CC(C)CCCCOCC(C)C 34a_100000210257_100011216152 [0,0,0,0,0,1|3,0,0]=4 1389 B11R0.30 CC(C)CCCCOCC(C)C 34a_100011214890_100000210624 [0,0,0,0,0,1|3,0,0]=4 1390 B11R0.30 CC(C)CCCCOCC(C)C 7a_100011214890_100000210760 [0,0,0,0,0,1|3,0,0]=4 1391 B11R0.30 CC(C)CCCCOCC(C)F 34a_100015925927_100011216152 [0,0,0,0,0,1|3,0,0]=4 1392 B11R0.30 CC(C)CCCCOCC(C)O 34a_100011214890_100011218427 [0,0,0,0,0,1|2,0,0]=3 1393 B11R0.30 CC(C)CCCCOCC(C)O 7a_100011214890_100011218427 [0,0,0,0,0,1|2,0,0]=3 1394 B11R0.30 CC(C)CCCCOC[C@@H](C)Cl 34a_100016084084_100011216152 [0,0,0,0,0,1|3,0,0]=4 1395 B11R0.30 CC(C)CCCCOC[C@@H](C)N 34a_100000737577_100011216152 [0,0,0,0,0,1|3,0,0]=4 1396 B11R0.30 CC(C)CCCCOC[C@@H](C)O 34a_100011214890_100009817552 [0,0,0,0,0,1|2,0,0]=3 1397 B11R0.30 CC(C)CCCCOC[C@@H](C)O 7a_100011214890_100009817552 [0,0,0,0,0,1|2,0,0]=3 1398 B11R0.30 CC(C)CCCCSCC(C)C 62a_100000210624_100011216152 [0,0,0,0,0,1|3,0,0]=4 1399 B11R0.30 CC(C)CCCCSCC(C)C 62a_100011216152_100000210760 [0,0,0,0,0,1|3,0,0]=4 1400 B11R0.30 CC(C)CCCCSCC(C)O 62a_100011216152_100011218427 [0,0,0,0,0,1|2,0,0]=3 1401 B11R0.30 CC(C)CCCCSCC(C)O 62a_100011218427_100011216152 [0,0,0,0,0,1|2,0,0]=3 1402 B11R0.30 CC(C)CCCCSC[C@@H](C)O 62a_100009817552_100011216152 [0,0,0,0,0,1|2,0,0]=3 1403 B11R0.30 CC(C)CCCCSC[C@@H](C)O 62a_100011216152_100009817552 [0,0,0,0,0,1|2,0,0]=3 1404 B11R0.30 CC(C)CCCNCCC(C)C 2230a_200000737386_100000210312 [0,0,0,0,0,1|3,0,0]=4 1405 B11R0.30 CC(C)CCCNCCC(C)C 269862a_200000737386_100000185833 [0,0,0,0,0,1|3,0,0]=4 1406 B11R0.30 CC(C)CCCNCCC(C)C 34a_200000737386_100000210312 [0,0,0,0,0,1|3,0,0]=4 1407 B11R0.30 CC(C)CCCNCCC(C)O 2230a_200000737386_100012276601 [0,0,0,0,0,1|2,0,0]=3 1408 B11R0.30 CC(C)CCCNCCC(C)O 2230a_200000755665_100011214892 [0,0,0,0,0,1|2,0,0]=3 1409 B11R0.30 CC(C)CCCNCCC(C)O 34a_200000737386_100012276601 [0,0,0,0,0,1|2,0,0]=3 1410 B11R0.30 CC(C)CCCOCCC(C)Br 34a_100009893172_100011214892 [0,0,0,0,0,1|2,0,0]=3 1411 B11R0.30 CC(C)CCCOCCC(C)C 34a_100000210254_100011214892 [0,0,0,0,0,1|2,0,0]=3 1412 B11R0.30 CC(C)CCCOCCC(C)C 34a_100000210774_100000210312 [0,0,0,0,0,1|2,0,0]=3 1413 B11R0.30 CC(C)CCCOCCC(C)C 7a_100000210254_100011214892 [0,0,0,0,0,1|2,0,0]=3 1414 B11R0.30 CC(C)CCCOCCC(C)C 7a_100000210774_100000210626 [0,0,0,0,0,1|2,0,0]=3 1415 B11R0.30 CC(C)CCCOCCC(C)O 34a_100000210774_100012276601 [0,0,0,0,0,1|1,0,0]=2 1416 B11R0.30 CC(C)CCCOCCC(C)O 7a_100000210774_100012276601 [0,0,0,0,0,1|1,0,0]=2 1417 B11R0.30 CC(C)CCCOCCC(F)F 34a_100103093639_100011214892 [0,0,0,0,0,1|3,0,0]=4 1418 B11R0.30 CC(C)CCCOCCN(C)C 7a_100000210774_100000755713 [0,0,0,0,0,1|3,0,0]=4 1419 B11R0.30 CC(C)CCCOCC[C@@H](C)N 34a_100000706166_100011214892 [0,0,0,0,0,1|2,0,0]=3 1420 B11R0.30 CC(C)CCCOCOC(C)C 34a_100000210774_100000709892 [0,0,0,0,0,1|3,0,0]=4 1421 B11R0.30 CC(C)CCCSCCC(C)C 62a_100000210312_100011214892 [0,0,0,0,0,1|2,1,0]=4 1422 B11R0.30 CC(C)CCCSCCC(C)C 62a_100011214892_100000210312 [0,0,0,0,0,1|2,1,0]=4 1423 B11R0.30 CC(C)CCCSCCC(C)O 62a_100011214892_100012276601 [0,0,0,0,0,1|1,1,0]=3 1424 B11R0.30 CC(C)CCCSCCC(C)O 62a_100012276601_100011214892 [0,0,0,0,0,1|1,1,0]=3 1425 B11R0.30 CC(C)CCNCCOC(C)C 2230a_100000701111_100000210312 [0,0,0,0,0,1|3,0,0]=4 1426 B11R0.30 CC(C)CCNCCOC(C)C 269862a_100000701111_100000185833 [0,0,0,0,0,1|3,0,0]=4 1427 B11R0.30 CC(C)CCNCCOC(C)C 34a_100000701111_100000210312 [0,0,0,0,0,1|3,0,0]=4 1428 B11R0.30 CC(C)CCNCCSC(C)C 2230a_100000731138_100000210312 [0,0,0,0,0,1|3,0,0]=4 1429 B11R0.30 CC(C)CCNCCSC(C)C 269862a_100000731138_100000185833 [0,0,0,0,0,1|3,0,0]=4 1430 B11R0.30 CC(C)CCNCCSC(C)C 34a_100000731138_100000210312 [0,0,0,0,0,1|3,0,0]=4 1431 B11R0.30 CC(C)CCOCCCC(C)O 34a_100000210254_200000718107 [0,0,0,0,0,1|1,0,0]=2 1432 B11R0.30 CC(C)CCOCCCC(C)O 7a_100000210254_200000718107 [0,0,0,0,0,1|1,0,0]=2 1433 B11R0.30 CC(C)CCOCCCN(C)C 7a_100000210254_100000757444 [0,0,0,0,0,1|3,0,0]=4 1434 B11R0.30 CC(C)CCOCCNC(C)C 34a_100000224655_100000210312 [0,0,0,0,0,1|2,0,0]=3 1435 B11R0.30 CC(C)CCOCCOC(C)C 34a_100000210254_100000211751 [0,0,0,0,0,1|2,0,0]=3 1436 B11R0.30 CC(C)CCOCCOC(C)C 34a_100000211219_100000210312 [0,0,0,0,0,1|2,0,0]=3 1437 B11R0.30 CC(C)CCOCCOC(C)C 7a_100000210254_100000211751 [0,0,0,0,0,1|2,0,0]=3 1438 B11R0.30 CC(C)CCOCCOC(C)C 7a_100000211219_100000210626 [0,0,0,0,0,1|2,0,0]=3 1439 B11R0.30 CC(C)CCOCCSC(C)C 34a_100000210254_100000730970 [0,0,0,0,0,1|2,0,0]=3 1440 B11R0.30 CC(C)CCOCCSC(C)C 34a_200011212901_100000210312 [0,0,0,0,0,1|2,0,0]=3 1441 B11R0.30 CC(C)CCOCCSC(C)C 7a_100000210254_100000730970 [0,0,0,0,0,1|2,0,0]=3 1442 B11R0.30 CC(C)CCOCCSC(C)C 7a_200011212901_100000210626 [0,0,0,0,0,1|2,0,0]=3 1443 B11R0.30 CC(C)CCSCCCC(C)O 62a_100000210312_200000718107 [0,0,0,0,0,1|1,1,0]=3 1444 B11R0.30 CC(C)CCSCCCC(C)O 62a_200000718107_100000210312 [0,0,0,0,0,1|1,1,0]=3 1445 B11R0.30 CC(C)CCSCCOC(C)C 62a_100000210312_100000211751 [0,0,0,0,0,1|2,1,0]=4 1446 B11R0.30 CC(C)CCSCCOC(C)C 62a_100000211751_100000210312 [0,0,0,0,0,1|2,1,0]=4 1447 B11R0.30 CC(C)CCSCCSC(C)C 62a_100000210312_100000730970 [0,0,0,0,0,1|2,1,0]=4 1448 B11R0.30 CC(C)CCSCCSC(C)C 62a_100000730970_100000210312 [0,0,0,0,0,1|2,1,0]=4 1449 B11R0.30 CC(C)CNCCOCC(C)O 34a_100015185251_100011218427 [0,0,0,0,0,1|3,0,0]=4 1450 B11R0.30 CC(C)CNCCOC[C@@H](C)O 34a_100015185251_100009817552 [0,0,0,0,0,1|3,0,0]=4 1451 B11R0.30 CC(C)COCCOCC(C)O 34a_100000703358_100011218427 [0,0,0,0,0,1|3,0,0]=4 1452 B11R0.30 CC(C)COCCOCC(C)O 7a_100000703358_100011218427 [0,0,0,0,0,1|3,0,0]=4 1453 B11R0.30 CC(C)COCCOC[C@@H](C)O 34a_100000703358_100009817552 [0,0,0,0,0,1|3,0,0]=4 1454 B11R0.30 CC(C)COCCOC[C@@H](C)O 7a_100000703358_100009817552 [0,0,0,0,0,1|3,0,0]=4 1455 B11R0.30 CC(C)CSCCOCC(C)O 34a_200000230437_100011218427 [0,0,0,0,0,1|3,0,0]=4 1456 B11R0.30 CC(C)CSCCOCC(C)O 7a_200000230437_100011218427 [0,0,0,0,0,1|3,0,0]=4 1457 B11R0.30 CC(C)CSCCOC[C@@H](C)O 34a_200000230437_100009817552 [0,0,0,0,0,1|3,0,0]=4 1458 B11R0.30 CC(C)CSCCOC[C@@H](C)O 7a_200000230437_100009817552 [0,0,0,0,0,1|3,0,0]=4 1459 B11R0.30 CC(C)NCCCOC[C@@H](C)O 34a_100000182298_100009817552 [0,0,0,0,0,1|3,0,0]=4 1460 B11R0.30 CC(C)NCCOCOC(C)C 34a_100000224655_100000709892 [0,0,0,0,0,1|3,0,0]=4 1461 B11R0.30 CC(C)OCCCNC[C@@H](C)O 2230a_100000737246_100009817552 [0,0,0,0,0,1|3,0,0]=4 1462 B11R0.30 CC(C)OCCCNC[C@@H](C)O 34a_100000737246_100009817552 [0,0,0,0,0,1|3,0,0]=4 1463 B11R0.30 CC(C)OCCOCCC(F)F 34a_100103093639_100000211751 [0,0,0,0,0,1|3,0,0]=4 1464 B11R0.30 CC(C)OCCOCCN(C)C 7a_100000211219_100000755713 [0,0,0,0,0,1|3,0,0]=4 1465 B11R0.30 CC(C)OCCOCC[C@@H](C)N 34a_100000706166_100000211751 [0,0,0,0,0,1|2,0,0]=3 1466 B11R0.30 CC(C)OCCOCOC(C)C 34a_100000211219_100000709892 [0,0,0,0,0,1|3,0,0]=4 1467 B11R0.30 CC(C)OCOCCSC(C)C 34a_200011212901_100000709892 [0,0,0,0,0,1|3,0,0]=4 1468 B11R0.30 CC(C)SCCOCCC(F)F 34a_100103093639_100000730970 [0,0,0,0,0,1|3,0,0]=4 1469 B11R0.30 CC(C)SCCOCCN(C)C 7a_200011212901_100000755713 [0,0,0,0,0,1|3,0,0]=4 1470 B11R0.30 CC(C)SCCOCC[C@@H](C)N 34a_100000706166_100000730970 [0,0,0,0,0,1|2,0,0]=3 1471 B11R0.30 CC(O)CCCNCCC(C)O 2230a_200000755665_200000718107 [0,0,0,0,0,1|1,0,0]=2 1472 B11R0.30 CC(O)CCCOCCC(=O)N 34a_100000757172_200000718107 [0,0,0,0,0,1|1,0,2]=4 1473 B11R0.30 CC(O)CCCOCCC(=O)N 7a_100000757172_200000718107 [0,0,0,0,0,1|1,0,2]=4 1474 B11R0.30 CC(O)CCCOCCC(C)Br 34a_100009893172_200000718107 [0,0,0,0,0,1|1,0,0]=2 1475 B11R0.30 CC(O)CCCOCCC(F)F 34a_100103093639_200000718107 [0,0,0,0,0,1|2,0,0]=3 1476 B11R0.30 CC(O)CCCOCC[C@@H](C)N 34a_100000706166_200000718107 [0,0,0,0,0,1|1,0,0]=2 1477 B11R0.30 CC(O)CCCSCCC(C)O 62a_100012276601_200000718107 [0,0,0,0,0,1|0,1,0]=2 1478 B11R0.30 CC(O)CCCSCCC(C)O 62a_200000718107_100012276601 [0,0,0,0,0,1|0,1,0]=2 1479 B11R0.30 CC(O)CCCSCCN(C)C 62a_200000718107_100000755713 [0,0,0,0,0,1|2,1,0]=4 1480 B11R0.30 CC(O)CCCSCOC(C)C 62a_100000709892_200000718107 [0,0,0,0,0,1|2,1,0]=4 1481 B11R0.30 CC(O)CCCSCOC(C)C 62a_200000718107_100000709892 [0,0,0,0,0,1|2,1,0]=4 1482 B11R0.30 CC(O)CCNCCCS(=O)C 2230a_200000753449_100012276601 [0,0,0,0,0,1|2,0,1]=4 1483 B11R0.30 CC(O)CCNCCOC(C)C 2230a_100000701111_100012276601 [0,0,0,0,0,1|2,0,0]=3 1484 B11R0.30 CC(O)CCNCCOC(C)C 2230a_200000755665_100000211751 [0,0,0,0,0,1|2,0,0]=3 1485 B11R0.30 CC(O)CCNCCOC(C)C 34a_100000701111_100012276601 [0,0,0,0,0,1|2,0,0]=3 1486 B11R0.30 CC(O)CCNCCSC(C)C 2230a_100000731138_100012276601 [0,0,0,0,0,1|2,0,0]=3 1487 B11R0.30 CC(O)CCNCCSC(C)C 2230a_200000755665_100000730970 [0,0,0,0,0,1|2,0,0]=3 1488 B11R0.30 CC(O)CCNCCSC(C)C 34a_100000731138_100012276601 [0,0,0,0,0,1|2,0,0]=3 1489 B11R0.30 CC(O)CCOCCC[N+](=O)[O-] 34a_200000037920_100012276601 [0,0,0,0,0,1|2,0,1]=4 1490 B11R0.30 CC(O)CCOCCNC(=O)N 34a_100000181757_100012276601 [0,0,0,0,0,1|1,0,2]=4 1491 B11R0.30 CC(O)CCOCCNC(C)C 34a_100000224655_100012276601 [0,0,0,0,0,1|1,0,0]=2 1492 B11R0.30 CC(O)CCOCCOC(=O)N 7a_100000766696_100012276601 [0,0,0,0,0,1|1,0,2]=4 1493 B11R0.30 CC(O)CCOCCOC(C)C 34a_100000211219_100012276601 [0,0,0,0,0,1|1,0,0]=2 1494 B11R0.30 CC(O)CCOCCOC(C)C 7a_100000211219_100012276601 [0,0,0,0,0,1|1,0,0]=2 1495 B11R0.30 CC(O)CCOCCSC(C)C 34a_200011212901_100012276601 [0,0,0,0,0,1|1,0,0]=2 1496 B11R0.30 CC(O)CCOCCSC(C)C 7a_200011212901_100012276601 [0,0,0,0,0,1|1,0,0]=2 1497 B11R0.30 CC(O)CCSCCCN(C)C 62a_100012276601_100000757444 [0,0,0,0,0,1|2,1,0]=4 1498 B11R0.30 CC(O)CCSCCOC(C)C 62a_100000211751_100012276601 [0,0,0,0,0,1|1,1,0]=3 1499 B11R0.30 CC(O)CCSCCOC(C)C 62a_100012276601_100000211751 [0,0,0,0,0,1|1,1,0]=3 1500 B11R0.30 CC(O)CCSCCSC(C)C 62a_100000730970_100012276601 [0,0,0,0,0,1|1,1,0]=3 1501 B11R0.30 CC(O)CCSCCSC(C)C 62a_100012276601_100000730970 [0,0,0,0,0,1|1,1,0]=3 1502 B11R0.30 CC(O)CNCCCCB(O)O 2230a_100000210904_200009817182 [0,0,0,0,0,1|3,0,0]=4 1503 B11R0.30 CC(O)CNCCCCB(O)O 34a_100000210904_200009817182 [0,0,0,0,0,1|3,0,0]=4 1504 B11R0.30 CC(O)CNCCCOC(C)C 2230a_100000737246_100011218427 [0,0,0,0,0,1|3,0,0]=4 1505 B11R0.30 CC(O)CNCCCOC(C)C 34a_100000737246_100011218427 [0,0,0,0,0,1|3,0,0]=4 1506 B11R0.30 CC(O)COCCCNC(C)C 34a_100000182298_100011218427 [0,0,0,0,0,1|3,0,0]=4 1507 B11R0.30 CC(O)CSCCCCB(O)O 62a_100011218427_200009817182 [0,0,0,0,0,1|3,0,0]=4 1508 B11R0.30 CC(O)CSCCCCB(O)O 62a_200009817182_100011218427 [0,0,0,0,0,1|3,0,0]=4 1509 B11R0.30 CC(O)CSCCCCN(C)C 62a_100011218427_100000690147 [0,0,0,0,0,1|3,0,0]=4 1510 B11R0.30 C[C@@H](O)CSCCCCB(O)O 62a_100009817552_200009817182 [0,0,0,0,0,1|3,0,0]=4 1511 B11R0.30 C[C@@H](O)CSCCCCB(O)O 62a_200009817182_100009817552 [0,0,0,0,0,1|3,0,0]=4 1512 B11R0.30 C[C@@H](O)CSCCCCN(C)C 62a_100009817552_100000690147 [0,0,0,0,0,1|3,0,0]=4 1513 B8R0.4 C#CCCOCCCC 34a_100000210227_100000688953 [2,0,0,0,0,0|0,0,2]=4 1514 B8R0.4 C#CCCOCCCC 34a_100011215631_100000210210 [2,0,0,0,0,0|0,0,2]=4 1515 B8R0.4 C#CCCOCCCC 7a_100000210227_100000688953 [2,0,0,0,0,0|0,0,2]=4 1516 B8R0.4 C#CCCOCCCO 34a_100011215631_100000230001 [2,0,0,0,0,0|0,0,2]=4 1517 B8R0.4 C/C=C/COCCCC 34a_100000210227_100102629194 [2,0,0,0,0,0|0,0,2]=4 1518 B8R0.4 C/C=C/COCCCC 34a_100016270725_100000210210 [2,0,0,0,0,0|0,0,2]=4 1519 B8R0.4 C/C=C/COCCCC 7a_100000210227_100102629194 [2,0,0,0,0,0|0,0,2]=4 1520 B8R0.4 C/C=C/COCCCO 34a_100016270725_100000230001 [2,0,0,0,0,0|0,0,2]=4 1521 B8R0.4 C=CCCOCCCC 34a_100000210227_100000754431 [2,0,0,0,0,0|0,0,2]=4 1522 B8R0.4 C=CCCOCCCC 34a_100011205117_100000210210 [2,0,0,0,0,0|0,0,2]=4 1523 B8R0.4 C=CCCOCCCC 7a_100000210227_100000754431 [2,0,0,0,0,0|0,0,2]=4 1524 B8R0.4 C=CCCOCCCO 34a_100011205117_100000230001 [2,0,0,0,0,0|0,0,2]=4 1525 B8R0.4 CC#CCOCCCC 34a_100000210227_100000748600 [2,0,0,0,0,0|0,0,2]=4 1526 B8R0.4 CC#CCOCCCC 34a_100000761923_100000210210 [2,0,0,0,0,0|0,0,2]=4 1527 B8R0.4 CC#CCOCCCC 7a_100000210227_100000748600 [2,0,0,0,0,0|0,0,2]=4 1528 B8R0.4 CC#CCOCCCO 34a_100000761923_100000230001 [2,0,0,0,0,0|0,0,2]=4 1529 B8R0.4 CC=CCOCCCC 34a_100000210227_100000070051 [2,0,0,0,0,0|0,0,2]=4 1530 B8R0.4 CC=CCOCCCC 7a_100000210227_100000070051 [2,0,0,0,0,0|0,0,2]=4 1531 B8R0.4 CCCCCCCNC 2230a_100000229938_200000210301 [2,0,0,0,0,0|2,0,0]=4 1532 B8R0.4 CCCCCCCNC 2230a_106832991635_100000210681 [2,0,0,0,0,0|2,0,0]=4 1533 B8R0.4 CCCCCCCNC 34a_100102657272_100000210614 [2,0,0,0,0,0|2,0,0]=4 1534 B8R0.4 CCCCCCCNC 7a_106832991635_100000210614 [2,0,0,0,0,0|2,0,0]=4 1535 B8R0.4 CCCCCCCN[13CH3] 2230a_100000229938_200025704644 [2,0,0,0,0,0|2,0,0]=4 1536 B8R0.4 CCCCCCCOC 34a_100000210272_200000210301 [2,0,0,0,0,0|2,0,0]=4 1537 B8R0.4 CCCCCCCOC 34a_100138415774_100000210614 [2,0,0,0,0,0|2,0,0]=4 1538 B8R0.4 CCCCCCCOC 7a_100000210272_200000210301 [2,0,0,0,0,0|2,0,0]=4 1539 B8R0.4 CCCCCCCO[13CH3] 34a_100000210272_200025704644 [2,0,0,0,0,0|2,0,0]=4 1540 B8R0.4 CCCCCCCO[13CH3] 7a_100000210272_200025704644 [2,0,0,0,0,0|2,0,0]=4 1541 B8R0.4 CCCCCCCSC 62a_100000210614_200000210301 [2,0,0,0,0,0|2,0,0]=4 1542 B8R0.4 CCCCCCCSC 62a_200000210301_100000210316 [2,0,0,0,0,0|2,0,0]=4 1543 B8R0.4 CCCCCCCS[13CH3] 62a_100000210614_200025704644 [2,0,0,0,0,0|2,0,0]=4 1544 B8R0.4 CCCCCCCS[13CH3] 62a_200025704644_100000210316 [2,0,0,0,0,0|2,0,0]=4 1545 B8R0.4 CCCCCCNCC 2230a_100000210581_100000210202 [2,0,0,0,0,0|2,0,0]=4 1546 B8R0.4 CCCCCCNCC 2230a_100015525214_100000210314 [2,0,0,0,0,0|2,0,0]=4 1547 B8R0.4 CCCCCCOCC 34a_100000210259_100000210202 [2,0,0,0,0,0|2,0,0]=4 1548 B8R0.4 CCCCCCOCC 34a_100121572206_100000210314 [2,0,0,0,0,0|2,0,0]=4 1549 B8R0.4 CCCCCCOCC 7a_100000210259_100000210202 [2,0,0,0,0,0|2,0,0]=4 1550 B8R0.4 CCCCCCSCC 62a_100000210202_100000210757 [2,0,0,0,0,0|2,0,0]=4 1551 B8R0.4 CCCCCCSCC 62a_100000210314_100000210202 [2,0,0,0,0,0|2,0,0]=4 1552 B8R0.4 CCCCCNCCC 2230a_100000209983_100000210303 [2,0,0,0,0,0|2,0,0]=4 1553 B8R0.4 CCCCCNCCO 2230a_100000209983_100000211926 [2,0,0,0,0,0|2,0,0]=4 1554 B8R0.4 CCCCCNCCO 2230a_100016997473_100000210326 [2,0,0,0,0,0|2,0,0]=4 1555 B8R0.4 CCCCCNCCO 34a_100016990907_100000718602 [2,0,0,0,0,0|2,0,0]=4 1556 B8R0.4 CCCCCOCCC 34a_100000210253_100000210303 [2,0,0,0,0,0|2,0,0]=4 1557 B8R0.4 CCCCCOCCC 34a_100000210258_100000718602 [2,0,0,0,0,0|2,0,0]=4 1558 B8R0.4 CCCCCOCCC 7a_100000210253_100000210303 [2,0,0,0,0,0|2,0,0]=4 1559 B8R0.4 CCCCCOCCO 34a_100000210253_100000211926 [2,0,0,0,0,0|2,0,0]=4 1560 B8R0.4 CCCCCOCCO 7a_100000210253_100000211926 [2,0,0,0,0,0|2,0,0]=4 1561 B8R0.4 CCCCCSCCC 62a_100000210303_100000210326 [2,0,0,0,0,0|2,0,0]=4 1562 B8R0.4 CCCCCSCCC 62a_100000210326_100000210303 [2,0,0,0,0,0|2,0,0]=4 1563 B8R0.4 CCCCCSCCO 62a_100000210326_100000211926 [2,0,0,0,0,0|2,0,0]=4 1564 B8R0.4 CCCCCSCCO 62a_100000211926_100000210326 [2,0,0,0,0,0|2,0,0]=4 1565 B8R0.4 CCCCNCCCC 2230a_100000102301_100000210211 [2,0,0,0,0,0|1,0,0]=3 1566 B8R0.4 CCCCNCCCC 7a_106832991798_100000210211 [2,0,0,0,0,0|1,0,0]=3 1567 B8R0.4 CCCCNCCCF 2230a_100000102301_100011934791 [2,0,0,0,0,0|2,0,0]=4 1568 B8R0.4 CCCCNCCCF 2230a_100015189416_100000210211 [2,0,0,0,0,0|2,0,0]=4 1569 B8R0.4 CCCCNCCCF 34a_100015189416_100000210210 [2,0,0,0,0,0|2,0,0]=4 1570 B8R0.4 CCCCNCCCF 7a_106832991798_100011934791 [2,0,0,0,0,0|2,0,0]=4 1571 B8R0.4 CCCCNCCCO 2230a_100000102301_100000230001 [2,0,0,0,0,0|1,0,0]=3 1572 B8R0.4 CCCCNCCCO 7a_106832991798_100011215043 [2,0,0,0,0,0|1,0,0]=3 1573 B8R0.4 CCCCNCCOC 2230a_100000102301_100011201679 [2,0,0,0,0,0|2,0,0]=4 1574 B8R0.4 CCCCNCCOC 2230a_100000209980_100000210211 [2,0,0,0,0,0|2,0,0]=4 1575 B8R0.4 CCCCNCCOC 7a_106832991798_100000233755 [2,0,0,0,0,0|2,0,0]=4 1576 B8R0.4 CCCCNCCSC 2230a_100000102301_100000751147 [2,0,0,0,0,0|2,0,0]=4 1577 B8R0.4 CCCCNCCSC 2230a_100020590264_100000210211 [2,0,0,0,0,0|2,0,0]=4 1578 B8R0.4 CCCCNCCSC 7a_106832991798_100000212216 [2,0,0,0,0,0|2,0,0]=4 1579 B8R0.4 CCCCOCCC#N 7a_100000210227_100000184422 [2,0,0,0,0,0|1,0,1]=4 1580 B8R0.4 CCCCOCCCBr 34a_100011217188_100000210210 [2,0,0,0,0,0|1,0,0]=3 1581 B8R0.4 CCCCOCCCC 34a_100000210227_100000210210 [2,0,0,0,0,0|0,0,0]=2 1582 B8R0.4 CCCCOCCCC 7a_100000210227_100000210211 [2,0,0,0,0,0|0,0,0]=2 1583 B8R0.4 CCCCOCCCCl 34a_100000230001_100000210210 [2,0,0,0,0,0|1,0,0]=3 1584 B8R0.4 CCCCOCCCF 34a_100000210227_100011934791 [2,0,0,0,0,0|1,0,0]=3 1585 B8R0.4 CCCCOCCCF 34a_100000759539_100000210210 [2,0,0,0,0,0|1,0,0]=3 1586 B8R0.4 CCCCOCCCF 7a_100000210227_100011934791 [2,0,0,0,0,0|1,0,0]=3 1587 B8R0.4 CCCCOCCCN 34a_100000182051_100000210210 [2,0,0,0,0,0|1,0,0]=3 1588 B8R0.4 CCCCOCCCO 34a_100000210227_100000230001 [2,0,0,0,0,0|0,0,0]=2 1589 B8R0.4 CCCCOCCCO 7a_100000210227_100011215043 [2,0,0,0,0,0|0,0,0]=2 1590 B8R0.4 CCCCOCCNC 2230a_106832991635_100000743108 [2,0,0,0,0,0|1,0,0]=3 1591 B8R0.4 CCCCOCCNC 34a_100102657272_100000743108 [2,0,0,0,0,0|1,0,0]=3 1592 B8R0.4 CCCCOCCNC 7a_106832991635_100000743108 [2,0,0,0,0,0|1,0,0]=3 1593 B8R0.4 CCCCOCCOC 34a_100000210227_100011201679 [2,0,0,0,0,0|1,0,0]=3 1594 B8R0.4 CCCCOCCOC 34a_100000210237_100000210210 [2,0,0,0,0,0|1,0,0]=3 1595 B8R0.4 CCCCOCCOC 34a_100000210238_200000210301 [2,0,0,0,0,0|1,0,0]=3 1596 B8R0.4 CCCCOCCOC 34a_100138415774_100000743108 [2,0,0,0,0,0|1,0,0]=3 1597 B8R0.4 CCCCOCCOC 7a_100000210227_100000233755 [2,0,0,0,0,0|1,0,0]=3 1598 B8R0.4 CCCCOCCOC 7a_100000210238_200000210301 [2,0,0,0,0,0|1,0,0]=3 1599 B8R0.4 CCCCOCCON 34a_100000700252_100000210210 [2,0,0,0,0,0|2,0,0]=4 1600 B8R0.4 CCCCOCCO[13CH3] 34a_100000210238_200025704644 [2,0,0,0,0,0|1,0,0]=3 1601 B8R0.4 CCCCOCCO[13CH3] 7a_100000210238_200025704644 [2,0,0,0,0,0|1,0,0]=3 1602 B8R0.4 CCCCOCCSC 34a_100000210227_100000212216 [2,0,0,0,0,0|1,0,0]=3 1603 B8R0.4 CCCCOCCSC 34a_100000230434_100000210210 [2,0,0,0,0,0|1,0,0]=3 1604 B8R0.4 CCCCOCCSC 62a_100000743108_200000210301 [2,0,0,0,0,0|1,0,0]=3 1605 B8R0.4 CCCCOCCSC 62a_200000210301_100000743108 [2,0,0,0,0,0|1,0,0]=3 1606 B8R0.4 CCCCOCCSC 7a_100000210227_100000212216 [2,0,0,0,0,0|1,0,0]=3 1607 B8R0.4 CCCCOCCSC 7a_100000230434_100000210211 [2,0,0,0,0,0|1,0,0]=3 1608 B8R0.4 CCCCOCCS[13CH3] 62a_100000743108_200025704644 [2,0,0,0,0,0|1,0,0]=3 1609 B8R0.4 CCCCOCCS[13CH3] 62a_200025704644_100000743108 [2,0,0,0,0,0|1,0,0]=3 1610 B8R0.4 CCCCOCNCC 2230a_100015525214_100011995733 [2,0,0,0,0,0|1,0,0]=3 1611 B8R0.4 CCCCOCOCC 34a_100121572206_100011995733 [2,0,0,0,0,0|1,0,0]=3 1612 B8R0.4 CCCCOCSCC 62a_100000210202_100011995733 [2,0,0,0,0,0|1,0,0]=3 1613 B8R0.4 CCCCOCSCC 62a_100011995733_100000210202 [2,0,0,0,0,0|1,0,0]=3 1614 B8R0.4 CCCCOCSCF 62a_100011995733_100015361967 [2,0,0,0,0,0|2,0,0]=4 1615 B8R0.4 CCCCOCSCF 62a_100015361967_100011995733 [2,0,0,0,0,0|2,0,0]=4 1616 B8R0.4 CCCCSCCCC 62a_100000210211_100000210210 [2,0,0,0,0,0|0,1,0]=3 1617 B8R0.4 CCCCSCCCF 62a_100000210211_100011934791 [2,0,0,0,0,0|1,1,0]=4 1618 B8R0.4 CCCCSCCCF 62a_100011934791_100000210210 [2,0,0,0,0,0|1,1,0]=4 1619 B8R0.4 CCCCSCCCO 62a_100000210211_100011215043 [2,0,0,0,0,0|0,1,0]=3 1620 B8R0.4 CCCCSCCCO 62a_100011215043_100000210210 [2,0,0,0,0,0|0,1,0]=3 1621 B8R0.4 CCCCSCCNC 2230a_100025743550_200000210301 [2,0,0,0,0,0|1,1,0]=4 1622 B8R0.4 CCCCSCCN[13CH3] 2230a_100025743550_200025704644 [2,0,0,0,0,0|1,1,0]=4 1623 B8R0.4 CCCCSCCOC 34a_200000230436_200000210301 [2,0,0,0,0,0|1,1,0]=4 1624 B8R0.4 CCCCSCCOC 62a_100000210211_100000233755 [2,0,0,0,0,0|1,1,0]=4 1625 B8R0.4 CCCCSCCOC 62a_100000233755_100000210210 [2,0,0,0,0,0|1,1,0]=4 1626 B8R0.4 CCCCSCCOC 7a_200000230436_200000210301 [2,0,0,0,0,0|1,1,0]=4 1627 B8R0.4 CCCCSCCO[13CH3] 34a_200000230436_200025704644 [2,0,0,0,0,0|1,1,0]=4 1628 B8R0.4 CCCCSCCO[13CH3] 7a_200000230436_200025704644 [2,0,0,0,0,0|1,1,0]=4 1629 B8R0.4 CCCCSCCSC 62a_100000210211_100000751147 [2,0,0,0,0,0|1,1,0]=4 1630 B8R0.4 CCCCSCCSC 62a_100000212216_100000210210 [2,0,0,0,0,0|1,1,0]=4 1631 B8R0.4 CCCCSCOCC 62a_100000210211_100000739092 [2,0,0,0,0,0|1,1,0]=4 1632 B8R0.4 CCCCSCOCC 62a_100000739092_100000210210 [2,0,0,0,0,0|1,1,0]=4 1633 B8R0.4 CCCNCCCCO 2230a_100000750430_100000210303 [2,0,0,0,0,0|2,0,0]=4 1634 B8R0.4 CCCNCCCCO 34a_100000750430_100000210303 [2,0,0,0,0,0|2,0,0]=4 1635 B8R0.4 CCCOCCCCO 34a_100000210258_100011216708 [2,0,0,0,0,0|2,0,0]=4 1636 B8R0.4 CCCSCCCCO 62a_100000210303_100000210776 [2,0,0,0,0,0|2,0,0]=4 1637 B8R0.4 CCCSCCCCO 62a_100000210776_100000210303 [2,0,0,0,0,0|2,0,0]=4 1638 B8R0.4 CCNCCCCCO 2230a_100000762737_100000210202 [2,0,0,0,0,0|2,0,0]=4 1639 B8R0.4 CCNCCCCCO 2230a_100015525214_100000746330 [2,0,0,0,0,0|2,0,0]=4 1640 B8R0.4 CCNCCCCCO 34a_100000762737_100000210202 [2,0,0,0,0,0|2,0,0]=4 1641 B8R0.4 CCNCOCCOC 2230a_100015525214_100000231047 [2,0,0,0,0,0|2,0,0]=4 1642 B8R0.4 CCOCCCCCO 34a_100121572206_100000746330 [2,0,0,0,0,0|2,0,0]=4 1643 B8R0.4 CCOCSCCCO 62a_100000739092_100011215043 [2,0,0,0,0,0|1,1,0]=4 1644 B8R0.4 CCOCSCCCO 62a_100011215043_100000739092 [2,0,0,0,0,0|1,1,0]=4 1645 B8R0.4 CCSCCCCCO 62a_100000210202_100000746330 [2,0,0,0,0,0|2,0,0]=4 1646 B8R0.4 CCSCCCCCO 62a_100000746330_100000210202 [2,0,0,0,0,0|2,0,0]=4 1647 B8R0.4 CCSCOCCOC 62a_100000210202_100000231047 [2,0,0,0,0,0|2,0,0]=4 1648 B8R0.4 CCSCOCCOC 62a_100000231047_100000210202 [2,0,0,0,0,0|2,0,0]=4 1649 B8R0.4 CNCCCCCCO 2230a_100000686447_200000210301 [2,0,0,0,0,0|2,0,0]=4 1650 B8R0.4 CNCCCCCCO 2230a_106832991635_100000766143 [2,0,0,0,0,0|2,0,0]=4 1651 B8R0.4 CNCCCCCCO 34a_100000686447_200000210301 [2,0,0,0,0,0|2,0,0]=4 1652 B8R0.4 CNCCCCCCO 34a_100102657272_100000766143 [2,0,0,0,0,0|2,0,0]=4 1653 B8R0.4 CNCCCCCCO 7a_106832991635_100000766143 [2,0,0,0,0,0|2,0,0]=4 1654 B8R0.4 CNCCOCCOC 2230a_100000745349_200000210301 [2,0,0,0,0,0|2,0,0]=4 1655 B8R0.4 CNCCOCCOC 2230a_106832991635_100000695917 [2,0,0,0,0,0|2,0,0]=4 1656 B8R0.4 CNCCOCCOC 34a_100000228057_200000210301 [2,0,0,0,0,0|2,0,0]=4 1657 B8R0.4 CNCCOCCOC 34a_100000745349_200000210301 [2,0,0,0,0,0|2,0,0]=4 1658 B8R0.4 CNCCOCCOC 34a_100102657272_100000695917 [2,0,0,0,0,0|2,0,0]=4 1659 B8R0.4 CNCCOCCOC 7a_106832991635_100000695917 [2,0,0,0,0,0|2,0,0]=4 1660 B8R0.4 CNCCOCCO[13CH3] 34a_100000228057_200025704644 [2,0,0,0,0,0|2,0,0]=4 1661 B8R0.4 COCCCCCCO 34a_100138415774_100000766143 [2,0,0,0,0,0|2,0,0]=4 1662 B8R0.4 COCCNCCCO 2230a_100000209980_100000230001 [2,0,0,0,0,0|2,0,0]=4 1663 B8R0.4 COCCOCCCBr 34a_100011217188_100011201679 [2,0,0,0,0,0|2,0,0]=4 1664 B8R0.4 COCCOCCCCl 34a_100000230001_100011201679 [2,0,0,0,0,0|2,0,0]=4 1665 B8R0.4 COCCOCCCF 34a_100000210237_100011934791 [2,0,0,0,0,0|2,0,0]=4 1666 B8R0.4 COCCOCCCF 34a_100000759539_100011201679 [2,0,0,0,0,0|2,0,0]=4 1667 B8R0.4 COCCOCCCN 34a_100000182051_100011201679 [2,0,0,0,0,0|2,0,0]=4 1668 B8R0.4 COCCOCCCO 34a_100000210237_100000230001 [2,0,0,0,0,0|1,0,0]=3 1669 B8R0.4 COCCOCCN[13CH3] 2230a_100000745349_200025704644 [2,0,0,0,0,0|2,0,0]=4 1670 B8R0.4 COCCOCCN[13CH3] 34a_100000745349_200025704644 [2,0,0,0,0,0|2,0,0]=4 1671 B8R0.4 COCCOCCOC 34a_100000210237_100011201679 [2,0,0,0,0,0|2,0,0]=4 1672 B8R0.4 COCCOCCOC 34a_100011215163_200000210301 [2,0,0,0,0,0|2,0,0]=4 1673 B8R0.4 COCCOCCOC 34a_100138415774_100000695917 [2,0,0,0,0,0|2,0,0]=4 1674 B8R0.4 COCCOCCOC 7a_100011215163_200000210301 [2,0,0,0,0,0|2,0,0]=4 1675 B8R0.4 COCCOCCO[13CH3] 34a_100011215163_200025704644 [2,0,0,0,0,0|2,0,0]=4 1676 B8R0.4 COCCOCCO[13CH3] 7a_100011215163_200025704644 [2,0,0,0,0,0|2,0,0]=4 1677 B8R0.4 COCCOCCSC 34a_100000210237_100000212216 [2,0,0,0,0,0|2,0,0]=4 1678 B8R0.4 COCCOCCSC 34a_100000230434_100011201679 [2,0,0,0,0,0|2,0,0]=4 1679 B8R0.4 COCCOCCSC 62a_100000695917_200000210301 [2,0,0,0,0,0|2,0,0]=4 1680 B8R0.4 COCCOCCSC 62a_200000210301_100000695917 [2,0,0,0,0,0|2,0,0]=4 1681 B8R0.4 COCCOCCSC 7a_100000230434_100000233755 [2,0,0,0,0,0|2,0,0]=4 1682 B8R0.4 COCCOCCS[13CH3] 62a_100000695917_200025704644 [2,0,0,0,0,0|2,0,0]=4 1683 B8R0.4 COCCOCCS[13CH3] 62a_200025704644_100000695917 [2,0,0,0,0,0|2,0,0]=4 1684 B8R0.4 COCCSCCCO 62a_100000233755_100011215043 [2,0,0,0,0,0|1,1,0]=4 1685 B8R0.4 COCCSCCCO 62a_100011215043_100000233755 [2,0,0,0,0,0|1,1,0]=4 1686 B8R0.4 CSCCCCCCO 62a_100000766143_200000210301 [2,0,0,0,0,0|2,0,0]=4 1687 B8R0.4 CSCCCCCCO 62a_200000210301_100000766143 [2,0,0,0,0,0|2,0,0]=4 1688 B8R0.4 CSCCNCCCO 2230a_100020590264_100000230001 [2,0,0,0,0,0|2,0,0]=4 1689 B8R0.4 CSCCOCCCBr 34a_100011217188_100000212216 [2,0,0,0,0,0|2,0,0]=4 1690 B8R0.4 CSCCOCCCCl 34a_100000230001_100000212216 [2,0,0,0,0,0|2,0,0]=4 1691 B8R0.4 CSCCOCCCF 34a_100000230434_100011934791 [2,0,0,0,0,0|2,0,0]=4 1692 B8R0.4 CSCCOCCCF 34a_100000759539_100000212216 [2,0,0,0,0,0|2,0,0]=4 1693 B8R0.4 CSCCOCCCF 7a_100000230434_100011934791 [2,0,0,0,0,0|2,0,0]=4 1694 B8R0.4 CSCCOCCCN 34a_100000182051_100000212216 [2,0,0,0,0,0|2,0,0]=4 1695 B8R0.4 CSCCOCCCO 34a_100000230434_100000230001 [2,0,0,0,0,0|1,0,0]=3 1696 B8R0.4 CSCCOCCCO 7a_100000230434_100011215043 [2,0,0,0,0,0|1,0,0]=3 1697 B8R0.4 CSCCOCCSC 34a_100000230434_100000212216 [2,0,0,0,0,0|2,0,0]=4 1698 B8R0.4 CSCCOCCSC 7a_100000230434_100000212216 [2,0,0,0,0,0|2,0,0]=4 1699 B8R0.4 CSCCSCCCO 62a_100000212216_100011215043 [2,0,0,0,0,0|1,1,0]=4 1700 B8R0.4 CSCCSCCCO 62a_100011215043_100000751147 [2,0,0,0,0,0|1,1,0]=4 1701 B8R0.4 FCCCOCCCBr 34a_100011217188_100011934791 [2,0,0,0,0,0|2,0,0]=4 1702 B8R0.4 FCCCOCCCCl 34a_100000230001_100011934791 [2,0,0,0,0,0|2,0,0]=4 1703 B8R0.4 FCCCOCCCF 34a_100000759539_100011934791 [2,0,0,0,0,0|2,0,0]=4 1704 B8R0.4 NCCCOCCCF 34a_100000182051_100011934791 [2,0,0,0,0,0|2,0,0]=4 1705 B8R0.4 NCCCOCCCO 34a_100000182051_100000230001 [2,0,0,0,0,0|1,0,0]=3 1706 B8R0.4 NOCCOCCCO 34a_100000700252_100000230001 [2,0,0,0,0,0|2,0,0]=4 1707 B8R0.4 OCCCCNCCO 2230a_100000750430_100000211926 [2,0,0,0,0,0|2,0,0]=4 1708 B8R0.4 OCCCCNCCO 2230a_100016997473_100000210776 [2,0,0,0,0,0|2,0,0]=4 1709 B8R0.4 OCCCCNCCO 34a_100000750430_100000211926 [2,0,0,0,0,0|2,0,0]=4 1710 B8R0.4 OCCCCNCCO 34a_100016990907_100011216708 [2,0,0,0,0,0|2,0,0]=4 1711 B8R0.4 OCCCCSCCO 62a_100000210776_100000211926 [2,0,0,0,0,0|2,0,0]=4 1712 B8R0.4 OCCCCSCCO 62a_100000211926_100000210776 [2,0,0,0,0,0|2,0,0]=4 1713 B8R0.4 OCCCNCCCF 2230a_100015189416_100000230001 [2,0,0,0,0,0|2,0,0]=4 1714 B8R0.4 OCCCNCCCF 34a_100015189416_100000230001 [2,0,0,0,0,0|2,0,0]=4 1715 B8R0.4 OCCCOCCCBr 34a_100011217188_100000230001 [2,0,0,0,0,0|1,0,0]=3 1716 B8R0.4 OCCCOCCCCl 34a_100000230001_100000230001 [2,0,0,0,0,0|1,0,0]=3 1717 B8R0.4 OCCCOCCCF 34a_100000759539_100000230001 [2,0,0,0,0,0|1,0,0]=3 1718 B8R0.4 OCCCSCCCF 62a_100011215043_100011934791 [2,0,0,0,0,0|1,1,0]=4 1719 B8R0.4 OCCCSCCCF 62a_100011934791_100011215043 [2,0,0,0,0,0|1,1,0]=4 1720 B8R0.4 OCCCSCCCO 62a_100011215043_100011215043 [2,0,0,0,0,0|0,1,0]=3 1721 B8R0.4 [13CH3]NCCCCCCO 2230a_100000686447_200025704644 [2,0,0,0,0,0|2,0,0]=4 1722 B8R0.4 [13CH3]NCCCCCCO 34a_100000686447_200025704644 [2,0,0,0,0,0|2,0,0]=4 1723 B8R0.4 [13CH3]SCCCCCCO 62a_100000766143_200025704644 [2,0,0,0,0,0|2,0,0]=4 1724 B8R0.4 [13CH3]SCCCCCCO 62a_200025704644_100000766143 [2,0,0,0,0,0|2,0,0]=4 1725 B8R0.7 C#CCCOCC(C)O 34a_100011215631_100011218427 [2,0,0,0,0,0|0,0,2]=4 1726 B8R0.7 C#CCCOC[C@@H](C)O 34a_100011215631_100009817552 [2,0,0,0,0,0|0,0,2]=4 1727 B8R0.7 C#CCOCCC(C)O 34a_100000210247_100012276601 [2,0,0,0,0,0|0,0,2]=4 1728 B8R0.7 C/C=C/COCC(C)O 34a_100016270725_100011218427 [2,0,0,0,0,0|0,0,2]=4 1729 B8R0.7 C/C=C/COC[C@@H](C)O 34a_100016270725_100009817552 [2,0,0,0,0,0|0,0,2]=4 1730 B8R0.7 C=C(C)CCOCCC 34a_100000210258_100000730704 [2,0,0,0,0,0|1,0,1]=4 1731 B8R0.7 C=C(C)CCOCCC 34a_100000764851_100000210303 [2,0,0,0,0,0|1,0,1]=4 1732 B8R0.7 C=C(C)CCOCCO 34a_100000764851_100000211926 [2,0,0,0,0,0|1,0,1]=4 1733 B8R0.7 C=C(C)COCCCC 34a_100000210227_100000748629 [2,0,0,0,0,0|1,0,1]=4 1734 B8R0.7 C=C(C)COCCCC 34a_100000210245_100000210210 [2,0,0,0,0,0|1,0,1]=4 1735 B8R0.7 C=C(C)COCCCC 7a_100000210227_100000748629 [2,0,0,0,0,0|1,0,1]=4 1736 B8R0.7 C=C(C)COCCCO 34a_100000210245_100000230001 [2,0,0,0,0,0|1,0,1]=4 1737 B8R0.7 C=CCCOCC(C)O 34a_100011205117_100011218427 [2,0,0,0,0,0|0,0,2]=4 1738 B8R0.7 C=CCCOC[C@@H](C)O 34a_100011205117_100009817552 [2,0,0,0,0,0|0,0,2]=4 1739 B8R0.7 C=CCOCCC(C)O 34a_200000210373_100012276601 [2,0,0,0,0,0|0,0,2]=4 1740 B8R0.7 CC#CCOCC(C)O 34a_100000761923_100011218427 [2,0,0,0,0,0|0,0,2]=4 1741 B8R0.7 CC#CCOC[C@@H](C)O 34a_100000761923_100009817552 [2,0,0,0,0,0|0,0,2]=4 1742 B8R0.7 CC(=O)CCCCCO 1458a_100000070787_100000746330 [2,0,0,0,0,0|0,0,2]=4 1743 B8R0.7 CC(=O)CCCCCO 1458a_100102619762_200000210301 [2,0,0,0,0,0|0,0,2]=4 1744 B8R0.7 CC(=O)CCOCCO 1458a_100000070787_100011215305 [2,0,0,0,0,0|0,0,2]=4 1745 B8R0.7 CC(=O)CCOCCO 1458a_100011229844_200000210301 [2,0,0,0,0,0|0,0,2]=4 1746 B8R0.7 CC(=O)CCOCCO 34a_100000759926_100000211926 [2,0,0,0,0,0|0,0,2]=4 1747 B8R0.7 CC(=O)CCOCCO 7a_100000759926_100000211926 [2,0,0,0,0,0|0,0,2]=4 1748 B8R0.7 CC(=O)COCCCO 34a_100000211253_100000230001 [2,0,0,0,0,0|0,0,2]=4 1749 B8R0.7 CC(Br)CCOCCF 34a_100009893172_100011217306 [2,0,0,0,0,0|2,0,0]=4 1750 B8R0.7 CC(Br)CCOCCO 34a_100009893172_100000211926 [2,0,0,0,0,0|1,0,0]=3 1751 B8R0.7 CC(Br)COCCCF 34a_100012180447_100011934791 [2,0,0,0,0,0|2,0,0]=4 1752 B8R0.7 CC(Br)COCCCO 34a_100012180447_100000230001 [2,0,0,0,0,0|1,0,0]=3 1753 B8R0.7 CC(C)CCCCO[13CH3] 34a_100011214890_200025704644 [2,0,0,0,0,0|2,0,0]=4 1754 B8R0.7 CC(C)CCCCO[13CH3] 7a_100011214890_200025704644 [2,0,0,0,0,0|2,0,0]=4 1755 B8R0.7 CC(C)CCCCS[13CH3] 62a_100011216152_200025704644 [2,0,0,0,0,0|2,0,0]=4 1756 B8R0.7 CC(C)CCCCS[13CH3] 62a_200025704644_100011216152 [2,0,0,0,0,0|2,0,0]=4 1757 B8R0.7 CC(C)CCNCCO 2230a_100016997473_100000210312 [2,0,0,0,0,0|2,0,0]=4 1758 B8R0.7 CC(C)CCNCCO 269862a_100000210304_100000185833 [2,0,0,0,0,0|2,0,0]=4 1759 B8R0.7 CC(C)CCNCCO 34a_100016990907_100000210312 [2,0,0,0,0,0|2,0,0]=4 1760 B8R0.7 CC(C)CCOCCBr 34a_100000211926_100000210312 [2,0,0,0,0,0|2,0,0]=4 1761 B8R0.7 CC(C)CCOCCF 34a_100000210254_100011217306 [2,0,0,0,0,0|2,0,0]=4 1762 B8R0.7 CC(C)CCOCCF 7a_100000210254_100011217306 [2,0,0,0,0,0|2,0,0]=4 1763 B8R0.7 CC(C)CCOCCN 34a_100000210304_100000210312 [2,0,0,0,0,0|2,0,0]=4 1764 B8R0.7 CC(C)CCOCCO 34a_100000210254_100000211926 [2,0,0,0,0,0|1,0,0]=3 1765 B8R0.7 CC(C)CCOCCO 7a_100000210254_100000211926 [2,0,0,0,0,0|1,0,0]=3 1766 B8R0.7 CC(C)CCSCCO 62a_100000210312_100000211926 [2,0,0,0,0,0|1,1,0]=4 1767 B8R0.7 CC(C)CCSCCO 62a_100000211926_100000210312 [2,0,0,0,0,0|1,1,0]=4 1768 B8R0.7 CC(C)CNCCCO 2230a_100000210953_100000230001 [2,0,0,0,0,0|2,0,0]=4 1769 B8R0.7 CC(C)CNCCCO 270004a_100000182051_100000210432 [2,0,0,0,0,0|2,0,0]=4 1770 B8R0.7 CC(C)CNCCCO 34a_100000210953_100000230001 [2,0,0,0,0,0|2,0,0]=4 1771 B8R0.7 CC(C)COCCCBr 34a_100011217188_100000210624 [2,0,0,0,0,0|2,0,0]=4 1772 B8R0.7 CC(C)COCCCCl 34a_100000230001_100000210624 [2,0,0,0,0,0|2,0,0]=4 1773 B8R0.7 CC(C)COCCCF 34a_100000210257_100011934791 [2,0,0,0,0,0|2,0,0]=4 1774 B8R0.7 CC(C)COCCCF 34a_100000759539_100000210624 [2,0,0,0,0,0|2,0,0]=4 1775 B8R0.7 CC(C)COCCCN 34a_100000182051_100000210624 [2,0,0,0,0,0|2,0,0]=4 1776 B8R0.7 CC(C)COCCCO 34a_100000210257_100000230001 [2,0,0,0,0,0|1,0,0]=3 1777 B8R0.7 CC(C)COCCO[13CH3] 34a_100000703358_200025704644 [2,0,0,0,0,0|2,0,0]=4 1778 B8R0.7 CC(C)COCCO[13CH3] 7a_100000703358_200025704644 [2,0,0,0,0,0|2,0,0]=4 1779 B8R0.7 CC(C)CSCCCO 62a_100000210624_100011215043 [2,0,0,0,0,0|1,1,0]=4 1780 B8R0.7 CC(C)CSCCCO 62a_100011215043_100000210760 [2,0,0,0,0,0|1,1,0]=4 1781 B8R0.7 CC(C)NCCCCO 2230a_100000750430_100000210206 [2,0,0,0,0,0|2,0,0]=4 1782 B8R0.7 CC(C)NCCCCO 2230a_100138425928_100000210776 [2,0,0,0,0,0|2,0,0]=4 1783 B8R0.7 CC(C)NCCCCO 34a_100000750430_100000210206 [2,0,0,0,0,0|2,0,0]=4 1784 B8R0.7 CC(C)NCCCCO 34a_100138425928_100011216708 [2,0,0,0,0,0|2,0,0]=4 1785 B8R0.7 CC(C)OCCCCO 34a_100000212225_100011216708 [2,0,0,0,0,0|2,0,0]=4 1786 B8R0.7 CC(C)SCCCCO 62a_100000210206_100000210776 [2,0,0,0,0,0|2,0,0]=4 1787 B8R0.7 CC(C)SCCCCO 62a_100000210776_100000210206 [2,0,0,0,0,0|2,0,0]=4 1788 B8R0.7 CC(F)COCCCF 34a_100015925927_100011934791 [2,0,0,0,0,0|2,0,0]=4 1789 B8R0.7 CC(F)COCCCO 34a_100015925927_100000230001 [2,0,0,0,0,0|1,0,0]=3 1790 B8R0.7 CC(O)CCCSCF 62a_100015361967_200000718107 [2,0,0,0,0,0|2,0,0]=4 1791 B8R0.7 CC(O)CCCSCF 62a_200000718107_100015361967 [2,0,0,0,0,0|2,0,0]=4 1792 B8R0.7 CC(O)CCNCCF 2230a_200000755665_100011217306 [2,0,0,0,0,0|2,0,0]=4 1793 B8R0.7 CC(O)CCNCCF 34a_100000724931_100012276601 [2,0,0,0,0,0|2,0,0]=4 1794 B8R0.7 CC(O)CCNCCO 2230a_100016997473_100012276601 [2,0,0,0,0,0|1,0,0]=3 1795 B8R0.7 CC(O)CCNCCO 2230a_200000755665_100000211926 [2,0,0,0,0,0|1,0,0]=3 1796 B8R0.7 CC(O)CCNCCO 34a_100016990907_100012276601 [2,0,0,0,0,0|1,0,0]=3 1797 B8R0.7 CC(O)CCOCCBr 34a_100000211926_100012276601 [2,0,0,0,0,0|1,0,0]=3 1798 B8R0.7 CC(O)CCOCCN 34a_100000210304_100012276601 [2,0,0,0,0,0|1,0,0]=3 1799 B8R0.7 CC(O)CCSCCF 62a_100011217306_100012276601 [2,0,0,0,0,0|1,1,0]=4 1800 B8R0.7 CC(O)CCSCCF 62a_100012276601_100011217306 [2,0,0,0,0,0|1,1,0]=4 1801 B8R0.7 CC(O)CCSCCO 62a_100000211926_100012276601 [2,0,0,0,0,0|0,1,0]=3 1802 B8R0.7 CC(O)CCSCCO 62a_100012276601_100000211926 [2,0,0,0,0,0|0,1,0]=3 1803 B8R0.7 CC(O)CNCCCF 2230a_100000210904_100011934791 [2,0,0,0,0,0|2,0,0]=4 1804 B8R0.7 CC(O)CNCCCF 2230a_100015189416_100011218427 [2,0,0,0,0,0|2,0,0]=4 1805 B8R0.7 CC(O)CNCCCF 34a_100000210904_100011934791 [2,0,0,0,0,0|2,0,0]=4 1806 B8R0.7 CC(O)CNCCCF 34a_100015189416_100011218427 [2,0,0,0,0,0|2,0,0]=4 1807 B8R0.7 CC(O)CNCCCO 2230a_100000210904_100000230001 [2,0,0,0,0,0|1,0,0]=3 1808 B8R0.7 CC(O)CNCCCO 34a_100000210904_100000230001 [2,0,0,0,0,0|1,0,0]=3 1809 B8R0.7 CC(O)COCCCBr 34a_100011217188_100011218427 [2,0,0,0,0,0|1,0,0]=3 1810 B8R0.7 CC(O)COCCCCl 34a_100000230001_100011218427 [2,0,0,0,0,0|1,0,0]=3 1811 B8R0.7 CC(O)COCCCF 34a_100000759539_100011218427 [2,0,0,0,0,0|1,0,0]=3 1812 B8R0.7 CC(O)COCCCN 34a_100000182051_100011218427 [2,0,0,0,0,0|1,0,0]=3 1813 B8R0.7 CC(O)COCCON 34a_100000700252_100011218427 [2,0,0,0,0,0|2,0,0]=4 1814 B8R0.7 CC(O)CSCCCF 62a_100011218427_100011934791 [2,0,0,0,0,0|1,1,0]=4 1815 B8R0.7 CC(O)CSCCCF 62a_100011934791_100011218427 [2,0,0,0,0,0|1,1,0]=4 1816 B8R0.7 CC(O)CSCCCO 62a_100011215043_100011218427 [2,0,0,0,0,0|0,1,0]=3 1817 B8R0.7 CC(O)CSCCCO 62a_100011218427_100011215043 [2,0,0,0,0,0|0,1,0]=3 1818 B8R0.7 CCCCCCC(=O)C 1458a_100000070787_100000210757 [2,0,0,0,0,0|0,0,2]=4 1819 B8R0.7 CCCCCCC(=O)C 1458a_100102632555_200000210301 [2,0,0,0,0,0|0,0,2]=4 1820 B8R0.7 CCCCCCC(=O)[13CH3] 1458a_100102632555_200025704644 [2,0,0,0,0,0|0,0,2]=4 1821 B8R0.7 CCCCCCN(C)C 2230a_100102631434_100000210314 [2,0,0,0,0,0|2,0,0]=4 1822 B8R0.7 CCCCCCN(C)C 2230a_106256046315_200000210301 [2,0,0,0,0,0|2,0,0]=4 1823 B8R0.7 CCCCCCN(C)C 269982a_100102631434_100000210757 [2,0,0,0,0,0|2,0,0]=4 1824 B8R0.7 CCCCCCN(C)C 269982a_106256046315_200000210301 [2,0,0,0,0,0|2,0,0]=4 1825 B8R0.7 CCCCCCN(C)[13CH3] 2230a_106256046315_200025704644 [2,0,0,0,0,0|2,0,0]=4 1826 B8R0.7 CCCCCCN(C)[13CH3] 269982a_106256046315_200025704644 [2,0,0,0,0,0|2,0,0]=4 1827 B8R0.7 CCCCCNC(C)C 2230a_100000209983_100000210206 [2,0,0,0,0,0|2,0,0]=4 1828 B8R0.7 CCCCCNC(C)C 2230a_100138425928_100000210326 [2,0,0,0,0,0|2,0,0]=4 1829 B8R0.7 CCCCCNC(C)C 34a_100138425928_100000718602 [2,0,0,0,0,0|2,0,0]=4 1830 B8R0.7 CCCCCOC(C)C 34a_100000210253_100000210206 [2,0,0,0,0,0|2,0,0]=4 1831 B8R0.7 CCCCCOC(C)C 34a_100000212225_100000718602 [2,0,0,0,0,0|2,0,0]=4 1832 B8R0.7 CCCCCOC(C)C 7a_100000210253_100000210206 [2,0,0,0,0,0|2,0,0]=4 1833 B8R0.7 CCCCCSC(C)C 62a_100000210206_100000210326 [2,0,0,0,0,0|2,0,0]=4 1834 B8R0.7 CCCCCSC(C)C 62a_100000210326_100000210206 [2,0,0,0,0,0|2,0,0]=4 1835 B8R0.7 CCCCNCC(C)C 2230a_100000102301_100000210760 [2,0,0,0,0,0|2,0,0]=4 1836 B8R0.7 CCCCNCC(C)C 2230a_100000210953_100000210211 [2,0,0,0,0,0|2,0,0]=4 1837 B8R0.7 CCCCNCC(C)C 270004a_100000102301_100000210432 [2,0,0,0,0,0|2,0,0]=4 1838 B8R0.7 CCCCNCC(C)C 34a_100000210953_100000210210 [2,0,0,0,0,0|2,0,0]=4 1839 B8R0.7 CCCCNCC(C)C 7a_106832991798_100000210760 [2,0,0,0,0,0|2,0,0]=4 1840 B8R0.7 CCCCNCC(C)O 2230a_100000102301_100011218427 [2,0,0,0,0,0|1,0,0]=3 1841 B8R0.7 CCCCNCC(C)O 2230a_100000210904_100000210211 [2,0,0,0,0,0|1,0,0]=3 1842 B8R0.7 CCCCNCC(C)O 34a_100000210904_100000210210 [2,0,0,0,0,0|1,0,0]=3 1843 B8R0.7 CCCCNCC(C)O 7a_106832991798_100011218427 [2,0,0,0,0,0|1,0,0]=3 1844 B8R0.7 CCCCNC[C@@H](C)O 2230a_100000102301_100009817552 [2,0,0,0,0,0|1,0,0]=3 1845 B8R0.7 CCCCNC[C@@H](C)O 7a_106832991798_100009817552 [2,0,0,0,0,0|1,0,0]=3 1846 B8R0.7 CCCCOCC(=O)C 1458a_100000070787_100011995733 [2,0,0,0,0,0|0,0,2]=4 1847 B8R0.7 CCCCOCC(=O)C 1458a_100000757543_200000210301 [2,0,0,0,0,0|0,0,2]=4 1848 B8R0.7 CCCCOCC(=O)C 34a_100000211253_100000210210 [2,0,0,0,0,0|0,0,2]=4 1849 B8R0.7 CCCCOCC(=O)[13CH3] 1458a_100000757543_200025704644 [2,0,0,0,0,0|0,0,2]=4 1850 B8R0.7 CCCCOCC(C)Br 34a_100012180447_100000210210 [2,0,0,0,0,0|1,0,0]=3 1851 B8R0.7 CCCCOCC(C)C 34a_100000210227_100000210624 [2,0,0,0,0,0|1,0,0]=3 1852 B8R0.7 CCCCOCC(C)C 34a_100000210257_100000210210 [2,0,0,0,0,0|1,0,0]=3 1853 B8R0.7 CCCCOCC(C)C 7a_100000210227_100000210760 [2,0,0,0,0,0|1,0,0]=3 1854 B8R0.7 CCCCOCC(C)F 34a_100015925927_100000210210 [2,0,0,0,0,0|1,0,0]=3 1855 B8R0.7 CCCCOCC(C)O 34a_100000210227_100011218427 [2,0,0,0,0,0|0,0,0]=2 1856 B8R0.7 CCCCOCC(C)O 7a_100000210227_100011218427 [2,0,0,0,0,0|0,0,0]=2 1857 B8R0.7 CCCCOCC(F)F 34a_100000210227_100011934356 [2,0,0,0,0,0|2,0,0]=4 1858 B8R0.7 CCCCOCC(F)F 34a_100000743014_100000210210 [2,0,0,0,0,0|2,0,0]=4 1859 B8R0.7 CCCCOCC(F)F 7a_100000210227_100011934356 [2,0,0,0,0,0|2,0,0]=4 1860 B8R0.7 CCCCOCN(C)C 2230a_100102631434_100011995733 [2,0,0,0,0,0|2,0,0]=4 1861 B8R0.7 CCCCOCN(C)C 269982a_100102631434_100011995733 [2,0,0,0,0,0|2,0,0]=4 1862 B8R0.7 CCCCOC[C@@H](C)Cl 34a_100016084084_100000210210 [2,0,0,0,0,0|1,0,0]=3 1863 B8R0.7 CCCCOC[C@@H](C)N 34a_100000737577_100000210210 [2,0,0,0,0,0|1,0,0]=3 1864 B8R0.7 CCCCOC[C@@H](C)O 34a_100000210227_100009817552 [2,0,0,0,0,0|0,0,0]=2 1865 B8R0.7 CCCCOC[C@@H](C)O 7a_100000210227_100009817552 [2,0,0,0,0,0|0,0,0]=2 1866 B8R0.7 CCCCSCC(C)C 62a_100000210211_100000210760 [2,0,0,0,0,0|1,1,0]=4 1867 B8R0.7 CCCCSCC(C)C 62a_100000210624_100000210210 [2,0,0,0,0,0|1,1,0]=4 1868 B8R0.7 CCCCSCC(C)O 62a_100000210211_100011218427 [2,0,0,0,0,0|0,1,0]=3 1869 B8R0.7 CCCCSCC(C)O 62a_100011218427_100000210210 [2,0,0,0,0,0|0,1,0]=3 1870 B8R0.7 CCCCSC[C@@H](C)O 62a_100000210211_100009817552 [2,0,0,0,0,0|0,1,0]=3 1871 B8R0.7 CCCCSC[C@@H](C)O 62a_100009817552_100000210210 [2,0,0,0,0,0|0,1,0]=3 1872 B8R0.7 CCCNCCC(C)C 269862a_100020643023_100000185833 [2,0,0,0,0,0|2,0,0]=4 1873 B8R0.7 CCCNCCC(C)O 2230a_200000755665_100000210303 [2,0,0,0,0,0|1,0,0]=3 1874 B8R0.7 CCCOCCC(=O)C 1458a_100000070787_100011215938 [2,0,0,0,0,0|0,0,2]=4 1875 B8R0.7 CCCOCCC(=O)C 34a_100000759926_100000210303 [2,0,0,0,0,0|0,0,2]=4 1876 B8R0.7 CCCOCCC(=O)C 7a_100000759926_100000210303 [2,0,0,0,0,0|0,0,2]=4 1877 B8R0.7 CCCOCCC(C)Br 34a_100009893172_100000210303 [2,0,0,0,0,0|1,0,0]=3 1878 B8R0.7 CCCOCCC(C)C 34a_100000210254_100000210303 [2,0,0,0,0,0|1,0,0]=3 1879 B8R0.7 CCCOCCC(C)C 34a_100000210258_100000210312 [2,0,0,0,0,0|1,0,0]=3 1880 B8R0.7 CCCOCCC(C)C 7a_100000210254_100000210303 [2,0,0,0,0,0|1,0,0]=3 1881 B8R0.7 CCCOCCC(C)O 34a_100000210258_100012276601 [2,0,0,0,0,0|0,0,0]=2 1882 B8R0.7 CCCOCCC(F)F 34a_100103093639_100000210303 [2,0,0,0,0,0|2,0,0]=4 1883 B8R0.7 CCCOCCN(C)C 2230a_100102631434_100011215938 [2,0,0,0,0,0|2,0,0]=4 1884 B8R0.7 CCCOCCN(C)C 269982a_100102631434_100011215938 [2,0,0,0,0,0|2,0,0]=4 1885 B8R0.7 CCCOCC[C@@H](C)N 34a_100000706166_100000210303 [2,0,0,0,0,0|1,0,0]=3 1886 B8R0.7 CCCOCOC(C)C 34a_100000210258_100000709892 [2,0,0,0,0,0|2,0,0]=4 1887 B8R0.7 CCCSCCC(C)C 62a_100000210303_100000210312 [2,0,0,0,0,0|1,1,0]=4 1888 B8R0.7 CCCSCCC(C)C 62a_100000210312_100000210303 [2,0,0,0,0,0|1,1,0]=4 1889 B8R0.7 CCCSCCC(C)O 62a_100000210303_100012276601 [2,0,0,0,0,0|0,1,0]=3 1890 B8R0.7 CCCSCCC(C)O 62a_100012276601_100000210303 [2,0,0,0,0,0|0,1,0]=3 1891 B8R0.7 CCNCCCC(C)C 2230a_100015525214_100011214892 [2,0,0,0,0,0|2,0,0]=4 1892 B8R0.7 CCNCCCC(C)C 2230a_200000737386_100000210202 [2,0,0,0,0,0|2,0,0]=4 1893 B8R0.7 CCNCCCC(C)C 34a_200000737386_100000210202 [2,0,0,0,0,0|2,0,0]=4 1894 B8R0.7 CCNCCCC(C)O 2230a_100015525214_200000718107 [2,0,0,0,0,0|1,0,0]=3 1895 B8R0.7 CCOCCCC(C)C 34a_100000210774_100000210202 [2,0,0,0,0,0|2,0,0]=4 1896 B8R0.7 CCOCCCC(C)C 34a_100121572206_100011214892 [2,0,0,0,0,0|2,0,0]=4 1897 B8R0.7 CCOCCCC(C)C 7a_100000210774_100000210202 [2,0,0,0,0,0|2,0,0]=4 1898 B8R0.7 CCOCCCC(C)O 34a_100121572206_200000718107 [2,0,0,0,0,0|1,0,0]=3 1899 B8R0.7 CCOCSCC(C)O 62a_100000739092_100011218427 [2,0,0,0,0,0|1,1,0]=4 1900 B8R0.7 CCOCSCC(C)O 62a_100011218427_100000739092 [2,0,0,0,0,0|1,1,0]=4 1901 B8R0.7 CCOCSC[C@@H](C)O 62a_100000739092_100009817552 [2,0,0,0,0,0|1,1,0]=4 1902 B8R0.7 CCOCSC[C@@H](C)O 62a_100009817552_100000739092 [2,0,0,0,0,0|1,1,0]=4 1903 B8R0.7 CCSCCCC(C)C 62a_100000210202_100011214892 [2,0,0,0,0,0|2,0,0]=4 1904 B8R0.7 CCSCCCC(C)C 62a_100011214892_100000210202 [2,0,0,0,0,0|2,0,0]=4 1905 B8R0.7 CCSCCCC(C)O 62a_100000210202_200000718107 [2,0,0,0,0,0|1,0,0]=3 1906 B8R0.7 CCSCCCC(C)O 62a_200000718107_100000210202 [2,0,0,0,0,0|1,0,0]=3 1907 B8R0.7 CN(C)CCCCCO 2230a_100000722520_200000210301 [2,0,0,0,0,0|2,0,0]=4 1908 B8R0.7 CN(C)CCCCCO 2230a_100102631434_100000746330 [2,0,0,0,0,0|2,0,0]=4 1909 B8R0.7 CN(C)CCCCCO 269982a_100000722520_200000210301 [2,0,0,0,0,0|2,0,0]=4 1910 B8R0.7 CN(C)CCCCCO 269982a_100102631434_100000746330 [2,0,0,0,0,0|2,0,0]=4 1911 B8R0.7 CN(C)CCOCCO 2230a_100000228057_200000210301 [2,0,0,0,0,0|2,0,0]=4 1912 B8R0.7 CN(C)CCOCCO 2230a_100102631434_100011215305 [2,0,0,0,0,0|2,0,0]=4 1913 B8R0.7 CN(C)CCOCCO 269982a_100000228057_200000210301 [2,0,0,0,0,0|2,0,0]=4 1914 B8R0.7 CN(C)CCOCCO 269982a_100102631434_100011215305 [2,0,0,0,0,0|2,0,0]=4 1915 B8R0.7 CN([13CH3])CCCCCO 2230a_100000722520_200025704644 [2,0,0,0,0,0|2,0,0]=4 1916 B8R0.7 CN([13CH3])CCCCCO 269982a_100000722520_200025704644 [2,0,0,0,0,0|2,0,0]=4 1917 B8R0.7 CN([13CH3])CCOCCO 2230a_100000228057_200025704644 [2,0,0,0,0,0|2,0,0]=4 1918 B8R0.7 CN([13CH3])CCOCCO 269982a_100000228057_200025704644 [2,0,0,0,0,0|2,0,0]=4 1919 B8R0.7 CNCCCCC(C)C 2230a_106832991635_100011216152 [2,0,0,0,0,0|2,0,0]=4 1920 B8R0.7 CNCCCCC(C)C 34a_100102657272_100011216152 [2,0,0,0,0,0|2,0,0]=4 1921 B8R0.7 CNCCCCC(C)C 7a_106832991635_100011216152 [2,0,0,0,0,0|2,0,0]=4 1922 B8R0.7 COCCCCC(C)C 34a_100011214890_200000210301 [2,0,0,0,0,0|2,0,0]=4 1923 B8R0.7 COCCCCC(C)C 34a_100138415774_100011216152 [2,0,0,0,0,0|2,0,0]=4 1924 B8R0.7 COCCCCC(C)C 7a_100011214890_200000210301 [2,0,0,0,0,0|2,0,0]=4 1925 B8R0.7 COCCNCC(C)O 2230a_100000209980_100011218427 [2,0,0,0,0,0|2,0,0]=4 1926 B8R0.7 COCCNCC(C)O 2230a_100000210904_100011201679 [2,0,0,0,0,0|2,0,0]=4 1927 B8R0.7 COCCNCC(C)O 34a_100000210904_100011201679 [2,0,0,0,0,0|2,0,0]=4 1928 B8R0.7 COCCNC[C@@H](C)O 2230a_100000209980_100009817552 [2,0,0,0,0,0|2,0,0]=4 1929 B8R0.7 COCCOCC(C)Br 34a_100012180447_100011201679 [2,0,0,0,0,0|2,0,0]=4 1930 B8R0.7 COCCOCC(C)C 34a_100000210237_100000210624 [2,0,0,0,0,0|2,0,0]=4 1931 B8R0.7 COCCOCC(C)C 34a_100000210257_100011201679 [2,0,0,0,0,0|2,0,0]=4 1932 B8R0.7 COCCOCC(C)C 34a_100000703358_200000210301 [2,0,0,0,0,0|2,0,0]=4 1933 B8R0.7 COCCOCC(C)C 7a_100000703358_200000210301 [2,0,0,0,0,0|2,0,0]=4 1934 B8R0.7 COCCOCC(C)F 34a_100015925927_100011201679 [2,0,0,0,0,0|2,0,0]=4 1935 B8R0.7 COCCOCC(C)O 34a_100000210237_100011218427 [2,0,0,0,0,0|1,0,0]=3 1936 B8R0.7 COCCOC[C@@H](C)Cl 34a_100016084084_100011201679 [2,0,0,0,0,0|2,0,0]=4 1937 B8R0.7 COCCOC[C@@H](C)N 34a_100000737577_100011201679 [2,0,0,0,0,0|2,0,0]=4 1938 B8R0.7 COCCOC[C@@H](C)O 34a_100000210237_100009817552 [2,0,0,0,0,0|1,0,0]=3 1939 B8R0.7 COCCSCC(C)O 62a_100000233755_100011218427 [2,0,0,0,0,0|1,1,0]=4 1940 B8R0.7 COCCSCC(C)O 62a_100011218427_100000233755 [2,0,0,0,0,0|1,1,0]=4 1941 B8R0.7 COCCSC[C@@H](C)O 62a_100000233755_100009817552 [2,0,0,0,0,0|1,1,0]=4 1942 B8R0.7 COCCSC[C@@H](C)O 62a_100009817552_100000233755 [2,0,0,0,0,0|1,1,0]=4 1943 B8R0.7 COCNCCC(C)O 2230a_200000755665_100000766300 [2,0,0,0,0,0|2,0,0]=4 1944 B8R0.7 COCSCCC(C)O 62a_100000766300_100012276601 [2,0,0,0,0,0|1,1,0]=4 1945 B8R0.7 COCSCCC(C)O 62a_100012276601_100000766300 [2,0,0,0,0,0|1,1,0]=4 1946 B8R0.7 CSCCCCC(C)C 62a_100011216152_200000210301 [2,0,0,0,0,0|2,0,0]=4 1947 B8R0.7 CSCCCCC(C)C 62a_200000210301_100011216152 [2,0,0,0,0,0|2,0,0]=4 1948 B8R0.7 CSCCNCC(C)O 2230a_100000210904_100000751147 [2,0,0,0,0,0|2,0,0]=4 1949 B8R0.7 CSCCNCC(C)O 2230a_100020590264_100011218427 [2,0,0,0,0,0|2,0,0]=4 1950 B8R0.7 CSCCNCC(C)O 34a_100000210904_100000212216 [2,0,0,0,0,0|2,0,0]=4 1951 B8R0.7 CSCCNC[C@@H](C)O 2230a_100020590264_100009817552 [2,0,0,0,0,0|2,0,0]=4 1952 B8R0.7 CSCCOCC(C)Br 34a_100012180447_100000212216 [2,0,0,0,0,0|2,0,0]=4 1953 B8R0.7 CSCCOCC(C)C 34a_100000210257_100000212216 [2,0,0,0,0,0|2,0,0]=4 1954 B8R0.7 CSCCOCC(C)C 34a_100000230434_100000210624 [2,0,0,0,0,0|2,0,0]=4 1955 B8R0.7 CSCCOCC(C)C 7a_100000230434_100000210760 [2,0,0,0,0,0|2,0,0]=4 1956 B8R0.7 CSCCOCC(C)F 34a_100015925927_100000212216 [2,0,0,0,0,0|2,0,0]=4 1957 B8R0.7 CSCCOCC(C)O 34a_100000230434_100011218427 [2,0,0,0,0,0|1,0,0]=3 1958 B8R0.7 CSCCOCC(C)O 7a_100000230434_100011218427 [2,0,0,0,0,0|1,0,0]=3 1959 B8R0.7 CSCCOC[C@@H](C)Cl 34a_100016084084_100000212216 [2,0,0,0,0,0|2,0,0]=4 1960 B8R0.7 CSCCOC[C@@H](C)N 34a_100000737577_100000212216 [2,0,0,0,0,0|2,0,0]=4 1961 B8R0.7 CSCCOC[C@@H](C)O 34a_100000230434_100009817552 [2,0,0,0,0,0|1,0,0]=3 1962 B8R0.7 CSCCOC[C@@H](C)O 7a_100000230434_100009817552 [2,0,0,0,0,0|1,0,0]=3 1963 B8R0.7 CSCCSCC(C)O 62a_100000212216_100011218427 [2,0,0,0,0,0|1,1,0]=4 1964 B8R0.7 CSCCSCC(C)O 62a_100011218427_100000751147 [2,0,0,0,0,0|1,1,0]=4 1965 B8R0.7 CSCCSC[C@@H](C)O 62a_100000212216_100009817552 [2,0,0,0,0,0|1,1,0]=4 1966 B8R0.7 CSCCSC[C@@H](C)O 62a_100009817552_100000751147 [2,0,0,0,0,0|1,1,0]=4 1967 B8R0.7 CSCNCCC(C)O 2230a_200000755665_100011218213 [2,0,0,0,0,0|2,0,0]=4 1968 B8R0.7 CSCOCCC(C)Br 34a_100009893172_100011218213 [2,0,0,0,0,0|2,0,0]=4 1969 B8R0.7 CSCOCCC(C)C 34a_100000210254_100011218213 [2,0,0,0,0,0|2,0,0]=4 1970 B8R0.7 CSCOCC[C@@H](C)N 34a_100000706166_100011218213 [2,0,0,0,0,0|2,0,0]=4 1971 B8R0.7 CSCSCCC(C)O 62a_100011218213_100012276601 [2,0,0,0,0,0|1,1,0]=4 1972 B8R0.7 CSCSCCC(C)O 62a_100012276601_100011218213 [2,0,0,0,0,0|1,1,0]=4 1973 B8R0.7 C[C@@H](Cl)COCCCF 34a_100016084084_100011934791 [2,0,0,0,0,0|2,0,0]=4 1974 B8R0.7 C[C@@H](Cl)COCCCO 34a_100016084084_100000230001 [2,0,0,0,0,0|1,0,0]=3 1975 B8R0.7 C[C@@H](N)CCOCCF 34a_100000706166_100011217306 [2,0,0,0,0,0|2,0,0]=4 1976 B8R0.7 C[C@@H](N)CCOCCO 34a_100000706166_100000211926 [2,0,0,0,0,0|1,0,0]=3 1977 B8R0.7 C[C@@H](N)COCCCF 34a_100000737577_100011934791 [2,0,0,0,0,0|2,0,0]=4 1978 B8R0.7 C[C@@H](N)COCCCO 34a_100000737577_100000230001 [2,0,0,0,0,0|1,0,0]=3 1979 B8R0.7 C[C@@H](O)CNCCCF 2230a_100015189416_100009817552 [2,0,0,0,0,0|2,0,0]=4 1980 B8R0.7 C[C@@H](O)CNCCCF 34a_100015189416_100009817552 [2,0,0,0,0,0|2,0,0]=4 1981 B8R0.7 C[C@@H](O)COCCCBr 34a_100011217188_100009817552 [2,0,0,0,0,0|1,0,0]=3 1982 B8R0.7 C[C@@H](O)COCCCCl 34a_100000230001_100009817552 [2,0,0,0,0,0|1,0,0]=3 1983 B8R0.7 C[C@@H](O)COCCCF 34a_100000759539_100009817552 [2,0,0,0,0,0|1,0,0]=3 1984 B8R0.7 C[C@@H](O)COCCCN 34a_100000182051_100009817552 [2,0,0,0,0,0|1,0,0]=3 1985 B8R0.7 C[C@@H](O)COCCON 34a_100000700252_100009817552 [2,0,0,0,0,0|2,0,0]=4 1986 B8R0.7 C[C@@H](O)CSCCCF 62a_100009817552_100011934791 [2,0,0,0,0,0|1,1,0]=4 1987 B8R0.7 C[C@@H](O)CSCCCF 62a_100011934791_100009817552 [2,0,0,0,0,0|1,1,0]=4 1988 B8R0.7 C[C@@H](O)CSCCCO 62a_100009817552_100011215043 [2,0,0,0,0,0|0,1,0]=3 1989 B8R0.7 C[C@@H](O)CSCCCO 62a_100011215043_100009817552 [2,0,0,0,0,0|0,1,0]=3 1990 B8R0.7 OCCCOCC(F)F 34a_100000743014_100000230001 [2,0,0,0,0,0|2,0,0]=4 1991 B8R0.7 OCCOCCC(F)F 34a_100103093639_100000211926 [2,0,0,0,0,0|2,0,0]=4 1992 B8R0.7 [13CH3]C(=O)CCCCCO 1458a_100102619762_200025704644 [2,0,0,0,0,0|0,0,2]=4 1993 B8R0.7 [13CH3]C(=O)CCOCCO 1458a_100011229844_200025704644 [2,0,0,0,0,0|0,0,2]=4 1994 B10R0.3 C#CCC(C)OCCC(C)O 34a_100000685586_100012276601 [1,1,0,0,0,0|0,0,2]=4 1995 B10R0.3 C#CCC(C)OCCC(C)O 7a_100000685586_100012276601 [1,1,0,0,0,0|0,0,2]=4 1996 B10R0.3 C/C=C/C(C)OCCC(C)O 34a_200102604097_100012276601 [1,1,0,0,0,0|0,0,2]=4 1997 B10R0.3 C=C(C)CCOC(C)CCC 34a_100000764384_100000730704 [1,1,0,0,0,0|1,0,1]=4 1998 B10R0.3 C=C(C)CCOC(C)CCC 34a_100000764851_100000766640 [1,1,0,0,0,0|1,0,1]=4 1999 B10R0.3 C=C(C)CCOC(C)CCC 7a_100000764384_100000730704 [1,1,0,0,0,0|1,0,1]=4 2000 B10R0.3 C=C(C)CCOC(C)CCO 34a_100000764851_100009893172 [1,1,0,0,0,0|1,0,1]=4 2001 B10R0.3 C=CC[C@@H](C)OCCC(C)O 34a_100000731007_100012276601 [1,1,0,0,0,0|0,0,2]=4 2002 B10R0.3 C=CC[C@@H](C)OCCC(C)O 7a_100000731007_100012276601 [1,1,0,0,0,0|0,0,2]=4 2003 B10R0.3 CC#CC(C)OCCC(C)O 34a_100011216543_100012276601 [1,1,0,0,0,0|0,0,2]=4 2004 B10R0.3 CC(=O)CCOC(C)CCO 34a_100000759926_100009893172 [1,1,0,0,0,0|0,0,2]=4 2005 B10R0.3 CC(=O)CCOC(C)CCO 7a_100000759926_100009893172 [1,1,0,0,0,0|0,0,2]=4 2006 B10R0.3 CC(Br)CCOC(C)CCO 34a_100009893172_100009893172 [1,1,0,0,0,0|1,0,0]=3 2007 B10R0.3 CC(C)CCN[C@H](C)CCO 2230a_100000706166_100000210312 [1,1,0,0,0,0|2,0,0]=4 2008 B10R0.3 CC(C)CCN[C@H](C)CCO 269862a_100000706166_100000185833 [1,1,0,0,0,0|2,0,0]=4 2009 B10R0.3 CC(C)CCN[C@H](C)CCO 34a_100000706166_100000210312 [1,1,0,0,0,0|2,0,0]=4 2010 B10R0.3 CC(C)CCOC(C)CCBr 34a_100012276601_100000210312 [1,1,0,0,0,0|2,0,0]=4 2011 B10R0.3 CC(C)CCOC(C)CCO 34a_100000210254_100009893172 [1,1,0,0,0,0|1,0,0]=3 2012 B10R0.3 CC(C)CCOC(C)CCO 7a_100000210254_100009893172 [1,1,0,0,0,0|1,0,0]=3 2013 B10R0.3 CC(C)CCSC(C)CCO 62a_100000210312_100009893172 [1,1,0,0,0,0|1,1,0]=4 2014 B10R0.3 CC(C)CCSC(C)CCO 62a_100009893172_100000210312 [1,1,0,0,0,0|1,1,0]=4 2015 B10R0.3 CC(CCO)OCCC(F)F 34a_100103093639_100009893172 [1,1,0,0,0,0|2,0,0]=4 2016 B10R0.3 CC(CCO)OCC[C@@H](C)N 34a_100000706166_100009893172 [1,1,0,0,0,0|1,0,0]=3 2017 B10R0.3 CC(O)CCCC(=O)CCO 1458a_100011216618_200000718107 [1,1,0,0,0,0|1,0,1]=4 2018 B10R0.3 CC(O)CCCN(C)CCO 2230a_100000210263_200000718107 [1,1,0,0,0,0|2,0,0]=4 2019 B10R0.3 CC(O)CCCN(C)CCO 269982a_100000210263_200000718107 [1,1,0,0,0,0|2,0,0]=4 2020 B10R0.3 CC(O)CCNC(=O)CCO 240690a_200000755665_100011216618 [1,1,0,0,0,0|1,0,1]=4 2021 B10R0.3 CC(O)CCNC(C)CCO 2230a_200000755665_100009893172 [1,1,0,0,0,0|1,0,0]=3 2022 B10R0.3 CC(O)CCN[C@H](C)CCO 2230a_100000706166_100012276601 [1,1,0,0,0,0|1,0,0]=3 2023 B10R0.3 CC(O)CCN[C@H](C)CCO 34a_100000706166_100012276601 [1,1,0,0,0,0|1,0,0]=3 2024 B10R0.3 CC(O)CCOC(C)CCBr 34a_100012276601_100012276601 [1,1,0,0,0,0|1,0,0]=3 2025 B10R0.3 CC(O)CCSC(C)CCO 62a_100009893172_100012276601 [1,1,0,0,0,0|0,1,0]=3 2026 B10R0.3 CC(O)CCSC(C)CCO 62a_100012276601_100009893172 [1,1,0,0,0,0|0,1,0]=3 2027 B10R0.3 CCCC(=O)CCCC(C)O 1458a_100000211992_200000718107 [1,1,0,0,0,0|1,0,1]=4 2028 B10R0.3 CCCC(=O)NCCC(C)O 240690a_200000755665_100000211992 [1,1,0,0,0,0|1,0,1]=4 2029 B10R0.3 CCCC(=O)NCCC(C)O 527a_200000755665_100000211992 [1,1,0,0,0,0|1,0,1]=4 2030 B10R0.3 CCCC(C)CNCC(C)O 2230a_100000210904_100011216630 [1,1,0,0,0,0|2,0,0]=4 2031 B10R0.3 CCCC(C)CNCC(C)O 270004a_100000210904_100000243154 [1,1,0,0,0,0|2,0,0]=4 2032 B10R0.3 CCCC(C)CNCC(C)O 34a_100000210904_100011216630 [1,1,0,0,0,0|2,0,0]=4 2033 B10R0.3 CCCC(C)COCC(C)O 34a_100000688023_100011218427 [1,1,0,0,0,0|2,0,0]=4 2034 B10R0.3 CCCC(C)COCC(C)O 7a_100000688023_100011218427 [1,1,0,0,0,0|2,0,0]=4 2035 B10R0.3 CCCC(C)COC[C@@H](C)O 34a_100000688023_100009817552 [1,1,0,0,0,0|2,0,0]=4 2036 B10R0.3 CCCC(C)COC[C@@H](C)O 7a_100000688023_100009817552 [1,1,0,0,0,0|2,0,0]=4 2037 B10R0.3 CCCC(C)CSCC(C)O 62a_100011216630_100011218427 [1,1,0,0,0,0|2,0,0]=4 2038 B10R0.3 CCCC(C)CSCC(C)O 62a_100011218427_100011216630 [1,1,0,0,0,0|2,0,0]=4 2039 B10R0.3 CCCC(C)CSC[C@@H](C)O 62a_100009817552_100011216630 [1,1,0,0,0,0|2,0,0]=4 2040 B10R0.3 CCCC(C)CSC[C@@H](C)O 62a_100011216630_100009817552 [1,1,0,0,0,0|2,0,0]=4 2041 B10R0.3 CCCC(C)NCCC(C)C 2230a_100000741246_100000210312 [1,1,0,0,0,0|2,0,0]=4 2042 B10R0.3 CCCC(C)NCCC(C)C 269862a_100000741246_100000185833 [1,1,0,0,0,0|2,0,0]=4 2043 B10R0.3 CCCC(C)NCCC(C)C 270004a_100000210545_100000211909 [1,1,0,0,0,0|2,0,0]=4 2044 B10R0.3 CCCC(C)NCCC(C)O 2230a_100000741246_100012276601 [1,1,0,0,0,0|1,0,0]=3 2045 B10R0.3 CCCC(C)NCCC(C)O 2230a_200000755665_100000766640 [1,1,0,0,0,0|1,0,0]=3 2046 B10R0.3 CCCC(C)NCCC(C)O 270004a_200000755665_100000211909 [1,1,0,0,0,0|1,0,0]=3 2047 B10R0.3 CCCC(C)OCCC(=O)C 34a_100000759926_100000766640 [1,1,0,0,0,0|0,0,2]=4 2048 B10R0.3 CCCC(C)OCCC(=O)C 7a_100000759926_100000766640 [1,1,0,0,0,0|0,0,2]=4 2049 B10R0.3 CCCC(C)OCCC(=O)C 7a_100000764384_100000053229 [1,1,0,0,0,0|0,0,2]=4 2050 B10R0.3 CCCC(C)OCCC(C)Br 34a_100009893172_100000766640 [1,1,0,0,0,0|1,0,0]=3 2051 B10R0.3 CCCC(C)OCCC(C)C 34a_100000210254_100000766640 [1,1,0,0,0,0|1,0,0]=3 2052 B10R0.3 CCCC(C)OCCC(C)C 34a_100000764384_100000210312 [1,1,0,0,0,0|1,0,0]=3 2053 B10R0.3 CCCC(C)OCCC(C)C 7a_100000210254_100000766640 [1,1,0,0,0,0|1,0,0]=3 2054 B10R0.3 CCCC(C)OCCC(C)C 7a_100000764384_100000210626 [1,1,0,0,0,0|1,0,0]=3 2055 B10R0.3 CCCC(C)OCCC(C)O 34a_100000764384_100012276601 [1,1,0,0,0,0|0,0,0]=2 2056 B10R0.3 CCCC(C)OCCC(C)O 7a_100000764384_100012276601 [1,1,0,0,0,0|0,0,0]=2 2057 B10R0.3 CCCC(C)OCCC(F)F 34a_100103093639_100000766640 [1,1,0,0,0,0|2,0,0]=4 2058 B10R0.3 CCCC(C)OCCN(C)C 7a_100000764384_100000755713 [1,1,0,0,0,0|2,0,0]=4 2059 B10R0.3 CCCC(C)OCC[C@@H](C)N 34a_100000706166_100000766640 [1,1,0,0,0,0|1,0,0]=3 2060 B10R0.3 CCCC(C)OCOC(C)C 34a_100000764384_100000709892 [1,1,0,0,0,0|2,0,0]=4 2061 B10R0.3 CCCC(C)SCCC(C)C 62a_100000210312_100000766640 [1,1,0,0,0,0|1,1,0]=4 2062 B10R0.3 CCCC(C)SCCC(C)C 62a_100000766640_100000210312 [1,1,0,0,0,0|1,1,0]=4 2063 B10R0.3 CCCC(C)SCCC(C)O 62a_100000766640_100012276601 [1,1,0,0,0,0|0,1,0]=3 2064 B10R0.3 CCCC(C)SCCC(C)O 62a_100012276601_100000766640 [1,1,0,0,0,0|0,1,0]=3 2065 B10R0.3 CCCN(C)CCCC(C)O 2230a_100000747261_200000718107 [1,1,0,0,0,0|2,0,0]=4 2066 B10R0.3 CCCN(C)CCCC(C)O 269982a_100000747261_200000718107 [1,1,0,0,0,0|2,0,0]=4 2067 B10R0.3 CCC[C@H](N)COCC(C)O 34a_100000732646_100011218427 [1,1,0,0,0,0|2,0,0]=4 2068 B10R0.3 CCC[C@H](N)COC[C@@H](C)O 34a_100000732646_100009817552 [1,1,0,0,0,0|2,0,0]=4 2069 B10R0.3 COCC(C)NCCC(C)O 2230a_200000755665_100000765312 [1,1,0,0,0,0|2,0,0]=4 2070 B10R0.3 COCC(C)NCCC(C)O 270004a_200000755665_100000749346 [1,1,0,0,0,0|2,0,0]=4 2071 B10R0.3 COCC(C)OCCC(C)Br 34a_100009893172_100000765312 [1,1,0,0,0,0|2,0,0]=4 2072 B10R0.3 COCC(C)OCCC(C)C 34a_100000210254_100000765312 [1,1,0,0,0,0|2,0,0]=4 2073 B10R0.3 COCC(C)OCCC(C)C 7a_100000210254_100000765312 [1,1,0,0,0,0|2,0,0]=4 2074 B10R0.3 COCC(C)OCC[C@@H](C)N 34a_100000706166_100000765312 [1,1,0,0,0,0|2,0,0]=4 2075 B10R0.3 COCC(C)SCCC(C)O 62a_100000765312_100012276601 [1,1,0,0,0,0|1,1,0]=4 2076 B10R0.3 COCC(C)SCCC(C)O 62a_100012276601_100000765312 [1,1,0,0,0,0|1,1,0]=4 2077 B10R0.3 COC[C@@H](C)NCCC(C)O 2230a_100000764878_100012276601 [1,1,0,0,0,0|2,0,0]=4 2078 B10R0.3 COC[C@@H](C)OCCC(C)C 34a_100011934205_100000210312 [1,1,0,0,0,0|2,0,0]=4 2079 B10R0.3 COC[C@@H](C)OCCC(C)O 34a_100011934205_100012276601 [1,1,0,0,0,0|1,0,0]=3 2080 B10R0.3 CSCC(C)NCCC(C)O 270004a_200000755665_100011216314 [1,1,0,0,0,0|2,0,0]=4 2081 B10R0.4 C#CCCCNCCC(C)O 2230a_200000755665_100000731252 [1,1,0,0,0,0|1,0,1]=4 2082 B10R0.4 C#CCCCNCCC(C)O 34a_100000718082_100012276601 [1,1,0,0,0,0|1,0,1]=4 2083 B10R0.4 C#CCCCOCCC(C)Br 34a_100009893172_100000695029 [1,1,0,0,0,0|1,0,1]=4 2084 B10R0.4 C#CCCCOCCC(C)C 34a_100000210254_100000695029 [1,1,0,0,0,0|1,0,1]=4 2085 B10R0.4 C#CCCCOCCC(C)C 34a_100000215630_100000210312 [1,1,0,0,0,0|1,0,1]=4 2086 B10R0.4 C#CCCCOCCC(C)C 7a_100000210254_100011215417 [1,1,0,0,0,0|1,0,1]=4 2087 B10R0.4 C#CCCCOCCC(C)C 7a_100000215630_100000210626 [1,1,0,0,0,0|1,0,1]=4 2088 B10R0.4 C#CCCCOCCC(C)O 34a_100000215630_100012276601 [1,1,0,0,0,0|0,0,1]=3 2089 B10R0.4 C#CCCCOCCC(C)O 7a_100000215630_100012276601 [1,1,0,0,0,0|0,0,1]=3 2090 B10R0.4 C#CCCCOCC[C@@H](C)N 34a_100000706166_100000695029 [1,1,0,0,0,0|1,0,1]=4 2091 B10R0.4 C#CCCCSCCC(C)O 62a_100011215417_100012276601 [1,1,0,0,0,0|0,1,1]=4 2092 B10R0.4 C#CCCCSCCC(C)O 62a_100012276601_100011215417 [1,1,0,0,0,0|0,1,1]=4 2093 B10R0.4 C#CCCOCCCC(C)O 34a_100011215631_200000718107 [1,1,0,0,0,0|0,0,2]=4 2094 B10R0.4 C/C=C/CCOCCC(C)C 34a_100016278192_100000210312 [1,1,0,0,0,0|1,0,1]=4 2095 B10R0.4 C/C=C/CCOCCC(C)O 34a_100016278192_100012276601 [1,1,0,0,0,0|0,0,1]=3 2096 B10R0.4 C/C=C/COCCCC(C)O 34a_100016270725_200000718107 [1,1,0,0,0,0|0,0,2]=4 2097 B10R0.4 C=C(C)CCOCCCCBr 34a_100011216708_100000730704 [1,1,0,0,0,0|1,0,1]=4 2098 B10R0.4 C=C(C)CCOCCCCC 34a_100000210253_100000730704 [1,1,0,0,0,0|1,0,1]=4 2099 B10R0.4 C=C(C)CCOCCCCC 34a_100000764851_100000718602 [1,1,0,0,0,0|1,0,1]=4 2100 B10R0.4 C=C(C)CCOCCCCC 7a_100000210253_100000730704 [1,1,0,0,0,0|1,0,1]=4 2101 B10R0.4 C=C(C)CCOCCCCCl 34a_100000210776_100000730704 [1,1,0,0,0,0|1,0,1]=4 2102 B10R0.4 C=C(C)CCOCCCCCl 7a_100000210776_100000730704 [1,1,0,0,0,0|1,0,1]=4 2103 B10R0.4 C=C(C)CCOCCCCF 34a_100000764851_100000729493 [1,1,0,0,0,0|1,0,1]=4 2104 B10R0.4 C=C(C)CCOCCCCF 34a_100011995726_100000730704 [1,1,0,0,0,0|1,0,1]=4 2105 B10R0.4 C=C(C)CCOCCCCF 7a_100011995726_100000730704 [1,1,0,0,0,0|1,0,1]=4 2106 B10R0.4 C=C(C)CCOCCCCI 34a_200012148704_100000730704 [1,1,0,0,0,0|1,0,1]=4 2107 B10R0.4 C=C(C)CCOCCCCN 34a_100000750430_100000730704 [1,1,0,0,0,0|1,0,1]=4 2108 B10R0.4 C=C(C)CCOCCCCO 34a_100000764851_100011216708 [1,1,0,0,0,0|1,0,1]=4 2109 B10R0.4 C=C(C)CCOCCCNC 34a_100000213112_100000730704 [1,1,0,0,0,0|1,0,1]=4 2110 B10R0.4 C=C(C)CCOCCCOC 34a_100000740835_100000730704 [1,1,0,0,0,0|1,0,1]=4 2111 B10R0.4 C=C(C)CCOCCCOC 34a_100000764851_100000740836 [1,1,0,0,0,0|1,0,1]=4 2112 B10R0.4 C=C(C)CCOCCCSC 34a_100000690336_100000730704 [1,1,0,0,0,0|1,0,1]=4 2113 B10R0.4 C=C(C)CCOCCCSC 7a_100000690336_100000730704 [1,1,0,0,0,0|1,0,1]=4 2114 B10R0.4 C=C(C)CCOCCOCC 34a_100000210136_100000730704 [1,1,0,0,0,0|1,0,1]=4 2115 B10R0.4 C=C(C)CCOCCOCC 34a_100000764851_100000210147 [1,1,0,0,0,0|1,0,1]=4 2116 B10R0.4 C=C(C)CCOCCOCC 7a_100000210136_100000730704 [1,1,0,0,0,0|1,0,1]=4 2117 B10R0.4 C=C(C)CCOCCSCC 34a_100000212035_100000730704 [1,1,0,0,0,0|1,0,1]=4 2118 B10R0.4 C=C(C)CCOCCSCC 34a_100000764851_100000757381 [1,1,0,0,0,0|1,0,1]=4 2119 B10R0.4 C=C(C)CCOCCSCC 7a_100000212035_100000730704 [1,1,0,0,0,0|1,0,1]=4 2120 B10R0.4 C=C(C)COCOCCCC 34a_100000210245_100011995733 [1,1,0,0,0,0|1,0,1]=4 2121 B10R0.4 C=C(C)CSCOCCCC 62a_100000748629_100011995733 [1,1,0,0,0,0|1,0,1]=4 2122 B10R0.4 C=C(C)CSCOCCCC 62a_100011995733_100000211660 [1,1,0,0,0,0|1,0,1]=4 2123 B10R0.4 C=CCCCNCCC(C)O 2230a_100000700776_100012276601 [1,1,0,0,0,0|1,0,1]=4 2124 B10R0.4 C=CCCCNCCC(C)O 2230a_200000755665_100011713584 [1,1,0,0,0,0|1,0,1]=4 2125 B10R0.4 C=CCCCNCCC(C)O 34a_100000700776_100012276601 [1,1,0,0,0,0|1,0,1]=4 2126 B10R0.4 C=CCCCOCCC(C)Br 34a_100009893172_100000757094 [1,1,0,0,0,0|1,0,1]=4 2127 B10R0.4 C=CCCCOCCC(C)C 34a_100000210254_100000757094 [1,1,0,0,0,0|1,0,1]=4 2128 B10R0.4 C=CCCCOCCC(C)C 34a_100000758997_100000210312 [1,1,0,0,0,0|1,0,1]=4 2129 B10R0.4 C=CCCCOCCC(C)C 7a_100000210254_100000757094 [1,1,0,0,0,0|1,0,1]=4 2130 B10R0.4 C=CCCCOCCC(C)C 7a_100000758997_100000210626 [1,1,0,0,0,0|1,0,1]=4 2131 B10R0.4 C=CCCCOCCC(C)O 34a_100000758997_100012276601 [1,1,0,0,0,0|0,0,1]=3 2132 B10R0.4 C=CCCCOCCC(C)O 7a_100000758997_100012276601 [1,1,0,0,0,0|0,0,1]=3 2133 B10R0.4 C=CCCCOCC[C@@H](C)N 34a_100000706166_100000757094 [1,1,0,0,0,0|1,0,1]=4 2134 B10R0.4 C=CCCCSCCC(C)O 62a_100011713584_100012276601 [1,1,0,0,0,0|0,1,1]=4 2135 B10R0.4 C=CCCCSCCC(C)O 62a_100012276601_100000757094 [1,1,0,0,0,0|0,1,1]=4 2136 B10R0.4 C=CCCOCCCC(C)O 34a_100011205117_200000718107 [1,1,0,0,0,0|0,0,2]=4 2137 B10R0.4 C=COCCOCCC(C)O 34a_100000033082_100012276601 [1,1,0,0,0,0|0,0,2]=4 2138 B10R0.4 CC#CCCOCCC(C)C 34a_100000750427_100000210312 [1,1,0,0,0,0|1,0,1]=4 2139 B10R0.4 CC#CCCOCCC(C)O 34a_100000750427_100012276601 [1,1,0,0,0,0|0,0,1]=3 2140 B10R0.4 CC#CCOCCCC(C)O 34a_100000761923_200000718107 [1,1,0,0,0,0|0,0,2]=4 2141 B10R0.4 CC(=O)CCCOCCCO 34a_100000759063_100000230001 [1,1,0,0,0,0|0,0,2]=4 2142 B10R0.4 CC(=O)CCCOCCCO 7a_100000759063_100011215043 [1,1,0,0,0,0|0,0,2]=4 2143 B10R0.4 CC(=O)CCOCCCCCl 7a_100000210776_100000053229 [1,1,0,0,0,0|0,0,2]=4 2144 B10R0.4 CC(=O)CCOCCCCF 34a_100000759926_100000729493 [1,1,0,0,0,0|0,0,2]=4 2145 B10R0.4 CC(=O)CCOCCCCF 7a_100000759926_100000729493 [1,1,0,0,0,0|0,0,2]=4 2146 B10R0.4 CC(=O)CCOCCCCF 7a_100011995726_100000053229 [1,1,0,0,0,0|0,0,2]=4 2147 B10R0.4 CC(=O)CCOCCCCO 34a_100000759926_100011216708 [1,1,0,0,0,0|0,0,2]=4 2148 B10R0.4 CC(=O)CCOCCCCO 7a_100000759926_100000210776 [1,1,0,0,0,0|0,0,2]=4 2149 B10R0.4 CC(=O)NCCOCCCO 34a_100000158858_100000230001 [1,1,0,0,0,0|0,0,2]=4 2150 B10R0.4 CC(Br)CCOCC#CCO 34a_100009893172_200000047223 [1,1,0,0,0,0|1,0,1]=4 2151 B10R0.4 CC(Br)CCOCCCCF 34a_100009893172_100000729493 [1,1,0,0,0,0|1,0,0]=3 2152 B10R0.4 CC(Br)CCOCCCCO 34a_100009893172_100011216708 [1,1,0,0,0,0|1,0,0]=3 2153 B10R0.4 CC(Br)COCCCCCO 34a_100012180447_100000746330 [1,1,0,0,0,0|2,0,0]=4 2154 B10R0.4 CC(C)CCCCCCN[13CH3] 2230a_100000211014_200025704644 [1,1,0,0,0,0|2,0,0]=4 2155 B10R0.4 CC(C)CCCCCCN[13CH3] 34a_100000211014_200025704644 [1,1,0,0,0,0|2,0,0]=4 2156 B10R0.4 CC(C)CCCCNCCO 2230a_100016997473_100011216152 [1,1,0,0,0,0|2,0,0]=4 2157 B10R0.4 CC(C)CCCCNCCO 34a_100016990907_100011216152 [1,1,0,0,0,0|2,0,0]=4 2158 B10R0.4 CC(C)CCCCOCCO 34a_100011214890_100000211926 [1,1,0,0,0,0|2,0,0]=4 2159 B10R0.4 CC(C)CCCCOCCO 7a_100011214890_100000211926 [1,1,0,0,0,0|2,0,0]=4 2160 B10R0.4 CC(C)CCCCSCCO 62a_100000211926_100011216152 [1,1,0,0,0,0|2,0,0]=4 2161 B10R0.4 CC(C)CCCCSCCO 62a_100011216152_100000211926 [1,1,0,0,0,0|2,0,0]=4 2162 B10R0.4 CC(C)CCCNCCCO 2230a_200000737386_100000230001 [1,1,0,0,0,0|2,0,0]=4 2163 B10R0.4 CC(C)CCCNCCCO 34a_200000737386_100000230001 [1,1,0,0,0,0|2,0,0]=4 2164 B10R0.4 CC(C)CCCOCCCBr 34a_100011217188_100011214892 [1,1,0,0,0,0|2,0,0]=4 2165 B10R0.4 CC(C)CCCOCCCCl 34a_100000230001_100011214892 [1,1,0,0,0,0|2,0,0]=4 2166 B10R0.4 CC(C)CCCOCCCF 34a_100000210774_100011934791 [1,1,0,0,0,0|2,0,0]=4 2167 B10R0.4 CC(C)CCCOCCCF 34a_100000759539_100011214892 [1,1,0,0,0,0|2,0,0]=4 2168 B10R0.4 CC(C)CCCOCCCF 7a_100000210774_100011934791 [1,1,0,0,0,0|2,0,0]=4 2169 B10R0.4 CC(C)CCCOCCCN 34a_100000182051_100011214892 [1,1,0,0,0,0|2,0,0]=4 2170 B10R0.4 CC(C)CCCOCCCO 34a_100000210774_100000230001 [1,1,0,0,0,0|1,0,0]=3 2171 B10R0.4 CC(C)CCCOCCCO 7a_100000210774_100011215043 [1,1,0,0,0,0|1,0,0]=3 2172 B10R0.4 CC(C)CCCSCCCO 62a_100011214892_100011215043 [1,1,0,0,0,0|1,1,0]=4 2173 B10R0.4 CC(C)CCCSCCCO 62a_100011215043_100011214892 [1,1,0,0,0,0|1,1,0]=4 2174 B10R0.4 CC(C)CCNCCCCO 2230a_100000750430_100000210312 [1,1,0,0,0,0|2,0,0]=4 2175 B10R0.4 CC(C)CCNCCCCO 269862a_100000750430_100000185833 [1,1,0,0,0,0|2,0,0]=4 2176 B10R0.4 CC(C)CCNCCCCO 34a_100000750430_100000210312 [1,1,0,0,0,0|2,0,0]=4 2177 B10R0.4 CC(C)CCOCC#CCO 34a_100000210254_200000047223 [1,1,0,0,0,0|1,0,1]=4 2178 B10R0.4 CC(C)CCOCC#CCO 7a_100000210254_200000047223 [1,1,0,0,0,0|1,0,1]=4 2179 B10R0.4 CC(C)CCOCCCC#N 7a_100000210254_100000687738 [1,1,0,0,0,0|1,0,1]=4 2180 B10R0.4 CC(C)CCOCCCC=O 7a_100000210254_200011292268 [1,1,0,0,0,0|1,0,1]=4 2181 B10R0.4 CC(C)CCOCCCCBr 34a_100011216708_100000210312 [1,1,0,0,0,0|1,0,0]=3 2182 B10R0.4 CC(C)CCOCCCCCl 34a_100000210776_100000210312 [1,1,0,0,0,0|1,0,0]=3 2183 B10R0.4 CC(C)CCOCCCCCl 7a_100000210776_100000210626 [1,1,0,0,0,0|1,0,0]=3 2184 B10R0.4 CC(C)CCOCCCCF 34a_100000210254_100000729493 [1,1,0,0,0,0|1,0,0]=3 2185 B10R0.4 CC(C)CCOCCCCF 34a_100011995726_100000210312 [1,1,0,0,0,0|1,0,0]=3 2186 B10R0.4 CC(C)CCOCCCCF 7a_100000210254_100000729493 [1,1,0,0,0,0|1,0,0]=3 2187 B10R0.4 CC(C)CCOCCCCF 7a_100011995726_100000210626 [1,1,0,0,0,0|1,0,0]=3 2188 B10R0.4 CC(C)CCOCCCCI 34a_200012148704_100000210312 [1,1,0,0,0,0|1,0,0]=3 2189 B10R0.4 CC(C)CCOCCCCN 34a_100000750430_100000210312 [1,1,0,0,0,0|1,0,0]=3 2190 B10R0.4 CC(C)CCOCCCCO 34a_100000210254_100011216708 [1,1,0,0,0,0|1,0,0]=3 2191 B10R0.4 CC(C)CCOCCCCO 7a_100000210254_100000210776 [1,1,0,0,0,0|1,0,0]=3 2192 B10R0.4 CC(C)CCSCCCCF 62a_100000210312_100000729493 [1,1,0,0,0,0|1,1,0]=4 2193 B10R0.4 CC(C)CCSCCCCF 62a_100000729493_100000210312 [1,1,0,0,0,0|1,1,0]=4 2194 B10R0.4 CC(C)CCSCCCCO 62a_100000210312_100000210776 [1,1,0,0,0,0|1,1,0]=4 2195 B10R0.4 CC(C)CCSCCCCO 62a_100000210776_100000210312 [1,1,0,0,0,0|1,1,0]=4 2196 B10R0.4 CC(C)CNCCCCCO 2230a_100000210953_100000746330 [1,1,0,0,0,0|2,0,0]=4 2197 B10R0.4 CC(C)CNCCCCCO 2230a_100000762737_100000210760 [1,1,0,0,0,0|2,0,0]=4 2198 B10R0.4 CC(C)CNCCCCCO 270004a_100000762737_100000210432 [1,1,0,0,0,0|2,0,0]=4 2199 B10R0.4 CC(C)CNCCCCCO 34a_100000210953_100000746330 [1,1,0,0,0,0|2,0,0]=4 2200 B10R0.4 CC(C)CNCCCCCO 34a_100000762737_100000210624 [1,1,0,0,0,0|2,0,0]=4 2201 B10R0.4 CC(C)COCCCCCO 34a_100000210257_100000746330 [1,1,0,0,0,0|2,0,0]=4 2202 B10R0.4 CC(C)CSCCCCCO 62a_100000210624_100000746330 [1,1,0,0,0,0|2,0,0]=4 2203 B10R0.4 CC(C)CSCCCCCO 62a_100000746330_100000210760 [1,1,0,0,0,0|2,0,0]=4 2204 B10R0.4 CC(C)NCCCCCCO 2230a_100000686447_100000210206 [1,1,0,0,0,0|2,0,0]=4 2205 B10R0.4 CC(C)NCCCCCCO 2230a_100138425928_100000766143 [1,1,0,0,0,0|2,0,0]=4 2206 B10R0.4 CC(C)NCCCCCCO 34a_100000686447_100000210206 [1,1,0,0,0,0|2,0,0]=4 2207 B10R0.4 CC(C)NCCCCCCO 34a_100138425928_100000766143 [1,1,0,0,0,0|2,0,0]=4 2208 B10R0.4 CC(C)NCCOCCCF 34a_100000224655_100011934791 [1,1,0,0,0,0|2,0,0]=4 2209 B10R0.4 CC(C)NCCOCCCO 34a_100000224655_100000230001 [1,1,0,0,0,0|1,0,0]=3 2210 B10R0.4 CC(C)OCCCCCCO 34a_100000212225_100000766143 [1,1,0,0,0,0|2,0,0]=4 2211 B10R0.4 CC(C)OCCNCCCO 2230a_100000701111_100000230001 [1,1,0,0,0,0|2,0,0]=4 2212 B10R0.4 CC(C)OCCNCCCO 34a_100000701111_100000230001 [1,1,0,0,0,0|2,0,0]=4 2213 B10R0.4 CC(C)OCCOCCCBr 34a_100011217188_100000211751 [1,1,0,0,0,0|2,0,0]=4 2214 B10R0.4 CC(C)OCCOCCCCl 34a_100000230001_100000211751 [1,1,0,0,0,0|2,0,0]=4 2215 B10R0.4 CC(C)OCCOCCCF 34a_100000211219_100011934791 [1,1,0,0,0,0|2,0,0]=4 2216 B10R0.4 CC(C)OCCOCCCF 34a_100000759539_100000211751 [1,1,0,0,0,0|2,0,0]=4 2217 B10R0.4 CC(C)OCCOCCCF 7a_100000211219_100011934791 [1,1,0,0,0,0|2,0,0]=4 2218 B10R0.4 CC(C)OCCOCCCN 34a_100000182051_100000211751 [1,1,0,0,0,0|2,0,0]=4 2219 B10R0.4 CC(C)OCCOCCCO 34a_100000211219_100000230001 [1,1,0,0,0,0|1,0,0]=3 2220 B10R0.4 CC(C)OCCOCCCO 7a_100000211219_100011215043 [1,1,0,0,0,0|1,0,0]=3 2221 B10R0.4 CC(C)OCCSCCCO 62a_100000211751_100011215043 [1,1,0,0,0,0|1,1,0]=4 2222 B10R0.4 CC(C)OCCSCCCO 62a_100011215043_100000211751 [1,1,0,0,0,0|1,1,0]=4 2223 B10R0.4 CC(C)OCOCCCCBr 34a_100011216708_100000709892 [1,1,0,0,0,0|2,0,0]=4 2224 B10R0.4 CC(C)OCOCCCCCl 34a_100000210776_100000709892 [1,1,0,0,0,0|2,0,0]=4 2225 B10R0.4 CC(C)OCOCCCCF 34a_100011995726_100000709892 [1,1,0,0,0,0|2,0,0]=4 2226 B10R0.4 CC(C)OCOCCCCI 34a_200012148704_100000709892 [1,1,0,0,0,0|2,0,0]=4 2227 B10R0.4 CC(C)OCOCCCCN 34a_100000750430_100000709892 [1,1,0,0,0,0|2,0,0]=4 2228 B10R0.4 CC(C)SCCCCCCO 62a_100000210206_100000766143 [1,1,0,0,0,0|2,0,0]=4 2229 B10R0.4 CC(C)SCCCCCCO 62a_100000766143_100000210206 [1,1,0,0,0,0|2,0,0]=4 2230 B10R0.4 CC(C)SCCNCCCO 2230a_100000731138_100000230001 [1,1,0,0,0,0|2,0,0]=4 2231 B10R0.4 CC(C)SCCNCCCO 34a_100000731138_100000230001 [1,1,0,0,0,0|2,0,0]=4 2232 B10R0.4 CC(C)SCCOCCCBr 34a_100011217188_100000730970 [1,1,0,0,0,0|2,0,0]=4 2233 B10R0.4 CC(C)SCCOCCCCl 34a_100000230001_100000730970 [1,1,0,0,0,0|2,0,0]=4 2234 B10R0.4 CC(C)SCCOCCCF 34a_100000759539_100000730970 [1,1,0,0,0,0|2,0,0]=4 2235 B10R0.4 CC(C)SCCOCCCF 34a_200011212901_100011934791 [1,1,0,0,0,0|2,0,0]=4 2236 B10R0.4 CC(C)SCCOCCCF 7a_200011212901_100011934791 [1,1,0,0,0,0|2,0,0]=4 2237 B10R0.4 CC(C)SCCOCCCN 34a_100000182051_100000730970 [1,1,0,0,0,0|2,0,0]=4 2238 B10R0.4 CC(C)SCCOCCCO 34a_200011212901_100000230001 [1,1,0,0,0,0|1,0,0]=3 2239 B10R0.4 CC(C)SCCOCCCO 7a_200011212901_100011215043 [1,1,0,0,0,0|1,0,0]=3 2240 B10R0.4 CC(C)SCCSCCCO 62a_100000730970_100011215043 [1,1,0,0,0,0|1,1,0]=4 2241 B10R0.4 CC(C)SCCSCCCO 62a_100011215043_100000730970 [1,1,0,0,0,0|1,1,0]=4 2242 B10R0.4 CC(F)COCCCCCO 34a_100015925927_100000746330 [1,1,0,0,0,0|2,0,0]=4 2243 B10R0.4 CC(O)CCCNCCCF 2230a_100015189416_200000718107 [1,1,0,0,0,0|2,0,0]=4 2244 B10R0.4 CC(O)CCCNCCCF 34a_100015189416_200000718107 [1,1,0,0,0,0|2,0,0]=4 2245 B10R0.4 CC(O)CCCOCCCBr 34a_100011217188_200000718107 [1,1,0,0,0,0|1,0,0]=3 2246 B10R0.4 CC(O)CCCOCCCCl 34a_100000230001_200000718107 [1,1,0,0,0,0|1,0,0]=3 2247 B10R0.4 CC(O)CCCOCCCF 34a_100000759539_200000718107 [1,1,0,0,0,0|1,0,0]=3 2248 B10R0.4 CC(O)CCCOCCCN 34a_100000182051_200000718107 [1,1,0,0,0,0|1,0,0]=3 2249 B10R0.4 CC(O)CCCOCCON 34a_100000700252_200000718107 [1,1,0,0,0,0|2,0,0]=4 2250 B10R0.4 CC(O)CCCSCCCF 62a_100011934791_200000718107 [1,1,0,0,0,0|1,1,0]=4 2251 B10R0.4 CC(O)CCCSCCCF 62a_200000718107_100011934791 [1,1,0,0,0,0|1,1,0]=4 2252 B10R0.4 CC(O)CCCSCCCO 62a_100011215043_200000718107 [1,1,0,0,0,0|0,1,0]=3 2253 B10R0.4 CC(O)CCCSCCCO 62a_200000718107_100011215043 [1,1,0,0,0,0|0,1,0]=3 2254 B10R0.4 CC(O)CCNCC#CCO 2230a_200000755665_200000047223 [1,1,0,0,0,0|1,0,1]=4 2255 B10R0.4 CC(O)CCNCCCC#N 2230a_200000755665_100000687738 [1,1,0,0,0,0|1,0,1]=4 2256 B10R0.4 CC(O)CCNCCCC=O 2230a_200000755665_200011292268 [1,1,0,0,0,0|1,0,1]=4 2257 B10R0.4 CC(O)CCNCCCCF 2230a_200000755665_100000729493 [1,1,0,0,0,0|1,0,0]=3 2258 B10R0.4 CC(O)CCNCCCCO 2230a_100000750430_100012276601 [1,1,0,0,0,0|1,0,0]=3 2259 B10R0.4 CC(O)CCNCCCCO 2230a_200000755665_100000210776 [1,1,0,0,0,0|1,0,0]=3 2260 B10R0.4 CC(O)CCNCCCCO 34a_100000750430_100012276601 [1,1,0,0,0,0|1,0,0]=3 2261 B10R0.4 CC(O)CCOCC#CCCl 34a_200000047223_100012276601 [1,1,0,0,0,0|0,0,2]=4 2262 B10R0.4 CC(O)CCOCCCCBr 34a_100011216708_100012276601 [1,1,0,0,0,0|0,0,0]=2 2263 B10R0.4 CC(O)CCOCCCCCl 34a_100000210776_100012276601 [1,1,0,0,0,0|0,0,0]=2 2264 B10R0.4 CC(O)CCOCCCCCl 7a_100000210776_100012276601 [1,1,0,0,0,0|0,0,0]=2 2265 B10R0.4 CC(O)CCOCCCCF 34a_100011995726_100012276601 [1,1,0,0,0,0|0,0,0]=2 2266 B10R0.4 CC(O)CCOCCCCF 7a_100011995726_100012276601 [1,1,0,0,0,0|0,0,0]=2 2267 B10R0.4 CC(O)CCOCCCCI 34a_200012148704_100012276601 [1,1,0,0,0,0|0,0,0]=2 2268 B10R0.4 CC(O)CCOCCCCN 34a_100000750430_100012276601 [1,1,0,0,0,0|0,0,0]=2 2269 B10R0.4 CC(O)CCSCC#CCO 62a_100012276601_200000047223 [1,1,0,0,0,0|0,1,1]=4 2270 B10R0.4 CC(O)CCSCC#CCO 62a_200000047223_100012276601 [1,1,0,0,0,0|0,1,1]=4 2271 B10R0.4 CC(O)CCSCCCC#N 62a_100000687738_100012276601 [1,1,0,0,0,0|0,1,1]=4 2272 B10R0.4 CC(O)CCSCCCC#N 62a_100012276601_100000687738 [1,1,0,0,0,0|0,1,1]=4 2273 B10R0.4 CC(O)CCSCCCC=O 62a_100012276601_200011292268 [1,1,0,0,0,0|0,1,1]=4 2274 B10R0.4 CC(O)CCSCCCC=O 62a_200011292268_100012276601 [1,1,0,0,0,0|0,1,1]=4 2275 B10R0.4 CC(O)CCSCCCCF 62a_100000729493_100012276601 [1,1,0,0,0,0|0,1,0]=3 2276 B10R0.4 CC(O)CCSCCCCF 62a_100012276601_100000729493 [1,1,0,0,0,0|0,1,0]=3 2277 B10R0.4 CC(O)CCSCCCCO 62a_100000210776_100012276601 [1,1,0,0,0,0|0,1,0]=3 2278 B10R0.4 CC(O)CCSCCCCO 62a_100012276601_100000210776 [1,1,0,0,0,0|0,1,0]=3 2279 B10R0.4 CC(O)CNCCCCCF 2230a_100000210904_100000729378 [1,1,0,0,0,0|2,0,0]=4 2280 B10R0.4 CC(O)CNCCCCCF 34a_100000210904_100000729378 [1,1,0,0,0,0|2,0,0]=4 2281 B10R0.4 CC(O)CNCCCCCO 2230a_100000210904_100000746330 [1,1,0,0,0,0|1,0,0]=3 2282 B10R0.4 CC(O)CNCCCCCO 2230a_100000762737_100011218427 [1,1,0,0,0,0|1,0,0]=3 2283 B10R0.4 CC(O)CNCCCCCO 34a_100000210904_100000746330 [1,1,0,0,0,0|1,0,0]=3 2284 B10R0.4 CC(O)CNCCCCCO 34a_100000762737_100011218427 [1,1,0,0,0,0|1,0,0]=3 2285 B10R0.4 CC(O)CNCCOCCO 2230a_100000210904_100011215305 [1,1,0,0,0,0|2,0,0]=4 2286 B10R0.4 CC(O)CNCCOCCO 2230a_100000211614_100011218427 [1,1,0,0,0,0|2,0,0]=4 2287 B10R0.4 CC(O)CNCCOCCO 34a_100000210904_100000692535 [1,1,0,0,0,0|2,0,0]=4 2288 B10R0.4 CC(O)CNCCOCCO 34a_100000211614_100011218427 [1,1,0,0,0,0|2,0,0]=4 2289 B10R0.4 CC(O)CNCCSCCO 2230a_100011219999_100011218427 [1,1,0,0,0,0|2,0,0]=4 2290 B10R0.4 CC(O)COCCCCCBr 34a_100000746331_100011218427 [1,1,0,0,0,0|2,0,0]=4 2291 B10R0.4 CC(O)COCCCCCBr 7a_100000746331_100011218427 [1,1,0,0,0,0|2,0,0]=4 2292 B10R0.4 CC(O)COCCCCCCl 34a_100000746330_100011218427 [1,1,0,0,0,0|2,0,0]=4 2293 B10R0.4 CC(O)COCCCCCCl 7a_100000746330_100011218427 [1,1,0,0,0,0|2,0,0]=4 2294 B10R0.4 CC(O)COCCCCCI 34a_200012148887_100011218427 [1,1,0,0,0,0|2,0,0]=4 2295 B10R0.4 CC(O)COCCCCCI 7a_200012148887_100011218427 [1,1,0,0,0,0|2,0,0]=4 2296 B10R0.4 CC(O)COCCCCCN 34a_100000762737_100011218427 [1,1,0,0,0,0|2,0,0]=4 2297 B10R0.4 CC(O)CSCCCCCF 62a_100000729378_100011218427 [1,1,0,0,0,0|2,0,0]=4 2298 B10R0.4 CC(O)CSCCCCCF 62a_100011218427_100000729378 [1,1,0,0,0,0|2,0,0]=4 2299 B10R0.4 CC(O)CSCCCCCO 62a_100000746330_100011218427 [1,1,0,0,0,0|1,0,0]=3 2300 B10R0.4 CC(O)CSCCCCCO 62a_100011218427_100000746330 [1,1,0,0,0,0|1,0,0]=3 2301 B10R0.4 CC(O)CSCCOCCO 62a_100011215305_100011218427 [1,1,0,0,0,0|2,0,0]=4 2302 B10R0.4 CC(O)CSCCOCCO 62a_100011218427_100011215305 [1,1,0,0,0,0|2,0,0]=4 2303 B10R0.4 CC/C=C\CNCCC(C)O 2230a_200000755665_100103147603 [1,1,0,0,0,0|1,0,1]=4 2304 B10R0.4 CC/C=C\COCCC(C)Br 34a_100009893172_100103147603 [1,1,0,0,0,0|1,0,1]=4 2305 B10R0.4 CC/C=C\COCCC(C)C 34a_100000210254_100103147603 [1,1,0,0,0,0|1,0,1]=4 2306 B10R0.4 CC/C=C\COCCC(C)C 34a_100016268518_100000210312 [1,1,0,0,0,0|1,0,1]=4 2307 B10R0.4 CC/C=C\COCCC(C)C 7a_100000210254_100103147603 [1,1,0,0,0,0|1,0,1]=4 2308 B10R0.4 CC/C=C\COCCC(C)O 34a_100016268518_100012276601 [1,1,0,0,0,0|0,0,1]=3 2309 B10R0.4 CC/C=C\COCC[C@@H](C)N 34a_100000706166_100103147603 [1,1,0,0,0,0|1,0,1]=4 2310 B10R0.4 CC/C=C\CSCCC(C)O 62a_100012276601_100103147603 [1,1,0,0,0,0|0,1,1]=4 2311 B10R0.4 CC/C=C\CSCCC(C)O 62a_100103147603_100012276601 [1,1,0,0,0,0|0,1,1]=4 2312 B10R0.4 CCC#CCNCCC(C)O 2230a_200000755665_100009813939 [1,1,0,0,0,0|1,0,1]=4 2313 B10R0.4 CCC#CCOCCC(C)Br 34a_100009893172_100009813939 [1,1,0,0,0,0|1,0,1]=4 2314 B10R0.4 CCC#CCOCCC(C)C 34a_100000032950_100000210312 [1,1,0,0,0,0|1,0,1]=4 2315 B10R0.4 CCC#CCOCCC(C)C 34a_100000210254_100009813939 [1,1,0,0,0,0|1,0,1]=4 2316 B10R0.4 CCC#CCOCCC(C)C 7a_100000210254_100009813939 [1,1,0,0,0,0|1,0,1]=4 2317 B10R0.4 CCC#CCOCCC(C)O 34a_100000032950_100012276601 [1,1,0,0,0,0|0,0,1]=3 2318 B10R0.4 CCC#CCOCC[C@@H](C)N 34a_100000706166_100009813939 [1,1,0,0,0,0|1,0,1]=4 2319 B10R0.4 CCC#CCSCCC(C)O 62a_100009813939_100012276601 [1,1,0,0,0,0|0,1,1]=4 2320 B10R0.4 CCC#CCSCCC(C)O 62a_100012276601_100009813939 [1,1,0,0,0,0|0,1,1]=4 2321 B10R0.4 CCC/C=C/COCC(C)O 34a_100016278788_100011218427 [1,1,0,0,0,0|1,0,1]=4 2322 B10R0.4 CCC/C=C/COCC(C)O 7a_100016278788_100011218427 [1,1,0,0,0,0|1,0,1]=4 2323 B10R0.4 CCC/C=C/COC[C@@H](C)O 34a_100016278788_100009817552 [1,1,0,0,0,0|1,0,1]=4 2324 B10R0.4 CCC/C=C/COC[C@@H](C)O 7a_100016278788_100009817552 [1,1,0,0,0,0|1,0,1]=4 2325 B10R0.4 CCCC#CCOCC(C)O 34a_100000034806_100011218427 [1,1,0,0,0,0|1,0,1]=4 2326 B10R0.4 CCCC#CCOCC(C)O 7a_100000034806_100011218427 [1,1,0,0,0,0|1,0,1]=4 2327 B10R0.4 CCCC#CCOC[C@@H](C)O 34a_100000034806_100009817552 [1,1,0,0,0,0|1,0,1]=4 2328 B10R0.4 CCCC#CCOC[C@@H](C)O 7a_100000034806_100009817552 [1,1,0,0,0,0|1,0,1]=4 2329 B10R0.4 CCCCC=NNCC(C)O 4a_200000730056_100000210104 [1,1,0,0,0,0|2,0,0]=4 2330 B10R0.4 CCCCCCCNC(C)C 2230a_100000229938_100000210206 [1,1,0,0,0,0|2,0,0]=4 2331 B10R0.4 CCCCCCCNC(C)C 2230a_100138425928_100000210681 [1,1,0,0,0,0|2,0,0]=4 2332 B10R0.4 CCCCCCCNC(C)C 34a_100138425928_100000210614 [1,1,0,0,0,0|2,0,0]=4 2333 B10R0.4 CCCCCCCOC(C)C 34a_100000210272_100000210206 [1,1,0,0,0,0|2,0,0]=4 2334 B10R0.4 CCCCCCCOC(C)C 34a_100000212225_100000210614 [1,1,0,0,0,0|2,0,0]=4 2335 B10R0.4 CCCCCCCOC(C)C 7a_100000210272_100000210206 [1,1,0,0,0,0|2,0,0]=4 2336 B10R0.4 CCCCCCCSC(C)C 62a_100000210206_100000210316 [1,1,0,0,0,0|2,0,0]=4 2337 B10R0.4 CCCCCCCSC(C)C 62a_100000210614_100000210206 [1,1,0,0,0,0|2,0,0]=4 2338 B10R0.4 CCCCCCNCC(C)C 2230a_100000210581_100000210760 [1,1,0,0,0,0|2,0,0]=4 2339 B10R0.4 CCCCCCNCC(C)C 2230a_100000210953_100000210314 [1,1,0,0,0,0|2,0,0]=4 2340 B10R0.4 CCCCCCNCC(C)C 270004a_100000210581_100000210432 [1,1,0,0,0,0|2,0,0]=4 2341 B10R0.4 CCCCCCNCC(C)C 34a_100000210953_100000210314 [1,1,0,0,0,0|2,0,0]=4 2342 B10R0.4 CCCCCCNCC(C)O 2230a_100000210581_100011218427 [1,1,0,0,0,0|1,0,0]=3 2343 B10R0.4 CCCCCCNCC(C)O 2230a_100000210904_100000210314 [1,1,0,0,0,0|1,0,0]=3 2344 B10R0.4 CCCCCCNCC(C)O 34a_100000210904_100000210314 [1,1,0,0,0,0|1,0,0]=3 2345 B10R0.4 CCCCCCNC[C@@H](C)O 2230a_100000210581_100009817552 [1,1,0,0,0,0|1,0,0]=3 2346 B10R0.4 CCCCCCOCC(C)Br 34a_100012180447_100000210314 [1,1,0,0,0,0|2,0,0]=4 2347 B10R0.4 CCCCCCOCC(C)C 34a_100000210257_100000210314 [1,1,0,0,0,0|2,0,0]=4 2348 B10R0.4 CCCCCCOCC(C)C 34a_100000210259_100000210624 [1,1,0,0,0,0|2,0,0]=4 2349 B10R0.4 CCCCCCOCC(C)C 7a_100000210259_100000210760 [1,1,0,0,0,0|2,0,0]=4 2350 B10R0.4 CCCCCCOCC(C)F 34a_100015925927_100000210314 [1,1,0,0,0,0|2,0,0]=4 2351 B10R0.4 CCCCCCOCC(C)O 34a_100000210259_100011218427 [1,1,0,0,0,0|1,0,0]=3 2352 B10R0.4 CCCCCCOCC(C)O 7a_100000210259_100011218427 [1,1,0,0,0,0|1,0,0]=3 2353 B10R0.4 CCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210314 [1,1,0,0,0,0|2,0,0]=4 2354 B10R0.4 CCCCCCOC[C@@H](C)N 34a_100000737577_100000210314 [1,1,0,0,0,0|2,0,0]=4 2355 B10R0.4 CCCCCCOC[C@@H](C)O 34a_100000210259_100009817552 [1,1,0,0,0,0|1,0,0]=3 2356 B10R0.4 CCCCCCOC[C@@H](C)O 7a_100000210259_100009817552 [1,1,0,0,0,0|1,0,0]=3 2357 B10R0.4 CCCCCCSCC(C)C 62a_100000210314_100000210760 [1,1,0,0,0,0|2,0,0]=4 2358 B10R0.4 CCCCCCSCC(C)C 62a_100000210624_100000210757 [1,1,0,0,0,0|2,0,0]=4 2359 B10R0.4 CCCCCCSCC(C)O 62a_100000210314_100011218427 [1,1,0,0,0,0|1,0,0]=3 2360 B10R0.4 CCCCCCSCC(C)O 62a_100011218427_100000210757 [1,1,0,0,0,0|1,0,0]=3 2361 B10R0.4 CCCCCCSC[C@@H](C)O 62a_100000210314_100009817552 [1,1,0,0,0,0|1,0,0]=3 2362 B10R0.4 CCCCCCSC[C@@H](C)O 62a_100009817552_100000210757 [1,1,0,0,0,0|1,0,0]=3 2363 B10R0.4 CCCCCNCCC(C)C 2230a_100000209983_100000210312 [1,1,0,0,0,0|2,0,0]=4 2364 B10R0.4 CCCCCNCCC(C)C 269862a_100000209983_100000185833 [1,1,0,0,0,0|2,0,0]=4 2365 B10R0.4 CCCCCNCCC(C)O 2230a_100000209983_100012276601 [1,1,0,0,0,0|1,0,0]=3 2366 B10R0.4 CCCCCNCCC(C)O 2230a_200000755665_100000210326 [1,1,0,0,0,0|1,0,0]=3 2367 B10R0.4 CCCCCOCCC(=O)C 34a_100000759926_100000718602 [1,1,0,0,0,0|0,0,2]=4 2368 B10R0.4 CCCCCOCCC(=O)C 7a_100000210253_100000053229 [1,1,0,0,0,0|0,0,2]=4 2369 B10R0.4 CCCCCOCCC(=O)C 7a_100000759926_100000210326 [1,1,0,0,0,0|0,0,2]=4 2370 B10R0.4 CCCCCOCCC(C)Br 34a_100009893172_100000718602 [1,1,0,0,0,0|1,0,0]=3 2371 B10R0.4 CCCCCOCCC(C)C 34a_100000210253_100000210312 [1,1,0,0,0,0|1,0,0]=3 2372 B10R0.4 CCCCCOCCC(C)C 34a_100000210254_100000718602 [1,1,0,0,0,0|1,0,0]=3 2373 B10R0.4 CCCCCOCCC(C)C 7a_100000210253_100000210626 [1,1,0,0,0,0|1,0,0]=3 2374 B10R0.4 CCCCCOCCC(C)C 7a_100000210254_100000210326 [1,1,0,0,0,0|1,0,0]=3 2375 B10R0.4 CCCCCOCCC(C)O 34a_100000210253_100012276601 [1,1,0,0,0,0|0,0,0]=2 2376 B10R0.4 CCCCCOCCC(C)O 7a_100000210253_100012276601 [1,1,0,0,0,0|0,0,0]=2 2377 B10R0.4 CCCCCOCCC(F)F 34a_100103093639_100000718602 [1,1,0,0,0,0|2,0,0]=4 2378 B10R0.4 CCCCCOCCN(C)C 7a_100000210253_100000755713 [1,1,0,0,0,0|2,0,0]=4 2379 B10R0.4 CCCCCOCC[C@@H](C)N 34a_100000706166_100000718602 [1,1,0,0,0,0|1,0,0]=3 2380 B10R0.4 CCCCCOCOC(C)C 34a_100000210253_100000709892 [1,1,0,0,0,0|2,0,0]=4 2381 B10R0.4 CCCCCSCCC(C)C 62a_100000210312_100000210326 [1,1,0,0,0,0|1,1,0]=4 2382 B10R0.4 CCCCCSCCC(C)C 62a_100000210326_100000210312 [1,1,0,0,0,0|1,1,0]=4 2383 B10R0.4 CCCCCSCCC(C)O 62a_100000210326_100012276601 [1,1,0,0,0,0|0,1,0]=3 2384 B10R0.4 CCCCCSCCC(C)O 62a_100012276601_100000210326 [1,1,0,0,0,0|0,1,0]=3 2385 B10R0.4 CCCCNCCCC(C)C 2230a_100000102301_100011214892 [1,1,0,0,0,0|2,0,0]=4 2386 B10R0.4 CCCCNCCCC(C)C 2230a_200000737386_100000210211 [1,1,0,0,0,0|2,0,0]=4 2387 B10R0.4 CCCCNCCCC(C)C 34a_200000737386_100000210210 [1,1,0,0,0,0|2,0,0]=4 2388 B10R0.4 CCCCNCCCC(C)C 7a_106832991798_100011214892 [1,1,0,0,0,0|2,0,0]=4 2389 B10R0.4 CCCCNCCCC(C)O 2230a_100000102301_200000718107 [1,1,0,0,0,0|1,0,0]=3 2390 B10R0.4 CCCCNCCCC(C)O 7a_106832991798_200000718107 [1,1,0,0,0,0|1,0,0]=3 2391 B10R0.4 CCCCNCCOC(C)C 2230a_100000102301_100000211751 [1,1,0,0,0,0|2,0,0]=4 2392 B10R0.4 CCCCNCCOC(C)C 2230a_100000701111_100000210211 [1,1,0,0,0,0|2,0,0]=4 2393 B10R0.4 CCCCNCCOC(C)C 34a_100000701111_100000210210 [1,1,0,0,0,0|2,0,0]=4 2394 B10R0.4 CCCCNCCOC(C)C 7a_106832991798_100000211751 [1,1,0,0,0,0|2,0,0]=4 2395 B10R0.4 CCCCNCCSC(C)C 2230a_100000102301_100000730970 [1,1,0,0,0,0|2,0,0]=4 2396 B10R0.4 CCCCNCCSC(C)C 2230a_100000731138_100000210211 [1,1,0,0,0,0|2,0,0]=4 2397 B10R0.4 CCCCNCCSC(C)C 34a_100000731138_100000210210 [1,1,0,0,0,0|2,0,0]=4 2398 B10R0.4 CCCCNCCSC(C)C 7a_106832991798_100000730970 [1,1,0,0,0,0|2,0,0]=4 2399 B10R0.4 CCCCOCCC=C(C)C 34a_100000210227_100011217483 [1,1,0,0,0,0|1,0,1]=4 2400 B10R0.4 CCCCOCCC=C(C)C 7a_100000210227_100011217483 [1,1,0,0,0,0|1,0,1]=4 2401 B10R0.4 CCCCOCCCC(=O)C 34a_100000210227_100000685027 [1,1,0,0,0,0|0,0,2]=4 2402 B10R0.4 CCCCOCCCC(=O)C 34a_100000759063_100000210210 [1,1,0,0,0,0|0,0,2]=4 2403 B10R0.4 CCCCOCCCC(=O)C 7a_100000210227_100011215641 [1,1,0,0,0,0|0,0,2]=4 2404 B10R0.4 CCCCOCCCC(=O)C 7a_100000759063_100000210211 [1,1,0,0,0,0|0,0,2]=4 2405 B10R0.4 CCCCOCCCC(C)C 34a_100000210227_100011214892 [1,1,0,0,0,0|1,0,0]=3 2406 B10R0.4 CCCCOCCCC(C)C 34a_100000210774_100000210210 [1,1,0,0,0,0|1,0,0]=3 2407 B10R0.4 CCCCOCCCC(C)C 7a_100000210227_100011214892 [1,1,0,0,0,0|1,0,0]=3 2408 B10R0.4 CCCCOCCCC(C)C 7a_100000210774_100000210211 [1,1,0,0,0,0|1,0,0]=3 2409 B10R0.4 CCCCOCCCC(C)O 34a_100000210227_200000718107 [1,1,0,0,0,0|0,0,0]=2 2410 B10R0.4 CCCCOCCCC(C)O 7a_100000210227_200000718107 [1,1,0,0,0,0|0,0,0]=2 2411 B10R0.4 CCCCOCCCN(C)C 7a_100000210227_100000757444 [1,1,0,0,0,0|2,0,0]=4 2412 B10R0.4 CCCCOCCNC(=O)C 34a_100000158858_100000210210 [1,1,0,0,0,0|0,0,2]=4 2413 B10R0.4 CCCCOCCNC(=O)C 7a_100000210227_100000189650 [1,1,0,0,0,0|0,0,2]=4 2414 B10R0.4 CCCCOCCNC(C)C 2230a_100138425928_100000743108 [1,1,0,0,0,0|1,0,0]=3 2415 B10R0.4 CCCCOCCNC(C)C 34a_100000224655_100000210210 [1,1,0,0,0,0|1,0,0]=3 2416 B10R0.4 CCCCOCCNC(C)C 34a_100138425928_100000743108 [1,1,0,0,0,0|1,0,0]=3 2417 B10R0.4 CCCCOCCOC(=O)C 34a_100000210227_100009814007 [1,1,0,0,0,0|0,0,2]=4 2418 B10R0.4 CCCCOCCOC(=O)C 7a_100000210227_100009814007 [1,1,0,0,0,0|0,0,2]=4 2419 B10R0.4 CCCCOCCOC(C)C 34a_100000210227_100000211751 [1,1,0,0,0,0|1,0,0]=3 2420 B10R0.4 CCCCOCCOC(C)C 34a_100000210238_100000210206 [1,1,0,0,0,0|1,0,0]=3 2421 B10R0.4 CCCCOCCOC(C)C 34a_100000211219_100000210210 [1,1,0,0,0,0|1,0,0]=3 2422 B10R0.4 CCCCOCCOC(C)C 34a_100000212225_100000743108 [1,1,0,0,0,0|1,0,0]=3 2423 B10R0.4 CCCCOCCOC(C)C 7a_100000210227_100000211751 [1,1,0,0,0,0|1,0,0]=3 2424 B10R0.4 CCCCOCCOC(C)C 7a_100000210238_100000210206 [1,1,0,0,0,0|1,0,0]=3 2425 B10R0.4 CCCCOCCOC(C)C 7a_100000211219_100000210211 [1,1,0,0,0,0|1,0,0]=3 2426 B10R0.4 CCCCOCCSC(C)C 34a_100000210227_100000730970 [1,1,0,0,0,0|1,0,0]=3 2427 B10R0.4 CCCCOCCSC(C)C 34a_200011212901_100000210210 [1,1,0,0,0,0|1,0,0]=3 2428 B10R0.4 CCCCOCCSC(C)C 62a_100000210206_100000743108 [1,1,0,0,0,0|1,0,0]=3 2429 B10R0.4 CCCCOCCSC(C)C 62a_100000743108_100000210206 [1,1,0,0,0,0|1,0,0]=3 2430 B10R0.4 CCCCOCCSC(C)C 7a_100000210227_100000730970 [1,1,0,0,0,0|1,0,0]=3 2431 B10R0.4 CCCCOCCSC(C)C 7a_200011212901_100000210211 [1,1,0,0,0,0|1,0,0]=3 2432 B10R0.4 CCCCOCNCC(=O)O 269956a_100016091260_100011995733 [1,1,0,0,0,0|1,0,1]=4 2433 B10R0.4 CCCCOCNCC(C)C 2230a_100000210953_100011995733 [1,1,0,0,0,0|1,0,0]=3 2434 B10R0.4 CCCCOCNCC(C)C 34a_100000210953_100011995733 [1,1,0,0,0,0|1,0,0]=3 2435 B10R0.4 CCCCOCNCC(C)O 2230a_100000210904_100011995733 [1,1,0,0,0,0|0,0,0]=2 2436 B10R0.4 CCCCOCNCC(C)O 34a_100000210904_100011995733 [1,1,0,0,0,0|0,0,0]=2 2437 B10R0.4 CCCCOCNCC(F)F 34a_100000765723_100011995733 [1,1,0,0,0,0|2,0,0]=4 2438 B10R0.4 CCCCOCOCC(=O)C 34a_100000211253_100011995733 [1,1,0,0,0,0|0,0,2]=4 2439 B10R0.4 CCCCOCOCC(C)Br 34a_100012180447_100011995733 [1,1,0,0,0,0|1,0,0]=3 2440 B10R0.4 CCCCOCOCC(C)C 34a_100000210257_100011995733 [1,1,0,0,0,0|1,0,0]=3 2441 B10R0.4 CCCCOCOCC(C)F 34a_100015925927_100011995733 [1,1,0,0,0,0|1,0,0]=3 2442 B10R0.4 CCCCOCOCC(F)F 34a_100000743014_100011995733 [1,1,0,0,0,0|2,0,0]=4 2443 B10R0.4 CCCCOCOC[C@@H](C)Cl 34a_100016084084_100011995733 [1,1,0,0,0,0|1,0,0]=3 2444 B10R0.4 CCCCOCOC[C@@H](C)N 34a_100000737577_100011995733 [1,1,0,0,0,0|1,0,0]=3 2445 B10R0.4 CCCCOCSCC(C)C 62a_100000210624_100011995733 [1,1,0,0,0,0|1,0,0]=3 2446 B10R0.4 CCCCOCSCC(C)C 62a_100011995733_100000210760 [1,1,0,0,0,0|1,0,0]=3 2447 B10R0.4 CCCCOCSCC(C)O 62a_100011218427_100011995733 [1,1,0,0,0,0|0,0,0]=2 2448 B10R0.4 CCCCOCSCC(C)O 62a_100011995733_100011218427 [1,1,0,0,0,0|0,0,0]=2 2449 B10R0.4 CCCCOCSCC(F)F 62a_100011934356_100011995733 [1,1,0,0,0,0|2,0,0]=4 2450 B10R0.4 CCCCOCSCC(F)F 62a_100011995733_100011934356 [1,1,0,0,0,0|2,0,0]=4 2451 B10R0.4 CCCCOCSC[C@@H](C)O 62a_100009817552_100011995733 [1,1,0,0,0,0|0,0,0]=2 2452 B10R0.4 CCCCOCSC[C@@H](C)O 62a_100011995733_100009817552 [1,1,0,0,0,0|0,0,0]=2 2453 B10R0.4 CCCCSCCCC(C)C 62a_100000210211_100011214892 [1,1,0,0,0,0|1,1,0]=4 2454 B10R0.4 CCCCSCCCC(C)C 62a_100011214892_100000210210 [1,1,0,0,0,0|1,1,0]=4 2455 B10R0.4 CCCCSCCCC(C)O 62a_100000210211_200000718107 [1,1,0,0,0,0|0,1,0]=3 2456 B10R0.4 CCCCSCCCC(C)O 62a_200000718107_100000210210 [1,1,0,0,0,0|0,1,0]=3 2457 B10R0.4 CCCCSCCNC(C)C 2230a_100025743550_100000210206 [1,1,0,0,0,0|1,1,0]=4 2458 B10R0.4 CCCCSCCOC(C)C 34a_200000230436_100000210206 [1,1,0,0,0,0|1,1,0]=4 2459 B10R0.4 CCCCSCCOC(C)C 62a_100000210211_100000211751 [1,1,0,0,0,0|1,1,0]=4 2460 B10R0.4 CCCCSCCOC(C)C 62a_100000211751_100000210210 [1,1,0,0,0,0|1,1,0]=4 2461 B10R0.4 CCCCSCCOC(C)C 7a_200000230436_100000210206 [1,1,0,0,0,0|1,1,0]=4 2462 B10R0.4 CCCCSCCSC(C)C 62a_100000210211_100000730970 [1,1,0,0,0,0|1,1,0]=4 2463 B10R0.4 CCCCSCCSC(C)C 62a_100000730970_100000210210 [1,1,0,0,0,0|1,1,0]=4 2464 B10R0.4 CCCOCCCCC(C)C 34a_100000210258_100011216152 [1,1,0,0,0,0|2,0,0]=4 2465 B10R0.4 CCCOCCCCC(C)C 34a_100011214890_100000210303 [1,1,0,0,0,0|2,0,0]=4 2466 B10R0.4 CCCOCCCCC(C)C 7a_100011214890_100000210303 [1,1,0,0,0,0|2,0,0]=4 2467 B10R0.4 CCCOCCNCC(C)O 2230a_100000210904_100011215938 [1,1,0,0,0,0|2,0,0]=4 2468 B10R0.4 CCCOCCNCC(C)O 2230a_100161115042_100011218427 [1,1,0,0,0,0|2,0,0]=4 2469 B10R0.4 CCCOCCNCC(C)O 34a_100000210904_100011215938 [1,1,0,0,0,0|2,0,0]=4 2470 B10R0.4 CCCOCCNCC(C)O 34a_100161115042_100011218427 [1,1,0,0,0,0|2,0,0]=4 2471 B10R0.4 CCCOCCNC[C@@H](C)O 2230a_100161115042_100009817552 [1,1,0,0,0,0|2,0,0]=4 2472 B10R0.4 CCCOCCNC[C@@H](C)O 34a_100161115042_100009817552 [1,1,0,0,0,0|2,0,0]=4 2473 B10R0.4 CCCOCCOCC(C)O 34a_100000752267_100011218427 [1,1,0,0,0,0|2,0,0]=4 2474 B10R0.4 CCCOCCOCC(C)O 7a_100000752267_100011218427 [1,1,0,0,0,0|2,0,0]=4 2475 B10R0.4 CCCOCCOC[C@@H](C)O 34a_100000752267_100009817552 [1,1,0,0,0,0|2,0,0]=4 2476 B10R0.4 CCCOCCOC[C@@H](C)O 7a_100000752267_100009817552 [1,1,0,0,0,0|2,0,0]=4 2477 B10R0.4 CCCOCCSCC(C)O 62a_100011215938_100011218427 [1,1,0,0,0,0|2,0,0]=4 2478 B10R0.4 CCCOCCSCC(C)O 62a_100011218427_100011215938 [1,1,0,0,0,0|2,0,0]=4 2479 B10R0.4 CCCOCCSC[C@@H](C)O 62a_100009817552_100011215938 [1,1,0,0,0,0|2,0,0]=4 2480 B10R0.4 CCCOCCSC[C@@H](C)O 62a_100011215938_100009817552 [1,1,0,0,0,0|2,0,0]=4 2481 B10R0.4 CCCSCCCCC(C)C 62a_100000210303_100011216152 [1,1,0,0,0,0|2,0,0]=4 2482 B10R0.4 CCCSCCCCC(C)C 62a_100011216152_100000210303 [1,1,0,0,0,0|2,0,0]=4 2483 B10R0.4 CCCSCCNCC(C)O 2230a_100020603323_100011218427 [1,1,0,0,0,0|2,0,0]=4 2484 B10R0.4 CCCSCCNC[C@@H](C)O 2230a_100020603323_100009817552 [1,1,0,0,0,0|2,0,0]=4 2485 B10R0.4 CCCSCCOCC(C)O 34a_200000230433_100011218427 [1,1,0,0,0,0|2,0,0]=4 2486 B10R0.4 CCCSCCOCC(C)O 7a_200000230433_100011218427 [1,1,0,0,0,0|2,0,0]=4 2487 B10R0.4 CCCSCCOC[C@@H](C)O 34a_200000230433_100009817552 [1,1,0,0,0,0|2,0,0]=4 2488 B10R0.4 CCCSCCOC[C@@H](C)O 7a_200000230433_100009817552 [1,1,0,0,0,0|2,0,0]=4 2489 B10R0.4 CCNCCCCCC(C)C 2230a_100011290863_100000210202 [1,1,0,0,0,0|2,0,0]=4 2490 B10R0.4 CCNCCCCCC(C)C 2230a_100015525214_100000210682 [1,1,0,0,0,0|2,0,0]=4 2491 B10R0.4 CCNCCCCCC(C)C 34a_100011290863_100000210202 [1,1,0,0,0,0|2,0,0]=4 2492 B10R0.4 CCOCCCCCC(C)C 34a_100011995859_100000210202 [1,1,0,0,0,0|2,0,0]=4 2493 B10R0.4 CCOCCCCCC(C)C 34a_100121572206_100000210682 [1,1,0,0,0,0|2,0,0]=4 2494 B10R0.4 CCOCCCCCC(C)C 7a_100011995859_100000210202 [1,1,0,0,0,0|2,0,0]=4 2495 B10R0.4 CCOCCCNCC(C)O 2230a_100000210904_100012232248 [1,1,0,0,0,0|2,0,0]=4 2496 B10R0.4 CCOCCCNCC(C)O 2230a_100000210961_100011218427 [1,1,0,0,0,0|2,0,0]=4 2497 B10R0.4 CCOCCCNCC(C)O 34a_100000210904_100012232248 [1,1,0,0,0,0|2,0,0]=4 2498 B10R0.4 CCOCCCNCC(C)O 34a_100000210961_100011218427 [1,1,0,0,0,0|2,0,0]=4 2499 B10R0.4 CCOCCCNC[C@@H](C)O 2230a_100000210961_100009817552 [1,1,0,0,0,0|2,0,0]=4 2500 B10R0.4 CCOCCCNC[C@@H](C)O 34a_100000210961_100009817552 [1,1,0,0,0,0|2,0,0]=4 2501 B10R0.4 CCOCCCOCC(C)O 34a_100000757476_100011218427 [1,1,0,0,0,0|2,0,0]=4 2502 B10R0.4 CCOCCCOCC(C)O 7a_100000757476_100011218427 [1,1,0,0,0,0|2,0,0]=4 2503 B10R0.4 CCOCCCOC[C@@H](C)O 34a_100000757476_100009817552 [1,1,0,0,0,0|2,0,0]=4 2504 B10R0.4 CCOCCCOC[C@@H](C)O 7a_100000757476_100009817552 [1,1,0,0,0,0|2,0,0]=4 2505 B10R0.4 CCOCCCSCC(C)O 62a_100011218427_100012232248 [1,1,0,0,0,0|2,0,0]=4 2506 B10R0.4 CCOCCCSCC(C)O 62a_100012232248_100011218427 [1,1,0,0,0,0|2,0,0]=4 2507 B10R0.4 CCOCCCSC[C@@H](C)O 62a_100009817552_100012232248 [1,1,0,0,0,0|2,0,0]=4 2508 B10R0.4 CCOCCCSC[C@@H](C)O 62a_100012232248_100009817552 [1,1,0,0,0,0|2,0,0]=4 2509 B10R0.4 CCOCCNCCC(C)C 2230a_102516460346_100000210312 [1,1,0,0,0,0|2,0,0]=4 2510 B10R0.4 CCOCCNCCC(C)C 269862a_100011200944_100000185833 [1,1,0,0,0,0|2,0,0]=4 2511 B10R0.4 CCOCCNCCC(C)C 34a_102516460346_100000210312 [1,1,0,0,0,0|2,0,0]=4 2512 B10R0.4 CCOCCNCCC(C)O 2230a_102516460346_100012276601 [1,1,0,0,0,0|1,0,0]=3 2513 B10R0.4 CCOCCNCCC(C)O 2230a_200000755665_100011215890 [1,1,0,0,0,0|1,0,0]=3 2514 B10R0.4 CCOCCNCCC(C)O 34a_102516460346_100012276601 [1,1,0,0,0,0|1,0,0]=3 2515 B10R0.4 CCOCCOCCC(=O)C 1458a_100000070787_100011211534 [1,1,0,0,0,0|0,0,2]=4 2516 B10R0.4 CCOCCOCCC(=O)C 34a_100000759926_100000210147 [1,1,0,0,0,0|0,0,2]=4 2517 B10R0.4 CCOCCOCCC(=O)C 7a_100000210136_100000053229 [1,1,0,0,0,0|0,0,2]=4 2518 B10R0.4 CCOCCOCCC(=O)C 7a_100000759926_100011215890 [1,1,0,0,0,0|0,0,2]=4 2519 B10R0.4 CCOCCOCCC(C)Br 34a_100009893172_100000210147 [1,1,0,0,0,0|1,0,0]=3 2520 B10R0.4 CCOCCOCCC(C)C 34a_100000210136_100000210312 [1,1,0,0,0,0|1,0,0]=3 2521 B10R0.4 CCOCCOCCC(C)C 34a_100000210254_100000210147 [1,1,0,0,0,0|1,0,0]=3 2522 B10R0.4 CCOCCOCCC(C)C 7a_100000210136_100000210626 [1,1,0,0,0,0|1,0,0]=3 2523 B10R0.4 CCOCCOCCC(C)C 7a_100000210254_100011215890 [1,1,0,0,0,0|1,0,0]=3 2524 B10R0.4 CCOCCOCCC(C)O 34a_100000210136_100012276601 [1,1,0,0,0,0|0,0,0]=2 2525 B10R0.4 CCOCCOCCC(C)O 7a_100000210136_100012276601 [1,1,0,0,0,0|0,0,0]=2 2526 B10R0.4 CCOCCOCCC(F)F 34a_100103093639_100000210147 [1,1,0,0,0,0|2,0,0]=4 2527 B10R0.4 CCOCCOCCN(C)C 2230a_100102631434_100011211534 [1,1,0,0,0,0|2,0,0]=4 2528 B10R0.4 CCOCCOCCN(C)C 269982a_100102631434_100011211534 [1,1,0,0,0,0|2,0,0]=4 2529 B10R0.4 CCOCCOCCN(C)C 7a_100000210136_100000755713 [1,1,0,0,0,0|2,0,0]=4 2530 B10R0.4 CCOCCOCC[C@@H](C)N 34a_100000706166_100000210147 [1,1,0,0,0,0|1,0,0]=3 2531 B10R0.4 CCOCCOCOC(C)C 34a_100000210136_100000709892 [1,1,0,0,0,0|2,0,0]=4 2532 B10R0.4 CCOCCSCCC(C)C 62a_100000210147_100000210312 [1,1,0,0,0,0|1,1,0]=4 2533 B10R0.4 CCOCCSCCC(C)C 62a_100000210312_100011215890 [1,1,0,0,0,0|1,1,0]=4 2534 B10R0.4 CCOCCSCCC(C)O 62a_100000210147_100012276601 [1,1,0,0,0,0|0,1,0]=3 2535 B10R0.4 CCOCCSCCC(C)O 62a_100012276601_100011215890 [1,1,0,0,0,0|0,1,0]=3 2536 B10R0.4 CCOCSCCCC(C)O 62a_100000739092_200000718107 [1,1,0,0,0,0|1,1,0]=4 2537 B10R0.4 CCOCSCCCC(C)O 62a_200000718107_100000739092 [1,1,0,0,0,0|1,1,0]=4 2538 B10R0.4 CCSCCCCCC(C)C 62a_100000210202_100000210682 [1,1,0,0,0,0|2,0,0]=4 2539 B10R0.4 CCSCCCCCC(C)C 62a_100000210682_100000210202 [1,1,0,0,0,0|2,0,0]=4 2540 B10R0.4 CCSCCCOCC(C)O 34a_100011216438_100011218427 [1,1,0,0,0,0|2,0,0]=4 2541 B10R0.4 CCSCCCOCC(C)O 7a_100011216438_100011218427 [1,1,0,0,0,0|2,0,0]=4 2542 B10R0.4 CCSCCCOC[C@@H](C)O 34a_100011216438_100009817552 [1,1,0,0,0,0|2,0,0]=4 2543 B10R0.4 CCSCCCOC[C@@H](C)O 7a_100011216438_100009817552 [1,1,0,0,0,0|2,0,0]=4 2544 B10R0.4 CCSCCNCCC(C)C 2230a_100000106463_100000210312 [1,1,0,0,0,0|2,0,0]=4 2545 B10R0.4 CCSCCNCCC(C)C 269862a_100000106463_100000185833 [1,1,0,0,0,0|2,0,0]=4 2546 B10R0.4 CCSCCNCCC(C)O 2230a_100000106463_100012276601 [1,1,0,0,0,0|1,0,0]=3 2547 B10R0.4 CCSCCNCCC(C)O 2230a_200000755665_100000757381 [1,1,0,0,0,0|1,0,0]=3 2548 B10R0.4 CCSCCOCCC(=O)C 34a_100000759926_100000757381 [1,1,0,0,0,0|0,0,2]=4 2549 B10R0.4 CCSCCOCCC(=O)C 7a_100000212035_100000053229 [1,1,0,0,0,0|0,0,2]=4 2550 B10R0.4 CCSCCOCCC(=O)C 7a_100000759926_100000757381 [1,1,0,0,0,0|0,0,2]=4 2551 B10R0.4 CCSCCOCCC(C)Br 34a_100009893172_100000757381 [1,1,0,0,0,0|1,0,0]=3 2552 B10R0.4 CCSCCOCCC(C)C 34a_100000210254_100000757381 [1,1,0,0,0,0|1,0,0]=3 2553 B10R0.4 CCSCCOCCC(C)C 34a_100000212035_100000210312 [1,1,0,0,0,0|1,0,0]=3 2554 B10R0.4 CCSCCOCCC(C)C 7a_100000210254_100000757381 [1,1,0,0,0,0|1,0,0]=3 2555 B10R0.4 CCSCCOCCC(C)C 7a_100000212035_100000210626 [1,1,0,0,0,0|1,0,0]=3 2556 B10R0.4 CCSCCOCCC(C)O 34a_100000212035_100012276601 [1,1,0,0,0,0|0,0,0]=2 2557 B10R0.4 CCSCCOCCC(C)O 7a_100000212035_100012276601 [1,1,0,0,0,0|0,0,0]=2 2558 B10R0.4 CCSCCOCCC(F)F 34a_100103093639_100000757381 [1,1,0,0,0,0|2,0,0]=4 2559 B10R0.4 CCSCCOCCN(C)C 7a_100000212035_100000755713 [1,1,0,0,0,0|2,0,0]=4 2560 B10R0.4 CCSCCOCC[C@@H](C)N 34a_100000706166_100000757381 [1,1,0,0,0,0|1,0,0]=3 2561 B10R0.4 CCSCCOCOC(C)C 34a_100000212035_100000709892 [1,1,0,0,0,0|2,0,0]=4 2562 B10R0.4 CCSCCSCCC(C)C 62a_100000210312_100000757381 [1,1,0,0,0,0|1,1,0]=4 2563 B10R0.4 CCSCCSCCC(C)C 62a_100000757381_100000210312 [1,1,0,0,0,0|1,1,0]=4 2564 B10R0.4 CCSCCSCCC(C)O 62a_100000757381_100012276601 [1,1,0,0,0,0|0,1,0]=3 2565 B10R0.4 CCSCCSCCC(C)O 62a_100012276601_100000757381 [1,1,0,0,0,0|0,1,0]=3 2566 B10R0.4 CN(C)CCOCCCCCl 7a_100000210776_100000755713 [1,1,0,0,0,0|2,0,0]=4 2567 B10R0.4 CN(C)CCOCCCCF 7a_100011995726_100000755713 [1,1,0,0,0,0|2,0,0]=4 2568 B10R0.4 CNCCCCCCC(C)C 2230a_100000211014_200000210301 [1,1,0,0,0,0|2,0,0]=4 2569 B10R0.4 CNCCCCCCC(C)C 34a_100000211014_200000210301 [1,1,0,0,0,0|2,0,0]=4 2570 B10R0.4 CNCCCOCCC(C)C 34a_100000213112_100000210312 [1,1,0,0,0,0|1,0,0]=3 2571 B10R0.4 CNCCCOCCC(C)O 34a_100000213112_100012276601 [1,1,0,0,0,0|0,0,0]=2 2572 B10R0.4 CNCCCOCOC(C)C 34a_100000213112_100000709892 [1,1,0,0,0,0|2,0,0]=4 2573 B10R0.4 CNCCOCCOC(C)C 34a_100000228057_100000210206 [1,1,0,0,0,0|2,0,0]=4 2574 B10R0.4 COCCCCNCC(C)O 2230a_100000210904_100000730899 [1,1,0,0,0,0|2,0,0]=4 2575 B10R0.4 COCCCCNCC(C)O 34a_100000210904_100000755781 [1,1,0,0,0,0|2,0,0]=4 2576 B10R0.4 COCCCCOCC(C)O 34a_100000740925_100011218427 [1,1,0,0,0,0|2,0,0]=4 2577 B10R0.4 COCCCCOC[C@@H](C)O 34a_100000740925_100009817552 [1,1,0,0,0,0|2,0,0]=4 2578 B10R0.4 COCCCCSCC(C)O 62a_100000730899_100011218427 [1,1,0,0,0,0|2,0,0]=4 2579 B10R0.4 COCCCCSCC(C)O 62a_100011218427_100000730899 [1,1,0,0,0,0|2,0,0]=4 2580 B10R0.4 COCCCCSC[C@@H](C)O 62a_100000730899_100009817552 [1,1,0,0,0,0|2,0,0]=4 2581 B10R0.4 COCCCCSC[C@@H](C)O 62a_100009817552_100000730899 [1,1,0,0,0,0|2,0,0]=4 2582 B10R0.4 COCCCNCCC(C)C 269862a_100150723488_100000185833 [1,1,0,0,0,0|2,0,0]=4 2583 B10R0.4 COCCCNCCC(C)C 34a_100150723488_100000210312 [1,1,0,0,0,0|2,0,0]=4 2584 B10R0.4 COCCCNCCC(C)O 2230a_200000755665_100000740836 [1,1,0,0,0,0|1,0,0]=3 2585 B10R0.4 COCCCNCCC(C)O 34a_100150723488_100012276601 [1,1,0,0,0,0|1,0,0]=3 2586 B10R0.4 COCCCOCCC(=O)C 34a_100000759926_100000740836 [1,1,0,0,0,0|0,0,2]=4 2587 B10R0.4 COCCCOCCC(=O)C 7a_100000759926_100000740836 [1,1,0,0,0,0|0,0,2]=4 2588 B10R0.4 COCCCOCCC(C)Br 34a_100009893172_100000740836 [1,1,0,0,0,0|1,0,0]=3 2589 B10R0.4 COCCCOCCC(C)C 34a_100000210254_100000740836 [1,1,0,0,0,0|1,0,0]=3 2590 B10R0.4 COCCCOCCC(C)C 34a_100000740835_100000210312 [1,1,0,0,0,0|1,0,0]=3 2591 B10R0.4 COCCCOCCC(C)C 7a_100000210254_100000740836 [1,1,0,0,0,0|1,0,0]=3 2592 B10R0.4 COCCCOCCC(C)O 34a_100000740835_100012276601 [1,1,0,0,0,0|0,0,0]=2 2593 B10R0.4 COCCCOCCC(F)F 34a_100103093639_100000740836 [1,1,0,0,0,0|2,0,0]=4 2594 B10R0.4 COCCCOCC[C@@H](C)N 34a_100000706166_100000740836 [1,1,0,0,0,0|1,0,0]=3 2595 B10R0.4 COCCCOCOC(C)C 34a_100000740835_100000709892 [1,1,0,0,0,0|2,0,0]=4 2596 B10R0.4 COCCCSCCC(C)C 62a_100000210312_100000709357 [1,1,0,0,0,0|1,1,0]=4 2597 B10R0.4 COCCCSCCC(C)C 62a_100000709357_100000210312 [1,1,0,0,0,0|1,1,0]=4 2598 B10R0.4 COCCCSCCC(C)O 62a_100000709357_100012276601 [1,1,0,0,0,0|0,1,0]=3 2599 B10R0.4 COCCCSCCC(C)O 62a_100012276601_100000709357 [1,1,0,0,0,0|0,1,0]=3 2600 B10R0.4 COCCNCCCC(C)O 2230a_100000209980_200000718107 [1,1,0,0,0,0|2,0,0]=4 2601 B10R0.4 COCCOCCCC(C)C 34a_100000210237_100011214892 [1,1,0,0,0,0|2,0,0]=4 2602 B10R0.4 COCCOCCCC(C)C 34a_100000210774_100011201679 [1,1,0,0,0,0|2,0,0]=4 2603 B10R0.4 COCCOCCCC(C)C 7a_100000210774_100000233755 [1,1,0,0,0,0|2,0,0]=4 2604 B10R0.4 COCCOCCCC(C)O 34a_100000210237_200000718107 [1,1,0,0,0,0|1,0,0]=3 2605 B10R0.4 COCCOCCNC(C)C 2230a_100000745349_100000210206 [1,1,0,0,0,0|2,0,0]=4 2606 B10R0.4 COCCOCCNC(C)C 2230a_100138425928_100000695917 [1,1,0,0,0,0|2,0,0]=4 2607 B10R0.4 COCCOCCNC(C)C 34a_100000224655_100011201679 [1,1,0,0,0,0|2,0,0]=4 2608 B10R0.4 COCCOCCNC(C)C 34a_100000745349_100000210206 [1,1,0,0,0,0|2,0,0]=4 2609 B10R0.4 COCCOCCNC(C)C 34a_100138425928_100000695917 [1,1,0,0,0,0|2,0,0]=4 2610 B10R0.4 COCCOCCOC(C)C 34a_100000210237_100000211751 [1,1,0,0,0,0|2,0,0]=4 2611 B10R0.4 COCCOCCOC(C)C 34a_100000211219_100011201679 [1,1,0,0,0,0|2,0,0]=4 2612 B10R0.4 COCCOCCOC(C)C 34a_100000212225_100000695917 [1,1,0,0,0,0|2,0,0]=4 2613 B10R0.4 COCCOCCOC(C)C 34a_100011215163_100000210206 [1,1,0,0,0,0|2,0,0]=4 2614 B10R0.4 COCCOCCOC(C)C 7a_100000211219_100000233755 [1,1,0,0,0,0|2,0,0]=4 2615 B10R0.4 COCCOCCOC(C)C 7a_100011215163_100000210206 [1,1,0,0,0,0|2,0,0]=4 2616 B10R0.4 COCCOCCSC(C)C 34a_100000210237_100000730970 [1,1,0,0,0,0|2,0,0]=4 2617 B10R0.4 COCCOCCSC(C)C 34a_200011212901_100011201679 [1,1,0,0,0,0|2,0,0]=4 2618 B10R0.4 COCCOCCSC(C)C 62a_100000210206_100000695917 [1,1,0,0,0,0|2,0,0]=4 2619 B10R0.4 COCCOCCSC(C)C 62a_100000695917_100000210206 [1,1,0,0,0,0|2,0,0]=4 2620 B10R0.4 COCCOCCSC(C)C 7a_200011212901_100000233755 [1,1,0,0,0,0|2,0,0]=4 2621 B10R0.4 COCCOCNCC(C)C 2230a_100000210953_100000231047 [1,1,0,0,0,0|2,0,0]=4 2622 B10R0.4 COCCOCNCC(C)O 2230a_100000210904_100000231047 [1,1,0,0,0,0|1,0,0]=3 2623 B10R0.4 COCCOCSCC(C)C 62a_100000210624_100000231047 [1,1,0,0,0,0|2,0,0]=4 2624 B10R0.4 COCCOCSCC(C)C 62a_100000231047_100000210760 [1,1,0,0,0,0|2,0,0]=4 2625 B10R0.4 COCCOCSCC(C)O 62a_100000231047_100011218427 [1,1,0,0,0,0|1,0,0]=3 2626 B10R0.4 COCCOCSCC(C)O 62a_100011218427_100000231047 [1,1,0,0,0,0|1,0,0]=3 2627 B10R0.4 COCCOCSC[C@@H](C)O 62a_100000231047_100009817552 [1,1,0,0,0,0|1,0,0]=3 2628 B10R0.4 COCCOCSC[C@@H](C)O 62a_100009817552_100000231047 [1,1,0,0,0,0|1,0,0]=3 2629 B10R0.4 COCCSCCCC(C)O 62a_100000233755_200000718107 [1,1,0,0,0,0|1,1,0]=4 2630 B10R0.4 COCCSCCCC(C)O 62a_200000718107_100000233755 [1,1,0,0,0,0|1,1,0]=4 2631 B10R0.4 CSCCCCOCC(C)O 34a_100011217163_100011218427 [1,1,0,0,0,0|2,0,0]=4 2632 B10R0.4 CSCCCCOCC(C)O 7a_100011217163_100011218427 [1,1,0,0,0,0|2,0,0]=4 2633 B10R0.4 CSCCCCOC[C@@H](C)O 34a_100011217163_100009817552 [1,1,0,0,0,0|2,0,0]=4 2634 B10R0.4 CSCCCCOC[C@@H](C)O 7a_100011217163_100009817552 [1,1,0,0,0,0|2,0,0]=4 2635 B10R0.4 CSCCCNCCC(C)C 2230a_100000749238_100000210312 [1,1,0,0,0,0|2,0,0]=4 2636 B10R0.4 CSCCCNCCC(C)C 269862a_100000749238_100000185833 [1,1,0,0,0,0|2,0,0]=4 2637 B10R0.4 CSCCCNCCC(C)O 2230a_100000749238_100012276601 [1,1,0,0,0,0|1,0,0]=3 2638 B10R0.4 CSCCCOCCC(=O)C 7a_100000690336_100000053229 [1,1,0,0,0,0|0,0,2]=4 2639 B10R0.4 CSCCCOCCC(C)C 34a_100000690336_100000210312 [1,1,0,0,0,0|1,0,0]=3 2640 B10R0.4 CSCCCOCCC(C)C 7a_100000690336_100000210626 [1,1,0,0,0,0|1,0,0]=3 2641 B10R0.4 CSCCCOCCC(C)O 34a_100000690336_100012276601 [1,1,0,0,0,0|0,0,0]=2 2642 B10R0.4 CSCCCOCCC(C)O 7a_100000690336_100012276601 [1,1,0,0,0,0|0,0,0]=2 2643 B10R0.4 CSCCCOCCN(C)C 7a_100000690336_100000755713 [1,1,0,0,0,0|2,0,0]=4 2644 B10R0.4 CSCCCOCOC(C)C 34a_100000690336_100000709892 [1,1,0,0,0,0|2,0,0]=4 2645 B10R0.4 CSCCNCCCC(C)O 2230a_100020590264_200000718107 [1,1,0,0,0,0|2,0,0]=4 2646 B10R0.4 CSCCOCCCC(C)C 34a_100000210774_100000212216 [1,1,0,0,0,0|2,0,0]=4 2647 B10R0.4 CSCCOCCCC(C)C 34a_100000230434_100011214892 [1,1,0,0,0,0|2,0,0]=4 2648 B10R0.4 CSCCOCCCC(C)C 7a_100000210774_100000212216 [1,1,0,0,0,0|2,0,0]=4 2649 B10R0.4 CSCCOCCCC(C)C 7a_100000230434_100011214892 [1,1,0,0,0,0|2,0,0]=4 2650 B10R0.4 CSCCOCCCC(C)O 34a_100000230434_200000718107 [1,1,0,0,0,0|1,0,0]=3 2651 B10R0.4 CSCCOCCCC(C)O 7a_100000230434_200000718107 [1,1,0,0,0,0|1,0,0]=3 2652 B10R0.4 CSCCOCCNC(C)C 34a_100000224655_100000212216 [1,1,0,0,0,0|2,0,0]=4 2653 B10R0.4 CSCCOCCOC(C)C 34a_100000211219_100000212216 [1,1,0,0,0,0|2,0,0]=4 2654 B10R0.4 CSCCOCCOC(C)C 34a_100000230434_100000211751 [1,1,0,0,0,0|2,0,0]=4 2655 B10R0.4 CSCCOCCOC(C)C 7a_100000211219_100000212216 [1,1,0,0,0,0|2,0,0]=4 2656 B10R0.4 CSCCOCCOC(C)C 7a_100000230434_100000211751 [1,1,0,0,0,0|2,0,0]=4 2657 B10R0.4 CSCCOCCSC(C)C 34a_100000230434_100000730970 [1,1,0,0,0,0|2,0,0]=4 2658 B10R0.4 CSCCOCCSC(C)C 34a_200011212901_100000212216 [1,1,0,0,0,0|2,0,0]=4 2659 B10R0.4 CSCCOCCSC(C)C 7a_100000230434_100000730970 [1,1,0,0,0,0|2,0,0]=4 2660 B10R0.4 CSCCOCCSC(C)C 7a_200011212901_100000212216 [1,1,0,0,0,0|2,0,0]=4 2661 B10R0.4 CSCCSCCCC(C)O 62a_100000212216_200000718107 [1,1,0,0,0,0|1,1,0]=4 2662 B10R0.4 CSCCSCCCC(C)O 62a_200000718107_100000751147 [1,1,0,0,0,0|1,1,0]=4 2663 B10R0.4 C[C@@H](Cl)COCCCCCO 34a_100016084084_100000746330 [1,1,0,0,0,0|2,0,0]=4 2664 B10R0.4 C[C@@H](N)CCOCC#CCO 34a_100000706166_200000047223 [1,1,0,0,0,0|1,0,1]=4 2665 B10R0.4 C[C@@H](N)CCOCCCCF 34a_100000706166_100000729493 [1,1,0,0,0,0|1,0,0]=3 2666 B10R0.4 C[C@@H](N)CCOCCCCO 34a_100000706166_100011216708 [1,1,0,0,0,0|1,0,0]=3 2667 B10R0.4 C[C@@H](N)COCCCCCO 34a_100000737577_100000746330 [1,1,0,0,0,0|2,0,0]=4 2668 B10R0.4 C[C@@H](O)CNCCCCCO 2230a_100000762737_100009817552 [1,1,0,0,0,0|1,0,0]=3 2669 B10R0.4 C[C@@H](O)CNCCCCCO 34a_100000762737_100009817552 [1,1,0,0,0,0|1,0,0]=3 2670 B10R0.4 C[C@@H](O)CNCCOCCO 2230a_100000211614_100009817552 [1,1,0,0,0,0|2,0,0]=4 2671 B10R0.4 C[C@@H](O)CNCCOCCO 34a_100000211614_100009817552 [1,1,0,0,0,0|2,0,0]=4 2672 B10R0.4 C[C@@H](O)CNCCSCCO 2230a_100011219999_100009817552 [1,1,0,0,0,0|2,0,0]=4 2673 B10R0.4 C[C@@H](O)COCCCCCBr 34a_100000746331_100009817552 [1,1,0,0,0,0|2,0,0]=4 2674 B10R0.4 C[C@@H](O)COCCCCCBr 7a_100000746331_100009817552 [1,1,0,0,0,0|2,0,0]=4 2675 B10R0.4 C[C@@H](O)COCCCCCCl 34a_100000746330_100009817552 [1,1,0,0,0,0|2,0,0]=4 2676 B10R0.4 C[C@@H](O)COCCCCCCl 7a_100000746330_100009817552 [1,1,0,0,0,0|2,0,0]=4 2677 B10R0.4 C[C@@H](O)COCCCCCI 34a_200012148887_100009817552 [1,1,0,0,0,0|2,0,0]=4 2678 B10R0.4 C[C@@H](O)COCCCCCI 7a_200012148887_100009817552 [1,1,0,0,0,0|2,0,0]=4 2679 B10R0.4 C[C@@H](O)COCCCCCN 34a_100000762737_100009817552 [1,1,0,0,0,0|2,0,0]=4 2680 B10R0.4 C[C@@H](O)CSCCCCCF 62a_100000729378_100009817552 [1,1,0,0,0,0|2,0,0]=4 2681 B10R0.4 C[C@@H](O)CSCCCCCF 62a_100009817552_100000729378 [1,1,0,0,0,0|2,0,0]=4 2682 B10R0.4 C[C@@H](O)CSCCCCCO 62a_100000746330_100009817552 [1,1,0,0,0,0|1,0,0]=3 2683 B10R0.4 C[C@@H](O)CSCCCCCO 62a_100009817552_100000746330 [1,1,0,0,0,0|1,0,0]=3 2684 B10R0.4 C[C@@H](O)CSCCOCCO 62a_100009817552_100011215305 [1,1,0,0,0,0|2,0,0]=4 2685 B10R0.4 C[C@@H](O)CSCCOCCO 62a_100011215305_100009817552 [1,1,0,0,0,0|2,0,0]=4 2686 B10R0.4 FCCCCOCCC(F)F 34a_100103093639_100000729493 [1,1,0,0,0,0|2,0,0]=4 2687 B10R0.4 OCCCCOCCC(F)F 34a_100103093639_100011216708 [1,1,0,0,0,0|2,0,0]=4 2688 B10R0.6 CC(C)CC(C)NCCCO 2230a_100000692259_100000230001 [1,1,0,0,0,0|2,0,0]=4 2689 B10R0.6 CC(C)CC(C)OCCCBr 34a_100011217188_100000731052 [1,1,0,0,0,0|2,0,0]=4 2690 B10R0.6 CC(C)CC(C)OCCCCl 34a_100000230001_100000731052 [1,1,0,0,0,0|2,0,0]=4 2691 B10R0.6 CC(C)CC(C)OCCCF 34a_100000211805_100011934791 [1,1,0,0,0,0|2,0,0]=4 2692 B10R0.6 CC(C)CC(C)OCCCF 34a_100000759539_100000731052 [1,1,0,0,0,0|2,0,0]=4 2693 B10R0.6 CC(C)CC(C)OCCCF 7a_100000211805_100011934791 [1,1,0,0,0,0|2,0,0]=4 2694 B10R0.6 CC(C)CC(C)OCCCN 34a_100000182051_100000731052 [1,1,0,0,0,0|2,0,0]=4 2695 B10R0.6 CC(C)CC(C)OCCCO 34a_100000211805_100000230001 [1,1,0,0,0,0|1,0,0]=3 2696 B10R0.6 CC(C)CC(C)OCCCO 7a_100000211805_100011215043 [1,1,0,0,0,0|1,0,0]=3 2697 B10R0.6 CC(C)CC(C)SCCCO 62a_100000731052_100011215043 [1,1,0,0,0,0|1,1,0]=4 2698 B10R0.6 CC(C)CC(C)SCCCO 62a_100011215043_100000731052 [1,1,0,0,0,0|1,1,0]=4 2699 B10R0.6 CC(O)CC(=O)CCCCO 1458a_100000695505_100011218427 [1,1,0,0,0,0|1,0,1]=4 2700 B10R0.6 CC(O)CN(C)CCCCO 2230a_100000227577_100000210776 [1,1,0,0,0,0|2,0,0]=4 2701 B10R0.6 CC(O)CN(C)CCCCO 2230a_100000717598_100011218427 [1,1,0,0,0,0|2,0,0]=4 2702 B10R0.6 CC(O)CN(C)CCCCO 269982a_100000227577_100000210776 [1,1,0,0,0,0|2,0,0]=4 2703 B10R0.6 CC(O)CN(C)CCCCO 269982a_100000717598_100011218427 [1,1,0,0,0,0|2,0,0]=4 2704 B10R0.6 CCCCCC(=O)CC(C)O 1458a_100000212188_100011218427 [1,1,0,0,0,0|1,0,1]=4 2705 B10R0.6 CCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210326 [1,1,0,0,0,0|1,0,1]=4 2706 B10R0.6 CCCCCN(C)CC(C)O 2230a_100000223495_100011218427 [1,1,0,0,0,0|2,0,0]=4 2707 B10R0.6 CCCCCN(C)CC(C)O 2230a_100000227577_100000210326 [1,1,0,0,0,0|2,0,0]=4 2708 B10R0.6 CCCCCN(C)CC(C)O 269982a_100000223495_100011218427 [1,1,0,0,0,0|2,0,0]=4 2709 B10R0.6 CCCCCN(C)CC(C)O 269982a_100000227577_100000210215 [1,1,0,0,0,0|2,0,0]=4 2710 B10R0.6 CCCCCN(C)C[C@@H](C)O 2230a_100000223495_100009817552 [1,1,0,0,0,0|2,0,0]=4 2711 B10R0.6 CCCCCN(C)C[C@@H](C)O 269982a_100000223495_100009817552 [1,1,0,0,0,0|2,0,0]=4 2712 B10R0.6 CCCCNC(=O)C[C@@H](C)O 240690a_100000102301_100011933948 [1,1,0,0,0,0|1,0,1]=4 2713 B10R0.6 CCCCNC(C)CC(C)C 2230a_100000102301_100000731052 [1,1,0,0,0,0|2,0,0]=4 2714 B10R0.6 CCCCNC(C)CC(C)C 2230a_100000692259_100000210211 [1,1,0,0,0,0|2,0,0]=4 2715 B10R0.6 CCCCNC(C)CC(C)C 7a_106832991798_100000731052 [1,1,0,0,0,0|2,0,0]=4 2716 B10R0.6 CCCCOC(C)CC(C)C 34a_100000210227_100000731052 [1,1,0,0,0,0|1,0,0]=3 2717 B10R0.6 CCCCOC(C)CC(C)C 34a_100000211805_100000210210 [1,1,0,0,0,0|1,0,0]=3 2718 B10R0.6 CCCCOC(C)CC(C)C 7a_100000210227_100000731052 [1,1,0,0,0,0|1,0,0]=3 2719 B10R0.6 CCCCOC(C)CC(C)C 7a_100000211805_100000210211 [1,1,0,0,0,0|1,0,0]=3 2720 B10R0.6 CCCCSC(C)CC(C)C 62a_100000210211_100000731052 [1,1,0,0,0,0|1,1,0]=4 2721 B10R0.6 CCCCSC(C)CC(C)C 62a_100000731052_100000210210 [1,1,0,0,0,0|1,1,0]=4 2722 B10R0.6 COCCOC(C)CC(C)C 34a_100000210237_100000731052 [1,1,0,0,0,0|2,0,0]=4 2723 B10R0.6 COCCOC(C)CC(C)C 34a_100000211805_100011201679 [1,1,0,0,0,0|2,0,0]=4 2724 B10R0.6 COCCOC(C)CC(C)C 7a_100000211805_100000233755 [1,1,0,0,0,0|2,0,0]=4 2725 B10R0.6 CSCCOC(C)CC(C)C 34a_100000211805_100000212216 [1,1,0,0,0,0|2,0,0]=4 2726 B10R0.6 CSCCOC(C)CC(C)C 34a_100000230434_100000731052 [1,1,0,0,0,0|2,0,0]=4 2727 B10R0.6 CSCCOC(C)CC(C)C 7a_100000211805_100000212216 [1,1,0,0,0,0|2,0,0]=4 2728 B10R0.6 CSCCOC(C)CC(C)C 7a_100000230434_100000731052 [1,1,0,0,0,0|2,0,0]=4 2729 B10R0.6 C[C@@H](O)CC(=O)CCCCO 1458a_100011933948_100000210776 [1,1,0,0,0,0|1,0,1]=4 2730 B10R0.6 C[C@@H](O)CC(=O)NCCCO 240690a_100000182051_100011933948 [1,1,0,0,0,0|1,0,1]=4 2731 B10R0.6 C[C@@H](O)CN(C)CCCCO 2230a_100000717598_100009817552 [1,1,0,0,0,0|2,0,0]=4 2732 B10R0.6 C[C@@H](O)CN(C)CCCCO 269982a_100000717598_100009817552 [1,1,0,0,0,0|2,0,0]=4 2733 B10R0.22 C#CCCOCCC(C)(C)O 34a_100011215631_100000702414 [1,1,0,0,0,0|0,0,2]=4 2734 B10R0.22 C/C=C/COCCC(C)(C)O 34a_100016270725_100000702414 [1,1,0,0,0,0|0,0,2]=4 2735 B10R0.22 C=CCCOCCC(C)(C)O 34a_100011205117_100000702414 [1,1,0,0,0,0|0,0,2]=4 2736 B10R0.22 CC#CCOCCC(C)(C)O 34a_100000761923_100000702414 [1,1,0,0,0,0|0,0,2]=4 2737 B10R0.22 CC(C)(C)CCNCCCO 2230a_100000738805_100000230001 [1,1,0,0,0,0|2,0,0]=4 2738 B10R0.22 CC(C)(C)CCOCCCBr 34a_100011217188_100000755188 [1,1,0,0,0,0|2,0,0]=4 2739 B10R0.22 CC(C)(C)CCOCCCCl 34a_100000230001_100000755188 [1,1,0,0,0,0|2,0,0]=4 2740 B10R0.22 CC(C)(C)CCOCCCF 34a_100000759539_100000755188 [1,1,0,0,0,0|2,0,0]=4 2741 B10R0.22 CC(C)(C)CCOCCCF 7a_100000765024_100011934791 [1,1,0,0,0,0|2,0,0]=4 2742 B10R0.22 CC(C)(C)CCOCCCN 34a_100000182051_100000755188 [1,1,0,0,0,0|2,0,0]=4 2743 B10R0.22 CC(C)(C)CCOCCCO 7a_100000765024_100011215043 [1,1,0,0,0,0|1,0,0]=3 2744 B10R0.22 CC(C)(C)CCSCCCO 62a_100000755188_100011215043 [1,1,0,0,0,0|1,1,0]=4 2745 B10R0.22 CC(C)(C)CCSCCCO 62a_100011215043_100000755188 [1,1,0,0,0,0|1,1,0]=4 2746 B10R0.22 CC(C)(F)CCNCCCO 2230a_100016253952_100000230001 [1,1,0,0,0,0|2,0,0]=4 2747 B10R0.22 CC(C)(O)CCCCCS[13CH3] 62a_100010402123_200025704644 [1,1,0,0,0,0|2,0,0]=4 2748 B10R0.22 CC(C)(O)CCCCCS[13CH3] 62a_200025704644_100010402123 [1,1,0,0,0,0|2,0,0]=4 2749 B10R0.22 CC(C)(O)CCCNCCO 2230a_100016997473_100009888830 [1,1,0,0,0,0|2,0,0]=4 2750 B10R0.22 CC(C)(O)CCCNCCO 34a_100016990907_100009888830 [1,1,0,0,0,0|2,0,0]=4 2751 B10R0.22 CC(C)(O)CCCSCCO 62a_100000211926_100009888830 [1,1,0,0,0,0|2,0,0]=4 2752 B10R0.22 CC(C)(O)CCCSCCO 62a_100009888830_100000211926 [1,1,0,0,0,0|2,0,0]=4 2753 B10R0.22 CC(C)(O)CCNCCCF 2230a_100015189416_100000702414 [1,1,0,0,0,0|2,0,0]=4 2754 B10R0.22 CC(C)(O)CCNCCCF 34a_100015189416_100000702414 [1,1,0,0,0,0|2,0,0]=4 2755 B10R0.22 CC(C)(O)CCOCCCBr 34a_100011217188_100000702414 [1,1,0,0,0,0|1,0,0]=3 2756 B10R0.22 CC(C)(O)CCOCCCCl 34a_100000230001_100000702414 [1,1,0,0,0,0|1,0,0]=3 2757 B10R0.22 CC(C)(O)CCOCCCF 34a_100000759539_100000702414 [1,1,0,0,0,0|1,0,0]=3 2758 B10R0.22 CC(C)(O)CCOCCCN 34a_100000182051_100000702414 [1,1,0,0,0,0|1,0,0]=3 2759 B10R0.22 CC(C)(O)CCOCCON 34a_100000700252_100000702414 [1,1,0,0,0,0|2,0,0]=4 2760 B10R0.22 CC(C)(O)CCSCCCF 62a_100000702414_100011934791 [1,1,0,0,0,0|1,1,0]=4 2761 B10R0.22 CC(C)(O)CCSCCCF 62a_100011934791_100000702414 [1,1,0,0,0,0|1,1,0]=4 2762 B10R0.22 CC(C)(O)CCSCCCO 62a_100000702414_100011215043 [1,1,0,0,0,0|0,1,0]=3 2763 B10R0.22 CC(C)(O)CCSCCCO 62a_100011215043_100000702414 [1,1,0,0,0,0|0,1,0]=3 2764 B10R0.22 CC(C)(O)CNCCCCO 2230a_100000751335_100000210776 [1,1,0,0,0,0|2,0,0]=4 2765 B10R0.22 CC(C)(O)CNCCCCO 34a_100000750430_100000764493 [1,1,0,0,0,0|2,0,0]=4 2766 B10R0.22 CC(C)(O)CSCCCCO 62a_100000210776_100000764493 [1,1,0,0,0,0|2,0,0]=4 2767 B10R0.22 CC(C)(O)CSCCCCO 62a_100000764493_100000210776 [1,1,0,0,0,0|2,0,0]=4 2768 B10R0.22 CCCCCNCC(C)(C)O 2230a_100000751335_100000210326 [1,1,0,0,0,0|2,0,0]=4 2769 B10R0.22 CCCCCOCC(C)(C)O 34a_100000210253_100000764493 [1,1,0,0,0,0|2,0,0]=4 2770 B10R0.22 CCCCCOCC(C)(C)O 7a_100000210253_100000764493 [1,1,0,0,0,0|2,0,0]=4 2771 B10R0.22 CCCCCSCC(C)(C)O 62a_100000210326_100000764493 [1,1,0,0,0,0|2,0,0]=4 2772 B10R0.22 CCCCCSCC(C)(C)O 62a_100000764493_100000210326 [1,1,0,0,0,0|2,0,0]=4 2773 B10R0.22 CCCCNCCC(C)(C)C 2230a_100000102301_100000755188 [1,1,0,0,0,0|2,0,0]=4 2774 B10R0.22 CCCCNCCC(C)(C)C 2230a_100000738805_100000210211 [1,1,0,0,0,0|2,0,0]=4 2775 B10R0.22 CCCCNCCC(C)(C)C 7a_106832991798_100000755188 [1,1,0,0,0,0|2,0,0]=4 2776 B10R0.22 CCCCNCCC(C)(C)F 2230a_100016253952_100000210211 [1,1,0,0,0,0|2,0,0]=4 2777 B10R0.22 CCCCNCCC(C)(C)O 2230a_100000102301_100000702414 [1,1,0,0,0,0|1,0,0]=3 2778 B10R0.22 CCCCNCCC(C)(C)O 7a_106832991798_100000702414 [1,1,0,0,0,0|1,0,0]=3 2779 B10R0.22 CCCCOCCC(C)(C)C 34a_100000210227_100000755188 [1,1,0,0,0,0|1,0,0]=3 2780 B10R0.22 CCCCOCCC(C)(C)C 7a_100000210227_100000755188 [1,1,0,0,0,0|1,0,0]=3 2781 B10R0.22 CCCCOCCC(C)(C)C 7a_100000765024_100000210211 [1,1,0,0,0,0|1,0,0]=3 2782 B10R0.22 CCCCOCCC(C)(C)O 34a_100000210227_100000702414 [1,1,0,0,0,0|0,0,0]=2 2783 B10R0.22 CCCCOCCC(C)(C)O 7a_100000210227_100000702414 [1,1,0,0,0,0|0,0,0]=2 2784 B10R0.22 CCCCOCCC(F)(F)F 34a_100000210227_100011219754 [1,1,0,0,0,0|2,0,0]=4 2785 B10R0.22 CCCCOCCC(F)(F)F 34a_100000752437_100000210210 [1,1,0,0,0,0|2,0,0]=4 2786 B10R0.22 CCCCOCCC(F)(F)F 7a_100000210227_100011219754 [1,1,0,0,0,0|2,0,0]=4 2787 B10R0.22 CCCCOCCS(=O)(=O)C 34a_100000210227_100000731031 [1,1,0,0,0,0|1,0,1]=4 2788 B10R0.22 CCCCOCCS(=O)(=O)C 34a_100000211924_100000210210 [1,1,0,0,0,0|1,0,1]=4 2789 B10R0.22 CCCCOCCS(=O)(=O)C 7a_100000210227_100000230027 [1,1,0,0,0,0|1,0,1]=4 2790 B10R0.22 CCCCOCCS(=O)(=O)C 7a_100000211924_100000210211 [1,1,0,0,0,0|1,0,1]=4 2791 B10R0.22 CCCCOCC[N+](C)(C)C 34a_100000210227_100000085578 [1,1,0,0,0,0|2,0,0]=4 2792 B10R0.22 CCCCOCC[N+](C)(C)C 7a_100000210227_100000085578 [1,1,0,0,0,0|2,0,0]=4 2793 B10R0.22 CCCCOCC[N+](C)(C)C 7a_200020618287_100000210211 [1,1,0,0,0,0|2,0,0]=4 2794 B10R0.22 CCCCOCC[Si](C)(C)C 34a_100000210227_200000733723 [1,1,0,0,0,0|1,1,0]=4 2795 B10R0.22 CCCCOCC[Si](C)(C)C 7a_100000039746_100000210211 [1,1,0,0,0,0|1,1,0]=4 2796 B10R0.22 CCCCOCC[Si](C)(C)C 7a_100000210227_200000733723 [1,1,0,0,0,0|1,1,0]=4 2797 B10R0.22 CCCCOCNC(C)(C)C 2230a_100000715429_100011995733 [1,1,0,0,0,0|2,0,0]=4 2798 B10R0.22 CCCCOCOC(C)(C)C 34a_100015890283_100011995733 [1,1,0,0,0,0|2,0,0]=4 2799 B10R0.22 CCCCOCSC(C)(C)C 62a_100000211941_100011995733 [1,1,0,0,0,0|2,0,0]=4 2800 B10R0.22 CCCCOCSC(C)(C)C 62a_100011995733_100000211941 [1,1,0,0,0,0|2,0,0]=4 2801 B10R0.22 CCCCSCCC(C)(C)C 62a_100000210211_100000755188 [1,1,0,0,0,0|1,1,0]=4 2802 B10R0.22 CCCCSCCC(C)(C)C 62a_100000755188_100000210210 [1,1,0,0,0,0|1,1,0]=4 2803 B10R0.22 CCCCSCCC(C)(C)O 62a_100000210211_100000702414 [1,1,0,0,0,0|0,1,0]=3 2804 B10R0.22 CCCCSCCC(C)(C)O 62a_100000702414_100000210210 [1,1,0,0,0,0|0,1,0]=3 2805 B10R0.22 CCCOCCCC(C)(C)O 34a_100000210258_100009888830 [1,1,0,0,0,0|2,0,0]=4 2806 B10R0.22 CCCSCCCC(C)(C)O 62a_100000210303_100009888830 [1,1,0,0,0,0|2,0,0]=4 2807 B10R0.22 CCCSCCCC(C)(C)O 62a_100009888830_100000210303 [1,1,0,0,0,0|2,0,0]=4 2808 B10R0.22 CCOCSCCC(C)(C)O 62a_100000702414_100000739092 [1,1,0,0,0,0|1,1,0]=4 2809 B10R0.22 CCOCSCCC(C)(C)O 62a_100000739092_100000702414 [1,1,0,0,0,0|1,1,0]=4 2810 B10R0.22 CNCCCCCC(C)(C)O 2230a_106832991635_100010402123 [1,1,0,0,0,0|2,0,0]=4 2811 B10R0.22 CNCCCCCC(C)(C)O 34a_100102657272_100010402123 [1,1,0,0,0,0|2,0,0]=4 2812 B10R0.22 CNCCCCCC(C)(C)O 7a_106832991635_100010402123 [1,1,0,0,0,0|2,0,0]=4 2813 B10R0.22 COCCCCCC(C)(C)O 34a_100138415774_100010402123 [1,1,0,0,0,0|2,0,0]=4 2814 B10R0.22 COCCNCCC(C)(C)O 2230a_100000209980_100000702414 [1,1,0,0,0,0|2,0,0]=4 2815 B10R0.22 COCCOCCC(C)(C)C 34a_100000210237_100000755188 [1,1,0,0,0,0|2,0,0]=4 2816 B10R0.22 COCCOCCC(C)(C)C 7a_100000765024_100000233755 [1,1,0,0,0,0|2,0,0]=4 2817 B10R0.22 COCCOCCC(C)(C)O 34a_100000210237_100000702414 [1,1,0,0,0,0|1,0,0]=3 2818 B10R0.22 COCCSCCC(C)(C)O 62a_100000233755_100000702414 [1,1,0,0,0,0|1,1,0]=4 2819 B10R0.22 COCCSCCC(C)(C)O 62a_100000702414_100000233755 [1,1,0,0,0,0|1,1,0]=4 2820 B10R0.22 CS(=O)(=O)CCOCCCO 34a_100000211924_100000230001 [1,1,0,0,0,0|1,0,1]=4 2821 B10R0.22 CS(=O)(=O)CCOCCCO 7a_100000211924_100011215043 [1,1,0,0,0,0|1,0,1]=4 2822 B10R0.22 CSCCCCCC(C)(C)O 62a_100010402123_200000210301 [1,1,0,0,0,0|2,0,0]=4 2823 B10R0.22 CSCCCCCC(C)(C)O 62a_200000210301_100010402123 [1,1,0,0,0,0|2,0,0]=4 2824 B10R0.22 CSCCNCCC(C)(C)O 2230a_100020590264_100000702414 [1,1,0,0,0,0|2,0,0]=4 2825 B10R0.22 CSCCOCCC(C)(C)C 34a_100000230434_100000755188 [1,1,0,0,0,0|2,0,0]=4 2826 B10R0.22 CSCCOCCC(C)(C)C 7a_100000230434_100000755188 [1,1,0,0,0,0|2,0,0]=4 2827 B10R0.22 CSCCOCCC(C)(C)C 7a_100000765024_100000212216 [1,1,0,0,0,0|2,0,0]=4 2828 B10R0.22 CSCCOCCC(C)(C)O 34a_100000230434_100000702414 [1,1,0,0,0,0|1,0,0]=3 2829 B10R0.22 CSCCOCCC(C)(C)O 7a_100000230434_100000702414 [1,1,0,0,0,0|1,0,0]=3 2830 B10R0.22 CSCCSCCC(C)(C)O 62a_100000212216_100000702414 [1,1,0,0,0,0|1,1,0]=4 2831 B10R0.22 CSCCSCCC(C)(C)O 62a_100000702414_100000751147 [1,1,0,0,0,0|1,1,0]=4 2832 B10R0.22 C[N+](C)(C)CCOCCCO 7a_200020618287_100011215043 [1,1,0,0,0,0|2,0,0]=4 2833 B10R0.22 C[Si](C)(C)CCOCCCO 7a_100000039746_100011215043 [1,1,0,0,0,0|1,1,0]=4 2834 B10R0.22 OCCCOCCC(F)(F)F 34a_100000752437_100000230001 [1,1,0,0,0,0|2,0,0]=4 2835 B10R0.55 C=C(C)CCOCC(C)CC 34a_100000764851_100000748023 [1,1,0,0,0,0|1,0,1]=4 2836 B10R0.55 C=C(C)CCOCC(O)CC 34a_100000764851_100011218378 [1,1,0,0,0,0|1,0,1]=4 2837 B10R0.55 C=C(C)CCOCC(O)CO 34a_100000764851_100011219619 [1,1,0,0,0,0|1,0,1]=4 2838 B10R0.55 C=C(C)CCOC[C@@H](C)CC 34a_100000764851_100009816398 [1,1,0,0,0,0|1,0,1]=4 2839 B10R0.55 C=C(C)CCOC[C@@H](C)CC 7a_100009816381_100000730704 [1,1,0,0,0,0|1,0,1]=4 2840 B10R0.55 C=C(C)CCOC[C@@H](C)CO 34a_100000764851_100000059175 [1,1,0,0,0,0|1,0,1]=4 2841 B10R0.55 C=C(C)CCOC[C@@H](O)CO 34a_100000764851_100009815848 [1,1,0,0,0,0|1,0,1]=4 2842 B10R0.55 C=CC(C)COCCC(C)O 34a_100011215527_100012276601 [1,1,0,0,0,0|0,0,2]=4 2843 B10R0.55 C=CC(C)COCCC(C)O 7a_100011215527_100012276601 [1,1,0,0,0,0|0,0,2]=4 2844 B10R0.55 C=C[C@H](N)COCCC(C)O 34a_100016989147_100012276601 [1,1,0,0,0,0|0,0,2]=4 2845 B10R0.55 CC(=O)CCOCC(O)CO 34a_100000759926_100011219619 [1,1,0,0,0,0|0,0,2]=4 2846 B10R0.55 CC(=O)CCOCC(O)CO 7a_100000759926_100011219619 [1,1,0,0,0,0|0,0,2]=4 2847 B10R0.55 CC(=O)CCOC[C@@H](C)CO 34a_100000759926_100000059175 [1,1,0,0,0,0|0,0,2]=4 2848 B10R0.55 CC(=O)CCOC[C@@H](C)CO 7a_100000759926_100000059175 [1,1,0,0,0,0|0,0,2]=4 2849 B10R0.55 CC(=O)CCOC[C@@H](O)CO 34a_100000759926_100009815848 [1,1,0,0,0,0|0,0,2]=4 2850 B10R0.55 CC(=O)CCOC[C@@H](O)CO 7a_100000759926_100009815848 [1,1,0,0,0,0|0,0,2]=4 2851 B10R0.55 CC(Br)CCOCC(O)CO 34a_100009893172_100011219619 [1,1,0,0,0,0|1,0,0]=3 2852 B10R0.55 CC(Br)CCOC[C@@H](C)CO 34a_100009893172_100000059175 [1,1,0,0,0,0|1,0,0]=3 2853 B10R0.55 CC(Br)CCOC[C@@H](O)CF 34a_100009893172_100015614560 [1,1,0,0,0,0|2,0,0]=4 2854 B10R0.55 CC(Br)CCOC[C@@H](O)CO 34a_100009893172_100009815848 [1,1,0,0,0,0|1,0,0]=3 2855 B10R0.55 CC(C)CCNCC(C)CO 269862a_100000744482_100000185833 [1,1,0,0,0,0|2,0,0]=4 2856 B10R0.55 CC(C)CCNCC(C)CO 34a_100000744482_100000210312 [1,1,0,0,0,0|2,0,0]=4 2857 B10R0.55 CC(C)CCNC[C@@H](F)CO 269862a_100015665980_100000185833 [1,1,0,0,0,0|2,0,0]=4 2858 B10R0.55 CC(C)CCNC[C@@H](F)CO 34a_100015665980_100000210312 [1,1,0,0,0,0|2,0,0]=4 2859 B10R0.55 CC(C)CCNC[C@H](O)CO 2230a_100020644852_100000210312 [1,1,0,0,0,0|2,0,0]=4 2860 B10R0.55 CC(C)CCNC[C@H](O)CO 269862a_100020644852_100000185833 [1,1,0,0,0,0|2,0,0]=4 2861 B10R0.55 CC(C)CCOCC(C)CN 34a_100000744482_100000210312 [1,1,0,0,0,0|2,0,0]=4 2862 B10R0.55 CC(C)CCOCC(Cl)CCl 34a_100000033668_100000210312 [1,1,0,0,0,0|2,0,0]=4 2863 B10R0.55 CC(C)CCOCC(O)CO 34a_100000210254_100011219619 [1,1,0,0,0,0|1,0,0]=3 2864 B10R0.55 CC(C)CCOCC(O)CO 7a_100000210254_100011219619 [1,1,0,0,0,0|1,0,0]=3 2865 B10R0.55 CC(C)CCOC[C@@H](C)CO 34a_100000210254_100000059175 [1,1,0,0,0,0|1,0,0]=3 2866 B10R0.55 CC(C)CCOC[C@@H](C)CO 7a_100000210254_100000059175 [1,1,0,0,0,0|1,0,0]=3 2867 B10R0.55 CC(C)CCOC[C@@H](O)CF 34a_100000210254_100015614560 [1,1,0,0,0,0|2,0,0]=4 2868 B10R0.55 CC(C)CCOC[C@@H](O)CF 7a_100000210254_100015614560 [1,1,0,0,0,0|2,0,0]=4 2869 B10R0.55 CC(C)CCOC[C@@H](O)CO 34a_100000210254_100009815848 [1,1,0,0,0,0|1,0,0]=3 2870 B10R0.55 CC(C)CCOC[C@@H](O)CO 7a_100000210254_100009815848 [1,1,0,0,0,0|1,0,0]=3 2871 B10R0.55 CC(C)CCOC[C@H](F)CN 34a_100015665980_100000210312 [1,1,0,0,0,0|2,0,0]=4 2872 B10R0.55 CC(C)CCSCC(O)CO 62a_100000210312_100011219619 [1,1,0,0,0,0|1,1,0]=4 2873 B10R0.55 CC(C)CCSCC(O)CO 62a_100011219619_100000210312 [1,1,0,0,0,0|1,1,0]=4 2874 B10R0.55 CC(C)CCSC[C@@H](C)CO 62a_100000059175_100000210312 [1,1,0,0,0,0|1,1,0]=4 2875 B10R0.55 CC(C)CCSC[C@@H](C)CO 62a_100000210312_100000059175 [1,1,0,0,0,0|1,1,0]=4 2876 B10R0.55 CC(C)CCSC[C@@H](O)CO 62a_100000210312_100009815848 [1,1,0,0,0,0|1,1,0]=4 2877 B10R0.55 CC(C)CCSC[C@@H](O)CO 62a_100009815848_100000210312 [1,1,0,0,0,0|1,1,0]=4 2878 B10R0.55 CC(CO)CCNC[C@@H](C)O 2230a_106354213184_100009817552 [1,1,0,0,0,0|2,0,0]=4 2879 B10R0.55 CC(CO)CCNC[C@@H](C)O 34a_106354213184_100009817552 [1,1,0,0,0,0|2,0,0]=4 2880 B10R0.55 CC(O)CCCN[C@H](C)CO 2230a_100000737577_200000718107 [1,1,0,0,0,0|2,0,0]=4 2881 B10R0.55 CC(O)CCCSC(C)CO 62a_100012180447_200000718107 [1,1,0,0,0,0|2,0,0]=4 2882 B10R0.55 CC(O)CCCS[C@H](C)CO 62a_100016084084_200000718107 [1,1,0,0,0,0|2,0,0]=4 2883 B10R0.55 CC(O)CCCS[C@H](C)CO 62a_200000718107_100016084084 [1,1,0,0,0,0|2,0,0]=4 2884 B10R0.55 CC(O)CCNCC(C)CO 34a_100000744482_100012276601 [1,1,0,0,0,0|1,0,0]=3 2885 B10R0.55 CC(O)CCNCC(O)CO 2230a_200000755665_100011219619 [1,1,0,0,0,0|1,0,0]=3 2886 B10R0.55 CC(O)CCNC[C@@H](C)CO 2230a_200000755665_100000059175 [1,1,0,0,0,0|1,0,0]=3 2887 B10R0.55 CC(O)CCNC[C@@H](F)CO 34a_100015665980_100012276601 [1,1,0,0,0,0|1,0,0]=3 2888 B10R0.55 CC(O)CCNC[C@@H](O)CF 2230a_200000755665_100015614560 [1,1,0,0,0,0|2,0,0]=4 2889 B10R0.55 CC(O)CCNC[C@@H](O)CO 2230a_200000755665_100009815848 [1,1,0,0,0,0|1,0,0]=3 2890 B10R0.55 CC(O)CCNC[C@H](O)CO 2230a_100020644852_100012276601 [1,1,0,0,0,0|1,0,0]=3 2891 B10R0.55 CC(O)CCOCC(C)CN 34a_100000744482_100012276601 [1,1,0,0,0,0|1,0,0]=3 2892 B10R0.55 CC(O)CCOCC(Cl)CCl 34a_100000033668_100012276601 [1,1,0,0,0,0|1,0,0]=3 2893 B10R0.55 CC(O)CCOC[C@H](F)CN 34a_100015665980_100012276601 [1,1,0,0,0,0|1,0,0]=3 2894 B10R0.55 CC(O)CCSCC(O)CO 62a_100011219619_100012276601 [1,1,0,0,0,0|0,1,0]=3 2895 B10R0.55 CC(O)CCSCC(O)CO 62a_100012276601_100011219619 [1,1,0,0,0,0|0,1,0]=3 2896 B10R0.55 CC(O)CCSC[C@@H](C)CO 62a_100000059175_100012276601 [1,1,0,0,0,0|0,1,0]=3 2897 B10R0.55 CC(O)CCSC[C@@H](C)CO 62a_100012276601_100000059175 [1,1,0,0,0,0|0,1,0]=3 2898 B10R0.55 CC(O)CCSC[C@@H](O)CF 62a_100012276601_100015614560 [1,1,0,0,0,0|1,1,0]=4 2899 B10R0.55 CC(O)CCSC[C@@H](O)CF 62a_100015614560_100012276601 [1,1,0,0,0,0|1,1,0]=4 2900 B10R0.55 CC(O)CCSC[C@@H](O)CO 62a_100009815848_100012276601 [1,1,0,0,0,0|0,1,0]=3 2901 B10R0.55 CC(O)CCSC[C@@H](O)CO 62a_100012276601_100009815848 [1,1,0,0,0,0|0,1,0]=3 2902 B10R0.55 CC(O)CNCCC(C)CO 2230a_106354213184_100011218427 [1,1,0,0,0,0|2,0,0]=4 2903 B10R0.55 CC(O)CNCCC(C)CO 34a_106354213184_100011218427 [1,1,0,0,0,0|2,0,0]=4 2904 B10R0.55 CCC(=O)COCCC(C)C 34a_100000725409_100000210312 [1,1,0,0,0,0|1,0,1]=4 2905 B10R0.55 CCC(=O)COCCC(C)C 7a_100000210254_100000747405 [1,1,0,0,0,0|1,0,1]=4 2906 B10R0.55 CCC(=O)COCCC(C)O 34a_100000725409_100012276601 [1,1,0,0,0,0|0,0,1]=3 2907 B10R0.55 CCC(=O)CSCCC(C)O 62a_100000747405_100012276601 [1,1,0,0,0,0|0,1,1]=4 2908 B10R0.55 CCC(=O)CSCCC(C)O 62a_100012276601_100000747405 [1,1,0,0,0,0|0,1,1]=4 2909 B10R0.55 CCC(C)CCNCC(C)O 2230a_100020591266_100011218427 [1,1,0,0,0,0|2,0,0]=4 2910 B10R0.55 CCC(C)CCNC[C@@H](C)O 2230a_100020591266_100009817552 [1,1,0,0,0,0|2,0,0]=4 2911 B10R0.55 CCC(C)CCOCC(C)O 7a_100011215188_100011218427 [1,1,0,0,0,0|2,0,0]=4 2912 B10R0.55 CCC(C)CCOC[C@@H](C)O 7a_100011215188_100009817552 [1,1,0,0,0,0|2,0,0]=4 2913 B10R0.55 CCC(C)CNCCC(C)C 2230a_100020588543_100000210312 [1,1,0,0,0,0|2,0,0]=4 2914 B10R0.55 CCC(C)CNCCC(C)C 269862a_100020588543_100000185833 [1,1,0,0,0,0|2,0,0]=4 2915 B10R0.55 CCC(C)CNCCC(C)C 270004a_100000210545_100000243153 [1,1,0,0,0,0|2,0,0]=4 2916 B10R0.55 CCC(C)CNCCC(C)O 2230a_100020588543_100012276601 [1,1,0,0,0,0|1,0,0]=3 2917 B10R0.55 CCC(C)CNCCC(C)O 2230a_200000755665_100000748023 [1,1,0,0,0,0|1,0,0]=3 2918 B10R0.55 CCC(C)CNCCC(C)O 270004a_200000755665_100000243153 [1,1,0,0,0,0|1,0,0]=3 2919 B10R0.55 CCC(C)COCCC(=O)C 34a_100000759926_100000748023 [1,1,0,0,0,0|0,0,2]=4 2920 B10R0.55 CCC(C)COCCC(=O)C 7a_100000759926_100000748023 [1,1,0,0,0,0|0,0,2]=4 2921 B10R0.55 CCC(C)COCCC(C)Br 34a_100009893172_100000748023 [1,1,0,0,0,0|1,0,0]=3 2922 B10R0.55 CCC(C)COCCC(C)C 34a_100000210254_100000748023 [1,1,0,0,0,0|1,0,0]=3 2923 B10R0.55 CCC(C)COCCC(C)C 7a_100000210254_100000748023 [1,1,0,0,0,0|1,0,0]=3 2924 B10R0.55 CCC(C)COCCC(F)F 34a_100103093639_100000748023 [1,1,0,0,0,0|2,0,0]=4 2925 B10R0.55 CCC(C)COCC[C@@H](C)N 34a_100000706166_100000748023 [1,1,0,0,0,0|1,0,0]=3 2926 B10R0.55 CCC(C)CSCCC(C)C 62a_100000210312_100000748023 [1,1,0,0,0,0|1,1,0]=4 2927 B10R0.55 CCC(C)CSCCC(C)C 62a_100000748023_100000210312 [1,1,0,0,0,0|1,1,0]=4 2928 B10R0.55 CCC(C)CSCCC(C)O 62a_100000748023_100012276601 [1,1,0,0,0,0|0,1,0]=3 2929 B10R0.55 CCC(C)CSCCC(C)O 62a_100012276601_100000748023 [1,1,0,0,0,0|0,1,0]=3 2930 B10R0.55 CCC(C)NCCCC(C)O 2230a_100000209981_200000718107 [1,1,0,0,0,0|2,0,0]=4 2931 B10R0.55 CCC(C)OCCCC(C)O 7a_100000210228_200000718107 [1,1,0,0,0,0|2,0,0]=4 2932 B10R0.55 CCC(C)SCCCC(C)O 62a_100000758301_200000718107 [1,1,0,0,0,0|2,0,0]=4 2933 B10R0.55 CCC(C)SCCCC(C)O 62a_200000718107_100000758301 [1,1,0,0,0,0|2,0,0]=4 2934 B10R0.55 CCC(O)CNCCC(C)C 2230a_100011218483_100000210312 [1,1,0,0,0,0|2,0,0]=4 2935 B10R0.55 CCC(O)CNCCC(C)C 269862a_100011218483_100000185833 [1,1,0,0,0,0|2,0,0]=4 2936 B10R0.55 CCC(O)CNCCC(C)O 2230a_100011218483_100012276601 [1,1,0,0,0,0|1,0,0]=3 2937 B10R0.55 CCC(O)CNCCC(C)O 2230a_200000755665_100011218378 [1,1,0,0,0,0|1,0,0]=3 2938 B10R0.55 CCC(O)COCCC(=O)C 34a_100000759926_100011218378 [1,1,0,0,0,0|0,0,2]=4 2939 B10R0.55 CCC(O)COCCC(=O)C 7a_100000759926_100011218378 [1,1,0,0,0,0|0,0,2]=4 2940 B10R0.55 CCC(O)COCCC(C)Br 34a_100009893172_100011218378 [1,1,0,0,0,0|1,0,0]=3 2941 B10R0.55 CCC(O)COCCC(C)C 34a_100000210254_100011218378 [1,1,0,0,0,0|1,0,0]=3 2942 B10R0.55 CCC(O)COCCC(C)C 7a_100000210254_100011218378 [1,1,0,0,0,0|1,0,0]=3 2943 B10R0.55 CCC(O)COCCC(F)F 34a_100103093639_100011218378 [1,1,0,0,0,0|2,0,0]=4 2944 B10R0.55 CCC(O)COCC[C@@H](C)N 34a_100000706166_100011218378 [1,1,0,0,0,0|1,0,0]=3 2945 B10R0.55 CCC(O)CSCCC(C)C 62a_100000210312_100011218378 [1,1,0,0,0,0|1,1,0]=4 2946 B10R0.55 CCC(O)CSCCC(C)C 62a_100011218378_100000210312 [1,1,0,0,0,0|1,1,0]=4 2947 B10R0.55 CCC(O)CSCCC(C)O 62a_100011218378_100012276601 [1,1,0,0,0,0|0,1,0]=3 2948 B10R0.55 CCC(O)CSCCC(C)O 62a_100012276601_100011218378 [1,1,0,0,0,0|0,1,0]=3 2949 B10R0.55 CC[C@H](C)CNCCC(C)O 2230a_200000755665_100009816398 [1,1,0,0,0,0|1,0,0]=3 2950 B10R0.55 CC[C@H](C)COCCC(=O)C 34a_100000759926_100009816398 [1,1,0,0,0,0|0,0,2]=4 2951 B10R0.55 CC[C@H](C)COCCC(=O)C 7a_100000759926_100009816398 [1,1,0,0,0,0|0,0,2]=4 2952 B10R0.55 CC[C@H](C)COCCC(=O)C 7a_100009816381_100000053229 [1,1,0,0,0,0|0,0,2]=4 2953 B10R0.55 CC[C@H](C)COCCC(C)Br 34a_100009893172_100009816398 [1,1,0,0,0,0|1,0,0]=3 2954 B10R0.55 CC[C@H](C)COCCC(C)C 34a_100000210254_100009816398 [1,1,0,0,0,0|1,0,0]=3 2955 B10R0.55 CC[C@H](C)COCCC(C)C 7a_100000210254_100009816398 [1,1,0,0,0,0|1,0,0]=3 2956 B10R0.55 CC[C@H](C)COCCC(C)C 7a_100009816381_100000210626 [1,1,0,0,0,0|1,0,0]=3 2957 B10R0.55 CC[C@H](C)COCCC(C)O 7a_100009816381_100012276601 [1,1,0,0,0,0|0,0,0]=2 2958 B10R0.55 CC[C@H](C)COCCC(F)F 34a_100103093639_100009816398 [1,1,0,0,0,0|2,0,0]=4 2959 B10R0.55 CC[C@H](C)COCCN(C)C 7a_100009816381_100000755713 [1,1,0,0,0,0|2,0,0]=4 2960 B10R0.55 CC[C@H](C)COCC[C@@H](C)N 34a_100000706166_100009816398 [1,1,0,0,0,0|1,0,0]=3 2961 B10R0.55 CC[C@H](C)CSCCC(C)C 62a_100000210312_100009816398 [1,1,0,0,0,0|1,1,0]=4 2962 B10R0.55 CC[C@H](C)CSCCC(C)C 62a_100009816398_100000210312 [1,1,0,0,0,0|1,1,0]=4 2963 B10R0.55 CC[C@H](C)CSCCC(C)O 62a_100009816398_100012276601 [1,1,0,0,0,0|0,1,0]=3 2964 B10R0.55 CC[C@H](C)CSCCC(C)O 62a_100012276601_100009816398 [1,1,0,0,0,0|0,1,0]=3 2965 B10R0.55 CNC(=O)COCCC(C)O 34a_100000750040_100012276601 [1,1,0,0,0,0|1,0,1]=4 2966 B10R0.55 COC(C)COCCC(C)C 34a_100000690652_100000210312 [1,1,0,0,0,0|2,0,0]=4 2967 B10R0.55 COC(C)COCCC(C)O 34a_100000690652_100012276601 [1,1,0,0,0,0|1,0,0]=3 2968 B10R0.55 CO[C@H](C)CNCCC(C)O 2230a_100020591295_100012276601 [1,1,0,0,0,0|2,0,0]=4 2969 B10R0.55 C[C@@H](CO)COCCC(F)F 34a_100103093639_100000059175 [1,1,0,0,0,0|2,0,0]=4 2970 B10R0.55 C[C@@H](CO)COCC[C@@H](C)N 34a_100000706166_100000059175 [1,1,0,0,0,0|1,0,0]=3 2971 B10R0.55 C[C@@H](N)CCOCC(O)CO 34a_100000706166_100011219619 [1,1,0,0,0,0|1,0,0]=3 2972 B10R0.55 C[C@@H](N)CCOC[C@@H](O)CF 34a_100000706166_100015614560 [1,1,0,0,0,0|2,0,0]=4 2973 B10R0.55 C[C@@H](N)CCOC[C@@H](O)CO 34a_100000706166_100009815848 [1,1,0,0,0,0|1,0,0]=3 2974 B10R0.55 OCC(O)COCCC(F)F 34a_100103093639_100011219619 [1,1,0,0,0,0|2,0,0]=4 2975 B10R0.55 OC[C@H](O)COCCC(F)F 34a_100103093639_100009815848 [1,1,0,0,0,0|2,0,0]=4 2976 B10R0.74 C#CC(C)NCOCCCC 2230a_100000707721_100011995733 [1,1,0,0,0,0|2,0,0]=4 2977 B10R0.74 C#CC(C)NCOCCCC 34a_100000707721_100011995733 [1,1,0,0,0,0|2,0,0]=4 2978 B10R0.74 C#CC(C)SCOCCCC 62a_200000035995_100011995733 [1,1,0,0,0,0|2,0,0]=4 2979 B10R0.74 C#CCCOCCC(C)OC 7a_100000764861_100000688953 [1,1,0,0,0,0|0,0,2]=4 2980 B10R0.74 C#C[C@@H](C)OCOCCCC 34a_100009815206_100011995733 [1,1,0,0,0,0|2,0,0]=4 2981 B10R0.74 C/C=C/COCCC(C)OC 7a_100000764861_100102629194 [1,1,0,0,0,0|0,0,2]=4 2982 B10R0.74 C=CC(C)OCOCCCC 34a_100000695699_100011995733 [1,1,0,0,0,0|2,0,0]=4 2983 B10R0.74 C=CC(C)SCOCCCC 62a_100011215867_100011995733 [1,1,0,0,0,0|2,0,0]=4 2984 B10R0.74 C=CCCOCCC(C)OC 7a_100000764861_100000754431 [1,1,0,0,0,0|0,0,2]=4 2985 B10R0.74 CC#CCOCCC(C)OC 7a_100000764861_100000748600 [1,1,0,0,0,0|0,0,2]=4 2986 B10R0.74 CC(CO)CCNCCCF 2230a_106354213184_100011934791 [1,1,0,0,0,0|2,0,0]=4 2987 B10R0.74 CC(CO)CCNCCCF 34a_106354213184_100011934791 [1,1,0,0,0,0|2,0,0]=4 2988 B10R0.74 CC(CO)CCNCCCO 2230a_106354213184_100000230001 [1,1,0,0,0,0|1,0,0]=3 2989 B10R0.74 CC(CO)CCNCCCO 34a_106354213184_100000230001 [1,1,0,0,0,0|1,0,0]=3 2990 B10R0.74 CC(CO)CNCCCCO 34a_100000744482_100011216708 [1,1,0,0,0,0|2,0,0]=4 2991 B10R0.74 CC(CO)NCCCCCO 2230a_100000762737_100012180447 [1,1,0,0,0,0|2,0,0]=4 2992 B10R0.74 CC(CO)NCCCCCO 34a_100000762737_100012180447 [1,1,0,0,0,0|2,0,0]=4 2993 B10R0.74 CC(CO)SCCCCCO 62a_100012180447_100000746330 [1,1,0,0,0,0|2,0,0]=4 2994 B10R0.74 CC=CCOCCC(C)OC 7a_100000764861_100000070051 [1,1,0,0,0,0|0,0,2]=4 2995 B10R0.74 CCC(C)CCNCCCO 2230a_100020591266_100000230001 [1,1,0,0,0,0|2,0,0]=4 2996 B10R0.74 CCC(C)CCOCCCF 7a_100011215188_100011934791 [1,1,0,0,0,0|2,0,0]=4 2997 B10R0.74 CCC(C)CCOCCCO 7a_100011215188_100011215043 [1,1,0,0,0,0|1,0,0]=3 2998 B10R0.74 CCC(C)CCOCCOC 7a_100011215188_100000233755 [1,1,0,0,0,0|2,0,0]=4 2999 B10R0.74 CCC(C)CCOCCSC 7a_100011215188_100000212216 [1,1,0,0,0,0|2,0,0]=4 3000 B10R0.74 CCC(O)CNCCCCO 2230a_100000750430_100011218378 [1,1,0,0,0,0|2,0,0]=4 3001 B10R0.74 CCC(O)CNCCCCO 2230a_100011218483_100000210776 [1,1,0,0,0,0|2,0,0]=4 3002 B10R0.74 CCC(O)CNCCCCO 34a_100000750430_100011218378 [1,1,0,0,0,0|2,0,0]=4 3003 B10R0.74 CCC(O)CSCCCCO 62a_100000210776_100011218378 [1,1,0,0,0,0|2,0,0]=4 3004 B10R0.74 CCC(O)CSCCCCO 62a_100011218378_100000210776 [1,1,0,0,0,0|2,0,0]=4 3005 B10R0.74 CCCCCCCC(C)NC 2230a_106832991635_200011218727 [1,1,0,0,0,0|2,0,0]=4 3006 B10R0.74 CCCCCCCC(C)NC 270004a_106832991635_100000210596 [1,1,0,0,0,0|2,0,0]=4 3007 B10R0.74 CCCCCCCC(C)NC 34a_100102657272_200011218727 [1,1,0,0,0,0|2,0,0]=4 3008 B10R0.74 CCCCCCCC(C)NC 7a_106832991635_200011218727 [1,1,0,0,0,0|2,0,0]=4 3009 B10R0.74 CCCCCCCC(C)OC 34a_100138415774_200011218727 [1,1,0,0,0,0|1,0,0]=3 3010 B10R0.74 CCCCCCCC(C)OC 34a_200011215852_200000210301 [1,1,0,0,0,0|1,0,0]=3 3011 B10R0.74 CCCCCCCC(C)OC 7a_200011215852_200000210301 [1,1,0,0,0,0|1,0,0]=3 3012 B10R0.74 CCCCCCCC(C)O[13CH3] 34a_200011215852_200025704644 [1,1,0,0,0,0|1,0,0]=3 3013 B10R0.74 CCCCCCCC(C)O[13CH3] 7a_200011215852_200025704644 [1,1,0,0,0,0|1,0,0]=3 3014 B10R0.74 CCCCCCCC(C)SC 62a_200000210301_200011218727 [1,1,0,0,0,0|1,1,0]=4 3015 B10R0.74 CCCCCCCC(C)SC 62a_200011218727_200000210301 [1,1,0,0,0,0|1,1,0]=4 3016 B10R0.74 CCCCCCCC(C)S[13CH3] 62a_200011218727_200025704644 [1,1,0,0,0,0|1,1,0]=4 3017 B10R0.74 CCCCCCCC(C)S[13CH3] 62a_200025704644_200011218727 [1,1,0,0,0,0|1,1,0]=4 3018 B10R0.74 CCCCCCNC(C)CO 2230a_100000210581_100012180447 [1,1,0,0,0,0|2,0,0]=4 3019 B10R0.74 CCCCCCN[C@H](C)CO 2230a_100000737577_100000210314 [1,1,0,0,0,0|2,0,0]=4 3020 B10R0.74 CCCCCCOC(C)CO 34a_100000210259_100012180447 [1,1,0,0,0,0|2,0,0]=4 3021 B10R0.74 CCCCCCOC(C)CO 7a_100000210259_100012180447 [1,1,0,0,0,0|2,0,0]=4 3022 B10R0.74 CCCCCCSC(C)CO 62a_100012180447_100000210757 [1,1,0,0,0,0|2,0,0]=4 3023 B10R0.74 CCCCCCSC(C)OC 62a_100000210314_100009879195 [1,1,0,0,0,0|2,0,0]=4 3024 B10R0.74 CCCCCCSC(C)OC 62a_100009879195_100000210757 [1,1,0,0,0,0|2,0,0]=4 3025 B10R0.74 CCCCCCS[C@H](C)CO 62a_100000210314_100016084084 [1,1,0,0,0,0|2,0,0]=4 3026 B10R0.74 CCCCCCS[C@H](C)CO 62a_100016084084_100000210757 [1,1,0,0,0,0|2,0,0]=4 3027 B10R0.74 CCCCCNCC(C)CO 34a_100000744482_100000718602 [1,1,0,0,0,0|2,0,0]=4 3028 B10R0.74 CCCCCNCC(O)CC 2230a_100000209983_100011218378 [1,1,0,0,0,0|2,0,0]=4 3029 B10R0.74 CCCCCNCC(O)CC 2230a_100011218483_100000210326 [1,1,0,0,0,0|2,0,0]=4 3030 B10R0.74 CCCCCNCC(O)CO 2230a_100000209983_100011219619 [1,1,0,0,0,0|2,0,0]=4 3031 B10R0.74 CCCCCNC[C@@H](C)CO 2230a_100000209983_100000059175 [1,1,0,0,0,0|2,0,0]=4 3032 B10R0.74 CCCCCNC[C@@H](C)OC 2230a_100020591295_100000210326 [1,1,0,0,0,0|2,0,0]=4 3033 B10R0.74 CCCCCNC[C@@H](O)CF 2230a_100000209983_100015614560 [1,1,0,0,0,0|2,0,0]=4 3034 B10R0.74 CCCCCNC[C@@H](O)CO 2230a_100000209983_100009815848 [1,1,0,0,0,0|2,0,0]=4 3035 B10R0.74 CCCCCNC[C@H](O)CO 2230a_100020644852_100000210326 [1,1,0,0,0,0|2,0,0]=4 3036 B10R0.74 CCCCCOCC(C)OC 34a_100000690652_100000718602 [1,1,0,0,0,0|2,0,0]=4 3037 B10R0.74 CCCCCOCC(O)CC 34a_100000210253_100011218378 [1,1,0,0,0,0|2,0,0]=4 3038 B10R0.74 CCCCCOCC(O)CC 7a_100000210253_100011218378 [1,1,0,0,0,0|2,0,0]=4 3039 B10R0.74 CCCCCOCC(O)CO 34a_100000210253_100011219619 [1,1,0,0,0,0|2,0,0]=4 3040 B10R0.74 CCCCCOCC(O)CO 7a_100000210253_100011219619 [1,1,0,0,0,0|2,0,0]=4 3041 B10R0.74 CCCCCOC[C@@H](C)CO 34a_100000210253_100000059175 [1,1,0,0,0,0|2,0,0]=4 3042 B10R0.74 CCCCCOC[C@@H](C)CO 7a_100000210253_100000059175 [1,1,0,0,0,0|2,0,0]=4 3043 B10R0.74 CCCCCOC[C@@H](O)CF 34a_100000210253_100015614560 [1,1,0,0,0,0|2,0,0]=4 3044 B10R0.74 CCCCCOC[C@@H](O)CF 7a_100000210253_100015614560 [1,1,0,0,0,0|2,0,0]=4 3045 B10R0.74 CCCCCOC[C@@H](O)CO 34a_100000210253_100009815848 [1,1,0,0,0,0|2,0,0]=4 3046 B10R0.74 CCCCCOC[C@@H](O)CO 7a_100000210253_100009815848 [1,1,0,0,0,0|2,0,0]=4 3047 B10R0.74 CCCCCSCC(O)CC 62a_100000210326_100011218378 [1,1,0,0,0,0|2,0,0]=4 3048 B10R0.74 CCCCCSCC(O)CC 62a_100011218378_100000210326 [1,1,0,0,0,0|2,0,0]=4 3049 B10R0.74 CCCCCSCC(O)CO 62a_100000210326_100011219619 [1,1,0,0,0,0|2,0,0]=4 3050 B10R0.74 CCCCCSCC(O)CO 62a_100011219619_100000210326 [1,1,0,0,0,0|2,0,0]=4 3051 B10R0.74 CCCCCSC[C@@H](C)CO 62a_100000059175_100000210326 [1,1,0,0,0,0|2,0,0]=4 3052 B10R0.74 CCCCCSC[C@@H](C)CO 62a_100000210326_100000059175 [1,1,0,0,0,0|2,0,0]=4 3053 B10R0.74 CCCCCSC[C@@H](O)CF 62a_100000210326_100015614560 [1,1,0,0,0,0|2,0,0]=4 3054 B10R0.74 CCCCCSC[C@@H](O)CF 62a_100015614560_100000210326 [1,1,0,0,0,0|2,0,0]=4 3055 B10R0.74 CCCCCSC[C@@H](O)CO 62a_100000210326_100009815848 [1,1,0,0,0,0|2,0,0]=4 3056 B10R0.74 CCCCCSC[C@@H](O)CO 62a_100009815848_100000210326 [1,1,0,0,0,0|2,0,0]=4 3057 B10R0.74 CCCCNCCC(C)CC 2230a_100020591266_100000210211 [1,1,0,0,0,0|2,0,0]=4 3058 B10R0.74 CCCCNCCC(C)CO 2230a_106354213184_100000210211 [1,1,0,0,0,0|1,0,0]=3 3059 B10R0.74 CCCCNCCC(C)CO 34a_106354213184_100000210210 [1,1,0,0,0,0|1,0,0]=3 3060 B10R0.74 CCCCOCCC(=NO)N 34a_100000749954_100000210210 [1,1,0,0,0,0|1,0,1]=4 3061 B10R0.74 CCCCOCCC(=O)CC 1458a_100000210414_100000743108 [1,1,0,0,0,0|0,0,2]=4 3062 B10R0.74 CCCCOCCC(=O)CO 1458a_100000210174_100000743108 [1,1,0,0,0,0|0,0,2]=4 3063 B10R0.74 CCCCOCCC(=O)NC 34a_100000210227_100012179268 [1,1,0,0,0,0|0,0,2]=4 3064 B10R0.74 CCCCOCCC(=O)NC 34a_100000754576_100000210210 [1,1,0,0,0,0|0,0,2]=4 3065 B10R0.74 CCCCOCCC(=O)NC 7a_100000210227_100000737683 [1,1,0,0,0,0|0,0,2]=4 3066 B10R0.74 CCCCOCCC(=O)OC 34a_100000210227_100000742370 [1,1,0,0,0,0|0,0,2]=4 3067 B10R0.74 CCCCOCCC(=O)OC 7a_100000210227_100000204255 [1,1,0,0,0,0|0,0,2]=4 3068 B10R0.74 CCCCOCCC(C)CC 7a_100011215188_100000210211 [1,1,0,0,0,0|1,0,0]=3 3069 B10R0.74 CCCCOCCC(C)OC 7a_100000764861_100000210211 [1,1,0,0,0,0|0,0,0]=2 3070 B10R0.74 CCCCOCCN(C)CC 2230a_100000225621_100000743108 [1,1,0,0,0,0|2,0,0]=4 3071 B10R0.74 CCCCOCCN(C)CC 269982a_100000225621_100000743108 [1,1,0,0,0,0|2,0,0]=4 3072 B10R0.74 CCCCOCNC(C)C#N 2230a_100000737613_100011995733 [1,1,0,0,0,0|2,0,0]=4 3073 B10R0.74 CCCCOCNC(C)CC 2230a_100000209981_100011995733 [1,1,0,0,0,0|2,0,0]=4 3074 B10R0.74 CCCCOCN[C@H](C)CO 2230a_100000737577_100011995733 [1,1,0,0,0,0|1,0,0]=3 3075 B10R0.74 CCCCOCOC(C)C#N 34a_100011218135_100011995733 [1,1,0,0,0,0|2,0,0]=4 3076 B10R0.74 CCCCOCOC(C)CF 34a_100016041109_100011995733 [1,1,0,0,0,0|2,0,0]=4 3077 B10R0.74 CCCCOCOC(C)CN 34a_100000210904_100011995733 [1,1,0,0,0,0|2,0,0]=4 3078 B10R0.74 CCCCOCSC(C)C#N 62a_100000703298_100011995733 [1,1,0,0,0,0|2,0,0]=4 3079 B10R0.74 CCCCOCSC(C)C#N 62a_100011995733_100000703298 [1,1,0,0,0,0|2,0,0]=4 3080 B10R0.74 CCCCOCSC(C)CC 62a_100000758301_100011995733 [1,1,0,0,0,0|2,0,0]=4 3081 B10R0.74 CCCCOCSC(C)CC 62a_100011995733_100000758301 [1,1,0,0,0,0|2,0,0]=4 3082 B10R0.74 CCCCOCSC(C)CO 62a_100012180447_100011995733 [1,1,0,0,0,0|1,0,0]=3 3083 B10R0.74 CCCCOCSC(C)OC 62a_100009879195_100011995733 [1,1,0,0,0,0|1,0,0]=3 3084 B10R0.74 CCCCOCSC(C)OC 62a_100011995733_100009879195 [1,1,0,0,0,0|1,0,0]=3 3085 B10R0.74 CCCCOCS[C@H](C)CO 62a_100011995733_100016084084 [1,1,0,0,0,0|1,0,0]=3 3086 B10R0.74 CCCCOCS[C@H](C)CO 62a_100016084084_100011995733 [1,1,0,0,0,0|1,0,0]=3 3087 B10R0.74 CNC(=O)CCOCCCO 34a_100000754576_100000230001 [1,1,0,0,0,0|0,0,2]=4 3088 B10R0.74 COC(C)CCOCCC#N 7a_100000764861_100000184422 [1,1,0,0,0,0|1,0,1]=4 3089 B10R0.74 COC(C)CCOCCCF 7a_100000764861_100011934791 [1,1,0,0,0,0|1,0,0]=3 3090 B10R0.74 COC(C)CCOCCCO 7a_100000764861_100011215043 [1,1,0,0,0,0|0,0,0]=2 3091 B10R0.74 COC(C)CCOCCSC 7a_100000764861_100000212216 [1,1,0,0,0,0|1,0,0]=3 3092 B10R0.74 COC(C)COCCCCO 34a_100000690652_100011216708 [1,1,0,0,0,0|2,0,0]=4 3093 B10R0.74 COC(C)SCCCCCO 62a_100000746330_100009879195 [1,1,0,0,0,0|2,0,0]=4 3094 B10R0.74 COC(C)SCCCCCO 62a_100009879195_100000746330 [1,1,0,0,0,0|2,0,0]=4 3095 B10R0.74 COCCNCCC(C)CO 2230a_106354213184_100011201679 [1,1,0,0,0,0|2,0,0]=4 3096 B10R0.74 COCCNCCC(C)CO 34a_106354213184_100011201679 [1,1,0,0,0,0|2,0,0]=4 3097 B10R0.74 COCCOCCC(C)OC 7a_100000764861_100000233755 [1,1,0,0,0,0|1,0,0]=3 3098 B10R0.74 COCCOCN[C@H](C)CO 2230a_100000737577_100000231047 [1,1,0,0,0,0|2,0,0]=4 3099 B10R0.74 COCCOCSC(C)CO 62a_100012180447_100000231047 [1,1,0,0,0,0|2,0,0]=4 3100 B10R0.74 COCCOCSC(C)OC 62a_100000231047_100009879195 [1,1,0,0,0,0|2,0,0]=4 3101 B10R0.74 COCCOCSC(C)OC 62a_100009879195_100000231047 [1,1,0,0,0,0|2,0,0]=4 3102 B10R0.74 COCCOCS[C@H](C)CO 62a_100000231047_100016084084 [1,1,0,0,0,0|2,0,0]=4 3103 B10R0.74 COCCOCS[C@H](C)CO 62a_100016084084_100000231047 [1,1,0,0,0,0|2,0,0]=4 3104 B10R0.74 CO[C@H](C)CNCCCCO 2230a_100020591295_100000210776 [1,1,0,0,0,0|2,0,0]=4 3105 B10R0.74 CSCCNCCC(C)CO 2230a_106354213184_100000751147 [1,1,0,0,0,0|2,0,0]=4 3106 B10R0.74 CSCCNCCC(C)CO 34a_106354213184_100000212216 [1,1,0,0,0,0|2,0,0]=4 3107 B10R0.74 C[C@@H](CO)CNCCCCO 2230a_100000750430_100000059175 [1,1,0,0,0,0|2,0,0]=4 3108 B10R0.74 C[C@@H](CO)CNCCCCO 34a_100000750430_100000059175 [1,1,0,0,0,0|2,0,0]=4 3109 B10R0.74 C[C@@H](CO)CSCCCCO 62a_100000059175_100000210776 [1,1,0,0,0,0|2,0,0]=4 3110 B10R0.74 C[C@@H](CO)CSCCCCO 62a_100000210776_100000059175 [1,1,0,0,0,0|2,0,0]=4 3111 B10R0.74 C[C@H](CO)NCCCCCO 2230a_100000737577_100000746330 [1,1,0,0,0,0|2,0,0]=4 3112 B10R0.74 C[C@H](CO)SCCCCCO 62a_100000746330_100016084084 [1,1,0,0,0,0|2,0,0]=4 3113 B10R0.74 C[C@H](CO)SCCCCCO 62a_100016084084_100000746330 [1,1,0,0,0,0|2,0,0]=4 3114 B10R0.74 NC(=NO)CCOCCCO 34a_100000749954_100000230001 [1,1,0,0,0,0|1,0,1]=4 3115 B10R0.74 OCCCCNCC(O)CO 2230a_100000750430_100011219619 [1,1,0,0,0,0|2,0,0]=4 3116 B10R0.74 OCCCCNCC(O)CO 34a_100000750430_100011219619 [1,1,0,0,0,0|2,0,0]=4 3117 B10R0.74 OCCCCNC[C@@H](O)CF 2230a_100000750430_100015614560 [1,1,0,0,0,0|2,0,0]=4 3118 B10R0.74 OCCCCNC[C@@H](O)CF 34a_100000750430_100015614560 [1,1,0,0,0,0|2,0,0]=4 3119 B10R0.74 OCCCCNC[C@@H](O)CO 2230a_100000750430_100009815848 [1,1,0,0,0,0|2,0,0]=4 3120 B10R0.74 OCCCCNC[C@@H](O)CO 34a_100000750430_100009815848 [1,1,0,0,0,0|2,0,0]=4 3121 B10R0.74 OCCCCNC[C@H](O)CO 2230a_100020644852_100000210776 [1,1,0,0,0,0|2,0,0]=4 3122 B10R0.74 OCCCCSCC(O)CO 62a_100000210776_100011219619 [1,1,0,0,0,0|2,0,0]=4 3123 B10R0.74 OCCCCSCC(O)CO 62a_100011219619_100000210776 [1,1,0,0,0,0|2,0,0]=4 3124 B10R0.74 OCCCCSC[C@@H](O)CF 62a_100000210776_100015614560 [1,1,0,0,0,0|2,0,0]=4 3125 B10R0.74 OCCCCSC[C@@H](O)CF 62a_100015614560_100000210776 [1,1,0,0,0,0|2,0,0]=4 3126 B10R0.74 OCCCCSC[C@@H](O)CO 62a_100000210776_100009815848 [1,1,0,0,0,0|2,0,0]=4 3127 B10R0.74 OCCCCSC[C@@H](O)CO 62a_100009815848_100000210776 [1,1,0,0,0,0|2,0,0]=4 3128 B10R0.75 CC(=O)C(C)COCCCO 34a_100000032740_100000230001 [1,1,0,0,0,0|0,0,2]=4 3129 B10R0.75 CC(=O)C(C)COCCCO 7a_100000032740_100011215043 [1,1,0,0,0,0|0,0,2]=4 3130 B10R0.75 CC(C)C(O)CNCCCO 2230a_100000759067_100000230001 [1,1,0,0,0,0|2,0,0]=4 3131 B10R0.75 CC(C)C(O)CNCCCO 34a_100000759067_100000230001 [1,1,0,0,0,0|2,0,0]=4 3132 B10R0.75 CC(C)[C@@H](N)COCCCF 34a_100011830312_100011934791 [1,1,0,0,0,0|2,0,0]=4 3133 B10R0.75 CC(C)[C@@H](N)COCCCO 34a_100011830312_100000230001 [1,1,0,0,0,0|1,0,0]=3 3134 B10R0.75 CCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210757 [1,1,0,0,0,0|1,0,1]=4 3135 B10R0.75 CCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210757 [1,1,0,0,0,0|1,0,1]=4 3136 B10R0.75 CCCCNCC(O)C(C)C 2230a_100000759067_100000210211 [1,1,0,0,0,0|2,0,0]=4 3137 B10R0.75 CCCCNCC(O)C(C)C 34a_100000759067_100000210210 [1,1,0,0,0,0|2,0,0]=4 3138 B10R0.75 CCCCOCC(=O)C(C)C 1458a_100000210198_100011995733 [1,1,0,0,0,0|1,0,1]=4 3139 B10R0.75 CCCCOCC(=O)C(C)C 1458a_100000757543_100000210206 [1,1,0,0,0,0|1,0,1]=4 3140 B10R0.75 CCCCOCC(=O)C(C)C 34a_100000210227_100000753385 [1,1,0,0,0,0|1,0,1]=4 3141 B10R0.75 CCCCOCC(=O)C(C)C 7a_100000210227_100000753385 [1,1,0,0,0,0|1,0,1]=4 3142 B10R0.75 CCCCOCC(=O)C(C)F 1458a_100000062450_100011995733 [1,1,0,0,0,0|1,0,1]=4 3143 B10R0.75 CCCCOCC(=O)C(O)O 1458a_100000233687_100011995733 [1,1,0,0,0,0|1,0,1]=4 3144 B10R0.75 CCCCOCC(=O)[C@@H](C)O 1458a_100000717761_100011995733 [1,1,0,0,0,0|0,0,1]=3 3145 B10R0.75 CCCCOCC(=O)[C@H](C)O 1458a_217856618621_100011995733 [1,1,0,0,0,0|0,0,1]=3 3146 B10R0.75 CCCCOCC(C)C(=O)C 34a_100000032740_100000210210 [1,1,0,0,0,0|0,0,2]=4 3147 B10R0.75 CCCCOCC(C)C(=O)C 7a_100000032740_100000210211 [1,1,0,0,0,0|0,0,2]=4 3148 B10R0.75 CCCCOCN(C)C(C)C 269982a_200000211004_100011995733 [1,1,0,0,0,0|2,0,0]=4 3149 B10R0.75 CCCCOC[C@H](N)C(C)C 34a_100011830312_100000210210 [1,1,0,0,0,0|1,0,0]=3 3150 B10R0.75 COCCOC[C@H](N)C(C)C 34a_100011830312_100011201679 [1,1,0,0,0,0|2,0,0]=4 3151 B10R0.75 CSCCOC[C@H](N)C(C)C 34a_100011830312_100000212216 [1,1,0,0,0,0|2,0,0]=4 3152 B10R0.75 C[C@@H](O)C(=O)CCCCCO 1458a_100000717761_100000746330 [1,1,0,0,0,0|1,0,1]=4 3153 B10R0.75 C[C@H](O)C(=O)CCCCCO 1458a_217856618621_100000746330 [1,1,0,0,0,0|1,0,1]=4 3154 B10R0.78 CC(C)CCC(=O)CCCO 1458a_100000181311_100011215043 [1,1,0,0,0,0|2,0,0]=4 3155 B10R0.78 CC(C)CCN(C)CCCO 2230a_100000213112_100000210312 [1,1,0,0,0,0|2,0,0]=4 3156 B10R0.78 CC(C)CCN(C)CCCO 2230a_100000742789_100000230001 [1,1,0,0,0,0|2,0,0]=4 3157 B10R0.78 CC(C)CCN(C)CCCO 269982a_100000213112_100000210312 [1,1,0,0,0,0|2,0,0]=4 3158 B10R0.78 CC(C)CCN(C)CCCO 269982a_100000742789_100011215043 [1,1,0,0,0,0|2,0,0]=4 3159 B10R0.78 CC(O)CCN(C)CCCO 2230a_100000213112_100012276601 [1,1,0,0,0,0|1,0,0]=3 3160 B10R0.78 CC(O)CCN(C)CCCO 269982a_100000213112_100012276601 [1,1,0,0,0,0|1,0,0]=3 3161 B10R0.78 CCCCC(=O)CCC(C)C 1458a_100000181311_100000210211 [1,1,0,0,0,0|2,0,0]=4 3162 B10R0.78 CCCCC(=O)CCC(C)C 1458a_100000210183_100000210312 [1,1,0,0,0,0|2,0,0]=4 3163 B10R0.78 CCCCC(=O)CCC(C)O 1458a_100000210183_100012276601 [1,1,0,0,0,0|1,0,0]=3 3164 B10R0.78 CCCCC(=O)NCC(C)O 11a_100000210904_100000210183 [1,1,0,0,0,0|2,0,0]=4 3165 B10R0.78 CCCCC(=O)NCC(C)O 240690a_100000210904_100000210183 [1,1,0,0,0,0|2,0,0]=4 3166 B10R0.78 CCCCC(=O)NCC(C)O 527a_100000210904_100000210183 [1,1,0,0,0,0|2,0,0]=4 3167 B10R0.78 CCCCC(C)NCC(C)O 2230a_100000126638_100011218427 [1,1,0,0,0,0|2,0,0]=4 3168 B10R0.78 CCCCC(C)NCC(C)O 2230a_100000210904_200011215066 [1,1,0,0,0,0|2,0,0]=4 3169 B10R0.78 CCCCC(C)NCC(C)O 270004a_100000210904_100000210087 [1,1,0,0,0,0|2,0,0]=4 3170 B10R0.78 CCCCC(C)NCC(C)O 34a_100000210904_200011215066 [1,1,0,0,0,0|2,0,0]=4 3171 B10R0.78 CCCCC(C)NC[C@@H](C)O 2230a_100000126638_100009817552 [1,1,0,0,0,0|2,0,0]=4 3172 B10R0.78 CCCCC(C)OCC(C)O 34a_100000687866_100011218427 [1,1,0,0,0,0|2,0,0]=4 3173 B10R0.78 CCCCC(C)OCC(C)O 7a_100000687866_100011218427 [1,1,0,0,0,0|2,0,0]=4 3174 B10R0.78 CCCCC(C)OC[C@@H](C)O 34a_100000687866_100009817552 [1,1,0,0,0,0|2,0,0]=4 3175 B10R0.78 CCCCC(C)OC[C@@H](C)O 7a_100000687866_100009817552 [1,1,0,0,0,0|2,0,0]=4 3176 B10R0.78 CCCCC(C)SCC(C)O 62a_100011218427_200011215066 [1,1,0,0,0,0|2,0,0]=4 3177 B10R0.78 CCCCC(C)SCC(C)O 62a_200011215066_100011218427 [1,1,0,0,0,0|2,0,0]=4 3178 B10R0.78 CCCCC(C)SC[C@@H](C)O 62a_100009817552_200011215066 [1,1,0,0,0,0|2,0,0]=4 3179 B10R0.78 CCCCC(C)SC[C@@H](C)O 62a_200011215066_100009817552 [1,1,0,0,0,0|2,0,0]=4 3180 B10R0.78 CCCCN(C)CCC(C)C 2230a_100000207549_100000210312 [1,1,0,0,0,0|2,0,0]=4 3181 B10R0.78 CCCCN(C)CCC(C)C 2230a_100000742789_100000210211 [1,1,0,0,0,0|2,0,0]=4 3182 B10R0.78 CCCCN(C)CCC(C)C 269982a_100000207549_100000210312 [1,1,0,0,0,0|2,0,0]=4 3183 B10R0.78 CCCCN(C)CCC(C)C 269982a_100000742789_100000210211 [1,1,0,0,0,0|2,0,0]=4 3184 B10R0.78 CCCCN(C)CCC(C)O 2230a_100000207549_100012276601 [1,1,0,0,0,0|1,0,0]=3 3185 B10R0.78 CCCCN(C)CCC(C)O 269982a_100000207549_100012276601 [1,1,0,0,0,0|1,0,0]=3 3186 B10R0.78 CCCNC(=O)CCC(C)O 1626a_100020643023_100000718519 [1,1,0,0,0,0|2,0,0]=4 3187 B10R0.78 CCOCC(=O)CCC(C)O 1458a_100000211967_100012276601 [1,1,0,0,0,0|2,0,0]=4 3188 B10R0.78 CCSCC(=O)CCC(C)O 1458a_100000230394_100012276601 [1,1,0,0,0,0|2,0,0]=4 3189 B10R0.78 COCCC(=O)CCC(C)O 1458a_100000749529_100012276601 [1,1,0,0,0,0|2,0,0]=4 3190 B10R0.78 COCCN(C)CCC(C)O 2230a_100000743101_100012276601 [1,1,0,0,0,0|2,0,0]=4 3191 B10R0.78 COCCN(C)CCC(C)O 269982a_100000743101_100012276601 [1,1,0,0,0,0|2,0,0]=4 3192 B10R0.78 CSCCC(=O)CCC(C)O 1458a_100000174002_100012276601 [1,1,0,0,0,0|2,0,0]=4 3193 B10R0.78 CSCCN(C)CCC(C)O 2230a_100000686725_100012276601 [1,1,0,0,0,0|2,0,0]=4 3194 B10R0.78 CSCCN(C)CCC(C)O 269982a_100000686725_100012276601 [1,1,0,0,0,0|2,0,0]=4 3195 B10R0.15 C=C(C)CCOCC(C)(C)O 34a_100000764851_100000764493 [0,1,0,0,1,0|1,0,1]=4 3196 B10R0.15 C=C(C)COCCC(C)(C)O 34a_100000210245_100000702414 [0,1,0,0,1,0|1,0,1]=4 3197 B10R0.15 CC(=O)CCOCC(C)(C)O 34a_100000759926_100000764493 [0,1,0,0,1,0|0,0,2]=4 3198 B10R0.15 CC(=O)CCOCC(C)(C)O 7a_100000759926_100000764493 [0,1,0,0,1,0|0,0,2]=4 3199 B10R0.15 CC(=O)COCCC(C)(C)O 34a_100000211253_100000702414 [0,1,0,0,1,0|0,0,2]=4 3200 B10R0.15 CC(Br)CCOCC(C)(C)C 34a_100009893172_100011219605 [0,1,0,0,1,0|2,0,0]=4 3201 B10R0.15 CC(Br)CCOCC(C)(C)F 34a_100009893172_100011997219 [0,1,0,0,1,0|2,0,0]=4 3202 B10R0.15 CC(Br)CCOCC(C)(C)O 34a_100009893172_100000764493 [0,1,0,0,1,0|1,0,0]=3 3203 B10R0.15 CC(Br)COCCC(C)(C)C 34a_100012180447_100000755188 [0,1,0,0,1,0|2,0,0]=4 3204 B10R0.15 CC(Br)COCCC(C)(C)O 34a_100012180447_100000702414 [0,1,0,0,1,0|1,0,0]=3 3205 B10R0.15 CC(C)(O)CCOCC(F)F 34a_100000743014_100000702414 [0,1,0,0,1,0|2,0,0]=4 3206 B10R0.15 CC(C)(O)COCCC(F)F 34a_100103093639_100000764493 [0,1,0,0,1,0|2,0,0]=4 3207 B10R0.15 CC(C)CCNCC(C)(C)O 2230a_100000751335_100000210312 [0,1,0,0,1,0|2,0,0]=4 3208 B10R0.15 CC(C)CCNCC(C)(C)O 269862a_100000751335_100000185833 [0,1,0,0,1,0|2,0,0]=4 3209 B10R0.15 CC(C)CCOCC(C)(C)C 34a_100000210254_100011219605 [0,1,0,0,1,0|2,0,0]=4 3210 B10R0.15 CC(C)CCOCC(C)(C)F 34a_100000210254_100011997219 [0,1,0,0,1,0|2,0,0]=4 3211 B10R0.15 CC(C)CCOCC(C)(C)F 34a_100000716592_100000210312 [0,1,0,0,1,0|2,0,0]=4 3212 B10R0.15 CC(C)CCOCC(C)(C)O 34a_100000210254_100000764493 [0,1,0,0,1,0|1,0,0]=3 3213 B10R0.15 CC(C)CCOCC(C)(C)O 7a_100000210254_100000764493 [0,1,0,0,1,0|1,0,0]=3 3214 B10R0.15 CC(C)CCOCC(C)(F)F 34a_100000068830_100000210312 [0,1,0,0,1,0|2,0,0]=4 3215 B10R0.15 CC(C)CCSCC(C)(C)O 62a_100000210312_100000764493 [0,1,0,0,1,0|1,1,0]=4 3216 B10R0.15 CC(C)CCSCC(C)(C)O 62a_100000764493_100000210312 [0,1,0,0,1,0|1,1,0]=4 3217 B10R0.15 CC(C)CNCCC(C)(C)O 2230a_100000210953_100000702414 [0,1,0,0,1,0|2,0,0]=4 3218 B10R0.15 CC(C)CNCCC(C)(C)O 270004a_100000707701_100000210432 [0,1,0,0,1,0|2,0,0]=4 3219 B10R0.15 CC(C)CNCCC(C)(C)O 34a_100000210953_100000702414 [0,1,0,0,1,0|2,0,0]=4 3220 B10R0.15 CC(C)COCCC(C)(C)C 34a_100000210257_100000755188 [0,1,0,0,1,0|2,0,0]=4 3221 B10R0.15 CC(C)COCCC(C)(C)C 7a_100000765024_100000210760 [0,1,0,0,1,0|2,0,0]=4 3222 B10R0.15 CC(C)COCCC(C)(C)O 34a_100000210257_100000702414 [0,1,0,0,1,0|1,0,0]=3 3223 B10R0.15 CC(C)CSCCC(C)(C)O 62a_100000210624_100000702414 [0,1,0,0,1,0|1,1,0]=4 3224 B10R0.15 CC(C)CSCCC(C)(C)O 62a_100000702414_100000210760 [0,1,0,0,1,0|1,1,0]=4 3225 B10R0.15 CC(C)NCCCC(C)(C)O 2230a_100138425928_100009888830 [0,1,0,0,1,0|2,0,0]=4 3226 B10R0.15 CC(C)NCCCC(C)(C)O 34a_100138425928_100009888830 [0,1,0,0,1,0|2,0,0]=4 3227 B10R0.15 CC(C)OCCCC(C)(C)O 34a_100000212225_100009888830 [0,1,0,0,1,0|2,0,0]=4 3228 B10R0.15 CC(C)SCCCC(C)(C)O 62a_100000210206_100009888830 [0,1,0,0,1,0|2,0,0]=4 3229 B10R0.15 CC(C)SCCCC(C)(C)O 62a_100009888830_100000210206 [0,1,0,0,1,0|2,0,0]=4 3230 B10R0.15 CC(F)COCCC(C)(C)C 34a_100015925927_100000755188 [0,1,0,0,1,0|2,0,0]=4 3231 B10R0.15 CC(F)COCCC(C)(C)O 34a_100015925927_100000702414 [0,1,0,0,1,0|1,0,0]=3 3232 B10R0.15 CC(O)CCCNC(C)(C)C 2230a_100000715429_200000718107 [0,1,0,0,1,0|2,0,0]=4 3233 B10R0.15 CC(O)CCCOC(C)(C)C 34a_100015890283_200000718107 [0,1,0,0,1,0|2,0,0]=4 3234 B10R0.15 CC(O)CCCOC(C)(C)C 7a_100015890283_200000718107 [0,1,0,0,1,0|2,0,0]=4 3235 B10R0.15 CC(O)CCCSC(C)(C)C 62a_100000211941_200000718107 [0,1,0,0,1,0|2,0,0]=4 3236 B10R0.15 CC(O)CCCSC(C)(C)C 62a_200000718107_100000211941 [0,1,0,0,1,0|2,0,0]=4 3237 B10R0.15 CC(O)CCNCC(C)(C)C 2230a_100000743828_100012276601 [0,1,0,0,1,0|2,0,0]=4 3238 B10R0.15 CC(O)CCNCC(C)(C)C 270004a_200000755665_100011204126 [0,1,0,0,1,0|2,0,0]=4 3239 B10R0.15 CC(O)CCNCC(C)(C)F 2230a_100020643315_100012276601 [0,1,0,0,1,0|2,0,0]=4 3240 B10R0.15 CC(O)CCNCC(C)(C)O 2230a_100000751335_100012276601 [0,1,0,0,1,0|1,0,0]=3 3241 B10R0.15 CC(O)CCOCC(C)(C)F 34a_100000716592_100012276601 [0,1,0,0,1,0|1,0,0]=3 3242 B10R0.15 CC(O)CCOCC(C)(F)F 34a_100000068830_100012276601 [0,1,0,0,1,0|1,0,0]=3 3243 B10R0.15 CC(O)CCOCC(F)(F)Br 34a_100011217949_100012276601 [0,1,0,0,1,0|2,0,0]=4 3244 B10R0.15 CC(O)CCOCC(F)(F)Cl 34a_100000734434_100012276601 [0,1,0,0,1,0|2,0,0]=4 3245 B10R0.15 CC(O)CCOCC(F)(F)F 34a_100000210435_100012276601 [0,1,0,0,1,0|2,0,0]=4 3246 B10R0.15 CC(O)CCSCC(C)(C)C 62a_100011219605_100012276601 [0,1,0,0,1,0|1,1,0]=4 3247 B10R0.15 CC(O)CCSCC(C)(C)C 62a_100012276601_100011219605 [0,1,0,0,1,0|1,1,0]=4 3248 B10R0.15 CC(O)CCSCC(C)(C)F 62a_100011997219_100012276601 [0,1,0,0,1,0|1,1,0]=4 3249 B10R0.15 CC(O)CCSCC(C)(C)F 62a_100012276601_100011997219 [0,1,0,0,1,0|1,1,0]=4 3250 B10R0.15 CC(O)CCSCC(C)(C)O 62a_100000764493_100012276601 [0,1,0,0,1,0|0,1,0]=3 3251 B10R0.15 CC(O)CCSCC(C)(C)O 62a_100012276601_100000764493 [0,1,0,0,1,0|0,1,0]=3 3252 B10R0.15 CC(O)CNCCC(C)(C)C 2230a_100000210904_100000755188 [0,1,0,0,1,0|2,0,0]=4 3253 B10R0.15 CC(O)CNCCC(C)(C)C 2230a_100000738805_100011218427 [0,1,0,0,1,0|2,0,0]=4 3254 B10R0.15 CC(O)CNCCC(C)(C)C 34a_100000210904_100000755188 [0,1,0,0,1,0|2,0,0]=4 3255 B10R0.15 CC(O)CNCCC(C)(C)F 2230a_100016253952_100011218427 [0,1,0,0,1,0|2,0,0]=4 3256 B10R0.15 CC(O)CNCCC(C)(C)O 2230a_100000210904_100000702414 [0,1,0,0,1,0|1,0,0]=3 3257 B10R0.15 CC(O)CNCCC(C)(C)O 34a_100000210904_100000702414 [0,1,0,0,1,0|1,0,0]=3 3258 B10R0.15 CC(O)COCCC(C)(C)C 7a_100000765024_100011218427 [0,1,0,0,1,0|1,0,0]=3 3259 B10R0.15 CC(O)COCCC(F)(F)F 34a_100000752437_100011218427 [0,1,0,0,1,0|2,0,0]=4 3260 B10R0.15 CC(O)COCCS(=O)(=O)C 34a_100000211924_100011218427 [0,1,0,0,1,0|1,0,1]=4 3261 B10R0.15 CC(O)COCCS(=O)(=O)C 7a_100000211924_100011218427 [0,1,0,0,1,0|1,0,1]=4 3262 B10R0.15 CC(O)COCC[N+](C)(C)C 7a_200020618287_100011218427 [0,1,0,0,1,0|2,0,0]=4 3263 B10R0.15 CC(O)COCC[Si](C)(C)C 7a_100000039746_100011218427 [0,1,0,0,1,0|1,1,0]=4 3264 B10R0.15 CC(O)CSCCC(C)(C)C 62a_100000755188_100011218427 [0,1,0,0,1,0|1,1,0]=4 3265 B10R0.15 CC(O)CSCCC(C)(C)C 62a_100011218427_100000755188 [0,1,0,0,1,0|1,1,0]=4 3266 B10R0.15 CC(O)CSCCC(C)(C)O 62a_100000702414_100011218427 [0,1,0,0,1,0|0,1,0]=3 3267 B10R0.15 CC(O)CSCCC(C)(C)O 62a_100011218427_100000702414 [0,1,0,0,1,0|0,1,0]=3 3268 B10R0.15 C[C@@H](Cl)COCCC(C)(C)C 34a_100016084084_100000755188 [0,1,0,0,1,0|2,0,0]=4 3269 B10R0.15 C[C@@H](Cl)COCCC(C)(C)O 34a_100016084084_100000702414 [0,1,0,0,1,0|1,0,0]=3 3270 B10R0.15 C[C@@H](N)CCOCC(C)(C)C 34a_100000706166_100011219605 [0,1,0,0,1,0|2,0,0]=4 3271 B10R0.15 C[C@@H](N)CCOCC(C)(C)F 34a_100000706166_100011997219 [0,1,0,0,1,0|2,0,0]=4 3272 B10R0.15 C[C@@H](N)CCOCC(C)(C)O 34a_100000706166_100000764493 [0,1,0,0,1,0|1,0,0]=3 3273 B10R0.15 C[C@@H](N)COCCC(C)(C)C 34a_100000737577_100000755188 [0,1,0,0,1,0|2,0,0]=4 3274 B10R0.15 C[C@@H](N)COCCC(C)(C)O 34a_100000737577_100000702414 [0,1,0,0,1,0|1,0,0]=3 3275 B10R0.15 C[C@@H](O)CNCCC(C)(C)C 2230a_100000738805_100009817552 [0,1,0,0,1,0|2,0,0]=4 3276 B10R0.15 C[C@@H](O)CNCCC(C)(C)F 2230a_100016253952_100009817552 [0,1,0,0,1,0|2,0,0]=4 3277 B10R0.15 C[C@@H](O)COCCC(C)(C)C 7a_100000765024_100009817552 [0,1,0,0,1,0|1,0,0]=3 3278 B10R0.15 C[C@@H](O)COCCC(F)(F)F 34a_100000752437_100009817552 [0,1,0,0,1,0|2,0,0]=4 3279 B10R0.15 C[C@@H](O)COCCS(=O)(=O)C 34a_100000211924_100009817552 [0,1,0,0,1,0|1,0,1]=4 3280 B10R0.15 C[C@@H](O)COCCS(=O)(=O)C 7a_100000211924_100009817552 [0,1,0,0,1,0|1,0,1]=4 3281 B10R0.15 C[C@@H](O)COCC[N+](C)(C)C 7a_200020618287_100009817552 [0,1,0,0,1,0|2,0,0]=4 3282 B10R0.15 C[C@@H](O)COCC[Si](C)(C)C 7a_100000039746_100009817552 [0,1,0,0,1,0|1,1,0]=4 3283 B10R0.15 C[C@@H](O)CSCCC(C)(C)C 62a_100000755188_100009817552 [0,1,0,0,1,0|1,1,0]=4 3284 B10R0.15 C[C@@H](O)CSCCC(C)(C)C 62a_100009817552_100000755188 [0,1,0,0,1,0|1,1,0]=4 3285 B10R0.15 C[C@@H](O)CSCCC(C)(C)O 62a_100000702414_100009817552 [0,1,0,0,1,0|0,1,0]=3 3286 B10R0.15 C[C@@H](O)CSCCC(C)(C)O 62a_100009817552_100000702414 [0,1,0,0,1,0|0,1,0]=3 3287 B10R0.96 CC(C)CC(=O)CCC(C)O 1458a_100000210554_100012276601 [0,1,0,0,1,0|1,0,1]=4 3288 B10R0.96 CC(C)CC(C)NCC(C)O 2230a_100000210904_100000731052 [0,1,0,0,1,0|2,0,0]=4 3289 B10R0.96 CC(C)CC(C)NCC(C)O 2230a_100000692259_100011218427 [0,1,0,0,1,0|2,0,0]=4 3290 B10R0.96 CC(C)CC(C)NCC(C)O 34a_100000210904_100000731052 [0,1,0,0,1,0|2,0,0]=4 3291 B10R0.96 CC(C)CC(C)NC[C@@H](C)O 2230a_100000692259_100009817552 [0,1,0,0,1,0|2,0,0]=4 3292 B10R0.96 CC(C)CC(C)OCC(C)Br 34a_100012180447_100000731052 [0,1,0,0,1,0|2,0,0]=4 3293 B10R0.96 CC(C)CC(C)OCC(C)F 34a_100015925927_100000731052 [0,1,0,0,1,0|2,0,0]=4 3294 B10R0.96 CC(C)CC(C)OCC(C)O 34a_100000211805_100011218427 [0,1,0,0,1,0|1,0,0]=3 3295 B10R0.96 CC(C)CC(C)OCC(C)O 7a_100000211805_100011218427 [0,1,0,0,1,0|1,0,0]=3 3296 B10R0.96 CC(C)CC(C)OC[C@@H](C)Cl 34a_100016084084_100000731052 [0,1,0,0,1,0|2,0,0]=4 3297 B10R0.96 CC(C)CC(C)OC[C@@H](C)N 34a_100000737577_100000731052 [0,1,0,0,1,0|2,0,0]=4 3298 B10R0.96 CC(C)CC(C)OC[C@@H](C)O 34a_100000211805_100009817552 [0,1,0,0,1,0|1,0,0]=3 3299 B10R0.96 CC(C)CC(C)OC[C@@H](C)O 7a_100000211805_100009817552 [0,1,0,0,1,0|1,0,0]=3 3300 B10R0.96 CC(C)CC(C)SCC(C)O 62a_100000731052_100011218427 [0,1,0,0,1,0|1,1,0]=4 3301 B10R0.96 CC(C)CC(C)SCC(C)O 62a_100011218427_100000731052 [0,1,0,0,1,0|1,1,0]=4 3302 B10R0.96 CC(C)CC(C)SC[C@@H](C)O 62a_100000731052_100009817552 [0,1,0,0,1,0|1,1,0]=4 3303 B10R0.96 CC(C)CC(C)SC[C@@H](C)O 62a_100009817552_100000731052 [0,1,0,0,1,0|1,1,0]=4 3304 B10R0.96 CC(C)CCC(=O)CC(C)O 1458a_100000181311_100011218427 [0,1,0,0,1,0|1,0,1]=4 3305 B10R0.96 CC(C)CCC(=O)C[C@@H](C)O 1458a_100011933948_100000210312 [0,1,0,0,1,0|1,0,1]=4 3306 B10R0.96 CC(C)CCN(C)CC(C)O 2230a_100000227577_100000210312 [0,1,0,0,1,0|2,0,0]=4 3307 B10R0.96 CC(C)CCN(C)CC(C)O 2230a_100000742789_100011218427 [0,1,0,0,1,0|2,0,0]=4 3308 B10R0.96 CC(C)CCN(C)CC(C)O 269982a_100000227577_100000210312 [0,1,0,0,1,0|2,0,0]=4 3309 B10R0.96 CC(C)CCN(C)CC(C)O 269982a_100000742789_100011218427 [0,1,0,0,1,0|2,0,0]=4 3310 B10R0.96 CC(C)CCN(C)C[C@@H](C)O 2230a_100000742789_100009817552 [0,1,0,0,1,0|2,0,0]=4 3311 B10R0.96 CC(C)CCN(C)C[C@@H](C)O 269982a_100000742789_100009817552 [0,1,0,0,1,0|2,0,0]=4 3312 B10R0.96 CC(C)CN(C)CCC(C)O 2230a_100000747067_100012276601 [0,1,0,0,1,0|2,0,0]=4 3313 B10R0.96 CC(C)CN(C)CCC(C)O 269982a_100000747067_100012276601 [0,1,0,0,1,0|2,0,0]=4 3314 B10R0.96 CC(C)COC(C)CC(C)C 34a_100000210257_100000731052 [0,1,0,0,1,0|2,0,0]=4 3315 B10R0.96 CC(C)COC(C)CC(C)C 34a_100000211805_100000210624 [0,1,0,0,1,0|2,0,0]=4 3316 B10R0.96 CC(C)COC(C)CC(C)C 7a_100000211805_100000210760 [0,1,0,0,1,0|2,0,0]=4 3317 B10R0.96 CC(O)CCC(=O)C[C@@H](C)O 1458a_100011933948_100012276601 [0,1,0,0,1,0|0,0,1]=3 3318 B10R0.96 CC(O)CCN(C)CC(C)O 2230a_100000227577_100012276601 [0,1,0,0,1,0|1,0,0]=3 3319 B10R0.96 CC(O)CCN(C)CC(C)O 269982a_100000227577_100012276601 [0,1,0,0,1,0|1,0,0]=3 3320 B10R0.96 CC(O)CNC(=O)C[C@@H](C)O 240690a_100000210904_100011933948 [0,1,0,0,1,0|1,0,1]=4 3321 B10R0.98 CC(=O)C(C)COCC(C)O 34a_100000032740_100011218427 [0,1,0,0,1,0|0,0,2]=4 3322 B10R0.98 CC(=O)C(C)COCC(C)O 7a_100000032740_100011218427 [0,1,0,0,1,0|0,0,2]=4 3323 B10R0.98 CC(=O)C(C)COC[C@@H](C)O 34a_100000032740_100009817552 [0,1,0,0,1,0|0,0,2]=4 3324 B10R0.98 CC(=O)C(C)COC[C@@H](C)O 7a_100000032740_100009817552 [0,1,0,0,1,0|0,0,2]=4 3325 B10R0.98 CC(=O)C(C)OCCC(C)O 34a_100000212229_100012276601 [0,1,0,0,1,0|0,0,2]=4 3326 B10R0.98 CC(C)C(O)CNC[C@@H](C)O 2230a_100000759067_100009817552 [0,1,0,0,1,0|2,0,0]=4 3327 B10R0.98 CC(C)C(O)CNC[C@@H](C)O 34a_100000759067_100009817552 [0,1,0,0,1,0|2,0,0]=4 3328 B10R0.98 CC(C)CCCC(=O)[C@@H](C)O 1458a_100000717761_100011214892 [0,1,0,0,1,0|1,0,1]=4 3329 B10R0.98 CC(C)CCCC(=O)[C@H](C)O 1458a_217856618621_100011214892 [0,1,0,0,1,0|1,0,1]=4 3330 B10R0.98 CC(C)CCOC(C)C(C)C 7a_100000748068_100000210626 [0,1,0,0,1,0|2,0,0]=4 3331 B10R0.98 CC(C)COC[C@H](N)C(C)C 34a_100011830312_100000210624 [0,1,0,0,1,0|2,0,0]=4 3332 B10R0.98 CC(C)[C@@H](N)COC[C@@H](C)O 34a_100011830312_100009817552 [0,1,0,0,1,0|1,0,0]=3 3333 B10R0.98 CC(O)CCCC(=O)C(C)C 1458a_100000210198_200000718107 [0,1,0,0,1,0|1,0,1]=4 3334 B10R0.98 CC(O)CCCC(=O)C(C)F 1458a_100000062450_200000718107 [0,1,0,0,1,0|1,0,1]=4 3335 B10R0.98 CC(O)CCCC(=O)C(O)O 1458a_100000233687_200000718107 [0,1,0,0,1,0|1,0,1]=4 3336 B10R0.98 CC(O)CCCC(=O)[C@@H](C)O 1458a_100000717761_200000718107 [0,1,0,0,1,0|0,0,1]=3 3337 B10R0.98 CC(O)CCCC(=O)[C@H](C)O 1458a_217856618621_200000718107 [0,1,0,0,1,0|0,0,1]=3 3338 B10R0.98 CC(O)CCCN(C)C(C)C 269982a_200000211004_200000718107 [0,1,0,0,1,0|2,0,0]=4 3339 B10R0.98 CC(O)CCNC(=O)[C@@H](C)O 240690a_200000755665_100000717761 [0,1,0,0,1,0|1,0,1]=4 3340 B10R0.98 CC(O)CCNC(=O)[C@H](C)O 240690a_200000755665_217856618621 [0,1,0,0,1,0|1,0,1]=4 3341 B10R0.98 CC(O)CCNC(C)C(C)C 2230a_100000211541_100012276601 [0,1,0,0,1,0|2,0,0]=4 3342 B10R0.98 CC(O)CCOC(C)C(C)C 7a_100000748068_100012276601 [0,1,0,0,1,0|1,0,0]=3 3343 B10R0.98 CC(O)CNCC(O)C(C)C 2230a_100000759067_100011218427 [0,1,0,0,1,0|2,0,0]=4 3344 B10R0.98 CC(O)CNCC(O)C(C)C 34a_100000759067_100011218427 [0,1,0,0,1,0|2,0,0]=4 3345 B10R0.98 CC(O)COC[C@H](N)C(C)C 34a_100011830312_100011218427 [0,1,0,0,1,0|1,0,0]=3 3346 B12R0.42 CC(=O)C(C)COCCCC(C)O 34a_100000032740_200000718107 [0,1,0,0,0,1|0,0,2]=4 3347 B12R0.42 CC(=O)C(C)COCCCC(C)O 7a_100000032740_200000718107 [0,1,0,0,0,1|0,0,2]=4 3348 B12R0.42 CC(C)CCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210682 [0,1,0,0,0,1|2,0,0]=4 3349 B12R0.42 CC(C)CCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210682 [0,1,0,0,0,1|2,0,0]=4 3350 B12R0.42 CC(C)CCCOC[C@H](N)C(C)C 34a_100011830312_100011214892 [0,1,0,0,0,1|2,0,0]=4 3351 B12R0.42 CC(C)CCOCCC(N)C(C)C 34a_100161115045_100000210312 [0,1,0,0,0,1|2,0,0]=4 3352 B12R0.42 CC(C)OCCOC[C@H](N)C(C)C 34a_100011830312_100000211751 [0,1,0,0,0,1|2,0,0]=4 3353 B12R0.42 CC(C)SCCOC[C@H](N)C(C)C 34a_100011830312_100000730970 [0,1,0,0,0,1|2,0,0]=4 3354 B12R0.42 CC(O)CCCNCC(O)C(C)C 2230a_100000759067_200000718107 [0,1,0,0,0,1|2,0,0]=4 3355 B12R0.42 CC(O)CCCNCC(O)C(C)C 34a_100000759067_200000718107 [0,1,0,0,0,1|2,0,0]=4 3356 B12R0.42 CC(O)CCCOC[C@H](N)C(C)C 34a_100011830312_200000718107 [0,1,0,0,0,1|1,0,0]=3 3357 B12R0.42 CC(O)CCOCCC(=O)N(C)C 34a_200000747469_100012276601 [0,1,0,0,0,1|2,0,0]=4 3358 B12R0.42 CC(O)CCOCCC(N)C(C)C 34a_100161115045_100012276601 [0,1,0,0,0,1|1,0,0]=3 3359 B12R0.44 CC(C)CCC(=O)CCCC(C)O 1458a_100000181311_200000718107 [0,1,0,0,0,1|2,0,0]=4 3360 B12R0.44 CC(C)CCC(=O)NCCC(C)O 240690a_200000755665_100000181311 [0,1,0,0,0,1|2,0,0]=4 3361 B12R0.44 CC(C)CCC(=O)NCCC(C)O 527a_200000755665_100000181311 [0,1,0,0,0,1|2,0,0]=4 3362 B12R0.44 CC(C)CCC(C)NCCC(C)O 2230a_100138410893_100012276601 [0,1,0,0,0,1|2,0,0]=4 3363 B12R0.44 CC(C)CCC(C)NCCC(C)O 2230a_200000755665_100011261404 [0,1,0,0,0,1|2,0,0]=4 3364 B12R0.44 CC(C)CCC(C)NCCC(C)O 270004a_200000755665_100000210476 [0,1,0,0,0,1|2,0,0]=4 3365 B12R0.44 CC(C)CCC(C)OCCC(C)Br 34a_100009893172_100011261404 [0,1,0,0,0,1|2,0,0]=4 3366 B12R0.44 CC(C)CCC(C)OCCC(C)O 34a_100011215350_100012276601 [0,1,0,0,0,1|1,0,0]=3 3367 B12R0.44 CC(C)CCC(C)OCCC(C)O 7a_100011215350_100012276601 [0,1,0,0,0,1|1,0,0]=3 3368 B12R0.44 CC(C)CCC(C)OCC[C@@H](C)N 34a_100000706166_100011261404 [0,1,0,0,0,1|2,0,0]=4 3369 B12R0.44 CC(C)CCC(C)SCCC(C)O 62a_100011261404_100012276601 [0,1,0,0,0,1|1,1,0]=4 3370 B12R0.44 CC(C)CCC(C)SCCC(C)O 62a_100012276601_100011261404 [0,1,0,0,0,1|1,1,0]=4 3371 B12R0.44 CC(C)CCCC(=O)CCC(C)O 1458a_100011216857_100012276601 [0,1,0,0,0,1|2,0,0]=4 3372 B12R0.44 CC(C)CCCC(C)NCC(C)O 2230a_100000210607_100011218427 [0,1,0,0,0,1|2,0,0]=4 3373 B12R0.44 CC(C)CCCC(C)NCC(C)O 270004a_100000210904_100000753411 [0,1,0,0,0,1|2,0,0]=4 3374 B12R0.44 CC(C)CCCC(C)NC[C@@H](C)O 2230a_100000210607_100009817552 [0,1,0,0,0,1|2,0,0]=4 3375 B12R0.44 CC(C)CCCC(C)OCC(C)O 34a_200011218570_100011218427 [0,1,0,0,0,1|2,0,0]=4 3376 B12R0.44 CC(C)CCCC(C)OCC(C)O 7a_200011218570_100011218427 [0,1,0,0,0,1|2,0,0]=4 3377 B12R0.44 CC(C)CCCC(C)OC[C@@H](C)O 34a_200011218570_100009817552 [0,1,0,0,0,1|2,0,0]=4 3378 B12R0.44 CC(C)CCCC(C)OC[C@@H](C)O 7a_200011218570_100009817552 [0,1,0,0,0,1|2,0,0]=4 3379 B12R0.44 CC(C)CCN(C)CCCC(C)O 2230a_100000742789_200000718107 [0,1,0,0,0,1|2,0,0]=4 3380 B12R0.44 CC(C)CCN(C)CCCC(C)O 269982a_100000742789_200000718107 [0,1,0,0,0,1|2,0,0]=4 3381 B12R0.44 CC(C)CCNC(=O)CCC(C)O 1626a_100000210545_100000718519 [0,1,0,0,0,1|2,0,0]=4 3382 B12R0.44 CC(C)CCOC(C)CCC(C)C 34a_100000210254_100011261404 [0,1,0,0,0,1|2,0,0]=4 3383 B12R0.44 CC(C)CCOC(C)CCC(C)C 34a_100011215350_100000210312 [0,1,0,0,0,1|2,0,0]=4 3384 B12R0.44 CC(C)CCOC(C)CCC(C)C 7a_100011215350_100000210626 [0,1,0,0,0,1|2,0,0]=4 3385 B12R0.44 CC(C)COCC(=O)CCC(C)O 1458a_100011223364_100012276601 [0,1,0,0,0,1|2,0,0]=4 3386 B12R0.44 CC(O)CCCC(=O)NCC(C)O 527a_100000210904_100000761597 [0,1,0,0,0,1|1,0,1]=4 3387 B12R0.44 CC(O)CCNC(=O)NCC(C)O 273464a_200000755665_100000210904 [0,1,0,0,0,1|1,0,1]=4 3388 B12R0.44 CC(O)CCNC(=O)NCC(C)O 512a_100000210904_200000755665 [0,1,0,0,0,1|1,0,1]=4 3389 B12R0.44 CC(O)CCNC(=O)NCC(C)O 512a_200000755665_100000210904 [0,1,0,0,0,1|1,0,1]=4 3390 B12R0.137 C=C(C)CCOCCCC(C)(C)O 34a_100000764851_100009888830 [0,1,0,0,0,1|1,0,1]=4 3391 B12R0.137 CC(=O)CCCOCCC(C)(C)O 34a_100000759063_100000702414 [0,1,0,0,0,1|0,0,2]=4 3392 B12R0.137 CC(=O)CCCOCCC(C)(C)O 7a_100000759063_100000702414 [0,1,0,0,0,1|0,0,2]=4 3393 B12R0.137 CC(=O)CCOCCCC(C)(C)O 34a_100000759926_100009888830 [0,1,0,0,0,1|0,0,2]=4 3394 B12R0.137 CC(=O)CCOCCCC(C)(C)O 7a_100000759926_100009888830 [0,1,0,0,0,1|0,0,2]=4 3395 B12R0.137 CC(=O)NCCOCCC(C)(C)O 34a_100000158858_100000702414 [0,1,0,0,0,1|0,0,2]=4 3396 B12R0.137 CC(Br)CCOCCCC(C)(C)O 34a_100009893172_100009888830 [0,1,0,0,0,1|1,0,0]=3 3397 B12R0.137 CC(C)(O)CCCOCCC(F)F 34a_100103093639_100009888830 [0,1,0,0,0,1|2,0,0]=4 3398 B12R0.137 CC(C)CCCCNCC(C)(C)O 2230a_100000751335_100011216152 [0,1,0,0,0,1|2,0,0]=4 3399 B12R0.137 CC(C)CCCCOCC(C)(C)O 34a_100011214890_100000764493 [0,1,0,0,0,1|2,0,0]=4 3400 B12R0.137 CC(C)CCCCOCC(C)(C)O 7a_100011214890_100000764493 [0,1,0,0,0,1|2,0,0]=4 3401 B12R0.137 CC(C)CCCCSCC(C)(C)O 62a_100000764493_100011216152 [0,1,0,0,0,1|2,0,0]=4 3402 B12R0.137 CC(C)CCCCSCC(C)(C)O 62a_100011216152_100000764493 [0,1,0,0,0,1|2,0,0]=4 3403 B12R0.137 CC(C)CCCNCCC(C)(C)O 2230a_200000737386_100000702414 [0,1,0,0,0,1|2,0,0]=4 3404 B12R0.137 CC(C)CCCNCCC(C)(C)O 34a_200000737386_100000702414 [0,1,0,0,0,1|2,0,0]=4 3405 B12R0.137 CC(C)CCCOCCC(C)(C)C 34a_100000210774_100000755188 [0,1,0,0,0,1|2,0,0]=4 3406 B12R0.137 CC(C)CCCOCCC(C)(C)C 7a_100000210774_100000755188 [0,1,0,0,0,1|2,0,0]=4 3407 B12R0.137 CC(C)CCCOCCC(C)(C)C 7a_100000765024_100011214892 [0,1,0,0,0,1|2,0,0]=4 3408 B12R0.137 CC(C)CCCOCCC(C)(C)O 34a_100000210774_100000702414 [0,1,0,0,0,1|1,0,0]=3 3409 B12R0.137 CC(C)CCCOCCC(C)(C)O 7a_100000210774_100000702414 [0,1,0,0,0,1|1,0,0]=3 3410 B12R0.137 CC(C)CCCSCCC(C)(C)O 62a_100000702414_100011214892 [0,1,0,0,0,1|1,1,0]=4 3411 B12R0.137 CC(C)CCCSCCC(C)(C)O 62a_100011214892_100000702414 [0,1,0,0,0,1|1,1,0]=4 3412 B12R0.137 CC(C)CCOCCCC(C)(C)O 34a_100000210254_100009888830 [0,1,0,0,0,1|1,0,0]=3 3413 B12R0.137 CC(C)CCOCCCC(C)(C)O 7a_100000210254_100009888830 [0,1,0,0,0,1|1,0,0]=3 3414 B12R0.137 CC(C)CCOCCOC(C)(C)C 34a_100000693234_100000210312 [0,1,0,0,0,1|2,0,0]=4 3415 B12R0.137 CC(C)CCOCCOC(C)(C)C 7a_100000693234_100000210626 [0,1,0,0,0,1|2,0,0]=4 3416 B12R0.137 CC(C)CCSCCCC(C)(C)O 62a_100000210312_100009888830 [0,1,0,0,0,1|1,1,0]=4 3417 B12R0.137 CC(C)CCSCCCC(C)(C)O 62a_100009888830_100000210312 [0,1,0,0,0,1|1,1,0]=4 3418 B12R0.137 CC(C)NCCCCCC(C)(C)O 2230a_100138425928_100010402123 [0,1,0,0,0,1|2,0,0]=4 3419 B12R0.137 CC(C)NCCCCCC(C)(C)O 34a_100138425928_100010402123 [0,1,0,0,0,1|2,0,0]=4 3420 B12R0.137 CC(C)NCCOCCC(C)(C)C 34a_100000224655_100000755188 [0,1,0,0,0,1|2,0,0]=4 3421 B12R0.137 CC(C)NCCOCCC(C)(C)O 34a_100000224655_100000702414 [0,1,0,0,0,1|1,0,0]=3 3422 B12R0.137 CC(C)OCCCCCC(C)(C)O 34a_100000212225_100010402123 [0,1,0,0,0,1|2,0,0]=4 3423 B12R0.137 CC(C)OCCNCCC(C)(C)O 2230a_100000701111_100000702414 [0,1,0,0,0,1|2,0,0]=4 3424 B12R0.137 CC(C)OCCNCCC(C)(C)O 34a_100000701111_100000702414 [0,1,0,0,0,1|2,0,0]=4 3425 B12R0.137 CC(C)OCCOCCC(C)(C)C 34a_100000211219_100000755188 [0,1,0,0,0,1|2,0,0]=4 3426 B12R0.137 CC(C)OCCOCCC(C)(C)C 7a_100000211219_100000755188 [0,1,0,0,0,1|2,0,0]=4 3427 B12R0.137 CC(C)OCCOCCC(C)(C)C 7a_100000765024_100000211751 [0,1,0,0,0,1|2,0,0]=4 3428 B12R0.137 CC(C)OCCOCCC(C)(C)O 34a_100000211219_100000702414 [0,1,0,0,0,1|1,0,0]=3 3429 B12R0.137 CC(C)OCCOCCC(C)(C)O 7a_100000211219_100000702414 [0,1,0,0,0,1|1,0,0]=3 3430 B12R0.137 CC(C)OCCSCCC(C)(C)O 62a_100000211751_100000702414 [0,1,0,0,0,1|1,1,0]=4 3431 B12R0.137 CC(C)OCCSCCC(C)(C)O 62a_100000702414_100000211751 [0,1,0,0,0,1|1,1,0]=4 3432 B12R0.137 CC(C)SCCCCCC(C)(C)O 62a_100000210206_100010402123 [0,1,0,0,0,1|2,0,0]=4 3433 B12R0.137 CC(C)SCCCCCC(C)(C)O 62a_100010402123_100000210206 [0,1,0,0,0,1|2,0,0]=4 3434 B12R0.137 CC(C)SCCNCCC(C)(C)O 2230a_100000731138_100000702414 [0,1,0,0,0,1|2,0,0]=4 3435 B12R0.137 CC(C)SCCNCCC(C)(C)O 34a_100000731138_100000702414 [0,1,0,0,0,1|2,0,0]=4 3436 B12R0.137 CC(C)SCCOCCC(C)(C)C 34a_200011212901_100000755188 [0,1,0,0,0,1|2,0,0]=4 3437 B12R0.137 CC(C)SCCOCCC(C)(C)C 7a_100000765024_100000730970 [0,1,0,0,0,1|2,0,0]=4 3438 B12R0.137 CC(C)SCCOCCC(C)(C)C 7a_200011212901_100000755188 [0,1,0,0,0,1|2,0,0]=4 3439 B12R0.137 CC(C)SCCOCCC(C)(C)O 34a_200011212901_100000702414 [0,1,0,0,0,1|1,0,0]=3 3440 B12R0.137 CC(C)SCCOCCC(C)(C)O 7a_200011212901_100000702414 [0,1,0,0,0,1|1,0,0]=3 3441 B12R0.137 CC(C)SCCSCCC(C)(C)O 62a_100000702414_100000730970 [0,1,0,0,0,1|1,1,0]=4 3442 B12R0.137 CC(C)SCCSCCC(C)(C)O 62a_100000730970_100000702414 [0,1,0,0,0,1|1,1,0]=4 3443 B12R0.137 CC(O)CCCNCCC(C)(C)C 2230a_100000738805_200000718107 [0,1,0,0,0,1|2,0,0]=4 3444 B12R0.137 CC(O)CCCNCCC(C)(C)F 2230a_100016253952_200000718107 [0,1,0,0,0,1|2,0,0]=4 3445 B12R0.137 CC(O)CCCOCCC(C)(C)C 7a_100000765024_200000718107 [0,1,0,0,0,1|1,0,0]=3 3446 B12R0.137 CC(O)CCCOCCC(F)(F)F 34a_100000752437_200000718107 [0,1,0,0,0,1|2,0,0]=4 3447 B12R0.137 CC(O)CCCOCCS(=O)(=O)C 34a_100000211924_200000718107 [0,1,0,0,0,1|1,0,1]=4 3448 B12R0.137 CC(O)CCCOCCS(=O)(=O)C 7a_100000211924_200000718107 [0,1,0,0,0,1|1,0,1]=4 3449 B12R0.137 CC(O)CCCOCC[N+](C)(C)C 7a_200020618287_200000718107 [0,1,0,0,0,1|2,0,0]=4 3450 B12R0.137 CC(O)CCCOCC[Si](C)(C)C 7a_100000039746_200000718107 [0,1,0,0,0,1|1,1,0]=4 3451 B12R0.137 CC(O)CCCSCCC(C)(C)C 62a_100000755188_200000718107 [0,1,0,0,0,1|1,1,0]=4 3452 B12R0.137 CC(O)CCCSCCC(C)(C)C 62a_200000718107_100000755188 [0,1,0,0,0,1|1,1,0]=4 3453 B12R0.137 CC(O)CCCSCCC(C)(C)O 62a_100000702414_200000718107 [0,1,0,0,0,1|0,1,0]=3 3454 B12R0.137 CC(O)CCCSCCC(C)(C)O 62a_200000718107_100000702414 [0,1,0,0,0,1|0,1,0]=3 3455 B12R0.137 CC(O)CCNCCCC(C)(C)O 2230a_200000755665_100009888830 [0,1,0,0,0,1|1,0,0]=3 3456 B12R0.137 CC(O)CCNCCOC(C)(C)C 2230a_100000747557_100012276601 [0,1,0,0,0,1|2,0,0]=4 3457 B12R0.137 CC(O)CCNCCSC(C)(C)C 2230a_100000689375_100012276601 [0,1,0,0,0,1|2,0,0]=4 3458 B12R0.137 CC(O)CCOCCCC(F)(F)F 34a_100000749235_100012276601 [0,1,0,0,0,1|2,0,0]=4 3459 B12R0.137 CC(O)CCOCCCS(=O)(=O)C 34a_100000689940_100012276601 [0,1,0,0,0,1|1,0,1]=4 3460 B12R0.137 CC(O)CCOCCCS(=O)(=O)C 7a_100000689940_100012276601 [0,1,0,0,0,1|1,0,1]=4 3461 B12R0.137 CC(O)CCOCCC[Si](C)(C)C 7a_200011215415_100012276601 [0,1,0,0,0,1|1,1,0]=4 3462 B12R0.137 CC(O)CCOCCOC(C)(C)C 34a_100000693234_100012276601 [0,1,0,0,0,1|1,0,0]=3 3463 B12R0.137 CC(O)CCOCCOC(C)(C)C 7a_100000693234_100012276601 [0,1,0,0,0,1|1,0,0]=3 3464 B12R0.137 CC(O)CCOCCOC(F)(F)F 34a_100000761981_100012276601 [0,1,0,0,0,1|2,0,0]=4 3465 B12R0.137 CC(O)CCSCCCC(C)(C)O 62a_100009888830_100012276601 [0,1,0,0,0,1|0,1,0]=3 3466 B12R0.137 CC(O)CCSCCCC(C)(C)O 62a_100012276601_100009888830 [0,1,0,0,0,1|0,1,0]=3 3467 B12R0.137 CC(O)CNCOCC[Si](C)(C)C 2230a_100000210904_100000032501 [0,1,0,0,0,1|1,1,0]=4 3468 B12R0.137 CC(O)CNCOCC[Si](C)(C)C 34a_100000210904_100000032501 [0,1,0,0,0,1|1,1,0]=4 3469 B12R0.137 CC(O)CSCOCC[Si](C)(C)C 62a_100000032501_100011218427 [0,1,0,0,0,1|1,1,0]=4 3470 B12R0.137 CC(O)CSCOCC[Si](C)(C)C 62a_100011218427_100000032501 [0,1,0,0,0,1|1,1,0]=4 3471 B12R0.137 C[C@@H](N)CCOCCCC(C)(C)O 34a_100000706166_100009888830 [0,1,0,0,0,1|1,0,0]=3 3472 B12R0.137 C[C@@H](O)CSCOCC[Si](C)(C)C 62a_100000032501_100009817552 [0,1,0,0,0,1|1,1,0]=4 3473 B12R0.137 C[C@@H](O)CSCOCC[Si](C)(C)C 62a_100009817552_100000032501 [0,1,0,0,0,1|1,1,0]=4 3474 B12R0.184 CC(C)CCCCCNC(C)CO 2230a_100011290863_100012180447 [0,1,0,0,0,1|2,0,0]=4 3475 B12R0.184 CC(C)CCCCCNC(C)CO 34a_100011290863_100012180447 [0,1,0,0,0,1|2,0,0]=4 3476 B12R0.184 CC(C)CCCCCN[C@H](C)CO 2230a_100000737577_100000210682 [0,1,0,0,0,1|2,0,0]=4 3477 B12R0.184 CC(C)CCCCCOC(C)CO 34a_100011995859_100012180447 [0,1,0,0,0,1|2,0,0]=4 3478 B12R0.184 CC(C)CCCCCOC(C)CO 7a_100011995859_100012180447 [0,1,0,0,0,1|2,0,0]=4 3479 B12R0.184 CC(C)CCCCCSC(C)CO 62a_100012180447_100000210682 [0,1,0,0,0,1|2,0,0]=4 3480 B12R0.184 CC(C)CCCCCS[C@H](C)CO 62a_100000210682_100016084084 [0,1,0,0,0,1|2,0,0]=4 3481 B12R0.184 CC(C)CCCCCS[C@H](C)CO 62a_100016084084_100000210682 [0,1,0,0,0,1|2,0,0]=4 3482 B12R0.184 CC(C)CCCCNCC(C)CO 34a_100000744482_100011216152 [0,1,0,0,0,1|2,0,0]=4 3483 B12R0.184 CC(C)CCCCNC[C@H](O)CO 2230a_100020644852_100011216152 [0,1,0,0,0,1|2,0,0]=4 3484 B12R0.184 CC(C)CCCCOCC(O)CO 34a_100011214890_100011219619 [0,1,0,0,0,1|2,0,0]=4 3485 B12R0.184 CC(C)CCCCOCC(O)CO 7a_100011214890_100011219619 [0,1,0,0,0,1|2,0,0]=4 3486 B12R0.184 CC(C)CCCCOC[C@@H](C)CO 34a_100011214890_100000059175 [0,1,0,0,0,1|2,0,0]=4 3487 B12R0.184 CC(C)CCCCOC[C@@H](C)CO 7a_100011214890_100000059175 [0,1,0,0,0,1|2,0,0]=4 3488 B12R0.184 CC(C)CCCCOC[C@@H](O)CF 34a_100011214890_100015614560 [0,1,0,0,0,1|2,0,0]=4 3489 B12R0.184 CC(C)CCCCOC[C@@H](O)CF 7a_100011214890_100015614560 [0,1,0,0,0,1|2,0,0]=4 3490 B12R0.184 CC(C)CCCCOC[C@@H](O)CO 34a_100011214890_100009815848 [0,1,0,0,0,1|2,0,0]=4 3491 B12R0.184 CC(C)CCCCOC[C@@H](O)CO 7a_100011214890_100009815848 [0,1,0,0,0,1|2,0,0]=4 3492 B12R0.184 CC(C)CCCCSCC(O)CO 62a_100011216152_100011219619 [0,1,0,0,0,1|2,0,0]=4 3493 B12R0.184 CC(C)CCCCSCC(O)CO 62a_100011219619_100011216152 [0,1,0,0,0,1|2,0,0]=4 3494 B12R0.184 CC(C)CCCCSC[C@@H](C)CO 62a_100000059175_100011216152 [0,1,0,0,0,1|2,0,0]=4 3495 B12R0.184 CC(C)CCCCSC[C@@H](C)CO 62a_100011216152_100000059175 [0,1,0,0,0,1|2,0,0]=4 3496 B12R0.184 CC(C)CCCCSC[C@@H](O)CF 62a_100011216152_100015614560 [0,1,0,0,0,1|2,0,0]=4 3497 B12R0.184 CC(C)CCCCSC[C@@H](O)CF 62a_100015614560_100011216152 [0,1,0,0,0,1|2,0,0]=4 3498 B12R0.184 CC(C)CCCCSC[C@@H](O)CO 62a_100009815848_100011216152 [0,1,0,0,0,1|2,0,0]=4 3499 B12R0.184 CC(C)CCCCSC[C@@H](O)CO 62a_100011216152_100009815848 [0,1,0,0,0,1|2,0,0]=4 3500 B12R0.184 CC(C)CCCNCCC(C)CO 2230a_106354213184_100011214892 [0,1,0,0,0,1|2,0,0]=4 3501 B12R0.184 CC(C)CCCNCCC(C)CO 34a_106354213184_100011214892 [0,1,0,0,0,1|2,0,0]=4 3502 B12R0.184 CC(C)CCOCCC[C@@H](C)CN 34a_100160569302_100000210312 [0,1,0,0,0,1|2,0,0]=4 3503 B12R0.184 CC(CO)CCNCCOC(C)C 2230a_106354213184_100000211751 [0,1,0,0,0,1|2,0,0]=4 3504 B12R0.184 CC(CO)CCNCCOC(C)C 34a_106354213184_100000211751 [0,1,0,0,0,1|2,0,0]=4 3505 B12R0.184 CC(CO)CCNCCSC(C)C 2230a_106354213184_100000730970 [0,1,0,0,0,1|2,0,0]=4 3506 B12R0.184 CC(CO)CCNCCSC(C)C 34a_106354213184_100000730970 [0,1,0,0,0,1|2,0,0]=4 3507 B12R0.184 CC(O)CCCNCCC(C)CO 2230a_106354213184_200000718107 [0,1,0,0,0,1|1,0,0]=3 3508 B12R0.184 CC(O)CCCNCCC(C)CO 34a_106354213184_200000718107 [0,1,0,0,0,1|1,0,0]=3 3509 B12R0.184 CC(O)CCCOCCC(=NO)N 34a_100000749954_200000718107 [0,1,0,0,0,1|1,0,1]=4 3510 B12R0.184 CC(O)CCOCCC[C@@H](C)CN 34a_100160569302_100012276601 [0,1,0,0,0,1|1,0,0]=3 3511 B12R0.184 CCC(=O)NCCOCCC(C)O 34a_200000158885_100012276601 [0,1,0,0,0,1|0,0,2]=4 3512 B12R0.184 CCC(=O)NCCOCCC(C)O 7a_200000158885_100012276601 [0,1,0,0,0,1|0,0,2]=4 3513 B12R0.184 CCC(=O)OCCOCCC(C)O 7a_200000031056_100012276601 [0,1,0,0,0,1|0,0,2]=4 3514 B12R0.184 CCC(C)CCCOCCC(C)C 7a_100011216074_100000210626 [0,1,0,0,0,1|2,0,0]=4 3515 B12R0.184 CCC(C)CCCOCCC(C)O 7a_100011216074_100012276601 [0,1,0,0,0,1|1,0,0]=3 3516 B12R0.184 CCC(C)CCNCCCC(C)O 2230a_100020591266_200000718107 [0,1,0,0,0,1|2,0,0]=4 3517 B12R0.184 CCC(C)CCOCCCC(C)C 7a_100011215188_100011214892 [0,1,0,0,0,1|2,0,0]=4 3518 B12R0.184 CCC(C)CCOCCCC(C)O 7a_100011215188_200000718107 [0,1,0,0,0,1|1,0,0]=3 3519 B12R0.184 CCC(C)CCOCCOC(C)C 7a_100011215188_100000211751 [0,1,0,0,0,1|2,0,0]=4 3520 B12R0.184 CCC(C)CCOCCSC(C)C 7a_100011215188_100000730970 [0,1,0,0,0,1|2,0,0]=4 3521 B12R0.184 CCC(O)CNCCCCC(C)C 2230a_100011218483_100011216152 [0,1,0,0,0,1|2,0,0]=4 3522 B12R0.184 CCC(O)COCCCCC(C)C 34a_100011214890_100011218378 [0,1,0,0,0,1|2,0,0]=4 3523 B12R0.184 CCC(O)COCCCCC(C)C 7a_100011214890_100011218378 [0,1,0,0,0,1|2,0,0]=4 3524 B12R0.184 CCC(O)CSCCCCC(C)C 62a_100011216152_100011218378 [0,1,0,0,0,1|2,0,0]=4 3525 B12R0.184 CCC(O)CSCCCCC(C)C 62a_100011218378_100011216152 [0,1,0,0,0,1|2,0,0]=4 3526 B12R0.184 CNC(=O)CCOCCCC(C)O 34a_100000754576_200000718107 [0,1,0,0,0,1|0,0,2]=4 3527 B12R0.184 COC(=O)NCCOCCC(C)O 34a_100000757965_100012276601 [0,1,0,0,0,1|0,0,2]=4 3528 B12R0.184 COC(=O)OCCOCCC(C)O 34a_100010262106_100012276601 [0,1,0,0,0,1|0,0,2]=4 3529 B12R0.184 COC(C)CCOCCC=C(C)C 7a_100000764861_100011217483 [0,1,0,0,0,1|1,0,1]=4 3530 B12R0.184 COC(C)CCOCCCC(=O)C 7a_100000764861_100011215641 [0,1,0,0,0,1|0,0,2]=4 3531 B12R0.184 COC(C)CCOCCCC(C)C 7a_100000764861_100011214892 [0,1,0,0,0,1|1,0,0]=3 3532 B12R0.184 COC(C)CCOCCCC(C)O 7a_100000764861_200000718107 [0,1,0,0,0,1|0,0,0]=2 3533 B12R0.184 COC(C)CCOCCCN(C)C 7a_100000764861_100000757444 [0,1,0,0,0,1|2,0,0]=4 3534 B12R0.184 COC(C)CCOCCNC(=O)C 7a_100000764861_100000189650 [0,1,0,0,0,1|0,0,2]=4 3535 B12R0.184 COC(C)CCOCCOC(=O)C 7a_100000764861_100009814007 [0,1,0,0,0,1|0,0,2]=4 3536 B12R0.184 COC(C)CCOCCOC(C)C 7a_100000764861_100000211751 [0,1,0,0,0,1|1,0,0]=3 3537 B12R0.184 COC(C)CCOCCSC(C)C 7a_100000764861_100000730970 [0,1,0,0,0,1|1,0,0]=3 3538 B12R0.184 COC(C)COCCCCC(C)C 34a_100000690652_100011216152 [0,1,0,0,0,1|2,0,0]=4 3539 B12R0.184 COC(C)SCCCCCC(C)C 62a_100000210682_100009879195 [0,1,0,0,0,1|2,0,0]=4 3540 B12R0.184 COC(C)SCCCCCC(C)C 62a_100009879195_100000210682 [0,1,0,0,0,1|2,0,0]=4 3541 B12R0.184 CO[C@H](C)CNCCCCC(C)C 2230a_100020591295_100011216152 [0,1,0,0,0,1|2,0,0]=4 3542 B12R0.270 CC(C)CC(C)NCCCC(C)O 2230a_100000692259_200000718107 [0,1,0,0,0,1|2,0,0]=4 3543 B12R0.270 CC(C)CC(C)OCCCC(C)O 34a_100000211805_200000718107 [0,1,0,0,0,1|1,0,0]=3 3544 B12R0.270 CC(C)CC(C)OCCCC(C)O 7a_100000211805_200000718107 [0,1,0,0,0,1|1,0,0]=3 3545 B12R0.270 CC(C)CC(C)OCCNC(C)C 34a_100000224655_100000731052 [0,1,0,0,0,1|2,0,0]=4 3546 B12R0.270 CC(C)CC(C)OCCOC(C)C 34a_100000211219_100000731052 [0,1,0,0,0,1|2,0,0]=4 3547 B12R0.270 CC(C)CC(C)OCCOC(C)C 34a_100000211805_100000211751 [0,1,0,0,0,1|2,0,0]=4 3548 B12R0.270 CC(C)CC(C)OCCOC(C)C 7a_100000211219_100000731052 [0,1,0,0,0,1|2,0,0]=4 3549 B12R0.270 CC(C)CC(C)OCCOC(C)C 7a_100000211805_100000211751 [0,1,0,0,0,1|2,0,0]=4 3550 B12R0.270 CC(C)CC(C)OCCSC(C)C 34a_100000211805_100000730970 [0,1,0,0,0,1|2,0,0]=4 3551 B12R0.270 CC(C)CC(C)OCCSC(C)C 34a_200011212901_100000731052 [0,1,0,0,0,1|2,0,0]=4 3552 B12R0.270 CC(C)CC(C)OCCSC(C)C 7a_100000211805_100000730970 [0,1,0,0,0,1|2,0,0]=4 3553 B12R0.270 CC(C)CC(C)OCCSC(C)C 7a_200011212901_100000731052 [0,1,0,0,0,1|2,0,0]=4 3554 B12R0.270 CC(C)CC(C)SCCCC(C)O 62a_100000731052_200000718107 [0,1,0,0,0,1|1,1,0]=4 3555 B12R0.270 CC(C)CC(C)SCCCC(C)O 62a_200000718107_100000731052 [0,1,0,0,0,1|1,1,0]=4 3556 B12R0.270 CC(C)CCCCC(=O)CC(C)O 1458a_100011933920_100011218427 [0,1,0,0,0,1|2,0,0]=4 3557 B12R0.270 CC(C)CCCCC(=O)C[C@@H](C)O 1458a_100011933948_100011216152 [0,1,0,0,0,1|2,0,0]=4 3558 B12R0.270 CC(C)CCCCN(C)CC(C)O 2230a_100000227577_100011216152 [0,1,0,0,0,1|2,0,0]=4 3559 B12R0.270 CC(C)CCCCN(C)CC(C)O 269982a_100000227577_100011216152 [0,1,0,0,0,1|2,0,0]=4 3560 B12R0.270 CC(C)CCCOC(C)CC(C)C 34a_100000210774_100000731052 [0,1,0,0,0,1|2,0,0]=4 3561 B12R0.270 CC(C)CCCOC(C)CC(C)C 34a_100000211805_100011214892 [0,1,0,0,0,1|2,0,0]=4 3562 B12R0.270 CC(C)CCCOC(C)CC(C)C 7a_100000210774_100000731052 [0,1,0,0,0,1|2,0,0]=4 3563 B12R0.270 CC(C)CCCOC(C)CC(C)C 7a_100000211805_100011214892 [0,1,0,0,0,1|2,0,0]=4 3564 B12R0.270 CC(C)CCOC[C@@H](N)CC(C)C 34a_100011830311_100000210312 [0,1,0,0,0,1|2,0,0]=4 3565 B12R0.270 CC(C)C[C@H](N)CCOCC(C)O 34a_100161151251_100011218427 [0,1,0,0,0,1|2,0,0]=4 3566 B12R0.270 CC(C)C[C@H](N)CCOC[C@@H](C)O 34a_100161151251_100009817552 [0,1,0,0,0,1|2,0,0]=4 3567 B12R0.270 CC(C)C[C@H](N)COCCC(C)O 34a_100011830311_100012276601 [0,1,0,0,0,1|1,0,0]=3 3568 B12R0.3 CC(C)CC(C)OC(C)CC(C)C 34a_100000211805_100000731052 [0,2,0,0,0,0|2,0,0]=4 3569 B12R0.3 CC(C)CC(C)OC(C)CC(C)C 7a_100000211805_100000731052 [0,2,0,0,0,0|2,0,0]=4 3570 B12R0.66 CC(C)CC(C)NCCC(C)(C)O 2230a_100000692259_100000702414 [0,2,0,0,0,0|2,0,0]=4 3571 B12R0.66 CC(C)CC(C)OCCC(C)(C)C 34a_100000211805_100000755188 [0,2,0,0,0,0|2,0,0]=4 3572 B12R0.66 CC(C)CC(C)OCCC(C)(C)C 7a_100000211805_100000755188 [0,2,0,0,0,0|2,0,0]=4 3573 B12R0.66 CC(C)CC(C)OCCC(C)(C)C 7a_100000765024_100000731052 [0,2,0,0,0,0|2,0,0]=4 3574 B12R0.66 CC(C)CC(C)OCCC(C)(C)O 34a_100000211805_100000702414 [0,2,0,0,0,0|1,0,0]=3 3575 B12R0.66 CC(C)CC(C)OCCC(C)(C)O 7a_100000211805_100000702414 [0,2,0,0,0,0|1,0,0]=3 3576 B12R0.66 CC(C)CC(C)SCCC(C)(C)O 62a_100000702414_100000731052 [0,2,0,0,0,0|1,1,0]=4 3577 B12R0.66 CC(C)CC(C)SCCC(C)(C)O 62a_100000731052_100000702414 [0,2,0,0,0,0|1,1,0]=4 3578 B12R0.66 CC(O)CN(C)CCCC(C)(C)O 2230a_100000227577_100009888830 [0,2,0,0,0,0|2,0,0]=4 3579 B12R0.66 CC(O)CN(C)CCCC(C)(C)O 269982a_100000227577_100009888830 [0,2,0,0,0,0|2,0,0]=4 3580 B12R0.140 CC(C)CCOC(C)CC(C)(C)C 7a_200011218616_100000210626 [0,2,0,0,0,0|2,0,0]=4 3581 B12R0.140 CC(O)CCCC(=O)CC(C)(C)O 1458a_100000693243_200000718107 [0,2,0,0,0,0|1,0,1]=4 3582 B12R0.140 CC(O)CCCN(C)CC(C)(C)O 2230a_100000755907_200000718107 [0,2,0,0,0,0|2,0,0]=4 3583 B12R0.140 CC(O)CCCN(C)CC(C)(C)O 269982a_100000755907_200000718107 [0,2,0,0,0,0|2,0,0]=4 3584 B12R0.140 CC(O)CCNC(=O)CC(C)(C)O 527a_200000755665_100000693243 [0,2,0,0,0,0|1,0,1]=4 3585 B12R0.140 CC(O)CCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100012276601 [0,2,0,0,0,0|2,0,0]=4 3586 B12R0.140 CC(O)CCOC(C)CC(C)(C)C 7a_200011218616_100012276601 [0,2,0,0,0,0|1,0,0]=3 3587 B12R0.140 CC(O)CCOC(C)CC(F)(F)F 34a_200011470763_100012276601 [0,2,0,0,0,0|2,0,0]=4 3588 B12R0.140 CC(O)CCOC(C)CC(F)(F)F 7a_200011470763_100012276601 [0,2,0,0,0,0|2,0,0]=4 3589 B12R0.240 CC(O)CCCN(C)CC(O)CO 2230a_100011216503_200000718107 [0,2,0,0,0,0|2,0,0]=4 3590 B12R0.240 CC(O)CCCN(C)CC(O)CO 269982a_100011216503_200000718107 [0,2,0,0,0,0|2,0,0]=4 3591 B12R0.240 CCC(C)CC(C)NCCC(C)O 2230a_100000763565_100012276601 [0,2,0,0,0,0|2,0,0]=4 3592 B12R0.240 CCC(C)CC(C)NCCC(C)O 270004a_200000755665_100011710205 [0,2,0,0,0,0|2,0,0]=4 3593 B12R0.240 CCC(O)CC(=O)CCCC(C)O 1458a_100011667805_200000718107 [0,2,0,0,0,0|1,0,1]=4 3594 B12R0.240 CCC(O)CC(=O)NCCC(C)O 240690a_200000755665_100011667805 [0,2,0,0,0,0|1,0,1]=4 3595 B12R0.241 CC(C)CC(C)NCCC(C)CO 2230a_106354213184_100000731052 [0,2,0,0,0,0|2,0,0]=4 3596 B12R0.241 CC(C)CC(C)NCCC(C)CO 34a_106354213184_100000731052 [0,2,0,0,0,0|2,0,0]=4 3597 B12R0.241 CC(CO)CCNC(=O)C[C@@H](C)O 240690a_106354213184_100011933948 [0,2,0,0,0,0|1,0,1]=4 3598 B12R0.241 CCC(C)CCOC(C)CC(C)C 7a_100011215188_100000731052 [0,2,0,0,0,0|2,0,0]=4 3599 B12R0.241 COC(C)CCOC(C)CC(C)C 7a_100000764861_100000731052 [0,2,0,0,0,0|1,0,0]=3 3600 B12R0.258 CC(C)CC(C)N(C)CCC(C)O 2230a_100000745462_100012276601 [0,2,0,0,0,0|2,0,0]=4 3601 B12R0.258 CC(C)CC(C)N(C)CCC(C)O 269982a_100000745462_100012276601 [0,2,0,0,0,0|2,0,0]=4 3602 B12R0.258 CC(C)C[C@H](O)C(=O)CCC(C)O 1458a_100012027011_100012276601 [0,2,0,0,0,0|2,0,0]=4 3603 B12R0.535 C#CC(CC(C)C)OCCC(C)C 34a_100011215986_100000210312 [0,2,0,0,0,0|2,0,0]=4 3604 B12R0.535 C#CC(CC(C)C)OCCC(C)C 7a_100011215986_100000210626 [0,2,0,0,0,0|2,0,0]=4 3605 B12R0.535 C#CC(CC(C)C)OCCC(C)O 34a_100011215986_100012276601 [0,2,0,0,0,0|1,0,0]=3 3606 B12R0.535 C#CC(CC(C)C)OCCC(C)O 7a_100011215986_100012276601 [0,2,0,0,0,0|1,0,0]=3 3607 B12R0.535 C=CC(CC(C)C)OCCC(C)C 34a_100012186643_100000210312 [0,2,0,0,0,0|2,0,0]=4 3608 B12R0.535 C=CC(CC(C)C)OCCC(C)C 7a_100012186643_100000210626 [0,2,0,0,0,0|2,0,0]=4 3609 B12R0.535 C=CC(CC(C)C)OCCC(C)O 34a_100012186643_100012276601 [0,2,0,0,0,0|1,0,0]=3 3610 B12R0.535 C=CC(CC(C)C)OCCC(C)O 7a_100012186643_100012276601 [0,2,0,0,0,0|1,0,0]=3 3611 B12R0.535 CC(C)CC(C#N)NCCC(C)O 2230a_100000741378_100012276601 [0,2,0,0,0,0|2,0,0]=4 3612 B12R0.535 CC(C)CC(C#N)OCCC(C)O 34a_200011294978_100012276601 [0,2,0,0,0,0|1,0,0]=3 3613 B12R0.535 CC(C)CC(C#N)OCCC(C)O 7a_200011294978_100012276601 [0,2,0,0,0,0|1,0,0]=3 3614 B12R0.535 CC(C)CCOC(C#N)CC(C)C 34a_200011294978_100000210312 [0,2,0,0,0,0|2,0,0]=4 3615 B12R0.535 CC(C)CCOC(C#N)CC(C)C 7a_200011294978_100000210626 [0,2,0,0,0,0|2,0,0]=4 3616 B12R0.535 CC(C)C[C@@H](CO)NCCC(C)O 2230a_100011830311_100012276601 [0,2,0,0,0,0|2,0,0]=4 3617 B12R0.535 CC(C)C[C@@H](CO)NCCC(C)O 34a_100011830311_100012276601 [0,2,0,0,0,0|2,0,0]=4 3618 B12R0.535 CCN(CCCC(C)O)C[C@H](C)O 2230a_100000729506_200000718107 [0,2,0,0,0,0|2,0,0]=4 3619 B12R0.535 CCN(CCCC(C)O)C[C@H](C)O 269982a_100000729506_200000718107 [0,2,0,0,0,0|2,0,0]=4 3620 B12R0.687 CC(C)CC(C)OC[C@H](N)C(C)C 34a_100011830312_100000731052 [0,2,0,0,0,0|2,0,0]=4 3621 B12R0.697 CC(=O)CC(C)(C)OCCC(C)O 7a_100000210262_100012276601 [0,2,0,0,0,0|0,0,2]=4 3622 B12R0.697 CC(C)CC(C)(C)NCCC(C)O 2230a_100011346068_100012276601 [0,2,0,0,0,0|2,0,0]=4 3623 B12R0.86 CCN(C)C(C)COCCC(C)O 7a_100000732741_100012276601 [0,2,0,0,0,0|2,0,0]=4 3624 B12R0.86 COC(=O)C(C)COCCC(C)O 34a_100000749362_100012276601 [0,2,0,0,0,0|0,0,2]=4 3625 B12R0.86 COC(=O)C(C)COCCC(C)O 7a_100000749362_100012276601 [0,2,0,0,0,0|0,0,2]=4 3626 B12R0.86 COC(=O)C(F)COCCC(C)O 34a_200009849844_100012276601 [0,2,0,0,0,0|0,0,2]=4 3627 B12R0.86 COC(=O)[C@H](N)COCCC(C)O 34a_100000003586_100012276601 [0,2,0,0,0,0|0,0,2]=4 3628 B12R0.186 COC(C)CCOCC(=O)C(C)C 7a_100000764861_100000753385 [0,2,0,0,0,0|1,0,1]=4 3629 B12R0.238 CC(C)CCOCC(CN)C(C)C 34a_100000692819_100000210312 [0,2,0,0,0,0|2,0,0]=4 3630 B12R0.238 CC(O)CCCN[C@H](CO)[C@@H](C)O 2230a_100015196842_200000718107 [0,2,0,0,0,0|2,0,0]=4 3631 B12R0.238 CC(O)CCCN[C@H](CO)[C@@H](C)O 34a_100015196842_200000718107 [0,2,0,0,0,0|2,0,0]=4 3632 B12R0.238 CC(O)CCNCC(CO)C(C)C 34a_100000692819_100012276601 [0,2,0,0,0,0|2,0,0]=4 3633 B12R0.238 CC(O)CCOCC(CN)C(C)C 34a_100000692819_100012276601 [0,2,0,0,0,0|1,0,0]=3 3634 B12R0.238 CCC(CNCCC(C)O)C(C)C 269862a_200000755665_100011214906 [0,2,0,0,0,0|2,0,0]=4 3635 B12R0.238 CCC(COCCC(C)C)C(C)C 34a_100011995916_100000210312 [0,2,0,0,0,0|2,0,0]=4 3636 B12R0.238 CCC(COCCC(C)C)C(C)C 7a_100011995916_100000210626 [0,2,0,0,0,0|2,0,0]=4 3637 B12R0.238 CCC(COCCC(C)O)C(C)C 34a_100011995916_100012276601 [0,2,0,0,0,0|1,0,0]=3 3638 B12R0.238 CCC(COCCC(C)O)C(C)C 7a_100011995916_100012276601 [0,2,0,0,0,0|1,0,0]=3 3639 B12R0.238 CC[C@H](NCCCC(C)O)[C@@H](C)O 2230a_100161114882_200000718107 [0,2,0,0,0,0|2,0,0]=4 3640 B12R0.238 CC[C@H](NCCCC(C)O)[C@@H](C)O 34a_100161114882_200000718107 [0,2,0,0,0,0|2,0,0]=4 3641 B12R0.264 CC(=O)C(C)COCCC(C)(C)O 34a_100000032740_100000702414 [0,2,0,0,0,0|0,0,2]=4 3642 B12R0.264 CC(=O)C(C)COCCC(C)(C)O 7a_100000032740_100000702414 [0,2,0,0,0,0|0,0,2]=4 3643 B12R0.264 CC(C)C(O)CNCCC(C)(C)O 2230a_100000759067_100000702414 [0,2,0,0,0,0|2,0,0]=4 3644 B12R0.264 CC(C)C(O)CNCCC(C)(C)O 34a_100000759067_100000702414 [0,2,0,0,0,0|2,0,0]=4 3645 B12R0.264 CC(C)[C@@H](N)COCCC(C)(C)C 34a_100011830312_100000755188 [0,2,0,0,0,0|2,0,0]=4 3646 B12R0.264 CC(C)[C@@H](N)COCCC(C)(C)O 34a_100011830312_100000702414 [0,2,0,0,0,0|1,0,0]=3 3647 B12R0.269 CC(C)CCNC[C@@H](F)C(C)(C)O 269862a_100015379105_100000185833 [0,2,0,0,0,0|2,0,0]=4 3648 B12R0.269 CC(O)CCCN[C@@H](C)C(C)(C)O 2230a_100025708725_200000718107 [0,2,0,0,0,0|2,0,0]=4 3649 B12R0.269 CC(O)CCOCC(=O)C(C)(C)C 34a_200011592769_100012276601 [0,2,0,0,0,0|1,0,1]=4 3650 B12R0.269 CC(O)CCOCC(=O)C(C)(C)C 7a_200011592769_100012276601 [0,2,0,0,0,0|1,0,1]=4 3651 B12R0.269 CC(O)CCOCC(Br)C(F)(F)F 34a_100009817051_100012276601 [0,2,0,0,0,0|2,0,0]=4 3652 B12R0.269 CC(O)CCOCC(C)C(F)(F)F 34a_100010286394_100012276601 [0,2,0,0,0,0|2,0,0]=4 3653 B12R0.692 CC(O)CCOCC(F)(F)C(F)F 34a_100000210902_100012276601 [0,2,0,0,0,0|2,0,0]=4 3654 B12R0.150 CC(C)(O)CCCNC[C@H](O)CO 2230a_100020644852_100009888830 [0,2,0,0,0,0|2,0,0]=4 3655 B12R0.150 CC(C)(O)CCCSCC(O)CO 62a_100009888830_100011219619 [0,2,0,0,0,0|2,0,0]=4 3656 B12R0.150 CC(C)(O)CCCSCC(O)CO 62a_100011219619_100009888830 [0,2,0,0,0,0|2,0,0]=4 3657 B12R0.150 CC(C)(O)CCCSC[C@@H](O)CF 62a_100009888830_100015614560 [0,2,0,0,0,0|2,0,0]=4 3658 B12R0.150 CC(C)(O)CCCSC[C@@H](O)CF 62a_100015614560_100009888830 [0,2,0,0,0,0|2,0,0]=4 3659 B12R0.150 CC(C)(O)CCCSC[C@@H](O)CO 62a_100009815848_100009888830 [0,2,0,0,0,0|2,0,0]=4 3660 B12R0.150 CC(C)(O)CCCSC[C@@H](O)CO 62a_100009888830_100009815848 [0,2,0,0,0,0|2,0,0]=4 3661 B12R0.150 CC(C)(O)CCOCCC(=NO)N 34a_100000749954_100000702414 [0,2,0,0,0,0|1,0,1]=4 3662 B12R0.150 CC(CO)CCNCCC(C)(C)C 2230a_106354213184_100000755188 [0,2,0,0,0,0|2,0,0]=4 3663 B12R0.150 CC(CO)CCNCCC(C)(C)C 34a_106354213184_100000755188 [0,2,0,0,0,0|2,0,0]=4 3664 B12R0.150 CC(CO)CCNCCC(C)(C)O 2230a_106354213184_100000702414 [0,2,0,0,0,0|1,0,0]=3 3665 B12R0.150 CC(CO)CCNCCC(C)(C)O 34a_106354213184_100000702414 [0,2,0,0,0,0|1,0,0]=3 3666 B12R0.150 CC(CO)CNCCCC(C)(C)O 34a_100000744482_100009888830 [0,2,0,0,0,0|2,0,0]=4 3667 B12R0.150 CCC(C)CCNCCC(C)(C)O 2230a_100020591266_100000702414 [0,2,0,0,0,0|2,0,0]=4 3668 B12R0.150 CCC(C)CCOCCC(C)(C)C 7a_100011215188_100000755188 [0,2,0,0,0,0|2,0,0]=4 3669 B12R0.150 CCC(C)CCOCCC(C)(C)O 7a_100011215188_100000702414 [0,2,0,0,0,0|1,0,0]=3 3670 B12R0.150 CCC(O)CNCCCC(C)(C)O 2230a_100011218483_100009888830 [0,2,0,0,0,0|2,0,0]=4 3671 B12R0.150 CCC(O)CSCCCC(C)(C)O 62a_100009888830_100011218378 [0,2,0,0,0,0|2,0,0]=4 3672 B12R0.150 CCC(O)CSCCCC(C)(C)O 62a_100011218378_100009888830 [0,2,0,0,0,0|2,0,0]=4 3673 B12R0.150 CNC(=O)CCOCCC(C)(C)O 34a_100000754576_100000702414 [0,2,0,0,0,0|0,0,2]=4 3674 B12R0.150 COC(C)CCOCCC(C)(C)C 7a_100000764861_100000755188 [0,2,0,0,0,0|1,0,0]=3 3675 B12R0.150 COC(C)CCOCCC(C)(C)O 7a_100000764861_100000702414 [0,2,0,0,0,0|0,0,0]=2 3676 B12R0.150 COC(C)CCOCCC(F)(F)F 7a_100000764861_100011219754 [0,2,0,0,0,0|2,0,0]=4 3677 B12R0.150 COC(C)CCOCCS(=O)(=O)C 7a_100000764861_100000230027 [0,2,0,0,0,0|1,0,1]=4 3678 B12R0.150 COC(C)CCOCC[N+](C)(C)C 7a_100000764861_100000085578 [0,2,0,0,0,0|2,0,0]=4 3679 B12R0.150 COC(C)CCOCC[Si](C)(C)C 7a_100000764861_200000733723 [0,2,0,0,0,0|1,1,0]=4 3680 B12R0.150 COC(C)COCCCC(C)(C)O 34a_100000690652_100009888830 [0,2,0,0,0,0|2,0,0]=4 3681 B12R0.150 CO[C@H](C)CNCCCC(C)(C)O 2230a_100020591295_100009888830 [0,2,0,0,0,0|2,0,0]=4 3682 B12R0.150 C[C@@H](CO)CSCCCC(C)(C)O 62a_100000059175_100009888830 [0,2,0,0,0,0|2,0,0]=4 3683 B12R0.150 C[C@@H](CO)CSCCCC(C)(C)O 62a_100009888830_100000059175 [0,2,0,0,0,0|2,0,0]=4 3684 B12R0.210 C=C(C)CCOCCC(C)(C)OC 7a_100000699976_100000730704 [0,2,0,0,0,0|1,0,1]=4 3685 B12R0.210 CC(O)CCCNCC(C)(C)CO 2230a_100020635058_200000718107 [0,2,0,0,0,0|2,0,0]=4 3686 B12R0.210 CC(O)CCCSCC(C)(C)CO 62a_100009813988_200000718107 [0,2,0,0,0,0|2,0,0]=4 3687 B12R0.210 CC(O)CCCSCC(C)(C)CO 62a_200000718107_100009813988 [0,2,0,0,0,0|2,0,0]=4 3688 B12R0.210 CC(O)CNCCCC(C)(C)CO 2230a_100000039164_100011218427 [0,2,0,0,0,0|2,0,0]=4 3689 B12R0.210 CCS(=O)(=O)CCOCCC(C)O 34a_200011216379_100012276601 [0,2,0,0,0,0|1,0,1]=4 3690 B12R0.210 CCS(=O)(=O)CCOCCC(C)O 7a_200011216379_100012276601 [0,2,0,0,0,0|1,0,1]=4 3691 B12R0.210 COC(C)(C)CCOCCC(=O)C 7a_100000699976_100000053229 [0,2,0,0,0,0|0,0,2]=4 3692 B12R0.210 COC(C)(C)CCOCCC(C)C 7a_100000699976_100000210626 [0,2,0,0,0,0|1,0,0]=3 3693 B12R0.210 COC(C)(C)CCOCCC(C)O 7a_100000699976_100012276601 [0,2,0,0,0,0|0,0,0]=2 3694 B12R0.210 COC(C)(C)CCOCCN(C)C 7a_100000699976_100000755713 [0,2,0,0,0,0|2,0,0]=4 3695 B12R0.210 COC(C)(C)CNCCCC(C)O 2230a_100000763424_200000718107 [0,2,0,0,0,0|2,0,0]=4 3696 B12R0.210 COC(C)(C)CSCCCC(C)O 62a_100000701081_200000718107 [0,2,0,0,0,0|2,0,0]=4 3697 B12R0.210 COC(C)(C)CSCCCC(C)O 62a_200000718107_100000701081 [0,2,0,0,0,0|2,0,0]=4 3698 B12R0.210 C[C@@H](O)CNCCCC(C)(C)CO 2230a_100000039164_100009817552 [0,2,0,0,0,0|2,0,0]=4 3699 B12R0.390 CC(C)CCN(C)CCC(C)(C)O 2230a_100000742789_100000702414 [0,2,0,0,0,0|2,0,0]=4 3700 B12R0.390 CC(O)CCC(=O)CCC(C)(C)C 1458a_100000757465_100012276601 [0,2,0,0,0,0|2,0,0]=4 3701 B12R0.390 CC(O)CCC(=O)CCC(C)(F)F 1458a_100000030992_100012276601 [0,2,0,0,0,0|2,0,0]=4 3702 B12R0.390 CC(O)CCC(=O)NCC(C)(C)O 1626a_100000751335_100000718519 [0,2,0,0,0,0|2,0,0]=4 3703 B12R0.638 CC(C)(C)CCNCCC(C)(C)O 2230a_100000738805_100000702414 [0,2,0,0,0,0|2,0,0]=4 3704 B12R0.638 CC(C)(C)CCOCCC(C)(C)C 7a_100000765024_100000755188 [0,2,0,0,0,0|2,0,0]=4 3705 B12R0.638 CC(C)(C)CCOCCC(C)(C)O 7a_100000765024_100000702414 [0,2,0,0,0,0|1,0,0]=3 3706 B12R0.638 CC(C)(C)CCSCCC(C)(C)O 62a_100000702414_100000755188 [0,2,0,0,0,0|1,1,0]=4 3707 B12R0.638 CC(C)(C)CCSCCC(C)(C)O 62a_100000755188_100000702414 [0,2,0,0,0,0|1,1,0]=4 3708 B12R0.638 CC(C)(O)CCCNCC(C)(C)O 2230a_100000751335_100009888830 [0,2,0,0,0,0|2,0,0]=4 3709 B12R0.638 CC(C)(O)CCCSCC(C)(C)O 62a_100000764493_100009888830 [0,2,0,0,0,0|2,0,0]=4 3710 B12R0.638 CC(C)(O)CCCSCC(C)(C)O 62a_100009888830_100000764493 [0,2,0,0,0,0|2,0,0]=4 3711 B12R0.638 CC(C)(O)CCNCCC(C)(C)F 2230a_100016253952_100000702414 [0,2,0,0,0,0|2,0,0]=4 3712 B12R0.638 CC(C)(O)CCOCCC(F)(F)F 34a_100000752437_100000702414 [0,2,0,0,0,0|2,0,0]=4 3713 B12R0.638 CC(C)(O)CCOCCS(=O)(=O)C 34a_100000211924_100000702414 [0,2,0,0,0,0|1,0,1]=4 3714 B12R0.638 CC(C)(O)CCOCCS(=O)(=O)C 7a_100000211924_100000702414 [0,2,0,0,0,0|1,0,1]=4 3715 B12R0.638 CC(C)(O)CCOCC[N+](C)(C)C 7a_200020618287_100000702414 [0,2,0,0,0,0|2,0,0]=4 3716 B12R0.638 CC(C)(O)CCOCC[Si](C)(C)C 7a_100000039746_100000702414 [0,2,0,0,0,0|1,1,0]=4 3717 B12R0.638 CC(C)(O)CCSCCC(C)(C)O 62a_100000702414_100000702414 [0,2,0,0,0,0|0,1,0]=3 3718 B12R0.189 CCC(C)CCC(=O)CCC(C)O 1458a_100000701222_100012276601 [0,2,0,0,0,0|2,0,0]=4 3719 B12R0.189 CCC(O)CCC(=O)NCC(C)O 240690a_100000210904_203496584001 [0,2,0,0,0,0|2,0,0]=4 3720 B12R0.189 CO[C@H](C)CNC(=O)CCC(C)O 1626a_100020591295_100000718519 [0,2,0,0,0,0|2,0,0]=4 3721 B12R0.540 CCN(CCC(C)C)CCC(C)O 2230a_100000207693_100012276601 [0,2,0,0,0,0|2,0,0]=4 3722 B12R0.540 CCN(CCC(C)C)CCC(C)O 269982a_100000207693_100012276601 [0,2,0,0,0,0|2,0,0]=4 3723 B12R0.35 C=C(C)CCOCCC(OC)OC 34a_100000764851_100000139399 [0,2,0,0,0,0|1,0,1]=4 3724 B12R0.35 CCC(COCCCC(C)O)OC 34a_100011934954_200000718107 [0,2,0,0,0,0|2,0,0]=4 3725 B12R0.35 CCC(COCCCC(C)O)OC 7a_100011934954_200000718107 [0,2,0,0,0,0|2,0,0]=4 3726 B12R0.35 CCN(CC)CCOCCC(C)O 7a_100016990331_100012276601 [0,2,0,0,0,0|2,0,0]=4 3727 B12R0.35 COC(CCCNCC(C)O)OC 2230a_100000210904_100000069011 [0,2,0,0,0,0|2,0,0]=4 3728 B12R0.35 COC(CCCNCC(C)O)OC 34a_100000210904_100000069011 [0,2,0,0,0,0|2,0,0]=4 3729 B12R0.35 COC(CCCSCC(C)O)OC 62a_100000069011_100011218427 [0,2,0,0,0,0|2,0,0]=4 3730 B12R0.35 COC(CCCSCC(C)O)OC 62a_100011218427_100000069011 [0,2,0,0,0,0|2,0,0]=4 3731 B12R0.35 COC(CCCSC[C@@H](C)O)OC 62a_100000069011_100009817552 [0,2,0,0,0,0|2,0,0]=4 3732 B12R0.35 COC(CCCSC[C@@H](C)O)OC 62a_100009817552_100000069011 [0,2,0,0,0,0|2,0,0]=4 3733 B12R0.35 COC(CCNCCC(C)O)OC 2230a_200000755665_100009813347 [0,2,0,0,0,0|1,0,0]=3 3734 B12R0.35 COC(CCOCCC(=O)C)OC 34a_100000759926_100000139399 [0,2,0,0,0,0|0,0,2]=4 3735 B12R0.35 COC(CCOCCC(=O)C)OC 7a_100000759926_100009813347 [0,2,0,0,0,0|0,0,2]=4 3736 B12R0.35 COC(CCOCCC(C)Br)OC 34a_100009893172_100000139399 [0,2,0,0,0,0|1,0,0]=3 3737 B12R0.35 COC(CCOCCC(C)C)OC 34a_100000210254_100000139399 [0,2,0,0,0,0|1,0,0]=3 3738 B12R0.35 COC(CCOCCC(C)C)OC 7a_100000210254_100009813347 [0,2,0,0,0,0|1,0,0]=3 3739 B12R0.35 COC(CCOCCC(F)F)OC 34a_100103093639_100000139399 [0,2,0,0,0,0|2,0,0]=4 3740 B12R0.35 COC(CCOCC[C@@H](C)N)OC 34a_100000706166_100000139399 [0,2,0,0,0,0|1,0,0]=3 3741 B12R0.35 COC(CCSCCC(C)C)OC 62a_100000139399_100000210312 [0,2,0,0,0,0|1,1,0]=4 3742 B12R0.35 COC(CCSCCC(C)C)OC 62a_100000210312_100000139399 [0,2,0,0,0,0|1,1,0]=4 3743 B12R0.35 COC(CCSCCC(C)O)OC 62a_100000139399_100012276601 [0,2,0,0,0,0|0,1,0]=3 3744 B12R0.35 COC(CCSCCC(C)O)OC 62a_100012276601_100000139399 [0,2,0,0,0,0|0,1,0]=3 3745 B12R0.35 COC(COCCCC(C)O)OC 34a_100011216393_200000718107 [0,2,0,0,0,0|2,0,0]=4 3746 B12R0.35 COC(CSCCCC(C)O)OC 62a_100000751394_200000718107 [0,2,0,0,0,0|2,0,0]=4 3747 B12R0.35 COC(CSCCCC(C)O)OC 62a_200000718107_100000751394 [0,2,0,0,0,0|2,0,0]=4 3748 B12R0.183 CNC(=O)CCOCCC(C)OC 7a_100000764861_100000737683 [0,2,0,0,0,0|0,0,2]=4 3749 B12R0.183 COC(=O)CCOCCC(C)OC 7a_100000764861_100000204255 [0,2,0,0,0,0|0,0,2]=4 3750 B12R0.277 CC(O)CCCSC[C@@H](O)CC#N 62a_100000001066_200000718107 [0,2,0,0,0,0|2,0,0]=4 3751 B12R0.277 CC(O)CCCSC[C@@H](O)CC#N 62a_200000718107_100000001066 [0,2,0,0,0,0|2,0,0]=4 3752 B12R0.277 CCCC(C)CCOCCC(C)C 34a_100011217855_100000210312 [0,2,0,0,0,0|2,0,0]=4 3753 B12R0.277 CCCC(C)CCOCCC(C)C 7a_100011217855_100000210626 [0,2,0,0,0,0|2,0,0]=4 3754 B12R0.277 CCCC(C)CCOCCC(C)O 34a_100011217855_100012276601 [0,2,0,0,0,0|1,0,0]=3 3755 B12R0.277 CCCC(C)CCOCCC(C)O 7a_100011217855_100012276601 [0,2,0,0,0,0|1,0,0]=3 3756 B12R0.277 CCC[C@H](N)CCOCCC(C)C 34a_100015193777_100000210312 [0,2,0,0,0,0|2,0,0]=4 3757 B12R0.277 CCC[C@H](N)CCOCCC(C)O 34a_100015193777_100012276601 [0,2,0,0,0,0|1,0,0]=3 3758 B12R0.277 COCC(O)CNCCCC(C)O 2230a_100000756049_200000718107 [0,2,0,0,0,0|2,0,0]=4 3759 B12R0.277 COCC(O)CNCCCC(C)O 34a_100000756049_200000718107 [0,2,0,0,0,0|2,0,0]=4 3760 B12R0.277 COCC(O)CSCCCC(C)O 62a_100011215053_200000718107 [0,2,0,0,0,0|2,0,0]=4 3761 B12R0.277 COCC(O)CSCCCC(C)O 62a_200000718107_100011215053 [0,2,0,0,0,0|2,0,0]=4 3762 B10R1.10 CCCN1CCCC(C1)O 2230a_100000211013_100000210303 [1,0,0,1,0,0|2,0,0]=4 3763 B10R1.10 CCCN1CCCC(C1)O 269982a_100000211013_100000210303 [1,0,0,1,0,0|2,0,0]=4 3764 B10R1.10 CCNC1CCCC(C1)O 2230a_100015190357_100000210202 [1,0,0,1,0,0|2,0,0]=4 3765 B10R1.10 CCNC1CCCC(C1)O 270004a_100015525214_100012613340 [1,0,0,1,0,0|2,0,0]=4 3766 B10R1.10 CNCC1CCCC(C1)O 2230a_100011254705_200000210301 [1,0,0,1,0,0|2,0,0]=4 3767 B10R1.10 OCCN1CCCC(C1)O 2230a_100000211013_100000211926 [1,0,0,1,0,0|2,0,0]=4 3768 B10R1.10 OCCN1CCCC(C1)O 269982a_100000211013_100000211926 [1,0,0,1,0,0|2,0,0]=4 3769 B10R1.10 [13CH3]NCC1CCCC(C1)O 2230a_100011254705_200025704644 [1,0,0,1,0,0|2,0,0]=4 3770 B10R1.16 CCCCN1CCC(C1)O 2230a_100011215560_100000210211 [1,0,0,1,0,0|1,0,0]=3 3771 B10R1.16 CCCCN1CCC(C1)O 269982a_100011215560_100000210211 [1,0,0,1,0,0|1,0,0]=3 3772 B10R1.16 CCCCN1CC[C@@H](C1)F 2230a_100015203821_100000210211 [1,0,0,1,0,0|2,0,0]=4 3773 B10R1.16 CCCCN1CC[C@@H](C1)F 269982a_100015203821_100000210211 [1,0,0,1,0,0|2,0,0]=4 3774 B10R1.16 CCCCN1CC[C@@H](C1)F 34a_100015203821_100000210210 [1,0,0,1,0,0|2,0,0]=4 3775 B10R1.16 CCCCN1CC[C@H](C1)C 2230a_100016987628_100000210211 [1,0,0,1,0,0|2,0,0]=4 3776 B10R1.16 CCCCN1CC[C@H](C1)C 269982a_100016987628_100000210211 [1,0,0,1,0,0|2,0,0]=4 3777 B10R1.16 CCCCN1CC[C@H](C1)C 34a_100016987628_100000210210 [1,0,0,1,0,0|2,0,0]=4 3778 B10R1.16 CCCNC1CCC(C1)O 270004a_100020643023_100012614533 [1,0,0,1,0,0|2,0,0]=4 3779 B10R1.16 CCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000210303 [1,0,0,1,0,0|2,0,0]=4 3780 B10R1.16 CCOCN1CCC(C1)O 269982a_100011215560_100000739092 [1,0,0,1,0,0|2,0,0]=4 3781 B10R1.16 COCCN1CCC(C1)O 2230a_100011215560_100011201679 [1,0,0,1,0,0|2,0,0]=4 3782 B10R1.16 COCCN1CCC(C1)O 269982a_100011215560_100000233755 [1,0,0,1,0,0|2,0,0]=4 3783 B10R1.16 CSCCN1CCC(C1)O 2230a_100011215560_100000751147 [1,0,0,1,0,0|2,0,0]=4 3784 B10R1.16 CSCCN1CCC(C1)O 269982a_100011215560_100000212216 [1,0,0,1,0,0|2,0,0]=4 3785 B10R1.16 C[C@@H]1CCN(C1)CCCO 2230a_100016987628_100000230001 [1,0,0,1,0,0|2,0,0]=4 3786 B10R1.16 C[C@@H]1CCN(C1)CCCO 269982a_100016987628_100011215043 [1,0,0,1,0,0|2,0,0]=4 3787 B10R1.16 C[C@@H]1CCN(C1)CCCO 34a_100016987628_100000230001 [1,0,0,1,0,0|2,0,0]=4 3788 B10R1.16 OC1CCN(C1)CCCF 2230a_100011215560_100011934791 [1,0,0,1,0,0|2,0,0]=4 3789 B10R1.16 OC1CCN(C1)CCCF 269982a_100011215560_100011934791 [1,0,0,1,0,0|2,0,0]=4 3790 B10R1.16 OCCCN1CCC(C1)O 2230a_100011215560_100000230001 [1,0,0,1,0,0|1,0,0]=3 3791 B10R1.16 OCCCN1CCC(C1)O 269982a_100011215560_100011215043 [1,0,0,1,0,0|1,0,0]=3 3792 B10R1.16 OCCCN1CC[C@@H](C1)F 2230a_100015203821_100000230001 [1,0,0,1,0,0|2,0,0]=4 3793 B10R1.16 OCCCN1CC[C@@H](C1)F 269982a_100015203821_100011215043 [1,0,0,1,0,0|2,0,0]=4 3794 B10R1.16 OCCCN1CC[C@@H](C1)F 34a_100015203821_100000230001 [1,0,0,1,0,0|2,0,0]=4 3795 B10R1.16 OCCNC1CCC(C1)O 270004a_100000210304_100012614533 [1,0,0,1,0,0|2,0,0]=4 3796 B10R1.16 OCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000211926 [1,0,0,1,0,0|2,0,0]=4 3797 B10R1.18 CC(=O)CC1CCCCO1 1458a_100000070787_100000211543 [1,0,0,1,0,0|0,0,2]=4 3798 B10R1.18 CC(=O)CC1CCCCO1 1458a_100000238585_200000210301 [1,0,0,1,0,0|0,0,2]=4 3799 B10R1.18 CC(C)OC1CCCCO1 34a_100000033831_100000210206 [1,0,0,1,0,0|2,0,0]=4 3800 B10R1.18 CN(C)CC1CCCCO1 2230a_100000225654_200000210301 [1,0,0,1,0,0|2,0,0]=4 3801 B10R1.18 CN(C)CC1CCCCO1 2230a_100102631434_100000211543 [1,0,0,1,0,0|2,0,0]=4 3802 B10R1.18 CN(C)CC1CCCCO1 269982a_100000225654_200000210301 [1,0,0,1,0,0|2,0,0]=4 3803 B10R1.18 CN(C)CC1CCCCO1 269982a_100102631434_100000211543 [1,0,0,1,0,0|2,0,0]=4 3804 B10R1.18 CN(C)CC1CCCCO1 34a_100000225654_200000210301 [1,0,0,1,0,0|2,0,0]=4 3805 B10R1.18 CN([13CH3])CC1CCCCO1 2230a_100000225654_200025704644 [1,0,0,1,0,0|2,0,0]=4 3806 B10R1.18 CN([13CH3])CC1CCCCO1 269982a_100000225654_200025704644 [1,0,0,1,0,0|2,0,0]=4 3807 B10R1.18 CN([13CH3])CC1CCCCO1 34a_100000225654_200025704644 [1,0,0,1,0,0|2,0,0]=4 3808 B10R1.18 [13CH3]C(=O)CC1CCCCO1 1458a_100000238585_200025704644 [1,0,0,1,0,0|0,0,2]=4 3809 B10R1.24 CCCCCN1CC(C1)O 269982a_100000749847_100000210215 [1,0,0,1,0,0|2,0,0]=4 3810 B10R1.24 CCCCNC1CC(C1)F 2230a_100016993743_100000210211 [1,0,0,1,0,0|2,0,0]=4 3811 B10R1.24 CCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000210211 [1,0,0,1,0,0|1,0,0]=3 3812 B10R1.24 CCCNCC1CC(C1)O 2230a_100016992100_100000210303 [1,0,0,1,0,0|2,0,0]=4 3813 B10R1.24 COCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100011201679 [1,0,0,1,0,0|2,0,0]=4 3814 B10R1.24 CSCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000751147 [1,0,0,1,0,0|2,0,0]=4 3815 B10R1.24 OCCCCN1CC(C1)O 269982a_100000749847_100000210776 [1,0,0,1,0,0|2,0,0]=4 3816 B10R1.24 OCCCNC1CC(C1)F 2230a_100016993743_100000230001 [1,0,0,1,0,0|2,0,0]=4 3817 B10R1.24 OCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000230001 [1,0,0,1,0,0|1,0,0]=3 3818 B10R1.24 OCCNCC1CC(C1)O 2230a_100016992100_100000211926 [1,0,0,1,0,0|2,0,0]=4 3819 B10R1.24 O[C@H]1C[C@@H](C1)NCCCF 2230a_100020629032_100011934791 [1,0,0,1,0,0|2,0,0]=4 3820 B10R1.56 CC1CC1COCCCF 34a_100000744939_100011934791 [1,0,0,1,0,0|2,0,0]=4 3821 B10R1.56 CC1CC1COCCCF 7a_100000744939_100011934791 [1,0,0,1,0,0|2,0,0]=4 3822 B10R1.56 CC1CC1COCCCO 34a_100000744939_100000230001 [1,0,0,1,0,0|1,0,0]=3 3823 B10R1.56 CC1CC1COCCCO 7a_100000744939_100011215043 [1,0,0,1,0,0|1,0,0]=3 3824 B10R1.56 CCCCOCC1CC1C 34a_100000744939_100000210210 [1,0,0,1,0,0|1,0,0]=3 3825 B10R1.56 CCCCOCC1CC1C 7a_100000744939_100000210211 [1,0,0,1,0,0|1,0,0]=3 3826 B10R1.56 COCCOCC1CC1C 34a_100000744939_100011201679 [1,0,0,1,0,0|2,0,0]=4 3827 B10R1.56 COCCOCC1CC1C 7a_100000744939_100000233755 [1,0,0,1,0,0|2,0,0]=4 3828 B10R1.56 CSCCOCC1CC1C 34a_100000744939_100000212216 [1,0,0,1,0,0|2,0,0]=4 3829 B10R1.56 CSCCOCC1CC1C 7a_100000744939_100000212216 [1,0,0,1,0,0|2,0,0]=4 3830 B10R1.61 CC(C)[C@H]1COCCN1C 2230a_100025712635_200000210301 [1,0,0,1,0,0|2,0,0]=4 3831 B10R1.61 CC(C)[C@H]1COCCN1C 269982a_100025712635_200000210301 [1,0,0,1,0,0|2,0,0]=4 3832 B10R1.61 CC(C)[C@H]1COCCN1C 34a_100025712635_200000210301 [1,0,0,1,0,0|2,0,0]=4 3833 B10R1.61 CC(C)[C@H]1COCCN1[13CH3] 2230a_100025712635_200025704644 [1,0,0,1,0,0|2,0,0]=4 3834 B10R1.61 CC(C)[C@H]1COCCN1[13CH3] 269982a_100025712635_200025704644 [1,0,0,1,0,0|2,0,0]=4 3835 B10R1.61 CC(C)[C@H]1COCCN1[13CH3] 34a_100025712635_200025704644 [1,0,0,1,0,0|2,0,0]=4 3836 B10R1.64 CC(O)CN1CCC[C@@H]1C 2230a_100020605311_100011218427 [1,0,0,1,0,0|2,0,0]=4 3837 B10R1.64 CC(O)CN1CCC[C@@H]1C 269982a_100020605311_100011218427 [1,0,0,1,0,0|2,0,0]=4 3838 B10R1.64 CC(O)CN1CCC[C@H]1C 2230a_100015189458_100011218427 [1,0,0,1,0,0|2,0,0]=4 3839 B10R1.64 CC(O)CN1CCC[C@H]1C 269982a_100015189458_100011218427 [1,0,0,1,0,0|2,0,0]=4 3840 B10R1.64 CC(O)CN1CCC[C@H]1C 34a_100015189458_100011218427 [1,0,0,1,0,0|2,0,0]=4 3841 B10R1.64 C[C@@H](O)CN1CCC[C@@H]1C 2230a_100020605311_100009817552 [1,0,0,1,0,0|2,0,0]=4 3842 B10R1.64 C[C@@H](O)CN1CCC[C@@H]1C 269982a_100020605311_100009817552 [1,0,0,1,0,0|2,0,0]=4 3843 B10R1.64 C[C@@H]1CCCN1C[C@@H](C)O 2230a_100015189458_100009817552 [1,0,0,1,0,0|2,0,0]=4 3844 B10R1.64 C[C@@H]1CCCN1C[C@@H](C)O 269982a_100015189458_100009817552 [1,0,0,1,0,0|2,0,0]=4 3845 B10R1.64 C[C@@H]1CCCN1C[C@@H](C)O 34a_100015189458_100009817552 [1,0,0,1,0,0|2,0,0]=4 3846 B10R1.66 CC(C)CCN1CCCC1 2230a_100000188435_100000210312 [1,0,0,1,0,0|2,0,0]=4 3847 B10R1.66 CC(C)CCN1CCCC1 269982a_100000188435_100000210312 [1,0,0,1,0,0|2,0,0]=4 3848 B10R1.66 CC(O)CCN1CCCC1 2230a_100000188435_100012276601 [1,0,0,1,0,0|1,0,0]=3 3849 B10R1.66 CC(O)CCN1CCCC1 269982a_100000188435_100012276601 [1,0,0,1,0,0|1,0,0]=3 3850 B10R1.66 CC(O)CCN1CCSC1 2230a_100011215254_100012276601 [1,0,0,1,0,0|2,0,0]=4 3851 B10R1.66 CC(O)CCN1CCSC1 269982a_100011215254_100012276601 [1,0,0,1,0,0|2,0,0]=4 3852 B10R1.66 CC(O)CNC1CCCC1 2230a_100000210904_100000179811 [1,0,0,1,0,0|2,0,0]=4 3853 B10R1.66 CC(O)CNC1CCCC1 2230a_100000211070_100011218427 [1,0,0,1,0,0|2,0,0]=4 3854 B10R1.66 CC(O)CNC1CCCC1 270004a_100000210904_100000210133 [1,0,0,1,0,0|2,0,0]=4 3855 B10R1.66 CC(O)CNC1CCCC1 34a_100000210904_100000179811 [1,0,0,1,0,0|2,0,0]=4 3856 B10R1.66 CC(O)CNC1CCCC1 34a_100000211070_100011218427 [1,0,0,1,0,0|2,0,0]=4 3857 B10R1.66 CC(O)COC1CCCC1 34a_100000210269_100011218427 [1,0,0,1,0,0|2,0,0]=4 3858 B10R1.66 CC(O)COC1CCCC1 7a_100000210269_100011218427 [1,0,0,1,0,0|2,0,0]=4 3859 B10R1.66 CC(O)COC1CCCO1 34a_100000085407_100011218427 [1,0,0,1,0,0|2,0,0]=4 3860 B10R1.66 CC(O)CSC1CCCC1 62a_100011217020_100011218427 [1,0,0,1,0,0|2,0,0]=4 3861 B10R1.66 CC(O)CSC1CCCC1 62a_100011218427_100000179811 [1,0,0,1,0,0|2,0,0]=4 3862 B10R1.66 C[C@@H](O)CNC1CCCC1 2230a_100000211070_100009817552 [1,0,0,1,0,0|2,0,0]=4 3863 B10R1.66 C[C@@H](O)CNC1CCCC1 34a_100000211070_100009817552 [1,0,0,1,0,0|2,0,0]=4 3864 B10R1.66 C[C@@H](O)COC1CCCC1 34a_100000210269_100009817552 [1,0,0,1,0,0|2,0,0]=4 3865 B10R1.66 C[C@@H](O)COC1CCCC1 7a_100000210269_100009817552 [1,0,0,1,0,0|2,0,0]=4 3866 B10R1.66 C[C@@H](O)COC1CCCO1 34a_100000085407_100009817552 [1,0,0,1,0,0|2,0,0]=4 3867 B10R1.66 C[C@@H](O)CSC1CCCC1 62a_100009817552_100000179811 [1,0,0,1,0,0|2,0,0]=4 3868 B10R1.66 C[C@@H](O)CSC1CCCC1 62a_100011217020_100009817552 [1,0,0,1,0,0|2,0,0]=4 3869 B10R1.73 CC(O)CCN[C@@H]1C[C@@H]1F 2230a_100015190264_100012276601 [1,0,0,1,0,0|2,0,0]=4 3870 B10R1.73 CC(O)CCN[C@@H]1C[C@H]1F 2230a_100025746932_100012276601 [1,0,0,1,0,0|2,0,0]=4 3871 B10R1.73 CC(O)CCN[C@@H]1C[C@H]1F 34a_100025746932_100012276601 [1,0,0,1,0,0|2,0,0]=4 3872 B10R1.73 CC(O)COCC1CC1C 34a_100000744939_100011218427 [1,0,0,1,0,0|2,0,0]=4 3873 B10R1.73 CC(O)COCC1CC1C 7a_100000744939_100011218427 [1,0,0,1,0,0|2,0,0]=4 3874 B10R1.73 CC1CC1COC[C@@H](C)O 34a_100000744939_100009817552 [1,0,0,1,0,0|2,0,0]=4 3875 B10R1.73 CC1CC1COC[C@@H](C)O 7a_100000744939_100009817552 [1,0,0,1,0,0|2,0,0]=4 3876 B10R1.117 CC(C)CCN1CCC1C 269982a_100000755817_100000210312 [1,0,0,1,0,0|2,0,0]=4 3877 B10R1.117 CC(C)CCN1CCC1C 34a_100000755817_100000210312 [1,0,0,1,0,0|2,0,0]=4 3878 B10R1.117 CC(O)CCN1CCC1C 269982a_100000755817_100012276601 [1,0,0,1,0,0|1,0,0]=3 3879 B10R1.117 CC(O)CCN1CCC1C 34a_100000755817_100012276601 [1,0,0,1,0,0|1,0,0]=3 3880 B10R1.126 C=C(C)CCOCC1CC1 34a_100000211283_100000730704 [1,0,0,1,0,0|1,0,1]=4 3881 B10R1.126 C=C(C)CCOCC1CC1 34a_100000764851_100000742324 [1,0,0,1,0,0|1,0,1]=4 3882 B10R1.126 C=C(C)CCOCC1CO1 34a_100000764851_102125554688 [1,0,0,1,0,0|1,0,1]=4 3883 B10R1.126 C=C(C)CCOC[C@@H]1CO1 34a_100000757423_100000730704 [1,0,0,1,0,0|1,0,1]=4 3884 B10R1.126 CC(=O)CCOCC1CC1 34a_100000759926_100000742324 [1,0,0,1,0,0|0,0,2]=4 3885 B10R1.126 CC(=O)CCOCC1CC1 7a_100000759926_100000742324 [1,0,0,1,0,0|0,0,2]=4 3886 B10R1.126 CC(=O)CCOCC1CO1 34a_100000759926_102125554688 [1,0,0,1,0,0|0,0,2]=4 3887 B10R1.126 CC(=O)CCOCC1CO1 7a_100000759926_102125554688 [1,0,0,1,0,0|0,0,2]=4 3888 B10R1.126 CC(=O)CCOC[C@@H]1CO1 7a_100000759926_100000745022 [1,0,0,1,0,0|0,0,2]=4 3889 B10R1.126 CC(Br)CCOCC1CC1 34a_100009893172_100000742324 [1,0,0,1,0,0|1,0,0]=3 3890 B10R1.126 CC(Br)CCOCC1CO1 34a_100009893172_102125554688 [1,0,0,1,0,0|1,0,0]=3 3891 B10R1.126 CC(C)CCNCC1CC1 2230a_100000735609_100000210312 [1,0,0,1,0,0|2,0,0]=4 3892 B10R1.126 CC(C)CCNCC1CC1 269862a_100000210545_100000741477 [1,0,0,1,0,0|2,0,0]=4 3893 B10R1.126 CC(C)CCNCC1CC1 34a_100000735609_100000210312 [1,0,0,1,0,0|2,0,0]=4 3894 B10R1.126 CC(C)CCOCC1CC1 34a_100000210254_100000742324 [1,0,0,1,0,0|1,0,0]=3 3895 B10R1.126 CC(C)CCOCC1CC1 34a_100000211283_100000210312 [1,0,0,1,0,0|1,0,0]=3 3896 B10R1.126 CC(C)CCOCC1CC1 7a_100000210254_100000742324 [1,0,0,1,0,0|1,0,0]=3 3897 B10R1.126 CC(C)CCOCC1CO1 34a_100000210254_102125554688 [1,0,0,1,0,0|1,0,0]=3 3898 B10R1.126 CC(C)CCOCC1CO1 7a_100000210254_102125554688 [1,0,0,1,0,0|1,0,0]=3 3899 B10R1.126 CC(C)CCOCC1CS1 7a_100000210254_100000031435 [1,0,0,1,0,0|1,1,0]=4 3900 B10R1.126 CC(C)CCOC[C@@H]1CO1 34a_100000757423_100000210312 [1,0,0,1,0,0|1,0,0]=3 3901 B10R1.126 CC(C)CCOC[C@@H]1CO1 7a_100000210254_100000745022 [1,0,0,1,0,0|1,0,0]=3 3902 B10R1.126 CC(C)CCSCC1CC1 62a_100000210312_100000742324 [1,0,0,1,0,0|1,1,0]=4 3903 B10R1.126 CC(C)CCSCC1CC1 62a_100000756562_100000210312 [1,0,0,1,0,0|1,1,0]=4 3904 B10R1.126 CC(C)CCSCC1CO1 62a_100000210312_102125554688 [1,0,0,1,0,0|1,1,0]=4 3905 B10R1.126 CC(C)CCSCC1CO1 62a_102125554688_100000210312 [1,0,0,1,0,0|1,1,0]=4 3906 B10R1.126 CC(C)CCSC[C@@H]1CO1 62a_100000210312_100000745022 [1,0,0,1,0,0|1,1,0]=4 3907 B10R1.126 CC(C)CCSC[C@@H]1CO1 62a_100000745022_100000210312 [1,0,0,1,0,0|1,1,0]=4 3908 B10R1.126 CC(C)OCOCC1CC1 34a_100000211283_100000709892 [1,0,0,1,0,0|2,0,0]=4 3909 B10R1.126 CC(C)OCOC[C@@H]1CO1 34a_100000757423_100000709892 [1,0,0,1,0,0|2,0,0]=4 3910 B10R1.126 CC(O)CCCNC1CC1 34a_100000212008_200000718107 [1,0,0,1,0,0|2,0,0]=4 3911 B10R1.126 CC(O)CCCSC1CC1 62a_200000718107_100000211595 [1,0,0,1,0,0|2,0,0]=4 3912 B10R1.126 CC(O)CCNCC1CC1 2230a_100000735609_100012276601 [1,0,0,1,0,0|1,0,0]=3 3913 B10R1.126 CC(O)CCNCC1CC1 2230a_200000755665_100000742324 [1,0,0,1,0,0|1,0,0]=3 3914 B10R1.126 CC(O)CCNCC1CC1 269862a_200000755665_100000741477 [1,0,0,1,0,0|1,0,0]=3 3915 B10R1.126 CC(O)CCNCC1CC1 34a_100000735609_100012276601 [1,0,0,1,0,0|1,0,0]=3 3916 B10R1.126 CC(O)CCNCC1CO1 2230a_200000755665_100011216344 [1,0,0,1,0,0|1,0,0]=3 3917 B10R1.126 CC(O)CCOCC1CC1 34a_100000211283_100012276601 [1,0,0,1,0,0|0,0,0]=2 3918 B10R1.126 CC(O)CCOC[C@@H]1CO1 34a_100000757423_100012276601 [1,0,0,1,0,0|0,0,0]=2 3919 B10R1.126 CC(O)CCSCC1CC1 62a_100000756562_100012276601 [1,0,0,1,0,0|0,1,0]=3 3920 B10R1.126 CC(O)CCSCC1CC1 62a_100012276601_100000742324 [1,0,0,1,0,0|0,1,0]=3 3921 B10R1.126 CC(O)CCSCC1CO1 62a_100012276601_102125554688 [1,0,0,1,0,0|0,1,0]=3 3922 B10R1.126 CC(O)CCSCC1CO1 62a_102125554688_100012276601 [1,0,0,1,0,0|0,1,0]=3 3923 B10R1.126 CC(O)CCSCC1CS1 62a_100000031435_100012276601 [1,0,0,1,0,0|0,2,0]=4 3924 B10R1.126 CC(O)CCSCC1CS1 62a_100012276601_100000031435 [1,0,0,1,0,0|0,2,0]=4 3925 B10R1.126 CC(O)CCSC[C@@H]1CO1 62a_100000745022_100012276601 [1,0,0,1,0,0|0,1,0]=3 3926 B10R1.126 CC(O)CCSC[C@@H]1CO1 62a_100012276601_100000745022 [1,0,0,1,0,0|0,1,0]=3 3927 B10R1.126 CC(O)CNCCC1CC1 2230a_100000210904_100000694398 [1,0,0,1,0,0|2,0,0]=4 3928 B10R1.126 CC(O)CNCCC1CC1 34a_100000210904_100000694398 [1,0,0,1,0,0|2,0,0]=4 3929 B10R1.126 CC(O)CNCCC1CC1 34a_100000764129_100011218427 [1,0,0,1,0,0|2,0,0]=4 3930 B10R1.126 CC(O)CNCCC1CO1 2230a_100000210904_100000732470 [1,0,0,1,0,0|2,0,0]=4 3931 B10R1.126 CC(O)CNCCC1CO1 34a_100000210904_100000732470 [1,0,0,1,0,0|2,0,0]=4 3932 B10R1.126 CC(O)COCCC1CC1 34a_100000754188_100011218427 [1,0,0,1,0,0|2,0,0]=4 3933 B10R1.126 CC(O)COCCC1CC1 7a_100000754188_100011218427 [1,0,0,1,0,0|2,0,0]=4 3934 B10R1.126 CC(O)COCC[C@@H]1CO1 34a_100009820653_100011218427 [1,0,0,1,0,0|2,0,0]=4 3935 B10R1.126 CC(O)CSCCC1CC1 62a_100000764125_100011218427 [1,0,0,1,0,0|2,0,0]=4 3936 B10R1.126 CC(O)CSCCC1CC1 62a_100011218427_100000764125 [1,0,0,1,0,0|2,0,0]=4 3937 B10R1.126 CC(O)CSCCC1CO1 62a_100000732470_100011218427 [1,0,0,1,0,0|2,0,0]=4 3938 B10R1.126 CC(O)CSCCC1CO1 62a_100011218427_100000732470 [1,0,0,1,0,0|2,0,0]=4 3939 B10R1.126 C[C@@H](N)CCOCC1CC1 34a_100000706166_100000742324 [1,0,0,1,0,0|1,0,0]=3 3940 B10R1.126 C[C@@H](N)CCOCC1CO1 34a_100000706166_102125554688 [1,0,0,1,0,0|1,0,0]=3 3941 B10R1.126 C[C@@H](O)CNCCC1CC1 34a_100000764129_100009817552 [1,0,0,1,0,0|2,0,0]=4 3942 B10R1.126 C[C@@H](O)COCCC1CC1 34a_100000754188_100009817552 [1,0,0,1,0,0|2,0,0]=4 3943 B10R1.126 C[C@@H](O)COCCC1CC1 7a_100000754188_100009817552 [1,0,0,1,0,0|2,0,0]=4 3944 B10R1.126 C[C@@H](O)COCC[C@@H]1CO1 34a_100009820653_100009817552 [1,0,0,1,0,0|2,0,0]=4 3945 B10R1.126 C[C@@H](O)CSCCC1CC1 62a_100000764125_100009817552 [1,0,0,1,0,0|2,0,0]=4 3946 B10R1.126 C[C@@H](O)CSCCC1CC1 62a_100009817552_100000764125 [1,0,0,1,0,0|2,0,0]=4 3947 B10R1.126 C[C@@H](O)CSCCC1CO1 62a_100000732470_100009817552 [1,0,0,1,0,0|2,0,0]=4 3948 B10R1.126 C[C@@H](O)CSCCC1CO1 62a_100009817552_100000732470 [1,0,0,1,0,0|2,0,0]=4 3949 B10R1.126 FC(F)CCOCC1CC1 34a_100103093639_100000742324 [1,0,0,1,0,0|2,0,0]=4 3950 B10R1.126 FC(F)CCOCC1CO1 34a_100103093639_102125554688 [1,0,0,1,0,0|2,0,0]=4 3951 B10R1.127 C=C(C)CCOC1CCC1 34a_100000748187_100000730704 [1,0,0,1,0,0|1,0,1]=4 3952 B10R1.127 C=C(C)CCOC1CCC1 34a_100000764851_100000749161 [1,0,0,1,0,0|1,0,1]=4 3953 B10R1.127 CC(=O)CCOC1CCC1 34a_100000759926_100000749161 [1,0,0,1,0,0|0,0,2]=4 3954 B10R1.127 CC(Br)CCOC1CCC1 34a_100009893172_100000749161 [1,0,0,1,0,0|1,0,0]=3 3955 B10R1.127 CC(Br)CCOC1COC1 34a_100009893172_100009818527 [1,0,0,1,0,0|2,0,0]=4 3956 B10R1.127 CC(C)CCNC1CCC1 2230a_100000749019_100000210312 [1,0,0,1,0,0|2,0,0]=4 3957 B10R1.127 CC(C)CCNC1CCC1 269862a_100000749019_100000185833 [1,0,0,1,0,0|2,0,0]=4 3958 B10R1.127 CC(C)CCNC1CCC1 270004a_100000210545_100000241760 [1,0,0,1,0,0|2,0,0]=4 3959 B10R1.127 CC(C)CCNC1CCC1 34a_100000749019_100000210312 [1,0,0,1,0,0|2,0,0]=4 3960 B10R1.127 CC(C)CCOC1CCC1 34a_100000210254_100000749161 [1,0,0,1,0,0|1,0,0]=3 3961 B10R1.127 CC(C)CCOC1CCC1 34a_100000748187_100000210312 [1,0,0,1,0,0|1,0,0]=3 3962 B10R1.127 CC(C)CCOC1COC1 34a_100000210254_100009818527 [1,0,0,1,0,0|2,0,0]=4 3963 B10R1.127 CC(C)CCOC1COC1 7a_100000210254_100009818527 [1,0,0,1,0,0|2,0,0]=4 3964 B10R1.127 CC(C)CCOC1CSC1 7a_100000072292_100000210626 [1,0,0,1,0,0|2,0,0]=4 3965 B10R1.127 CC(C)CCSC1CCC1 62a_100000210312_100000749161 [1,0,0,1,0,0|1,1,0]=4 3966 B10R1.127 CC(C)OCOC1CCC1 34a_100000748187_100000709892 [1,0,0,1,0,0|2,0,0]=4 3967 B10R1.127 CC(O)CCCN1CCC1 269982a_100000754969_200000718107 [1,0,0,1,0,0|2,0,0]=4 3968 B10R1.127 CC(O)CCNC1CCC1 2230a_100000749019_100012276601 [1,0,0,1,0,0|1,0,0]=3 3969 B10R1.127 CC(O)CCNC1CCC1 270004a_200000755665_100000241760 [1,0,0,1,0,0|1,0,0]=3 3970 B10R1.127 CC(O)CCNC1CCC1 34a_100000749019_100012276601 [1,0,0,1,0,0|1,0,0]=3 3971 B10R1.127 CC(O)CCNC1COC1 2230a_100016991112_100012276601 [1,0,0,1,0,0|2,0,0]=4 3972 B10R1.127 CC(O)CCOC1CCC1 34a_100000748187_100012276601 [1,0,0,1,0,0|0,0,0]=2 3973 B10R1.127 CC(O)CCOC1CSC1 7a_100000072292_100012276601 [1,0,0,1,0,0|1,0,0]=3 3974 B10R1.127 CC(O)CCSC1CCC1 62a_100012276601_100000749161 [1,0,0,1,0,0|0,1,0]=3 3975 B10R1.127 CC(O)CCSC1COC1 62a_100012276601_100009818527 [1,0,0,1,0,0|1,1,0]=4 3976 B10R1.127 CC(O)CNCC1CCC1 2230a_100000210904_100000763275 [1,0,0,1,0,0|2,0,0]=4 3977 B10R1.127 CC(O)CNCC1CCC1 2230a_100000738700_100011218427 [1,0,0,1,0,0|2,0,0]=4 3978 B10R1.127 CC(O)CNCC1CCC1 269862a_100000210904_100000753134 [1,0,0,1,0,0|2,0,0]=4 3979 B10R1.127 CC(O)CNCC1CCC1 34a_100000210904_100000763275 [1,0,0,1,0,0|2,0,0]=4 3980 B10R1.127 CC(O)CNCC1CCC1 34a_100000738700_100011218427 [1,0,0,1,0,0|2,0,0]=4 3981 B10R1.127 CC(O)CNCC1CCO1 2230a_100000210904_100000103362 [1,0,0,1,0,0|2,0,0]=4 3982 B10R1.127 CC(O)CNCC1CCO1 34a_100000210904_100000103362 [1,0,0,1,0,0|2,0,0]=4 3983 B10R1.127 CC(O)CNC[C@@H]1CCO1 2230a_100020831831_100011218427 [1,0,0,1,0,0|2,0,0]=4 3984 B10R1.127 CC(O)CNC[C@@H]1CCO1 34a_100020831831_100011218427 [1,0,0,1,0,0|2,0,0]=4 3985 B10R1.127 CC(O)COCC1CCC1 34a_100000760304_100011218427 [1,0,0,1,0,0|2,0,0]=4 3986 B10R1.127 CC(O)COCC1CCO1 34a_100000039022_100011218427 [1,0,0,1,0,0|2,0,0]=4 3987 B10R1.127 CC(O)CSCC1CCC1 62a_100000763275_100011218427 [1,0,0,1,0,0|2,0,0]=4 3988 B10R1.127 CC(O)CSCC1CCC1 62a_100011218427_100000763275 [1,0,0,1,0,0|2,0,0]=4 3989 B10R1.127 CC(O)CSCC1CCO1 62a_100000103362_100011218427 [1,0,0,1,0,0|2,0,0]=4 3990 B10R1.127 CC(O)CSCC1CCO1 62a_100011218427_100000103362 [1,0,0,1,0,0|2,0,0]=4 3991 B10R1.127 C[C@@H](N)CCOC1CCC1 34a_100000706166_100000749161 [1,0,0,1,0,0|1,0,0]=3 3992 B10R1.127 C[C@@H](N)CCOC1COC1 34a_100000706166_100009818527 [1,0,0,1,0,0|2,0,0]=4 3993 B10R1.127 C[C@@H](O)CNCC1CCC1 2230a_100000738700_100009817552 [1,0,0,1,0,0|2,0,0]=4 3994 B10R1.127 C[C@@H](O)CNCC1CCC1 34a_100000738700_100009817552 [1,0,0,1,0,0|2,0,0]=4 3995 B10R1.127 C[C@@H](O)CNC[C@@H]1CCO1 2230a_100020831831_100009817552 [1,0,0,1,0,0|2,0,0]=4 3996 B10R1.127 C[C@@H](O)CNC[C@@H]1CCO1 34a_100020831831_100009817552 [1,0,0,1,0,0|2,0,0]=4 3997 B10R1.127 C[C@@H](O)COCC1CCC1 34a_100000760304_100009817552 [1,0,0,1,0,0|2,0,0]=4 3998 B10R1.127 C[C@@H](O)COCC1CCO1 34a_100000039022_100009817552 [1,0,0,1,0,0|2,0,0]=4 3999 B10R1.127 C[C@@H](O)CSCC1CCC1 62a_100000763275_100009817552 [1,0,0,1,0,0|2,0,0]=4 4000 B10R1.127 C[C@@H](O)CSCC1CCC1 62a_100009817552_100000763275 [1,0,0,1,0,0|2,0,0]=4 4001 B10R1.127 C[C@@H](O)CSCC1CCO1 62a_100000103362_100009817552 [1,0,0,1,0,0|2,0,0]=4 4002 B10R1.127 C[C@@H](O)CSCC1CCO1 62a_100009817552_100000103362 [1,0,0,1,0,0|2,0,0]=4 4003 B10R1.127 FC(F)CCOC1CCC1 34a_100103093639_100000749161 [1,0,0,1,0,0|2,0,0]=4 4004 B10R1.133 CCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100000210202 [1,0,0,1,0,0|2,0,0]=4 4005 B10R1.133 CCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100000210202 [1,0,0,1,0,0|2,0,0]=4 4006 B10R1.162 CCN1CCCCC(C1)O 2230a_100025706797_100000210202 [1,0,0,1,0,0|2,0,0]=4 4007 B10R1.162 CCN1CCCCC(C1)O 269982a_100025706797_100000204670 [1,0,0,1,0,0|2,0,0]=4 4008 B10R1.162 CN1CCOCC(C1)CO 2230a_100103147999_200000210301 [1,0,0,1,0,0|2,0,0]=4 4009 B10R1.162 CN1CCOCC(C1)CO 269982a_100103147999_200000210301 [1,0,0,1,0,0|2,0,0]=4 4010 B10R1.162 CN1CCOCC(C1)CO 34a_100103147999_200000210301 [1,0,0,1,0,0|2,0,0]=4 4011 B10R1.162 [13CH3]N1CCOCC(C1)CO 2230a_100103147999_200025704644 [1,0,0,1,0,0|2,0,0]=4 4012 B10R1.162 [13CH3]N1CCOCC(C1)CO 269982a_100103147999_200025704644 [1,0,0,1,0,0|2,0,0]=4 4013 B10R1.162 [13CH3]N1CCOCC(C1)CO 34a_100103147999_200025704644 [1,0,0,1,0,0|2,0,0]=4 4014 B10R1.177 BrCCCOCCC1CC1 34a_100011217188_100000694398 [1,0,0,1,0,0|2,0,0]=4 4015 B10R1.177 BrCCCOCCC1CO1 34a_100011217188_100000732470 [1,0,0,1,0,0|1,0,0]=3 4016 B10R1.177 C#CCCOCCC1CO1 34a_100011215631_100000732470 [1,0,0,1,0,0|0,0,2]=4 4017 B10R1.177 C#CCCOCC[C@@H]1CO1 34a_100009820653_100000688953 [1,0,0,1,0,0|0,0,2]=4 4018 B10R1.177 C/C=C/COCCC1CO1 34a_100016270725_100000732470 [1,0,0,1,0,0|0,0,2]=4 4019 B10R1.177 C/C=C/COCC[C@@H]1CO1 34a_100009820653_100102629194 [1,0,0,1,0,0|0,0,2]=4 4020 B10R1.177 C=CCCOCCC1CO1 34a_100011205117_100000732470 [1,0,0,1,0,0|0,0,2]=4 4021 B10R1.177 C=CCCOCC[C@@H]1CO1 34a_100009820653_100000754431 [1,0,0,1,0,0|0,0,2]=4 4022 B10R1.177 CC#CCOCCC1CO1 34a_100000761923_100000732470 [1,0,0,1,0,0|0,0,2]=4 4023 B10R1.177 CC#CCOCC[C@@H]1CO1 34a_100009820653_100000748600 [1,0,0,1,0,0|0,0,2]=4 4024 B10R1.177 CC=CCOCC[C@@H]1CO1 34a_100009820653_100000070051 [1,0,0,1,0,0|0,0,2]=4 4025 B10R1.177 CCCCCNCC1CO1 2230a_100000209983_100011216344 [1,0,0,1,0,0|2,0,0]=4 4026 B10R1.177 CCCCCOCC1CO1 34a_100000210253_102125554688 [1,0,0,1,0,0|2,0,0]=4 4027 B10R1.177 CCCCCOCC1CO1 7a_100000210253_102125554688 [1,0,0,1,0,0|2,0,0]=4 4028 B10R1.177 CCCCCOC[C@@H]1CO1 34a_100000757423_100000718602 [1,0,0,1,0,0|2,0,0]=4 4029 B10R1.177 CCCCCOC[C@@H]1CO1 7a_100000210253_100000745022 [1,0,0,1,0,0|2,0,0]=4 4030 B10R1.177 CCCCCSCC1CO1 62a_100000210326_102125554688 [1,0,0,1,0,0|2,0,0]=4 4031 B10R1.177 CCCCCSCC1CO1 62a_102125554688_100000210326 [1,0,0,1,0,0|2,0,0]=4 4032 B10R1.177 CCCCCSC[C@@H]1CO1 62a_100000210326_100000745022 [1,0,0,1,0,0|2,0,0]=4 4033 B10R1.177 CCCCCSC[C@@H]1CO1 62a_100000745022_100000210326 [1,0,0,1,0,0|2,0,0]=4 4034 B10R1.177 CCCCNCCC1CC1 2230a_100000102301_100000694398 [1,0,0,1,0,0|2,0,0]=4 4035 B10R1.177 CCCCNCCC1CC1 34a_100000764129_100000210210 [1,0,0,1,0,0|2,0,0]=4 4036 B10R1.177 CCCCNCCC1CC1 7a_106832991798_100000764125 [1,0,0,1,0,0|2,0,0]=4 4037 B10R1.177 CCCCNCCC1CO1 2230a_100000102301_100000732470 [1,0,0,1,0,0|1,0,0]=3 4038 B10R1.177 CCCCNCCC1CO1 7a_106832991798_100000732470 [1,0,0,1,0,0|1,0,0]=3 4039 B10R1.177 CCCCOCCC1CC1 34a_100000210227_100000694398 [1,0,0,1,0,0|1,0,0]=3 4040 B10R1.177 CCCCOCCC1CC1 34a_100000754188_100000210210 [1,0,0,1,0,0|1,0,0]=3 4041 B10R1.177 CCCCOCCC1CC1 7a_100000210227_100000764125 [1,0,0,1,0,0|1,0,0]=3 4042 B10R1.177 CCCCOCCC1CC1 7a_100000754188_100000210211 [1,0,0,1,0,0|1,0,0]=3 4043 B10R1.177 CCCCOCCC1CO1 34a_100000210227_100000732470 [1,0,0,1,0,0|0,0,0]=2 4044 B10R1.177 CCCCOCCC1CO1 7a_100000210227_100000732470 [1,0,0,1,0,0|0,0,0]=2 4045 B10R1.177 CCCCOCC[C@@H]1CO1 34a_100009820653_100000210210 [1,0,0,1,0,0|0,0,0]=2 4046 B10R1.177 CCCCOCNC1CC1 34a_100000212008_100011995733 [1,0,0,1,0,0|2,0,0]=4 4047 B10R1.177 CCCCOCSC1CC1 62a_100011995733_100000211595 [1,0,0,1,0,0|2,0,0]=4 4048 B10R1.177 CCCCSCCC1CC1 62a_100000210211_100000764125 [1,0,0,1,0,0|1,1,0]=4 4049 B10R1.177 CCCCSCCC1CC1 62a_100000764125_100000210210 [1,0,0,1,0,0|1,1,0]=4 4050 B10R1.177 CCCCSCCC1CO1 62a_100000210211_100000732470 [1,0,0,1,0,0|0,1,0]=3 4051 B10R1.177 CCCCSCCC1CO1 62a_100000732470_100000210210 [1,0,0,1,0,0|0,1,0]=3 4052 B10R1.177 CCCOCCCC1CO1 34a_100000210258_100000733510 [1,0,0,1,0,0|2,0,0]=4 4053 B10R1.177 CCCSCCCC1CO1 62a_100000210303_100000733510 [1,0,0,1,0,0|2,0,0]=4 4054 B10R1.177 CCCSCCCC1CO1 62a_100000733510_100000210303 [1,0,0,1,0,0|2,0,0]=4 4055 B10R1.177 CCOCSCCC1CO1 62a_100000732470_100000739092 [1,0,0,1,0,0|1,1,0]=4 4056 B10R1.177 CCOCSCCC1CO1 62a_100000739092_100000732470 [1,0,0,1,0,0|1,1,0]=4 4057 B10R1.177 COCCNCCC1CO1 2230a_100000209980_100000732470 [1,0,0,1,0,0|2,0,0]=4 4058 B10R1.177 COCCOCCC1CC1 34a_100000210237_100000694398 [1,0,0,1,0,0|2,0,0]=4 4059 B10R1.177 COCCOCCC1CC1 34a_100000754188_100011201679 [1,0,0,1,0,0|2,0,0]=4 4060 B10R1.177 COCCOCCC1CC1 7a_100000754188_100000233755 [1,0,0,1,0,0|2,0,0]=4 4061 B10R1.177 COCCOCCC1CO1 34a_100000210237_100000732470 [1,0,0,1,0,0|1,0,0]=3 4062 B10R1.177 COCCOCC[C@@H]1CO1 34a_100009820653_100011201679 [1,0,0,1,0,0|1,0,0]=3 4063 B10R1.177 COCCSCCC1CO1 62a_100000233755_100000732470 [1,0,0,1,0,0|1,1,0]=4 4064 B10R1.177 COCCSCCC1CO1 62a_100000732470_100000233755 [1,0,0,1,0,0|1,1,0]=4 4065 B10R1.177 CSCCNCCC1CO1 2230a_100020590264_100000732470 [1,0,0,1,0,0|2,0,0]=4 4066 B10R1.177 CSCCOCCC1CC1 34a_100000230434_100000694398 [1,0,0,1,0,0|2,0,0]=4 4067 B10R1.177 CSCCOCCC1CC1 34a_100000754188_100000212216 [1,0,0,1,0,0|2,0,0]=4 4068 B10R1.177 CSCCOCCC1CC1 7a_100000230434_100000764125 [1,0,0,1,0,0|2,0,0]=4 4069 B10R1.177 CSCCOCCC1CC1 7a_100000754188_100000212216 [1,0,0,1,0,0|2,0,0]=4 4070 B10R1.177 CSCCOCCC1CO1 34a_100000230434_100000732470 [1,0,0,1,0,0|1,0,0]=3 4071 B10R1.177 CSCCOCCC1CO1 7a_100000230434_100000732470 [1,0,0,1,0,0|1,0,0]=3 4072 B10R1.177 CSCCOCC[C@@H]1CO1 34a_100009820653_100000212216 [1,0,0,1,0,0|1,0,0]=3 4073 B10R1.177 CSCCSCCC1CO1 62a_100000212216_100000732470 [1,0,0,1,0,0|1,1,0]=4 4074 B10R1.177 CSCCSCCC1CO1 62a_100000732470_100000751147 [1,0,0,1,0,0|1,1,0]=4 4075 B10R1.177 ClCCCOCCC1CC1 34a_100000230001_100000694398 [1,0,0,1,0,0|2,0,0]=4 4076 B10R1.177 ClCCCOCCC1CO1 34a_100000230001_100000732470 [1,0,0,1,0,0|1,0,0]=3 4077 B10R1.177 FCCCNCCC1CO1 2230a_100015189416_100000732470 [1,0,0,1,0,0|2,0,0]=4 4078 B10R1.177 FCCCNCCC1CO1 34a_100015189416_100000732470 [1,0,0,1,0,0|2,0,0]=4 4079 B10R1.177 FCCCOCCC1CC1 34a_100000754188_100011934791 [1,0,0,1,0,0|2,0,0]=4 4080 B10R1.177 FCCCOCCC1CC1 34a_100000759539_100000694398 [1,0,0,1,0,0|2,0,0]=4 4081 B10R1.177 FCCCOCCC1CC1 7a_100000754188_100011934791 [1,0,0,1,0,0|2,0,0]=4 4082 B10R1.177 FCCCOCCC1CO1 34a_100000759539_100000732470 [1,0,0,1,0,0|1,0,0]=3 4083 B10R1.177 FCCCOCC[C@@H]1CO1 34a_100009820653_100011934791 [1,0,0,1,0,0|1,0,0]=3 4084 B10R1.177 FCCCSCCC1CO1 62a_100000732470_100011934791 [1,0,0,1,0,0|1,1,0]=4 4085 B10R1.177 FCCCSCCC1CO1 62a_100011934791_100000732470 [1,0,0,1,0,0|1,1,0]=4 4086 B10R1.177 NCCCOCCC1CC1 34a_100000182051_100000694398 [1,0,0,1,0,0|2,0,0]=4 4087 B10R1.177 NCCCOCCC1CO1 34a_100000182051_100000732470 [1,0,0,1,0,0|1,0,0]=3 4088 B10R1.177 NOCCOCCC1CO1 34a_100000700252_100000732470 [1,0,0,1,0,0|2,0,0]=4 4089 B10R1.177 OCCCCNCC1CO1 2230a_100000750430_100011216344 [1,0,0,1,0,0|2,0,0]=4 4090 B10R1.177 OCCCCNCC1CO1 34a_100000750430_102125554688 [1,0,0,1,0,0|2,0,0]=4 4091 B10R1.177 OCCCCOC[C@@H]1CO1 34a_100000757423_100011216708 [1,0,0,1,0,0|2,0,0]=4 4092 B10R1.177 OCCCCSCC1CO1 62a_100000210776_102125554688 [1,0,0,1,0,0|2,0,0]=4 4093 B10R1.177 OCCCCSCC1CO1 62a_102125554688_100000210776 [1,0,0,1,0,0|2,0,0]=4 4094 B10R1.177 OCCCCSC[C@@H]1CO1 62a_100000210776_100000745022 [1,0,0,1,0,0|2,0,0]=4 4095 B10R1.177 OCCCCSC[C@@H]1CO1 62a_100000745022_100000210776 [1,0,0,1,0,0|2,0,0]=4 4096 B10R1.177 OCCCNCCC1CC1 34a_100000764129_100000230001 [1,0,0,1,0,0|2,0,0]=4 4097 B10R1.177 OCCCOCCC1CC1 34a_100000754188_100000230001 [1,0,0,1,0,0|1,0,0]=3 4098 B10R1.177 OCCCOCCC1CC1 7a_100000754188_100011215043 [1,0,0,1,0,0|1,0,0]=3 4099 B10R1.177 OCCCOCC[C@@H]1CO1 34a_100009820653_100000230001 [1,0,0,1,0,0|0,0,0]=2 4100 B10R1.177 OCCCSCCC1CC1 62a_100000764125_100011215043 [1,0,0,1,0,0|1,1,0]=4 4101 B10R1.177 OCCCSCCC1CC1 62a_100011215043_100000764125 [1,0,0,1,0,0|1,1,0]=4 4102 B10R1.177 OCCCSCCC1CO1 62a_100000732470_100011215043 [1,0,0,1,0,0|0,1,0]=3 4103 B10R1.177 OCCCSCCC1CO1 62a_100011215043_100000732470 [1,0,0,1,0,0|0,1,0]=3 4104 B10R1.177 OCCNCCCC1CO1 2230a_100016997473_100000733510 [1,0,0,1,0,0|2,0,0]=4 4105 B10R1.177 OCCNCCCC1CO1 34a_100016990907_100000733510 [1,0,0,1,0,0|2,0,0]=4 4106 B10R1.177 OCCSCCCC1CO1 62a_100000211926_100000733510 [1,0,0,1,0,0|2,0,0]=4 4107 B10R1.177 OCCSCCCC1CO1 62a_100000733510_100000211926 [1,0,0,1,0,0|2,0,0]=4 4108 B10R1.54 CC(C)CN1CCC(C1)O 2230a_100011215560_100000210760 [0,0,0,1,1,0|2,0,0]=4 4109 B10R1.54 CC(C)CN1CCC(C1)O 269982a_100011215560_100000210624 [0,0,0,1,1,0|2,0,0]=4 4110 B10R1.54 CC(C)CN1CCC(C1)O 270004a_100011215560_100000210432 [0,0,0,1,1,0|2,0,0]=4 4111 B10R1.54 CC(C)N[C@H]1CC[C@H](C1)O 2230a_100015195300_100000210206 [0,0,0,1,1,0|2,0,0]=4 4112 B10R1.54 CC(O)CN1CCC(C1)O 2230a_100011215560_100011218427 [0,0,0,1,1,0|1,0,0]=3 4113 B10R1.54 CC(O)CN1CCC(C1)O 269982a_100011215560_100011218427 [0,0,0,1,1,0|1,0,0]=3 4114 B10R1.54 CC(O)CN1CC[C@@H](C1)F 2230a_100015203821_100011218427 [0,0,0,1,1,0|2,0,0]=4 4115 B10R1.54 CC(O)CN1CC[C@@H](C1)F 269982a_100015203821_100011218427 [0,0,0,1,1,0|2,0,0]=4 4116 B10R1.54 CC(O)CN1CC[C@@H](C1)F 34a_100015203821_100011218427 [0,0,0,1,1,0|2,0,0]=4 4117 B10R1.54 CC(O)CN1CC[C@H](C1)C 2230a_100016987628_100011218427 [0,0,0,1,1,0|2,0,0]=4 4118 B10R1.54 CC(O)CN1CC[C@H](C1)C 269982a_100016987628_100011218427 [0,0,0,1,1,0|2,0,0]=4 4119 B10R1.54 CC(O)CN1CC[C@H](C1)C 34a_100016987628_100011218427 [0,0,0,1,1,0|2,0,0]=4 4120 B10R1.54 C[C@@H](O)CN1CCC(C1)O 2230a_100011215560_100009817552 [0,0,0,1,1,0|1,0,0]=3 4121 B10R1.54 C[C@@H](O)CN1CCC(C1)O 269982a_100011215560_100009817552 [0,0,0,1,1,0|1,0,0]=3 4122 B10R1.54 C[C@@H](O)CN1CC[C@@H](C1)F 2230a_100015203821_100009817552 [0,0,0,1,1,0|2,0,0]=4 4123 B10R1.54 C[C@@H](O)CN1CC[C@@H](C1)F 269982a_100015203821_100009817552 [0,0,0,1,1,0|2,0,0]=4 4124 B10R1.54 C[C@@H](O)CN1CC[C@@H](C1)F 34a_100015203821_100009817552 [0,0,0,1,1,0|2,0,0]=4 4125 B10R1.54 C[C@@H]1CCN(C1)C[C@@H](C)O 2230a_100016987628_100009817552 [0,0,0,1,1,0|2,0,0]=4 4126 B10R1.54 C[C@@H]1CCN(C1)C[C@@H](C)O 269982a_100016987628_100009817552 [0,0,0,1,1,0|2,0,0]=4 4127 B10R1.54 C[C@@H]1CCN(C1)C[C@@H](C)O 34a_100016987628_100009817552 [0,0,0,1,1,0|2,0,0]=4 4128 B10R1.82 CC(C)CCN1CC(C1)O 269982a_100000749847_100000210312 [0,0,0,1,1,0|2,0,0]=4 4129 B10R1.82 CC(C)CN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000210760 [0,0,0,1,1,0|2,0,0]=4 4130 B10R1.82 CC(C)CN[C@H]1C[C@@H](C1)O 270004a_100020629032_100000210432 [0,0,0,1,1,0|2,0,0]=4 4131 B10R1.82 CC(C)NCC1CC(C1)O 2230a_100016992100_100000210206 [0,0,0,1,1,0|2,0,0]=4 4132 B10R1.82 CC(O)CCN1CC(C1)C 2230a_100000702820_100012276601 [0,0,0,1,1,0|2,0,0]=4 4133 B10R1.82 CC(O)CCN1CC(C1)C 269982a_100000702820_100012276601 [0,0,0,1,1,0|2,0,0]=4 4134 B10R1.82 CC(O)CCN1CC(C1)C 34a_100000702820_100012276601 [0,0,0,1,1,0|2,0,0]=4 4135 B10R1.82 CC(O)CCN1CC(C1)F 2230a_100000690557_100012276601 [0,0,0,1,1,0|2,0,0]=4 4136 B10R1.82 CC(O)CCN1CC(C1)F 269982a_100000690557_100012276601 [0,0,0,1,1,0|2,0,0]=4 4137 B10R1.82 CC(O)CCN1CC(C1)F 34a_100000690557_100012276601 [0,0,0,1,1,0|2,0,0]=4 4138 B10R1.82 CC(O)CCN1CC(C1)O 269982a_100000749847_100012276601 [0,0,0,1,1,0|1,0,0]=3 4139 B10R1.82 CC(O)CNC1CC(C1)F 2230a_100016993743_100011218427 [0,0,0,1,1,0|2,0,0]=4 4140 B10R1.82 CC(O)CN[C@H]1C[C@@H](C1)O 2230a_100020629032_100011218427 [0,0,0,1,1,0|1,0,0]=3 4141 B10R1.82 C[C@@H](O)CNC1CC(C1)F 2230a_100016993743_100009817552 [0,0,0,1,1,0|2,0,0]=4 4142 B10R1.82 C[C@@H](O)CN[C@H]1C[C@@H](C1)O 2230a_100020629032_100009817552 [0,0,0,1,1,0|1,0,0]=3 4143 B10R1.113 CC(=O)C1CCCC(C1)O 1458a_100000707227_200000210301 [0,0,0,1,1,0|0,0,2]=4 4144 B10R1.113 CC(C)N1CCCC(C1)O 2230a_100000211013_100000210206 [0,0,0,1,1,0|2,0,0]=4 4145 B10R1.113 CC(C)N1CCCC(C1)O 269982a_100000211013_100000210206 [0,0,0,1,1,0|2,0,0]=4 4146 B10R1.113 CC(O)C1CCCN(C1)C 2230a_100000740858_200000210301 [0,0,0,1,1,0|2,0,0]=4 4147 B10R1.113 CC(O)C1CCCN(C1)C 269982a_100000740858_200000210301 [0,0,0,1,1,0|2,0,0]=4 4148 B10R1.113 CC(O)C1CCCN(C1)C 34a_100000740858_200000210301 [0,0,0,1,1,0|2,0,0]=4 4149 B10R1.113 CC(O)C1CCCN(C1)[13CH3] 2230a_100000740858_200025704644 [0,0,0,1,1,0|2,0,0]=4 4150 B10R1.113 CC(O)C1CCCN(C1)[13CH3] 269982a_100000740858_200025704644 [0,0,0,1,1,0|2,0,0]=4 4151 B10R1.113 CC(O)C1CCCN(C1)[13CH3] 34a_100000740858_200025704644 [0,0,0,1,1,0|2,0,0]=4 4152 B10R1.113 CN(C)C1CCCC(C1)O 270004a_100102631434_100012613340 [0,0,0,1,1,0|2,0,0]=4 4153 B10R1.113 [13CH3]C(=O)C1CCCC(C1)O 1458a_100000707227_200025704644 [0,0,0,1,1,0|0,0,2]=4 4154 B10R1.276 CC1(COCCN(C1)[13CH3])O 2230a_100011091861_200025704644 [0,0,0,1,1,0|2,0,0]=4 4155 B10R1.276 CC1(COCCN(C1)[13CH3])O 269982a_100011091861_200025704644 [0,0,0,1,1,0|2,0,0]=4 4156 B10R1.276 CN1CCOCC(C1)(C)O 2230a_100011091861_200000210301 [0,0,0,1,1,0|2,0,0]=4 4157 B10R1.276 CN1CCOCC(C1)(C)O 269982a_100011091861_200000210301 [0,0,0,1,1,0|2,0,0]=4 4158 B12R1.105 CC(C)CCCN1CCC(C1)O 2230a_100011215560_100011214892 [0,0,0,1,0,1|2,0,0]=4 4159 B12R1.105 CC(C)CCCN1CCC(C1)O 269982a_100011215560_100011214892 [0,0,0,1,0,1|2,0,0]=4 4160 B12R1.105 CC(C)CCNC1CCC(C1)O 270004a_100000210545_100012614533 [0,0,0,1,0,1|2,0,0]=4 4161 B12R1.105 CC(C)CCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000210312 [0,0,0,1,0,1|2,0,0]=4 4162 B12R1.105 CC(C)CCN[C@H]1CC[C@H](C1)O 269862a_100015195300_100000185833 [0,0,0,1,0,1|2,0,0]=4 4163 B12R1.105 CC(C)CCOC1CCC(C1)C 34a_100000698185_100000210312 [0,0,0,1,0,1|2,0,0]=4 4164 B12R1.105 CC(C)OCCN1CCC(C1)O 2230a_100011215560_100000211751 [0,0,0,1,0,1|2,0,0]=4 4165 B12R1.105 CC(C)OCCN1CCC(C1)O 269982a_100011215560_100000211751 [0,0,0,1,0,1|2,0,0]=4 4166 B12R1.105 CC(C)SCCN1CCC(C1)O 2230a_100011215560_100000730970 [0,0,0,1,0,1|2,0,0]=4 4167 B12R1.105 CC(C)SCCN1CCC(C1)O 269982a_100011215560_100000730970 [0,0,0,1,0,1|2,0,0]=4 4168 B12R1.105 CC(O)CCCN1CCC(C1)O 2230a_100011215560_200000718107 [0,0,0,1,0,1|1,0,0]=3 4169 B12R1.105 CC(O)CCCN1CCC(C1)O 269982a_100011215560_200000718107 [0,0,0,1,0,1|1,0,0]=3 4170 B12R1.105 CC(O)CCCN1CC[C@@H](C1)F 2230a_100015203821_200000718107 [0,0,0,1,0,1|2,0,0]=4 4171 B12R1.105 CC(O)CCCN1CC[C@@H](C1)F 269982a_100015203821_200000718107 [0,0,0,1,0,1|2,0,0]=4 4172 B12R1.105 CC(O)CCCN1CC[C@@H](C1)F 34a_100015203821_200000718107 [0,0,0,1,0,1|2,0,0]=4 4173 B12R1.105 CC(O)CCCN1CC[C@H](C1)C 2230a_100016987628_200000718107 [0,0,0,1,0,1|2,0,0]=4 4174 B12R1.105 CC(O)CCCN1CC[C@H](C1)C 269982a_100016987628_200000718107 [0,0,0,1,0,1|2,0,0]=4 4175 B12R1.105 CC(O)CCCN1CC[C@H](C1)C 34a_100016987628_200000718107 [0,0,0,1,0,1|2,0,0]=4 4176 B12R1.105 CC(O)CCNC1CCC(C1)C 270004a_200000755665_100011215218 [0,0,0,1,0,1|2,0,0]=4 4177 B12R1.105 CC(O)CCNC1CCC(C1)O 270004a_200000755665_100012614533 [0,0,0,1,0,1|1,0,0]=3 4178 B12R1.105 CC(O)CCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100012276601 [0,0,0,1,0,1|1,0,0]=3 4179 B12R1.105 CC(O)CCOC1CCC(=O)C1 34a_100012614533_100012276601 [0,0,0,1,0,1|0,0,2]=4 4180 B12R1.105 CC(O)CCOC1CCC(C1)C 34a_100000698185_100012276601 [0,0,0,1,0,1|1,0,0]=3 4181 B12R1.105 CC(O)CCOC1CNC(=O)C1 34a_100000690082_100012276601 [0,0,0,1,0,1|0,0,2]=4 4182 B12R1.105 CC(O)CNN=C1CCC(C1)O 4a_200000730056_100012614533 [0,0,0,1,0,1|2,0,0]=4 4183 B12R1.143 CC(C)CCCOCC1CC1C 34a_100000744939_100011214892 [0,0,0,1,0,1|2,0,0]=4 4184 B12R1.143 CC(C)CCCOCC1CC1C 7a_100000744939_100011214892 [0,0,0,1,0,1|2,0,0]=4 4185 B12R1.143 CC(C)OCCOCC1CC1C 34a_100000744939_100000211751 [0,0,0,1,0,1|2,0,0]=4 4186 B12R1.143 CC(C)OCCOCC1CC1C 7a_100000744939_100000211751 [0,0,0,1,0,1|2,0,0]=4 4187 B12R1.143 CC(C)SCCOCC1CC1C 34a_100000744939_100000730970 [0,0,0,1,0,1|2,0,0]=4 4188 B12R1.143 CC(C)SCCOCC1CC1C 7a_100000744939_100000730970 [0,0,0,1,0,1|2,0,0]=4 4189 B12R1.143 CC(O)CCCOCC1CC1C 34a_100000744939_200000718107 [0,0,0,1,0,1|1,0,0]=3 4190 B12R1.143 CC(O)CCCOCC1CC1C 7a_100000744939_200000718107 [0,0,0,1,0,1|1,0,0]=3 4191 B12R1.220 C=C1CC(C1)COCCC(C)O 34a_100011011225_100012276601 [0,0,0,1,0,1|1,0,1]=4 4192 B12R1.220 CC(C)CCCCN1CC(C1)O 269982a_100000749847_100011216152 [0,0,0,1,0,1|2,0,0]=4 4193 B12R1.220 CC(C)CCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100011214892 [0,0,0,1,0,1|2,0,0]=4 4194 B12R1.220 CC(C)CCNCC1CC(C1)O 2230a_100016992100_100000210312 [0,0,0,1,0,1|2,0,0]=4 4195 B12R1.220 CC(C)CCNCC1CC(C1)O 269862a_100016992100_100000185833 [0,0,0,1,0,1|2,0,0]=4 4196 B12R1.220 CC(C)CCOCC1CC(C1)Cl 34a_100009874164_100000210312 [0,0,0,1,0,1|2,0,0]=4 4197 B12R1.220 CC(C)OCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000211751 [0,0,0,1,0,1|2,0,0]=4 4198 B12R1.220 CC(C)SCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000730970 [0,0,0,1,0,1|2,0,0]=4 4199 B12R1.220 CC(O)CCCNC1CC(C1)F 2230a_100016993743_200000718107 [0,0,0,1,0,1|2,0,0]=4 4200 B12R1.220 CC(O)CCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_200000718107 [0,0,0,1,0,1|1,0,0]=3 4201 B12R1.220 CC(O)CCNCC1CC(C1)O 2230a_100016992100_100012276601 [0,0,0,1,0,1|1,0,0]=3 4202 B12R1.220 CC(O)CCOCC1CC(=O)C1 34a_100000101936_100012276601 [0,0,0,1,0,1|0,0,2]=4 4203 B12R1.220 CC(O)CCOCC1CC(C1)Cl 34a_100009874164_100012276601 [0,0,0,1,0,1|1,0,0]=3 4204 B12R1.226 CC(C)CCN1CCCC(C1)O 2230a_100000211013_100000210312 [0,0,0,1,0,1|2,0,0]=4 4205 B12R1.226 CC(C)CCN1CCCC(C1)O 269982a_100000211013_100000210312 [0,0,0,1,0,1|2,0,0]=4 4206 B12R1.226 CC(C)CCN1CCOC(C1)O 2230a_100000688207_100000210312 [0,0,0,1,0,1|2,0,0]=4 4207 B12R1.226 CC(C)CCN1CCOC(C1)O 269982a_100000688207_100000210312 [0,0,0,1,0,1|2,0,0]=4 4208 B12R1.226 CC(C)CNC1CCCC(C1)O 2230a_100015190357_100000210760 [0,0,0,1,0,1|2,0,0]=4 4209 B12R1.226 CC(C)CNC1CCCC(C1)O 270004a_100000210953_100012613340 [0,0,0,1,0,1|2,0,0]=4 4210 B12R1.226 CC(C)CNC1CCCC(C1)O 270004a_100015190357_100000210432 [0,0,0,1,0,1|2,0,0]=4 4211 B12R1.226 CC(C)NCC1CCCC(C1)O 2230a_100011254705_100000210206 [0,0,0,1,0,1|2,0,0]=4 4212 B12R1.226 CC(O)CCN1CCCC(C1)F 2230a_100000697950_100012276601 [0,0,0,1,0,1|2,0,0]=4 4213 B12R1.226 CC(O)CCN1CCCC(C1)F 269982a_100000697950_100012276601 [0,0,0,1,0,1|2,0,0]=4 4214 B12R1.226 CC(O)CCN1CCCC(C1)F 34a_100000697950_100012276601 [0,0,0,1,0,1|2,0,0]=4 4215 B12R1.226 CC(O)CCN1CCCC(C1)O 2230a_100000211013_100012276601 [0,0,0,1,0,1|1,0,0]=3 4216 B12R1.226 CC(O)CCN1CCCC(C1)O 269982a_100000211013_100012276601 [0,0,0,1,0,1|1,0,0]=3 4217 B12R1.226 CC(O)CCN1CCC[C@@H](C1)C 2230a_100000717927_100012276601 [0,0,0,1,0,1|2,0,0]=4 4218 B12R1.226 CC(O)CCN1CCC[C@@H](C1)C 269982a_100000717927_100012276601 [0,0,0,1,0,1|2,0,0]=4 4219 B12R1.226 CC(O)CCN1CCC[C@@H](C1)C 34a_100000717927_100012276601 [0,0,0,1,0,1|2,0,0]=4 4220 B12R1.226 CC(O)CCN1CCOC(C1)C 2230a_100000729577_100012276601 [0,0,0,1,0,1|2,0,0]=4 4221 B12R1.226 CC(O)CCN1CCOC(C1)C 269982a_100000729577_100012276601 [0,0,0,1,0,1|2,0,0]=4 4222 B12R1.226 CC(O)CCN1CCOC(C1)C 34a_100000729577_100012276601 [0,0,0,1,0,1|2,0,0]=4 4223 B12R1.226 CC(O)CCN1CCOC(C1)O 2230a_100000688207_100012276601 [0,0,0,1,0,1|1,0,0]=3 4224 B12R1.226 CC(O)CCN1CCOC(C1)O 269982a_100000688207_100012276601 [0,0,0,1,0,1|1,0,0]=3 4225 B12R1.226 CC(O)CNC1CCCC(C1)C 2230a_100011194320_100011218427 [0,0,0,1,0,1|2,0,0]=4 4226 B12R1.226 CC(O)CNC1CCCC(C1)C 270004a_100000210904_100000183594 [0,0,0,1,0,1|2,0,0]=4 4227 B12R1.226 CC(O)CNC1CCCC(C1)C 34a_100011194320_100011218427 [0,0,0,1,0,1|2,0,0]=4 4228 B12R1.226 CC(O)CNC1CCCC(C1)O 2230a_100015190357_100011218427 [0,0,0,1,0,1|1,0,0]=3 4229 B12R1.226 CC(O)CNC1CCCC(C1)O 270004a_100000210904_100012613340 [0,0,0,1,0,1|1,0,0]=3 4230 B12R1.226 CC(O)COC1CCCC(C1)C 34a_100000211399_100011218427 [0,0,0,1,0,1|2,0,0]=4 4231 B12R1.226 CC1CCCC(C1)NC[C@@H](C)O 2230a_100011194320_100009817552 [0,0,0,1,0,1|2,0,0]=4 4232 B12R1.226 CC1CCCC(C1)NC[C@@H](C)O 34a_100011194320_100009817552 [0,0,0,1,0,1|2,0,0]=4 4233 B12R1.226 CC1CCCC(C1)OC[C@@H](C)O 34a_100000211399_100009817552 [0,0,0,1,0,1|2,0,0]=4 4234 B12R1.226 C[C@@H](O)CNC1CCCC(C1)O 2230a_100015190357_100009817552 [0,0,0,1,0,1|1,0,0]=3 4235 B12R1.261 CC(C)[C@H]1COCCN1C(C)C 2230a_100025712635_100000210206 [0,0,0,1,0,1|2,0,0]=4 4236 B12R1.261 CC(C)[C@H]1COCCN1C(C)C 269982a_100025712635_100000210206 [0,0,0,1,0,1|2,0,0]=4 4237 B12R1.261 CC(C)[C@H]1COCCN1C(C)C 34a_100025712635_100000210206 [0,0,0,1,0,1|2,0,0]=4 4238 B12R1.390 C=C(C)CCOCCCC1CO1 34a_100000764851_100000733510 [0,0,0,1,0,1|1,0,1]=4 4239 B12R1.390 CC(=CCCOCC[C@@H]1CO1)C 34a_100009820653_100011217483 [0,0,0,1,0,1|1,0,1]=4 4240 B12R1.390 CC(=O)CCCOCCC1CO1 34a_100000759063_100000732470 [0,0,0,1,0,1|0,0,2]=4 4241 B12R1.390 CC(=O)CCCOCCC1CO1 7a_100000759063_100000732470 [0,0,0,1,0,1|0,0,2]=4 4242 B12R1.390 CC(=O)CCCOCC[C@@H]1CO1 34a_100009820653_100000685027 [0,0,0,1,0,1|0,0,2]=4 4243 B12R1.390 CC(=O)CCOCCCC1CO1 34a_100000759926_100000733510 [0,0,0,1,0,1|0,0,2]=4 4244 B12R1.390 CC(=O)CCOCCCC1CO1 7a_100000759926_100000733510 [0,0,0,1,0,1|0,0,2]=4 4245 B12R1.390 CC(=O)NCCOCCC1CO1 34a_100000158858_100000732470 [0,0,0,1,0,1|0,0,2]=4 4246 B12R1.390 CC(=O)OCCOCC[C@@H]1CO1 34a_100009820653_100009814007 [0,0,0,1,0,1|0,0,2]=4 4247 B12R1.390 CC(Br)CCOCCCC1CO1 34a_100009893172_100000733510 [0,0,0,1,0,1|1,0,0]=3 4248 B12R1.390 CC(C)CCCCOCC1CO1 34a_100011214890_102125554688 [0,0,0,1,0,1|2,0,0]=4 4249 B12R1.390 CC(C)CCCCOCC1CO1 7a_100011214890_102125554688 [0,0,0,1,0,1|2,0,0]=4 4250 B12R1.390 CC(C)CCCCOC[C@@H]1CO1 34a_100000757423_100011216152 [0,0,0,1,0,1|2,0,0]=4 4251 B12R1.390 CC(C)CCCCOC[C@@H]1CO1 7a_100011214890_100000745022 [0,0,0,1,0,1|2,0,0]=4 4252 B12R1.390 CC(C)CCCCSCC1CO1 62a_100011216152_102125554688 [0,0,0,1,0,1|2,0,0]=4 4253 B12R1.390 CC(C)CCCCSCC1CO1 62a_102125554688_100011216152 [0,0,0,1,0,1|2,0,0]=4 4254 B12R1.390 CC(C)CCCCSC[C@@H]1CO1 62a_100000745022_100011216152 [0,0,0,1,0,1|2,0,0]=4 4255 B12R1.390 CC(C)CCCCSC[C@@H]1CO1 62a_100011216152_100000745022 [0,0,0,1,0,1|2,0,0]=4 4256 B12R1.390 CC(C)CCCNCCC1CO1 2230a_200000737386_100000732470 [0,0,0,1,0,1|2,0,0]=4 4257 B12R1.390 CC(C)CCCNCCC1CO1 34a_200000737386_100000732470 [0,0,0,1,0,1|2,0,0]=4 4258 B12R1.390 CC(C)CCCOCCC1CC1 34a_100000210774_100000694398 [0,0,0,1,0,1|2,0,0]=4 4259 B12R1.390 CC(C)CCCOCCC1CC1 34a_100000754188_100011214892 [0,0,0,1,0,1|2,0,0]=4 4260 B12R1.390 CC(C)CCCOCCC1CC1 7a_100000210774_100000764125 [0,0,0,1,0,1|2,0,0]=4 4261 B12R1.390 CC(C)CCCOCCC1CC1 7a_100000754188_100011214892 [0,0,0,1,0,1|2,0,0]=4 4262 B12R1.390 CC(C)CCCOCCC1CO1 34a_100000210774_100000732470 [0,0,0,1,0,1|1,0,0]=3 4263 B12R1.390 CC(C)CCCOCCC1CO1 7a_100000210774_100000732470 [0,0,0,1,0,1|1,0,0]=3 4264 B12R1.390 CC(C)CCCOCC[C@@H]1CO1 34a_100009820653_100011214892 [0,0,0,1,0,1|1,0,0]=3 4265 B12R1.390 CC(C)CCCSCCC1CO1 62a_100000732470_100011214892 [0,0,0,1,0,1|1,1,0]=4 4266 B12R1.390 CC(C)CCCSCCC1CO1 62a_100011214892_100000732470 [0,0,0,1,0,1|1,1,0]=4 4267 B12R1.390 CC(C)CCOCCCC1CO1 34a_100000210254_100000733510 [0,0,0,1,0,1|1,0,0]=3 4268 B12R1.390 CC(C)CCOCCCC1CO1 7a_100000210254_100000733510 [0,0,0,1,0,1|1,0,0]=3 4269 B12R1.390 CC(C)CCOCCNC1CC1 34a_100000738766_100000210312 [0,0,0,1,0,1|2,0,0]=4 4270 B12R1.390 CC(C)CCSCCCC1CO1 62a_100000210312_100000733510 [0,0,0,1,0,1|1,1,0]=4 4271 B12R1.390 CC(C)CCSCCCC1CO1 62a_100000733510_100000210312 [0,0,0,1,0,1|1,1,0]=4 4272 B12R1.390 CC(C)NCCOCCC1CC1 34a_100000224655_100000694398 [0,0,0,1,0,1|2,0,0]=4 4273 B12R1.390 CC(C)NCCOCCC1CO1 34a_100000224655_100000732470 [0,0,0,1,0,1|1,0,0]=3 4274 B12R1.390 CC(C)OCCNCCC1CO1 2230a_100000701111_100000732470 [0,0,0,1,0,1|2,0,0]=4 4275 B12R1.390 CC(C)OCCNCCC1CO1 34a_100000701111_100000732470 [0,0,0,1,0,1|2,0,0]=4 4276 B12R1.390 CC(C)OCCOCCC1CC1 34a_100000211219_100000694398 [0,0,0,1,0,1|2,0,0]=4 4277 B12R1.390 CC(C)OCCOCCC1CC1 34a_100000754188_100000211751 [0,0,0,1,0,1|2,0,0]=4 4278 B12R1.390 CC(C)OCCOCCC1CC1 7a_100000211219_100000764125 [0,0,0,1,0,1|2,0,0]=4 4279 B12R1.390 CC(C)OCCOCCC1CC1 7a_100000754188_100000211751 [0,0,0,1,0,1|2,0,0]=4 4280 B12R1.390 CC(C)OCCOCCC1CO1 34a_100000211219_100000732470 [0,0,0,1,0,1|1,0,0]=3 4281 B12R1.390 CC(C)OCCOCCC1CO1 7a_100000211219_100000732470 [0,0,0,1,0,1|1,0,0]=3 4282 B12R1.390 CC(C)OCCOCC[C@@H]1CO1 34a_100009820653_100000211751 [0,0,0,1,0,1|1,0,0]=3 4283 B12R1.390 CC(C)OCCSCCC1CO1 62a_100000211751_100000732470 [0,0,0,1,0,1|1,1,0]=4 4284 B12R1.390 CC(C)OCCSCCC1CO1 62a_100000732470_100000211751 [0,0,0,1,0,1|1,1,0]=4 4285 B12R1.390 CC(C)SCCNCCC1CO1 2230a_100000731138_100000732470 [0,0,0,1,0,1|2,0,0]=4 4286 B12R1.390 CC(C)SCCNCCC1CO1 34a_100000731138_100000732470 [0,0,0,1,0,1|2,0,0]=4 4287 B12R1.390 CC(C)SCCOCCC1CC1 34a_100000754188_100000730970 [0,0,0,1,0,1|2,0,0]=4 4288 B12R1.390 CC(C)SCCOCCC1CC1 34a_200011212901_100000694398 [0,0,0,1,0,1|2,0,0]=4 4289 B12R1.390 CC(C)SCCOCCC1CC1 7a_100000754188_100000730970 [0,0,0,1,0,1|2,0,0]=4 4290 B12R1.390 CC(C)SCCOCCC1CC1 7a_200011212901_100000764125 [0,0,0,1,0,1|2,0,0]=4 4291 B12R1.390 CC(C)SCCOCCC1CO1 34a_200011212901_100000732470 [0,0,0,1,0,1|1,0,0]=3 4292 B12R1.390 CC(C)SCCOCCC1CO1 7a_200011212901_100000732470 [0,0,0,1,0,1|1,0,0]=3 4293 B12R1.390 CC(C)SCCOCC[C@@H]1CO1 34a_100009820653_100000730970 [0,0,0,1,0,1|1,0,0]=3 4294 B12R1.390 CC(C)SCCSCCC1CO1 62a_100000730970_100000732470 [0,0,0,1,0,1|1,1,0]=4 4295 B12R1.390 CC(C)SCCSCCC1CO1 62a_100000732470_100000730970 [0,0,0,1,0,1|1,1,0]=4 4296 B12R1.390 CC(O)CCCNCCC1CC1 34a_100000764129_200000718107 [0,0,0,1,0,1|2,0,0]=4 4297 B12R1.390 CC(O)CCCOCCC1CC1 34a_100000754188_200000718107 [0,0,0,1,0,1|1,0,0]=3 4298 B12R1.390 CC(O)CCCOCCC1CC1 7a_100000754188_200000718107 [0,0,0,1,0,1|1,0,0]=3 4299 B12R1.390 CC(O)CCCOCC[C@@H]1CO1 34a_100009820653_200000718107 [0,0,0,1,0,1|0,0,0]=2 4300 B12R1.390 CC(O)CCCSCCC1CC1 62a_100000764125_200000718107 [0,0,0,1,0,1|1,1,0]=4 4301 B12R1.390 CC(O)CCCSCCC1CC1 62a_200000718107_100000764125 [0,0,0,1,0,1|1,1,0]=4 4302 B12R1.390 CC(O)CCCSCCC1CO1 62a_100000732470_200000718107 [0,0,0,1,0,1|0,1,0]=3 4303 B12R1.390 CC(O)CCCSCCC1CO1 62a_200000718107_100000732470 [0,0,0,1,0,1|0,1,0]=3 4304 B12R1.390 CC(O)CCNCCCC1CO1 2230a_200000755665_100000733510 [0,0,0,1,0,1|1,0,0]=3 4305 B12R1.390 CC(O)CCOCC#CC1CC1 34a_100000083941_100012276601 [0,0,0,1,0,1|1,0,1]=4 4306 B12R1.390 CC(O)CCOCC#CC1CC1 7a_100000083941_100012276601 [0,0,0,1,0,1|1,0,1]=4 4307 B12R1.390 CC(O)CCOCCNC1CC1 34a_100000738766_100012276601 [0,0,0,1,0,1|1,0,0]=3 4308 B12R1.390 CC(O)CCSCCCC1CO1 62a_100000733510_100012276601 [0,0,0,1,0,1|0,1,0]=3 4309 B12R1.390 CC(O)CCSCCCC1CO1 62a_100012276601_100000733510 [0,0,0,1,0,1|0,1,0]=3 4310 B12R1.390 C[C@@H](N)CCOCCCC1CO1 34a_100000706166_100000733510 [0,0,0,1,0,1|1,0,0]=3 4311 B12R1.390 FC(F)CCOCCCC1CO1 34a_100103093639_100000733510 [0,0,0,1,0,1|2,0,0]=4 4312 B12R1.392 CC(C)C1CCCN1C[C@@H](C)O 2230a_100000762757_100009817552 [0,0,0,1,0,1|2,0,0]=4 4313 B12R1.392 CC(C)C1CCCN1C[C@@H](C)O 269982a_100000762757_100009817552 [0,0,0,1,0,1|2,0,0]=4 4314 B12R1.392 CC(C)C1CCCN1C[C@@H](C)O 34a_100000762757_100009817552 [0,0,0,1,0,1|2,0,0]=4 4315 B12R1.392 CC(O)CN1CCCC1C(C)C 2230a_100000762757_100011218427 [0,0,0,1,0,1|2,0,0]=4 4316 B12R1.392 CC(O)CN1CCCC1C(C)C 269982a_100000762757_100011218427 [0,0,0,1,0,1|2,0,0]=4 4317 B12R1.392 CC(O)CN1CCCC1C(C)C 34a_100000762757_100011218427 [0,0,0,1,0,1|2,0,0]=4 4318 B12R1.874 CC(C)CN1CCCCC(C1)O 2230a_100025706797_100000210760 [0,0,0,1,0,1|2,0,0]=4 4319 B12R1.874 CC(C)CN1CCCCC(C1)O 269982a_100025706797_100000210624 [0,0,0,1,0,1|2,0,0]=4 4320 B12R1.874 CC(C)CN1CCCCC(C1)O 270004a_100025706797_100000210432 [0,0,0,1,0,1|2,0,0]=4 4321 B12R1.874 CC(O)CN1CCCCC(C1)O 2230a_100025706797_100011218427 [0,0,0,1,0,1|1,0,0]=3 4322 B12R1.874 CC(O)CN1CCCCC(C1)O 269982a_100025706797_100011218427 [0,0,0,1,0,1|1,0,0]=3 4323 B12R1.874 CC(O)CN1CCOC[C@@H](C1)O 2230a_100016073750_100011218427 [0,0,0,1,0,1|2,0,0]=4 4324 B12R1.874 CC(O)CN1CCOC[C@@H](C1)O 269982a_100016073750_100011218427 [0,0,0,1,0,1|2,0,0]=4 4325 B12R1.874 C[C@@H](O)CN1CCCCC(C1)O 2230a_100025706797_100009817552 [0,0,0,1,0,1|1,0,0]=3 4326 B12R1.874 C[C@@H](O)CN1CCCCC(C1)O 269982a_100025706797_100009817552 [0,0,0,1,0,1|1,0,0]=3 4327 B12R1.874 C[C@@H](O)CN1CCOC[C@@H](C1)O 2230a_100016073750_100009817552 [0,0,0,1,0,1|2,0,0]=4 4328 B12R1.874 C[C@@H](O)CN1CCOC[C@@H](C1)O 269982a_100016073750_100009817552 [0,0,0,1,0,1|2,0,0]=4 4329 B12R1.924 CC(C)CN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100000210760 [0,0,0,1,0,1|2,0,0]=4 4330 B12R1.924 CC(C)CN[C@@H]1CCC[C@@]1(C)O 270004a_100015977457_100000210432 [0,0,0,1,0,1|2,0,0]=4 4331 B12R1.924 CC(C)CN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100000210624 [0,0,0,1,0,1|2,0,0]=4 4332 B12R1.924 CC(O)CCN1CCCC1(C)C 2230a_100000761399_100012276601 [0,0,0,1,0,1|2,0,0]=4 4333 B12R1.924 CC(O)CCN1CCCC1(C)C 269982a_100000761399_100012276601 [0,0,0,1,0,1|2,0,0]=4 4334 B12R1.924 CC(O)CCN1CCCC1(C)C 34a_100000761399_100012276601 [0,0,0,1,0,1|2,0,0]=4 4335 B12R1.924 CC(O)CCN1CCSC1(C)C 2230a_100011217261_100012276601 [0,0,0,1,0,1|2,0,0]=4 4336 B12R1.924 CC(O)CCN1CCSC1(C)C 269982a_100011217261_100012276601 [0,0,0,1,0,1|2,0,0]=4 4337 B12R1.924 CC(O)CCN1CCSC1(C)C 34a_100011217261_100012276601 [0,0,0,1,0,1|2,0,0]=4 4338 B12R1.924 CC(O)CCN1COCC1(C)C 2230a_100000043020_100012276601 [0,0,0,1,0,1|2,0,0]=4 4339 B12R1.924 CC(O)CCN1COCC1(C)C 269982a_100000043020_100012276601 [0,0,0,1,0,1|2,0,0]=4 4340 B12R1.924 CC(O)CNC1CCCC1(C)C 269862a_100000210904_100000065263 [0,0,0,1,0,1|2,0,0]=4 4341 B12R1.924 CC(O)CN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100011218427 [0,0,0,1,0,1|1,0,0]=3 4342 B12R1.924 CC(O)CN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100011218427 [0,0,0,1,0,1|1,0,0]=3 4343 B12R1.924 CC(O)COC1CCCC1(C)C 34a_100000726220_100011218427 [0,0,0,1,0,1|2,0,0]=4 4344 B12R1.924 CC(O)COC1CCCC1(C)C 7a_100000726220_100011218427 [0,0,0,1,0,1|2,0,0]=4 4345 B12R1.924 C[C@@H](O)CN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100009817552 [0,0,0,1,0,1|1,0,0]=3 4346 B12R1.924 C[C@@H](O)CN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100009817552 [0,0,0,1,0,1|1,0,0]=3 4347 B12R1.924 C[C@@H](O)COC1CCCC1(C)C 34a_100000726220_100009817552 [0,0,0,1,0,1|2,0,0]=4 4348 B12R1.924 C[C@@H](O)COC1CCCC1(C)C 7a_100000726220_100009817552 [0,0,0,1,0,1|2,0,0]=4 4349 B12R1.1347 CC(C)CCOCC1CC1(C)C 34a_100000728257_100000210312 [0,0,0,1,0,1|2,0,0]=4 4350 B12R1.1347 CC(C)CCOCC1CC1(C)C 7a_100000728257_100000210626 [0,0,0,1,0,1|2,0,0]=4 4351 B12R1.1347 CC(C)CCOCC1OC1(C)C 34a_200010283642_100000210312 [0,0,0,1,0,1|2,0,0]=4 4352 B12R1.1347 CC(C)CCOCC1OC1(C)C 7a_200010283642_100000210626 [0,0,0,1,0,1|2,0,0]=4 4353 B12R1.1347 CC(O)CCOCC1CC1(C)C 34a_100000728257_100012276601 [0,0,0,1,0,1|1,0,0]=3 4354 B12R1.1347 CC(O)CCOCC1CC1(C)C 7a_100000728257_100012276601 [0,0,0,1,0,1|1,0,0]=3 4355 B12R1.1347 CC(O)CCOCC1CC1(F)F 34a_100000056500_100012276601 [0,0,0,1,0,1|2,0,0]=4 4356 B12R1.1347 CC(O)CCOCC1CC1(F)F 7a_100000056500_100012276601 [0,0,0,1,0,1|2,0,0]=4 4357 B12R1.1347 CC(O)CCOCC1OC1(C)C 34a_200010283642_100012276601 [0,0,0,1,0,1|1,0,0]=3 4358 B12R1.1347 CC(O)CCOCC1OC1(C)C 7a_200010283642_100012276601 [0,0,0,1,0,1|1,0,0]=3 4359 B12R1.103 CC(C)CC(C)N1CCC(C1)O 2230a_100011215560_100000731052 [0,1,0,1,0,0|2,0,0]=4 4360 B12R1.103 CC(C)CC(C)N1CCC(C1)O 269982a_100011215560_100000731052 [0,1,0,1,0,0|2,0,0]=4 4361 B12R1.103 CC(O)CC(=O)C1CCC(C1)O 1458a_100000688591_100011218427 [0,1,0,1,0,0|1,0,1]=4 4362 B12R1.103 CC(O)CN(C)C1CCC(C1)O 270004a_100000227577_100012614533 [0,1,0,1,0,0|2,0,0]=4 4363 B12R1.103 C[C@@H](O)CC(=O)N1CCC(C1)O 240690a_100011215560_100011933948 [0,1,0,1,0,0|1,0,1]=4 4364 B12R1.142 CC(C)CC(C)OCC1CC1C 34a_100000744939_100000731052 [0,1,0,1,0,0|2,0,0]=4 4365 B12R1.142 CC(C)CC(C)OCC1CC1C 7a_100000744939_100000731052 [0,1,0,1,0,0|2,0,0]=4 4366 B12R1.1020 CC(O)CN1CCCC(CC1)O 2230a_100015186869_100011218427 [0,1,0,1,0,0|2,0,0]=4 4367 B12R1.1020 CC(O)CN1CCCC(CC1)O 269982a_100015186869_100011218427 [0,1,0,1,0,0|2,0,0]=4 4368 B12R1.1020 C[C@@H](O)CN1CCCC(CC1)O 2230a_100015186869_100009817552 [0,1,0,1,0,0|2,0,0]=4 4369 B12R1.1020 C[C@@H](O)CN1CCCC(CC1)O 269982a_100015186869_100009817552 [0,1,0,1,0,0|2,0,0]=4 4370 B12R1.1061 CC(C)CC(C)N[C@H]1C[C@@H](C1)O 2230a_100020629032_100000731052 [0,1,0,1,0,0|2,0,0]=4 4371 B12R1.1061 C[C@@H](O)CC(=O)N[C@H]1C[C@@H](C1)O 240690a_100020629032_100011933948 [0,1,0,1,0,0|1,0,1]=4 4372 B12R1.1359 CC(O)CCNC(C)CC1CC1 270004a_200000755665_200000686933 [0,1,0,1,0,0|2,0,0]=4 4373 B12R1.1377 CC(C)CC(C)NCCC1CO1 2230a_100000692259_100000732470 [0,1,0,1,0,0|2,0,0]=4 4374 B12R1.1377 CC(C)CC(C)OCCC1CC1 34a_100000211805_100000694398 [0,1,0,1,0,0|2,0,0]=4 4375 B12R1.1377 CC(C)CC(C)OCCC1CC1 34a_100000754188_100000731052 [0,1,0,1,0,0|2,0,0]=4 4376 B12R1.1377 CC(C)CC(C)OCCC1CC1 7a_100000211805_100000764125 [0,1,0,1,0,0|2,0,0]=4 4377 B12R1.1377 CC(C)CC(C)OCCC1CC1 7a_100000754188_100000731052 [0,1,0,1,0,0|2,0,0]=4 4378 B12R1.1377 CC(C)CC(C)OCCC1CO1 34a_100000211805_100000732470 [0,1,0,1,0,0|1,0,0]=3 4379 B12R1.1377 CC(C)CC(C)OCCC1CO1 7a_100000211805_100000732470 [0,1,0,1,0,0|1,0,0]=3 4380 B12R1.1377 CC(C)CC(C)OCC[C@@H]1CO1 34a_100009820653_100000731052 [0,1,0,1,0,0|1,0,0]=3 4381 B12R1.1377 CC(C)CC(C)SCCC1CO1 62a_100000731052_100000732470 [0,1,0,1,0,0|1,1,0]=4 4382 B12R1.1377 CC(C)CC(C)SCCC1CO1 62a_100000732470_100000731052 [0,1,0,1,0,0|1,1,0]=4 4383 B12R1.1377 CC(O)CN(C)CCCC1CO1 2230a_100000227577_100000733510 [0,1,0,1,0,0|2,0,0]=4 4384 B12R1.1377 CC(O)CN(C)CCCC1CO1 269982a_100000227577_100000733510 [0,1,0,1,0,0|2,0,0]=4 4385 B12R1.1377 C[C@@H](O)CC(=O)CCCC1CO1 1458a_100011933948_100000733510 [0,1,0,1,0,0|1,0,1]=4 4386 B12R1.1810 CC(Br)CCOC1CC(C1)(F)F 34a_100009893172_100010741680 [0,1,0,1,0,0|2,0,0]=4 4387 B12R1.1810 CC(C)CCN[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100000210312 [0,1,0,1,0,0|2,0,0]=4 4388 B12R1.1810 CC(C)CCN[C@H]1C[C@@](C1)(C)O 269862a_100121572536_100000185833 [0,1,0,1,0,0|2,0,0]=4 4389 B12R1.1810 CC(C)CCOC1CC(C1)(F)F 34a_100000144188_100000210312 [0,1,0,1,0,0|2,0,0]=4 4390 B12R1.1810 CC(C)CCOC1CC(C1)(F)F 34a_100000210254_100010741680 [0,1,0,1,0,0|2,0,0]=4 4391 B12R1.1810 CC(C)CCOC1CC(C1)(F)F 7a_100000210254_100010741680 [0,1,0,1,0,0|2,0,0]=4 4392 B12R1.1810 CC(O)CCCN1CC(C1)(C)O 2230a_100000718560_200000718107 [0,1,0,1,0,0|2,0,0]=4 4393 B12R1.1810 CC(O)CCCN1CC(C1)(C)O 269982a_100000718560_200000718107 [0,1,0,1,0,0|2,0,0]=4 4394 B12R1.1810 CC(O)CCNC1CC(C1)(F)F 2230a_100000756238_100012276601 [0,1,0,1,0,0|2,0,0]=4 4395 B12R1.1810 CC(O)CCNC1CC(C1)(F)F 270004a_200000755665_100000144187 [0,1,0,1,0,0|2,0,0]=4 4396 B12R1.1810 CC(O)CCN[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100012276601 [0,1,0,1,0,0|1,0,0]=3 4397 B12R1.1810 CC(O)CCOC1CC(C1)(F)F 34a_100000144188_100012276601 [0,1,0,1,0,0|1,0,0]=3 4398 B12R1.1810 CC(O)CCOC1CS(=O)(=O)C1 34a_100000072295_100012276601 [0,1,0,1,0,0|1,0,1]=4 4399 B12R1.1810 CC(O)CCOC1CS(=O)(=O)C1 7a_100000072295_100012276601 [0,1,0,1,0,0|1,0,1]=4 4400 B12R1.1810 CC(O)CCSC1CC(C1)(F)F 62a_100010741680_100012276601 [0,1,0,1,0,0|1,1,0]=4 4401 B12R1.1810 CC(O)CNC[C@H]1C[C@@](C1)(C)O 2230a_100015257651_100011218427 [0,1,0,1,0,0|2,0,0]=4 4402 B12R1.1810 C[C@@H](N)CCOC1CC(C1)(F)F 34a_100000706166_100010741680 [0,1,0,1,0,0|2,0,0]=4 4403 B12R1.1810 C[C@@H](O)CNC[C@H]1C[C@@](C1)(C)O 2230a_100015257651_100009817552 [0,1,0,1,0,0|2,0,0]=4 4404 B12R1.1821 CC(O)CN1CCCC(C1)(C)O 2230a_100000695535_100011218427 [0,1,0,1,0,0|2,0,0]=4 4405 B12R1.1821 CC(O)CN1CCCC(C1)(C)O 269982a_100000695535_100011218427 [0,1,0,1,0,0|2,0,0]=4 4406 B12R1.1821 C[C@@H](O)CN1CCCC(C1)(C)O 2230a_100000695535_100009817552 [0,1,0,1,0,0|2,0,0]=4 4407 B12R1.1821 C[C@@H](O)CN1CCCC(C1)(C)O 269982a_100000695535_100009817552 [0,1,0,1,0,0|2,0,0]=4 4408 B12R1.19 CC(O)CN1CCC(C(C1)O)C 2230a_100000696640_100011218427 [0,1,0,1,0,0|2,0,0]=4 4409 B12R1.19 CC(O)CN1CCC(C(C1)O)C 269982a_100000696640_100011218427 [0,1,0,1,0,0|2,0,0]=4 4410 B12R1.19 CC(O)CN1CC[C@H]([C@H](C1)O)O 2230a_100000690696_100011218427 [0,1,0,1,0,0|2,0,0]=4 4411 B12R1.19 CC(O)CN1CC[C@H]([C@H](C1)O)O 269982a_100000690696_100011218427 [0,1,0,1,0,0|2,0,0]=4 4412 B12R1.19 CC1CCN(CC1O)C[C@@H](C)O 2230a_100000696640_100009817552 [0,1,0,1,0,0|2,0,0]=4 4413 B12R1.19 CC1CCN(CC1O)C[C@@H](C)O 269982a_100000696640_100009817552 [0,1,0,1,0,0|2,0,0]=4 4414 B12R1.19 C[C@@H](O)CN1CC[C@H]([C@H](C1)O)O 2230a_100000690696_100009817552 [0,1,0,1,0,0|2,0,0]=4 4415 B12R1.19 C[C@@H](O)CN1CC[C@H]([C@H](C1)O)O 269982a_100000690696_100009817552 [0,1,0,1,0,0|2,0,0]=4 4416 B12R1.110 CC(C)CCN1C[C@@H]([C@H](C1)F)O 2230a_100020590056_100000210312 [0,1,0,1,0,0|2,0,0]=4 4417 B12R1.110 CC(C)CCN1C[C@@H]([C@H](C1)F)O 269982a_100020590056_100000210312 [0,1,0,1,0,0|2,0,0]=4 4418 B12R1.110 CC(C)CCN1C[C@H]([C@H](C1)O)C 2230a_200015306588_100000210312 [0,1,0,1,0,0|2,0,0]=4 4419 B12R1.110 CC(C)CCN1C[C@H]([C@H](C1)O)C 269982a_200015306588_100000210312 [0,1,0,1,0,0|2,0,0]=4 4420 B12R1.110 CC(C)CCN1C[C@H]([C@H](C1)O)O 2230a_100015207562_100000210312 [0,1,0,1,0,0|2,0,0]=4 4421 B12R1.110 CC(C)CCN1C[C@H]([C@H](C1)O)O 269982a_100015207562_100000210312 [0,1,0,1,0,0|2,0,0]=4 4422 B12R1.110 CC(O)CCN1C[C@@H]([C@H](C1)F)O 2230a_100020590056_100012276601 [0,1,0,1,0,0|1,0,0]=3 4423 B12R1.110 CC(O)CCN1C[C@@H]([C@H](C1)F)O 269982a_100020590056_100012276601 [0,1,0,1,0,0|1,0,0]=3 4424 B12R1.110 CC(O)CCN1C[C@H]([C@H](C1)F)F 269982a_100103146936_100012276601 [0,1,0,1,0,0|2,0,0]=4 4425 B12R1.110 CC(O)CCN1C[C@H]([C@H](C1)F)F 34a_100103146936_100012276601 [0,1,0,1,0,0|2,0,0]=4 4426 B12R1.110 CC(O)CCN1C[C@H]([C@H](C1)O)C 2230a_200015306588_100012276601 [0,1,0,1,0,0|1,0,0]=3 4427 B12R1.110 CC(O)CCN1C[C@H]([C@H](C1)O)C 269982a_200015306588_100012276601 [0,1,0,1,0,0|1,0,0]=3 4428 B12R1.110 CC(O)CCN1C[C@H]([C@H](C1)O)O 2230a_100015207562_100012276601 [0,1,0,1,0,0|1,0,0]=3 4429 B12R1.110 CC(O)CCN1C[C@H]([C@H](C1)O)O 269982a_100015207562_100012276601 [0,1,0,1,0,0|1,0,0]=3 4430 B12R1.1222 CC(O)CCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_200000718107 [0,1,0,1,0,0|2,0,0]=4 4431 B12R1.1222 CC(O)CCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_200000718107 [0,1,0,1,0,0|2,0,0]=4 4432 B12R1.1356 CC(C)CCOC[C@H](N)C1CC1 34a_100020623730_100000210312 [0,1,0,1,0,0|2,0,0]=4 4433 B12R1.1356 CC(O)CCNCC(O)C1CC1 2230a_100000751198_100012276601 [0,1,0,1,0,0|2,0,0]=4 4434 B12R1.1356 CC(O)CCNCC(O)C1CC1 34a_100000751198_100012276601 [0,1,0,1,0,0|2,0,0]=4 4435 B12R1.1356 CC(O)CCOCC(=O)C1CC1 34a_100000686663_100012276601 [0,1,0,1,0,0|1,0,1]=4 4436 B12R1.1356 CC(O)CCOC[C@H](N)C1CC1 34a_100020623730_100012276601 [0,1,0,1,0,0|1,0,0]=3 4437 B12R1.1397 CC(=O)C(C)COCCC1CO1 34a_100000032740_100000732470 [0,1,0,1,0,0|0,0,2]=4 4438 B12R1.1397 CC(=O)C(C)COCCC1CO1 7a_100000032740_100000732470 [0,1,0,1,0,0|0,0,2]=4 4439 B12R1.1397 CC(C)C(=O)COCC[C@@H]1CO1 34a_100009820653_100000753385 [0,1,0,1,0,0|1,0,1]=4 4440 B12R1.1397 CC(C)C(O)CNCCC1CO1 2230a_100000759067_100000732470 [0,1,0,1,0,0|2,0,0]=4 4441 B12R1.1397 CC(C)C(O)CNCCC1CO1 34a_100000759067_100000732470 [0,1,0,1,0,0|2,0,0]=4 4442 B12R1.1397 CC(C)[C@@H](N)COCCC1CC1 34a_100011830312_100000694398 [0,1,0,1,0,0|2,0,0]=4 4443 B12R1.1397 CC(C)[C@@H](N)COCCC1CO1 34a_100011830312_100000732470 [0,1,0,1,0,0|1,0,0]=3 4444 B12R1.146 CC1CC1COCCC(C)(C)C 34a_100000744939_100000755188 [0,1,0,1,0,0|2,0,0]=4 4445 B12R1.146 CC1CC1COCCC(C)(C)C 7a_100000744939_100000755188 [0,1,0,1,0,0|2,0,0]=4 4446 B12R1.146 CC1CC1COCCC(C)(C)O 34a_100000744939_100000702414 [0,1,0,1,0,0|1,0,0]=3 4447 B12R1.146 CC1CC1COCCC(C)(C)O 7a_100000744939_100000702414 [0,1,0,1,0,0|1,0,0]=3 4448 B12R1.219 CC(C)(C)CCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000755188 [0,1,0,1,0,0|2,0,0]=4 4449 B12R1.219 CC(C)(O)CCCN1CC(C1)O 269982a_100000749847_100009888830 [0,1,0,1,0,0|2,0,0]=4 4450 B12R1.219 CC(C)(O)CCNC1CC(C1)F 2230a_100016993743_100000702414 [0,1,0,1,0,0|2,0,0]=4 4451 B12R1.219 CC(C)(O)CCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000702414 [0,1,0,1,0,0|1,0,0]=3 4452 B12R1.547 CC(C)(C)CCNCCC1CO1 2230a_100000738805_100000732470 [0,1,0,1,0,0|2,0,0]=4 4453 B12R1.547 CC(C)(C)CCOCCC1CC1 34a_100000754188_100000755188 [0,1,0,1,0,0|2,0,0]=4 4454 B12R1.547 CC(C)(C)CCOCCC1CC1 7a_100000754188_100000755188 [0,1,0,1,0,0|2,0,0]=4 4455 B12R1.547 CC(C)(C)CCOCCC1CC1 7a_100000765024_100000764125 [0,1,0,1,0,0|2,0,0]=4 4456 B12R1.547 CC(C)(C)CCOCCC1CO1 7a_100000765024_100000732470 [0,1,0,1,0,0|1,0,0]=3 4457 B12R1.547 CC(C)(C)CCOCC[C@@H]1CO1 34a_100009820653_100000755188 [0,1,0,1,0,0|1,0,0]=3 4458 B12R1.547 CC(C)(C)CCSCCC1CO1 62a_100000732470_100000755188 [0,1,0,1,0,0|1,1,0]=4 4459 B12R1.547 CC(C)(C)CCSCCC1CO1 62a_100000755188_100000732470 [0,1,0,1,0,0|1,1,0]=4 4460 B12R1.547 CC(C)(F)CCNCCC1CO1 2230a_100016253952_100000732470 [0,1,0,1,0,0|2,0,0]=4 4461 B12R1.547 CC(C)(O)CCCOC[C@@H]1CO1 34a_100000757423_100009888830 [0,1,0,1,0,0|2,0,0]=4 4462 B12R1.547 CC(C)(O)CCCSCC1CO1 62a_100009888830_102125554688 [0,1,0,1,0,0|2,0,0]=4 4463 B12R1.547 CC(C)(O)CCCSCC1CO1 62a_102125554688_100009888830 [0,1,0,1,0,0|2,0,0]=4 4464 B12R1.547 CC(C)(O)CCCSC[C@@H]1CO1 62a_100000745022_100009888830 [0,1,0,1,0,0|2,0,0]=4 4465 B12R1.547 CC(C)(O)CCCSC[C@@H]1CO1 62a_100009888830_100000745022 [0,1,0,1,0,0|2,0,0]=4 4466 B12R1.547 CC(C)(O)CCNCCC1CC1 34a_100000764129_100000702414 [0,1,0,1,0,0|2,0,0]=4 4467 B12R1.547 CC(C)(O)CCOCCC1CC1 34a_100000754188_100000702414 [0,1,0,1,0,0|1,0,0]=3 4468 B12R1.547 CC(C)(O)CCOCCC1CC1 7a_100000754188_100000702414 [0,1,0,1,0,0|1,0,0]=3 4469 B12R1.547 CC(C)(O)CCOCC[C@@H]1CO1 34a_100009820653_100000702414 [0,1,0,1,0,0|0,0,0]=2 4470 B12R1.547 CC(C)(O)CCSCCC1CC1 62a_100000702414_100000764125 [0,1,0,1,0,0|1,1,0]=4 4471 B12R1.547 CC(C)(O)CCSCCC1CC1 62a_100000764125_100000702414 [0,1,0,1,0,0|1,1,0]=4 4472 B12R1.547 CC(C)(O)CCSCCC1CO1 62a_100000702414_100000732470 [0,1,0,1,0,0|0,1,0]=3 4473 B12R1.547 CC(C)(O)CCSCCC1CO1 62a_100000732470_100000702414 [0,1,0,1,0,0|0,1,0]=3 4474 B12R1.547 CC(C)(O)CNCCCC1CO1 2230a_100000751335_100000733510 [0,1,0,1,0,0|2,0,0]=4 4475 B12R1.547 CC(C)(O)CSCCCC1CO1 62a_100000733510_100000764493 [0,1,0,1,0,0|2,0,0]=4 4476 B12R1.547 CC(C)(O)CSCCCC1CO1 62a_100000764493_100000733510 [0,1,0,1,0,0|2,0,0]=4 4477 B12R1.547 CS(=O)(=O)CCOCCC1CO1 34a_100000211924_100000732470 [0,1,0,1,0,0|1,0,1]=4 4478 B12R1.547 CS(=O)(=O)CCOCCC1CO1 7a_100000211924_100000732470 [0,1,0,1,0,0|1,0,1]=4 4479 B12R1.547 CS(=O)(=O)CCOCC[C@@H]1CO1 34a_100009820653_100000731031 [0,1,0,1,0,0|1,0,1]=4 4480 B12R1.547 C[N+](C)(C)CCOCCC1CO1 7a_200020618287_100000732470 [0,1,0,1,0,0|2,0,0]=4 4481 B12R1.547 C[N+](C)(C)CCOCC[C@@H]1CO1 34a_100009820653_100000085578 [0,1,0,1,0,0|2,0,0]=4 4482 B12R1.547 C[Si](C)(C)CCOCCC1CO1 7a_100000039746_100000732470 [0,1,0,1,0,0|1,1,0]=4 4483 B12R1.547 C[Si](C)(C)CCOCC[C@@H]1CO1 34a_100009820653_200000733723 [0,1,0,1,0,0|1,1,0]=4 4484 B12R1.547 FC(F)(F)CCOCCC1CO1 34a_100000752437_100000732470 [0,1,0,1,0,0|2,0,0]=4 4485 B12R1.547 FC(F)(F)CCOCC[C@@H]1CO1 34a_100009820653_100011219754 [0,1,0,1,0,0|2,0,0]=4 4486 B12R1.836 CC(C)(C)CCN1CCC(C1)O 2230a_100011215560_100000755188 [0,1,0,1,0,0|2,0,0]=4 4487 B12R1.836 CC(C)(C)CCN1CCC(C1)O 269982a_100011215560_100000755188 [0,1,0,1,0,0|2,0,0]=4 4488 B12R1.836 CC(C)(O)CCN1CCC(C1)O 2230a_100011215560_100000702414 [0,1,0,1,0,0|1,0,0]=3 4489 B12R1.836 CC(C)(O)CCN1CC[C@@H](C1)F 2230a_100015203821_100000702414 [0,1,0,1,0,0|2,0,0]=4 4490 B12R1.836 CC(C)(O)CCN1CC[C@@H](C1)F 34a_100015203821_100000702414 [0,1,0,1,0,0|2,0,0]=4 4491 B12R1.836 CC(C)(O)CNC1CCC(C1)O 270004a_100000751335_100012614533 [0,1,0,1,0,0|2,0,0]=4 4492 B12R1.836 C[C@@H]1CCN(C1)CCC(C)(C)O 2230a_100016987628_100000702414 [0,1,0,1,0,0|2,0,0]=4 4493 B12R1.836 C[C@@H]1CCN(C1)CCC(C)(C)O 34a_100016987628_100000702414 [0,1,0,1,0,0|2,0,0]=4 4494 B12R1.1361 CC(C)CCOCCC1(N=N1)C 34a_100009880064_100000210312 [0,1,0,1,0,0|2,0,0]=4 4495 B12R1.1361 CC(O)CCCNCC1(CC1)O 2230a_100011936951_200000718107 [0,1,0,1,0,0|2,0,0]=4 4496 B12R1.1361 CC(O)CCCSCC1(CO1)C 62a_100000760498_200000718107 [0,1,0,1,0,0|2,0,0]=4 4497 B12R1.1361 CC(O)CCCSCC1(CO1)C 62a_200000718107_100000760498 [0,1,0,1,0,0|2,0,0]=4 4498 B12R1.1361 CC(O)CCOCCC1(N=N1)C 34a_100009880064_100012276601 [0,1,0,1,0,0|1,0,0]=3 4499 B12R1.1806 CC(C)CCN1CCC(C1)(C)O 2230a_100000718628_100000210312 [0,1,0,1,0,0|2,0,0]=4 4500 B12R1.1806 CC(C)CCN1CCC(C1)(C)O 269982a_100000718628_100000210312 [0,1,0,1,0,0|2,0,0]=4 4501 B12R1.1806 CC(O)CCN1CCC(C1)(C)C 2230a_100000764714_100012276601 [0,1,0,1,0,0|2,0,0]=4 4502 B12R1.1806 CC(O)CCN1CCC(C1)(C)C 269982a_100000764714_100012276601 [0,1,0,1,0,0|2,0,0]=4 4503 B12R1.1806 CC(O)CCN1CCC(C1)(C)O 2230a_100000718628_100012276601 [0,1,0,1,0,0|1,0,0]=3 4504 B12R1.1806 CC(O)CCN1CCC(C1)(C)O 269982a_100000718628_100012276601 [0,1,0,1,0,0|1,0,0]=3 4505 B12R1.1806 CC(O)CCN1CCC(C1)(F)F 2230a_100000697292_100012276601 [0,1,0,1,0,0|2,0,0]=4 4506 B12R1.1806 CC(O)CCN1CCC(C1)(F)F 269982a_100000697292_100012276601 [0,1,0,1,0,0|2,0,0]=4 4507 B12R1.1806 CC(O)CCN1CCC(C1)(F)F 34a_100000697292_100012276601 [0,1,0,1,0,0|2,0,0]=4 4508 B12R1.21 CC(C)CCN1CCC(CC1)O 2230a_100025773856_100000210312 [0,1,0,1,0,0|2,0,0]=4 4509 B12R1.21 CC(C)CCN1CCC(CC1)O 269982a_100025773856_100000210312 [0,1,0,1,0,0|2,0,0]=4 4510 B12R1.21 CC(O)CCN1CCC(CC1)C 2230a_100000188429_100012276601 [0,1,0,1,0,0|2,0,0]=4 4511 B12R1.21 CC(O)CCN1CCC(CC1)C 269982a_100000188429_100012276601 [0,1,0,1,0,0|2,0,0]=4 4512 B12R1.21 CC(O)CCN1CCC(CC1)C 34a_100000188429_100012276601 [0,1,0,1,0,0|2,0,0]=4 4513 B12R1.21 CC(O)CCN1CCC(CC1)F 2230a_100015193889_100012276601 [0,1,0,1,0,0|2,0,0]=4 4514 B12R1.21 CC(O)CCN1CCC(CC1)F 269982a_100015193889_100012276601 [0,1,0,1,0,0|2,0,0]=4 4515 B12R1.21 CC(O)CCN1CCC(CC1)F 34a_100015193889_100012276601 [0,1,0,1,0,0|2,0,0]=4 4516 B12R1.21 CC(O)CCN1CCC(CC1)O 2230a_100025773856_100012276601 [0,1,0,1,0,0|1,0,0]=3 4517 B12R1.21 CC(O)CCN1CCC(CC1)O 269982a_100025773856_100012276601 [0,1,0,1,0,0|1,0,0]=3 4518 B12R1.21 CC(O)CNC1CCC(CC1)O 270004a_100000210904_100000764474 [0,1,0,1,0,0|2,0,0]=4 4519 B12R1.221 CC(C)CCC(=O)[C@H]1C[C@H](C1)O 1458a_100015266633_100000210312 [0,1,0,1,0,0|2,0,0]=4 4520 B12R1.221 CC(O)CCC(=O)C1CC(C1)C 1458a_100000686124_100012276601 [0,1,0,1,0,0|2,0,0]=4 4521 B12R1.221 CC(O)CCC(=O)C1CC(C1)F 1458a_100000062598_100012276601 [0,1,0,1,0,0|2,0,0]=4 4522 B12R1.221 CC(O)CCC(=O)[C@H]1C[C@H](C1)O 1458a_100015266633_100012276601 [0,1,0,1,0,0|1,0,0]=3 4523 B12R1.221 CC(O)CNC(=O)[C@H]1C[C@H](C1)O 240690a_100000210904_100015266633 [0,1,0,1,0,0|2,0,0]=4 4524 B12R1.221 CC(O)CNC(=O)[C@H]1C[C@H](C1)O 527a_100000210904_100015266633 [0,1,0,1,0,0|2,0,0]=4 4525 B12R1.552 CC(C)CCC(=O)CCC1CO1 1458a_100000181311_100000732470 [0,1,0,1,0,0|2,0,0]=4 4526 B12R1.552 CC(C)CCN(C)CCC1CO1 2230a_100000742789_100000732470 [0,1,0,1,0,0|2,0,0]=4 4527 B12R1.552 CC(C)CCN(C)CCC1CO1 269982a_100000742789_100000732470 [0,1,0,1,0,0|2,0,0]=4 4528 B12R1.552 CC(O)CCC(=O)CCC1CC1 1458a_100000756386_100012276601 [0,1,0,1,0,0|2,0,0]=4 4529 B12R1.2242 CC(O)CCC(=O)[C@H]1CC1(C)C 1458a_100000692687_100012276601 [0,1,0,1,0,0|2,0,0]=4 4530 B12R1.26 CCC(O)CNC1CCC(C1)O 270004a_100011218483_100012614533 [0,1,0,1,0,0|2,0,0]=4 4531 B12R1.26 CCC(O)CN[C@H]1CC[C@H](C1)O 2230a_100015195300_100011218378 [0,1,0,1,0,0|2,0,0]=4 4532 B12R1.26 CO[C@H](C)CNC1CCC(C1)O 270004a_100020591295_100012614533 [0,1,0,1,0,0|2,0,0]=4 4533 B12R1.26 C[C@@H](CO)CN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000059175 [0,1,0,1,0,0|2,0,0]=4 4534 B12R1.26 OCC(O)CN[C@H]1CC[C@H](C1)O 2230a_100015195300_100011219619 [0,1,0,1,0,0|2,0,0]=4 4535 B12R1.26 OC[C@H](O)CN[C@H]1CC[C@H](C1)O 2230a_100015195300_100009815848 [0,1,0,1,0,0|2,0,0]=4 4536 B12R1.26 O[C@@H]1CC[C@@H](C1)NC[C@@H](O)CF 2230a_100015195300_100015614560 [0,1,0,1,0,0|2,0,0]=4 4537 B12R1.50 CC(CO)NC1CCCC(C1)O 2230a_100015190357_100012180447 [0,1,0,1,0,0|2,0,0]=4 4538 B12R1.50 CCC(O)CN1CCCC(C1)O 2230a_100000211013_100011218378 [0,1,0,1,0,0|2,0,0]=4 4539 B12R1.50 CCC(O)CN1CCCC(C1)O 269982a_100000211013_100011218378 [0,1,0,1,0,0|2,0,0]=4 4540 B12R1.50 C[C@@H](CO)CN1CCCC(C1)O 2230a_100000211013_100000059175 [0,1,0,1,0,0|2,0,0]=4 4541 B12R1.50 C[C@@H](CO)CN1CCCC(C1)O 269982a_100000211013_100000059175 [0,1,0,1,0,0|2,0,0]=4 4542 B12R1.50 C[C@H](CO)NC1CCCC(C1)O 270004a_100000737577_100012613340 [0,1,0,1,0,0|2,0,0]=4 4543 B12R1.50 OC1CCCN(C1)C[C@@H](O)CF 2230a_100000211013_100015614560 [0,1,0,1,0,0|2,0,0]=4 4544 B12R1.50 OCC(O)CN1CCCC(C1)O 2230a_100000211013_100011219619 [0,1,0,1,0,0|2,0,0]=4 4545 B12R1.50 OC[C@H](O)CN1CCCC(C1)O 2230a_100000211013_100009815848 [0,1,0,1,0,0|2,0,0]=4 4546 B12R1.59 CC(C)CCN1CCC(C1)CO 2230a_100000748654_100000210312 [0,1,0,1,0,0|2,0,0]=4 4547 B12R1.59 CC(C)CCN1CCC(C1)CO 269982a_100000748654_100000210312 [0,1,0,1,0,0|2,0,0]=4 4548 B12R1.59 CC(C)CCN1CCC(C1)CO 34a_100000748654_100000210312 [0,1,0,1,0,0|2,0,0]=4 4549 B12R1.59 CC(O)CCN1CCC(C1)C#N 2230a_100016989334_100012276601 [0,1,0,1,0,0|2,0,0]=4 4550 B12R1.59 CC(O)CCN1CCC(C1)CO 2230a_100000748654_100012276601 [0,1,0,1,0,0|1,0,0]=3 4551 B12R1.59 CC(O)CCN1CCC(C1)CO 269982a_100000748654_100012276601 [0,1,0,1,0,0|1,0,0]=3 4552 B12R1.59 CC(O)CCN1CCC(C1)CO 34a_100000748654_100012276601 [0,1,0,1,0,0|1,0,0]=3 4553 B12R1.59 CO[C@@H]1CCN(C1)CCC(C)C 2230a_100000766984_100000210312 [0,1,0,1,0,0|2,0,0]=4 4554 B12R1.59 CO[C@@H]1CCN(C1)CCC(C)C 269982a_100000766984_100000210312 [0,1,0,1,0,0|2,0,0]=4 4555 B12R1.59 CO[C@@H]1CCN(C1)CCC(C)O 2230a_100000766984_100012276601 [0,1,0,1,0,0|1,0,0]=3 4556 B12R1.59 CO[C@@H]1CCN(C1)CCC(C)O 269982a_100000766984_100012276601 [0,1,0,1,0,0|1,0,0]=3 4557 B12R1.257 C=C(C)CCOCCC1COC1 34a_100009855314_100000730704 [0,1,0,1,0,0|1,0,1]=4 4558 B12R1.257 CC(C)CCOCCC1COC1 34a_100009855314_100000210312 [0,1,0,1,0,0|1,0,0]=3 4559 B12R1.257 CC(C)OCOCCC1COC1 34a_100009855314_100000709892 [0,1,0,1,0,0|2,0,0]=4 4560 B12R1.257 CC(O)CCCNCC1COC1 2230a_100015281925_200000718107 [0,1,0,1,0,0|2,0,0]=4 4561 B12R1.257 CC(O)CCCNCC1COC1 34a_100015281925_200000718107 [0,1,0,1,0,0|2,0,0]=4 4562 B12R1.257 CC(O)CCCNC[C@@H]1CCO1 2230a_100020831831_200000718107 [0,1,0,1,0,0|2,0,0]=4 4563 B12R1.257 CC(O)CCCNC[C@@H]1CCO1 34a_100020831831_200000718107 [0,1,0,1,0,0|2,0,0]=4 4564 B12R1.257 CC(O)CCCOCC1CCO1 34a_100000039022_200000718107 [0,1,0,1,0,0|2,0,0]=4 4565 B12R1.257 CC(O)CCCOCC1COC1 34a_100000060846_200000718107 [0,1,0,1,0,0|2,0,0]=4 4566 B12R1.257 CC(O)CCCSCC1CCO1 62a_100000103362_200000718107 [0,1,0,1,0,0|2,0,0]=4 4567 B12R1.257 CC(O)CCCSCC1CCO1 62a_200000718107_100000103362 [0,1,0,1,0,0|2,0,0]=4 4568 B12R1.257 CC(O)CCCSCC1COC1 62a_100010264016_200000718107 [0,1,0,1,0,0|2,0,0]=4 4569 B12R1.257 CC(O)CCCSCC1COC1 62a_200000718107_100010264016 [0,1,0,1,0,0|2,0,0]=4 4570 B12R1.257 CC(O)CCOCCC1COC1 34a_100009855314_100012276601 [0,1,0,1,0,0|0,0,0]=2 4571 B12R1.360 CC(CO)CCNCCC1CC1 2230a_106354213184_100000694398 [0,1,0,1,0,0|2,0,0]=4 4572 B12R1.360 CC(CO)CCNCCC1CC1 34a_106354213184_100000694398 [0,1,0,1,0,0|2,0,0]=4 4573 B12R1.360 CC(CO)CCNCCC1CO1 2230a_106354213184_100000732470 [0,1,0,1,0,0|1,0,0]=3 4574 B12R1.360 CC(CO)CCNCCC1CO1 34a_106354213184_100000732470 [0,1,0,1,0,0|1,0,0]=3 4575 B12R1.360 CC(CO)CNCCCC1CO1 34a_100000744482_100000733510 [0,1,0,1,0,0|2,0,0]=4 4576 B12R1.360 CCC(C)CCNCCC1CO1 2230a_100020591266_100000732470 [0,1,0,1,0,0|2,0,0]=4 4577 B12R1.360 CCC(C)CCOCCC1CC1 7a_100011215188_100000764125 [0,1,0,1,0,0|2,0,0]=4 4578 B12R1.360 CCC(C)CCOCCC1CO1 7a_100011215188_100000732470 [0,1,0,1,0,0|1,0,0]=3 4579 B12R1.360 CCC(O)CNCCCC1CO1 2230a_100011218483_100000733510 [0,1,0,1,0,0|2,0,0]=4 4580 B12R1.360 CCC(O)CSCCCC1CO1 62a_100000733510_100011218378 [0,1,0,1,0,0|2,0,0]=4 4581 B12R1.360 CCC(O)CSCCCC1CO1 62a_100011218378_100000733510 [0,1,0,1,0,0|2,0,0]=4 4582 B12R1.360 CNC(=O)CCOCCC1CO1 34a_100000754576_100000732470 [0,1,0,1,0,0|0,0,2]=4 4583 B12R1.360 CNC(=O)CCOCC[C@@H]1CO1 34a_100009820653_100012179268 [0,1,0,1,0,0|0,0,2]=4 4584 B12R1.360 COC(=O)CCOCC[C@@H]1CO1 34a_100009820653_100000742370 [0,1,0,1,0,0|0,0,2]=4 4585 B12R1.360 COC(C)CCOCCC1CC1 7a_100000764861_100000764125 [0,1,0,1,0,0|1,0,0]=3 4586 B12R1.360 COC(C)CCOCCC1CO1 7a_100000764861_100000732470 [0,1,0,1,0,0|0,0,0]=2 4587 B12R1.360 COC(C)COCCCC1CO1 34a_100000690652_100000733510 [0,1,0,1,0,0|2,0,0]=4 4588 B12R1.360 CO[C@H](C)CNCCCC1CO1 2230a_100020591295_100000733510 [0,1,0,1,0,0|2,0,0]=4 4589 B12R1.360 C[C@@H](CO)CSCCCC1CO1 62a_100000059175_100000733510 [0,1,0,1,0,0|2,0,0]=4 4590 B12R1.360 C[C@@H](CO)CSCCCC1CO1 62a_100000733510_100000059175 [0,1,0,1,0,0|2,0,0]=4 4591 B12R1.360 NC(=NO)CCOCCC1CO1 34a_100000749954_100000732470 [0,1,0,1,0,0|1,0,1]=4 4592 B12R1.360 OCC(O)CSCCCC1CO1 62a_100000733510_100011219619 [0,1,0,1,0,0|2,0,0]=4 4593 B12R1.360 OCC(O)CSCCCC1CO1 62a_100011219619_100000733510 [0,1,0,1,0,0|2,0,0]=4 4594 B12R1.360 OC[C@@H](O)CNCCCC1CO1 2230a_100020644852_100000733510 [0,1,0,1,0,0|2,0,0]=4 4595 B12R1.360 OC[C@H](O)CSCCCC1CO1 62a_100000733510_100009815848 [0,1,0,1,0,0|2,0,0]=4 4596 B12R1.360 OC[C@H](O)CSCCCC1CO1 62a_100009815848_100000733510 [0,1,0,1,0,0|2,0,0]=4 4597 B12R1.360 O[C@@H](CF)CSCCCC1CO1 62a_100000733510_100015614560 [0,1,0,1,0,0|2,0,0]=4 4598 B12R1.360 O[C@@H](CF)CSCCCC1CO1 62a_100015614560_100000733510 [0,1,0,1,0,0|2,0,0]=4 4599 B12R1.394 CCC(O)CNCC1CC(C1)O 2230a_100016992100_100011218378 [0,1,0,1,0,0|2,0,0]=4 4600 B12R1.394 C[C@@H](CO)CNCC1CC(C1)O 2230a_100016992100_100000059175 [0,1,0,1,0,0|2,0,0]=4 4601 B12R1.394 OC1CC(C1)CNC[C@@H](O)CF 2230a_100016992100_100015614560 [0,1,0,1,0,0|2,0,0]=4 4602 B12R1.394 OCC(O)CNCC1CC(C1)O 2230a_100016992100_100011219619 [0,1,0,1,0,0|2,0,0]=4 4603 B12R1.394 OC[C@H](O)CNCC1CC(C1)O 2230a_100016992100_100009815848 [0,1,0,1,0,0|2,0,0]=4 4604 B12R1.430 CC(C)CCNC1CC(C1)CO 269862a_100000095622_100000185833 [0,1,0,1,0,0|2,0,0]=4 4605 B12R1.430 CC(C)CCNC1CC(C1)CO 270004a_100000210545_100000101936 [0,1,0,1,0,0|2,0,0]=4 4606 B12R1.430 CC(C)CCSC1CC(C1)CO 62a_100000210312_100009874164 [0,1,0,1,0,0|1,1,0]=4 4607 B12R1.430 CC(C)CCSC1CC(C1)CO 62a_100009874164_100000210312 [0,1,0,1,0,0|1,1,0]=4 4608 B12R1.430 CC(O)CCCN1CC(C1)CO 269982a_100016987283_200000718107 [0,1,0,1,0,0|2,0,0]=4 4609 B12R1.430 CC(O)CCCN1CC(C1)CO 34a_100016987283_200000718107 [0,1,0,1,0,0|2,0,0]=4 4610 B12R1.430 CC(O)CCNC1CC(C1)C#N 270004a_200000755665_100000077199 [0,1,0,1,0,0|2,0,0]=4 4611 B12R1.430 CC(O)CCNC1CC(C1)CO 270004a_200000755665_100000101936 [0,1,0,1,0,0|1,0,0]=3 4612 B12R1.430 CC(O)CCSC1CC(C1)CO 62a_100009874164_100012276601 [0,1,0,1,0,0|0,1,0]=3 4613 B12R1.430 CC(O)CCSC1CC(C1)CO 62a_100012276601_100009874164 [0,1,0,1,0,0|0,1,0]=3 4614 B12R1.430 COC1CN(C1)CCCC(C)O 269982a_100000755009_200000718107 [0,1,0,1,0,0|2,0,0]=4 4615 B12R1.430 CO[C@H]1C[C@@H](C1)NCCC(C)C 2230a_100121570643_100000210312 [0,1,0,1,0,0|2,0,0]=4 4616 B12R1.430 CO[C@H]1C[C@@H](C1)NCCC(C)C 269862a_100121570643_100000185833 [0,1,0,1,0,0|2,0,0]=4 4617 B12R1.430 CO[C@H]1C[C@@H](C1)NCCC(C)O 2230a_100121570643_100012276601 [0,1,0,1,0,0|1,0,0]=3 4618 B12R1.438 CC(O)CN1CCCC(C1)CO 2230a_100000211344_100011218427 [0,1,0,1,0,0|2,0,0]=4 4619 B12R1.438 CC(O)CN1CCCC(C1)CO 269982a_100000211344_100011218427 [0,1,0,1,0,0|2,0,0]=4 4620 B12R1.438 CC(O)CN1CCCC(C1)CO 34a_100000211344_100011218427 [0,1,0,1,0,0|2,0,0]=4 4621 B12R1.438 COC1CCCN(C1)CC(C)O 2230a_100000695604_100011218427 [0,1,0,1,0,0|2,0,0]=4 4622 B12R1.438 COC1CCCN(C1)CC(C)O 269982a_100000695604_100011218427 [0,1,0,1,0,0|2,0,0]=4 4623 B12R1.438 COC1CCCN(C1)CC(C)O 34a_100000695604_100011218427 [0,1,0,1,0,0|2,0,0]=4 4624 B12R1.438 COC1CCCN(C1)C[C@@H](C)O 2230a_100000695604_100009817552 [0,1,0,1,0,0|2,0,0]=4 4625 B12R1.438 COC1CCCN(C1)C[C@@H](C)O 269982a_100000695604_100009817552 [0,1,0,1,0,0|2,0,0]=4 4626 B12R1.438 COC1CCCN(C1)C[C@@H](C)O 34a_100000695604_100009817552 [0,1,0,1,0,0|2,0,0]=4 4627 B12R1.438 C[C@@H](O)CN1CCCC(C1)CO 2230a_100000211344_100009817552 [0,1,0,1,0,0|2,0,0]=4 4628 B12R1.438 C[C@@H](O)CN1CCCC(C1)CO 269982a_100000211344_100009817552 [0,1,0,1,0,0|2,0,0]=4 4629 B12R1.438 C[C@@H](O)CN1CCCC(C1)CO 34a_100000211344_100009817552 [0,1,0,1,0,0|2,0,0]=4 4630 B12R1.534 CC(CO)N[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100012180447 [0,1,0,1,0,0|2,0,0]=4 4631 B12R1.534 CC(CO)N[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100012180447 [0,1,0,1,0,0|2,0,0]=4 4632 B12R1.679 CC(O)CN1CCC[C@@]1(C)CO 2230a_100016195882_100011218427 [0,1,0,1,0,0|2,0,0]=4 4633 B12R1.679 CC(O)CN1CCC[C@@]1(C)CO 269982a_100016195882_100011218427 [0,1,0,1,0,0|2,0,0]=4 4634 B12R1.679 CC(O)CN1CCC[C@@]1(C)CO 34a_100016195882_100011218427 [0,1,0,1,0,0|2,0,0]=4 4635 B12R1.679 C[C@@H](O)CN1CCC[C@@]1(C)CO 2230a_100016195882_100009817552 [0,1,0,1,0,0|2,0,0]=4 4636 B12R1.679 C[C@@H](O)CN1CCC[C@@]1(C)CO 269982a_100016195882_100009817552 [0,1,0,1,0,0|2,0,0]=4 4637 B12R1.679 C[C@@H](O)CN1CCC[C@@]1(C)CO 34a_100016195882_100009817552 [0,1,0,1,0,0|2,0,0]=4 4638 B12R1.1657 CC(CO)N1CCCCC(C1)O 2230a_100025706797_100012180447 [0,1,0,1,0,0|2,0,0]=4 4639 B12R1.1657 COC(C)N1CCCCC(C1)O 269982a_100025706797_100009879195 [0,1,0,1,0,0|2,0,0]=4 4640 B12R1.1657 C[C@H](CO)N1CCCCC(C1)O 269982a_100025706797_100016084084 [0,1,0,1,0,0|2,0,0]=4 4641 B12R2.1381 CC(O)CCN1CC2CC2C1 2230a_100000741873_100012276601 [0,0,0,2,0,0|2,0,0]=4 4642 B12R2.1381 CC(O)CCN1CC2CC2C1 269982a_100000741873_100012276601 [0,0,0,2,0,0|2,0,0]=4 4643 B12R2.1381 CC(O)CCN1CC2CC2C1 34a_100000741873_100012276601 [0,0,0,2,0,0|2,0,0]=4 4644 B12R2.2298 C[C@@H]1CCN(C1)CCC2CO2 2230a_100016987628_100000732470 [0,0,0,2,0,0|2,0,0]=4 4645 B12R2.2298 C[C@@H]1CCN(C1)CCC2CO2 269982a_100016987628_100000732470 [0,0,0,2,0,0|2,0,0]=4 4646 B12R2.2298 C[C@@H]1CCN(C1)CCC2CO2 34a_100016987628_100000732470 [0,0,0,2,0,0|2,0,0]=4 4647 B12R2.2298 F[C@H]1CCN(C1)CCC2CO2 2230a_100015203821_100000732470 [0,0,0,2,0,0|2,0,0]=4 4648 B12R2.2298 F[C@H]1CCN(C1)CCC2CO2 269982a_100015203821_100000732470 [0,0,0,2,0,0|2,0,0]=4 4649 B12R2.2298 F[C@H]1CCN(C1)CCC2CO2 34a_100015203821_100000732470 [0,0,0,2,0,0|2,0,0]=4 4650 B12R2.2298 OC1CCN(C1)CCC2CC2 2230a_100011215560_100000694398 [0,0,0,2,0,0|2,0,0]=4 4651 B12R2.2298 OC1CCN(C1)CCC2CC2 269982a_100011215560_100000694398 [0,0,0,2,0,0|2,0,0]=4 4652 B12R2.2298 OC1CCN(C1)CCC2CO2 2230a_100011215560_100000732470 [0,0,0,2,0,0|1,0,0]=3 4653 B12R2.2298 OC1CCN(C1)CCC2CO2 269982a_100011215560_100000732470 [0,0,0,2,0,0|1,0,0]=3 4654 B12R2.2298 O[C@@H]1CC[C@@H](C1)NCC2CO2 2230a_100015195300_100011216344 [0,0,0,2,0,0|2,0,0]=4 4655 B12R2.423 CC1CC1COCCC2CC2 34a_100000744939_100000694398 [0,0,0,2,0,0|2,0,0]=4 4656 B12R2.423 CC1CC1COCCC2CC2 7a_100000744939_100000764125 [0,0,0,2,0,0|2,0,0]=4 4657 B12R2.423 CC1CC1COCCC2CO2 34a_100000744939_100000732470 [0,0,0,2,0,0|1,0,0]=3 4658 B12R2.423 CC1CC1COCCC2CO2 7a_100000744939_100000732470 [0,0,0,2,0,0|1,0,0]=3 4659 B12R2.667 FC1CC(C1)NCCC2CO2 2230a_100016993743_100000732470 [0,0,0,2,0,0|2,0,0]=4 4660 B12R2.667 OC1CC(C1)CNCC2CO2 2230a_100016992100_100011216344 [0,0,0,2,0,0|2,0,0]=4 4661 B12R2.667 OC1CN(C1)CCCC2CO2 269982a_100000749847_100000733510 [0,0,0,2,0,0|2,0,0]=4 4662 B12R2.667 O[C@H]1C[C@@H](C1)NCCC2CC2 2230a_100020629032_100000694398 [0,0,0,2,0,0|2,0,0]=4 4663 B12R2.667 O[C@H]1C[C@@H](C1)NCCC2CO2 2230a_100020629032_100000732470 [0,0,0,2,0,0|1,0,0]=3 4664 B12R2.1286 OC1CCCN(C1)CC2CO2 2230a_100000211013_100011216344 [0,0,0,2,0,0|2,0,0]=4 4665 B12R2.1286 OC1CCCN(C1)CC2CO2 269982a_100000211013_102125554688 [0,0,0,2,0,0|2,0,0]=4 4666 B12R2.1286 OC1CCCN(C1)C[C@@H]2CO2 269982a_100000211013_100000745022 [0,0,0,2,0,0|2,0,0]=4 4667 B12R2.2014 C(CC1CC1)NCCC2CO2 34a_100000764129_100000732470 [0,0,0,2,0,0|2,0,0]=4 4668 B12R2.2014 C(CC1CC1)OCCC2CC2 34a_100000754188_100000694398 [0,0,0,2,0,0|2,0,0]=4 4669 B12R2.2014 C(CC1CC1)OCCC2CC2 7a_100000754188_100000764125 [0,0,0,2,0,0|2,0,0]=4 4670 B12R2.2014 C(CC1CC1)OCCC2CO2 34a_100000754188_100000732470 [0,0,0,2,0,0|1,0,0]=3 4671 B12R2.2014 C(CC1CC1)OCCC2CO2 7a_100000754188_100000732470 [0,0,0,2,0,0|1,0,0]=3 4672 B12R2.2014 C(CC1CC1)OCC[C@@H]2CO2 34a_100009820653_100000694398 [0,0,0,2,0,0|1,0,0]=3 4673 B12R2.2014 C(CC1CC1)SCCC2CO2 62a_100000732470_100000764125 [0,0,0,2,0,0|1,1,0]=4 4674 B12R2.2014 C(CC1CC1)SCCC2CO2 62a_100000764125_100000732470 [0,0,0,2,0,0|1,1,0]=4 4675 B12R2.2014 C(CC1CO1)OCC[C@@H]2CO2 34a_100009820653_100000732470 [0,0,0,2,0,0|0,0,0]=2 4676 B12R2.2014 C(CC1CO1)SCCC2CO2 62a_100000732470_100000732470 [0,0,0,2,0,0|0,1,0]=3 4677 B12R2.2014 C(COC[C@@H]1CO1)CC2CO2 34a_100000757423_100000733510 [0,0,0,2,0,0|2,0,0]=4 4678 B12R2.2014 C(CSCC1CO1)CC2CO2 62a_100000733510_102125554688 [0,0,0,2,0,0|2,0,0]=4 4679 B12R2.2014 C(CSCC1CO1)CC2CO2 62a_102125554688_100000733510 [0,0,0,2,0,0|2,0,0]=4 4680 B12R2.2014 C(CSC[C@@H]1CO1)CC2CO2 62a_100000733510_100000745022 [0,0,0,2,0,0|2,0,0]=4 4681 B12R2.2014 C(CSC[C@@H]1CO1)CC2CO2 62a_100000745022_100000733510 [0,0,0,2,0,0|2,0,0]=4 4682 B8R0.28 C=C(C)COCC(C)O 34a_100000210245_100011218427 [0,0,0,0,2,0|1,0,1]=4 4683 B8R0.28 C=C(C)COC[C@@H](C)O 34a_100000210245_100009817552 [0,0,0,0,2,0|1,0,1]=4 4684 B8R0.28 CC(=O)CCCC(C)O 1458a_100000070787_200000718107 [0,0,0,0,2,0|0,0,2]=4 4685 B8R0.28 CC(=O)COCC(C)O 34a_100000211253_100011218427 [0,0,0,0,2,0|0,0,2]=4 4686 B8R0.28 CC(=O)COC[C@@H](C)O 34a_100000211253_100009817552 [0,0,0,0,2,0|0,0,2]=4 4687 B8R0.28 CC(Br)CCOC(C)C 34a_100009893172_100000210206 [0,0,0,0,2,0|2,0,0]=4 4688 B8R0.28 CC(Br)COC[C@@H](C)O 34a_100012180447_100009817552 [0,0,0,0,2,0|1,0,0]=3 4689 B8R0.28 CC(C)CCOC(C)C 34a_100000210254_100000210206 [0,0,0,0,2,0|2,0,0]=4 4690 B8R0.28 CC(C)CCOC(C)C 34a_100000212225_100000210312 [0,0,0,0,2,0|2,0,0]=4 4691 B8R0.28 CC(C)CCOC(C)C 7a_100000210254_100000210206 [0,0,0,0,2,0|2,0,0]=4 4692 B8R0.28 CC(C)CNCC(C)O 2230a_100000210904_100000210760 [0,0,0,0,2,0|2,0,0]=4 4693 B8R0.28 CC(C)CNCC(C)O 2230a_100000210953_100011218427 [0,0,0,0,2,0|2,0,0]=4 4694 B8R0.28 CC(C)CNCC(C)O 270004a_100000210904_100000210432 [0,0,0,0,2,0|2,0,0]=4 4695 B8R0.28 CC(C)CNCC(C)O 34a_100000210904_100000210624 [0,0,0,0,2,0|2,0,0]=4 4696 B8R0.28 CC(C)CNCC(C)O 34a_100000210953_100011218427 [0,0,0,0,2,0|2,0,0]=4 4697 B8R0.28 CC(C)CNC[C@@H](C)O 2230a_100000210953_100009817552 [0,0,0,0,2,0|2,0,0]=4 4698 B8R0.28 CC(C)CNC[C@@H](C)O 34a_100000210953_100009817552 [0,0,0,0,2,0|2,0,0]=4 4699 B8R0.28 CC(C)COCC(C)Br 34a_100012180447_100000210624 [0,0,0,0,2,0|2,0,0]=4 4700 B8R0.28 CC(C)COCC(C)C 34a_100000210257_100000210624 [0,0,0,0,2,0|2,0,0]=4 4701 B8R0.28 CC(C)COCC(C)F 34a_100015925927_100000210624 [0,0,0,0,2,0|2,0,0]=4 4702 B8R0.28 CC(C)COCC(C)O 34a_100000210257_100011218427 [0,0,0,0,2,0|1,0,0]=3 4703 B8R0.28 CC(C)COC[C@@H](C)Cl 34a_100016084084_100000210624 [0,0,0,0,2,0|2,0,0]=4 4704 B8R0.28 CC(C)COC[C@@H](C)N 34a_100000737577_100000210624 [0,0,0,0,2,0|2,0,0]=4 4705 B8R0.28 CC(C)COC[C@@H](C)O 34a_100000210257_100009817552 [0,0,0,0,2,0|1,0,0]=3 4706 B8R0.28 CC(C)CSCC(C)O 62a_100000210624_100011218427 [0,0,0,0,2,0|1,1,0]=4 4707 B8R0.28 CC(C)CSCC(C)O 62a_100011218427_100000210760 [0,0,0,0,2,0|1,1,0]=4 4708 B8R0.28 CC(C)CSC[C@@H](C)O 62a_100000210624_100009817552 [0,0,0,0,2,0|1,1,0]=4 4709 B8R0.28 CC(C)CSC[C@@H](C)O 62a_100009817552_100000210760 [0,0,0,0,2,0|1,1,0]=4 4710 B8R0.28 CC(C)OCC[C@@H](C)N 34a_100000706166_100000210206 [0,0,0,0,2,0|2,0,0]=4 4711 B8R0.28 CC(F)COC[C@@H](C)O 34a_100015925927_100009817552 [0,0,0,0,2,0|1,0,0]=3 4712 B8R0.28 CC(O)CCCN(C)C 2230a_100102631434_200000718107 [0,0,0,0,2,0|2,0,0]=4 4713 B8R0.28 CC(O)CCCN(C)C 269982a_100102631434_200000718107 [0,0,0,0,2,0|2,0,0]=4 4714 B8R0.28 CC(O)CCNC(C)C 2230a_100138425928_100012276601 [0,0,0,0,2,0|2,0,0]=4 4715 B8R0.28 CC(O)CCNC(C)C 2230a_200000755665_100000210206 [0,0,0,0,2,0|2,0,0]=4 4716 B8R0.28 CC(O)CCNC(C)C 34a_100138425928_100012276601 [0,0,0,0,2,0|2,0,0]=4 4717 B8R0.28 CC(O)CCOC(C)C 34a_100000212225_100012276601 [0,0,0,0,2,0|1,0,0]=3 4718 B8R0.28 CC(O)CCSC(C)C 62a_100000210206_100012276601 [0,0,0,0,2,0|1,1,0]=4 4719 B8R0.28 CC(O)CCSC(C)C 62a_100012276601_100000210206 [0,0,0,0,2,0|1,1,0]=4 4720 B8R0.28 CC(O)CNCC(C)O 2230a_100000210904_100011218427 [0,0,0,0,2,0|1,0,0]=3 4721 B8R0.28 CC(O)CNCC(C)O 34a_100000210904_100011218427 [0,0,0,0,2,0|1,0,0]=3 4722 B8R0.28 CC(O)CNC[C@@H](C)O 2230a_100000210904_100009817552 [0,0,0,0,2,0|1,0,0]=3 4723 B8R0.28 CC(O)CNC[C@@H](C)O 34a_100000210904_100009817552 [0,0,0,0,2,0|1,0,0]=3 4724 B8R0.28 CC(O)COCC(C)Br 34a_100012180447_100011218427 [0,0,0,0,2,0|1,0,0]=3 4725 B8R0.28 CC(O)COCC(C)F 34a_100015925927_100011218427 [0,0,0,0,2,0|1,0,0]=3 4726 B8R0.28 CC(O)COCC(F)F 34a_100000743014_100011218427 [0,0,0,0,2,0|2,0,0]=4 4727 B8R0.28 CC(O)COC[C@@H](C)Cl 34a_100016084084_100011218427 [0,0,0,0,2,0|1,0,0]=3 4728 B8R0.28 CC(O)COC[C@@H](C)N 34a_100000737577_100011218427 [0,0,0,0,2,0|1,0,0]=3 4729 B8R0.28 CC(O)CSCC(C)O 62a_100011218427_100011218427 [0,0,0,0,2,0|0,1,0]=3 4730 B8R0.28 CC(O)CSC[C@@H](C)O 62a_100009817552_100011218427 [0,0,0,0,2,0|0,1,0]=3 4731 B8R0.28 CC(O)CSC[C@@H](C)O 62a_100011218427_100009817552 [0,0,0,0,2,0|0,1,0]=3 4732 B8R0.28 C[C@@H](N)COC[C@@H](C)O 34a_100000737577_100009817552 [0,0,0,0,2,0|1,0,0]=3 4733 B8R0.28 C[C@@H](O)COCC(F)F 34a_100000743014_100009817552 [0,0,0,0,2,0|2,0,0]=4 4734 B8R0.28 C[C@@H](O)COC[C@@H](C)Cl 34a_100016084084_100009817552 [0,0,0,0,2,0|1,0,0]=3 4735 B8R0.28 C[C@@H](O)CSC[C@@H](C)O 62a_100009817552_100009817552 [0,0,0,0,2,0|0,1,0]=3 4736 B12R0.268 CC(=O)CCCOCCCC(C)O 34a_100000759063_200000718107 [0,0,0,0,0,2|0,0,2]=4 4737 B12R0.268 CC(=O)CCCOCCCC(C)O 7a_100000759063_200000718107 [0,0,0,0,0,2|0,0,2]=4 4738 B12R0.268 CC(=O)NCCCOCCC(C)O 34a_100000752032_100012276601 [0,0,0,0,0,2|0,0,2]=4 4739 B12R0.268 CC(=O)NCCOCCCC(C)O 34a_100000158858_200000718107 [0,0,0,0,0,2|0,0,2]=4 4740 B12R0.268 CC(=O)OCCOCNCC(C)O 34a_100000210904_100000076355 [0,0,0,0,0,2|0,0,2]=4 4741 B12R0.268 CC(=O)OCCOCSCC(C)O 62a_100000076355_100011218427 [0,0,0,0,0,2|0,0,2]=4 4742 B12R0.268 CC(=O)OCCOCSCC(C)O 62a_100011218427_100000076355 [0,0,0,0,0,2|0,0,2]=4 4743 B12R0.268 CC(=O)OCCOCSC[C@@H](C)O 62a_100000076355_100009817552 [0,0,0,0,0,2|0,0,2]=4 4744 B12R0.268 CC(=O)OCCOCSC[C@@H](C)O 62a_100009817552_100000076355 [0,0,0,0,0,2|0,0,2]=4 4745 B12R0.268 CC(C)CCCCCNCC(C)O 2230a_100000210904_100000210682 [0,0,0,0,0,2|2,0,0]=4 4746 B12R0.268 CC(C)CCCCCNCC(C)O 2230a_100011290863_100011218427 [0,0,0,0,0,2|2,0,0]=4 4747 B12R0.268 CC(C)CCCCCNCC(C)O 34a_100000210904_100000210682 [0,0,0,0,0,2|2,0,0]=4 4748 B12R0.268 CC(C)CCCCCNCC(C)O 34a_100011290863_100011218427 [0,0,0,0,0,2|2,0,0]=4 4749 B12R0.268 CC(C)CCCCCNC[C@@H](C)O 2230a_100011290863_100009817552 [0,0,0,0,0,2|2,0,0]=4 4750 B12R0.268 CC(C)CCCCCNC[C@@H](C)O 34a_100011290863_100009817552 [0,0,0,0,0,2|2,0,0]=4 4751 B12R0.268 CC(C)CCCCCOCC(C)O 34a_100011995859_100011218427 [0,0,0,0,0,2|2,0,0]=4 4752 B12R0.268 CC(C)CCCCCOCC(C)O 7a_100011995859_100011218427 [0,0,0,0,0,2|2,0,0]=4 4753 B12R0.268 CC(C)CCCCCOC[C@@H](C)O 34a_100011995859_100009817552 [0,0,0,0,0,2|2,0,0]=4 4754 B12R0.268 CC(C)CCCCCOC[C@@H](C)O 7a_100011995859_100009817552 [0,0,0,0,0,2|2,0,0]=4 4755 B12R0.268 CC(C)CCCCCSCC(C)O 62a_100000210682_100011218427 [0,0,0,0,0,2|2,0,0]=4 4756 B12R0.268 CC(C)CCCCCSCC(C)O 62a_100011218427_100000210682 [0,0,0,0,0,2|2,0,0]=4 4757 B12R0.268 CC(C)CCCCCSC[C@@H](C)O 62a_100000210682_100009817552 [0,0,0,0,0,2|2,0,0]=4 4758 B12R0.268 CC(C)CCCCCSC[C@@H](C)O 62a_100009817552_100000210682 [0,0,0,0,0,2|2,0,0]=4 4759 B12R0.268 CC(C)CCCCNCCC(C)O 2230a_200000755665_100011216152 [0,0,0,0,0,2|2,0,0]=4 4760 B12R0.268 CC(C)CCCCOCCC(C)Br 34a_100009893172_100011216152 [0,0,0,0,0,2|2,0,0]=4 4761 B12R0.268 CC(C)CCCCOCCC(C)C 34a_100000210254_100011216152 [0,0,0,0,0,2|2,0,0]=4 4762 B12R0.268 CC(C)CCCCOCCC(C)C 34a_100011214890_100000210312 [0,0,0,0,0,2|2,0,0]=4 4763 B12R0.268 CC(C)CCCCOCCC(C)C 7a_100000210254_100011216152 [0,0,0,0,0,2|2,0,0]=4 4764 B12R0.268 CC(C)CCCCOCCC(C)C 7a_100011214890_100000210626 [0,0,0,0,0,2|2,0,0]=4 4765 B12R0.268 CC(C)CCCCOCCC(C)O 34a_100011214890_100012276601 [0,0,0,0,0,2|1,0,0]=3 4766 B12R0.268 CC(C)CCCCOCCC(C)O 7a_100011214890_100012276601 [0,0,0,0,0,2|1,0,0]=3 4767 B12R0.268 CC(C)CCCCOCC[C@@H](C)N 34a_100000706166_100011216152 [0,0,0,0,0,2|2,0,0]=4 4768 B12R0.268 CC(C)CCCCSCCC(C)O 62a_100011216152_100012276601 [0,0,0,0,0,2|1,1,0]=4 4769 B12R0.268 CC(C)CCCCSCCC(C)O 62a_100012276601_100011216152 [0,0,0,0,0,2|1,1,0]=4 4770 B12R0.268 CC(C)CCCNCCCC(C)O 2230a_200000737386_200000718107 [0,0,0,0,0,2|2,0,0]=4 4771 B12R0.268 CC(C)CCCNCCCC(C)O 34a_200000737386_200000718107 [0,0,0,0,0,2|2,0,0]=4 4772 B12R0.268 CC(C)CCCOCCCC(C)C 34a_100000210774_100011214892 [0,0,0,0,0,2|2,0,0]=4 4773 B12R0.268 CC(C)CCCOCCCC(C)C 7a_100000210774_100011214892 [0,0,0,0,0,2|2,0,0]=4 4774 B12R0.268 CC(C)CCCOCCCC(C)O 34a_100000210774_200000718107 [0,0,0,0,0,2|1,0,0]=3 4775 B12R0.268 CC(C)CCCOCCCC(C)O 7a_100000210774_200000718107 [0,0,0,0,0,2|1,0,0]=3 4776 B12R0.268 CC(C)CCCOCCNC(C)C 34a_100000224655_100011214892 [0,0,0,0,0,2|2,0,0]=4 4777 B12R0.268 CC(C)CCCOCCOC(C)C 34a_100000210774_100000211751 [0,0,0,0,0,2|2,0,0]=4 4778 B12R0.268 CC(C)CCCOCCOC(C)C 34a_100000211219_100011214892 [0,0,0,0,0,2|2,0,0]=4 4779 B12R0.268 CC(C)CCCOCCOC(C)C 7a_100000210774_100000211751 [0,0,0,0,0,2|2,0,0]=4 4780 B12R0.268 CC(C)CCCOCCOC(C)C 7a_100000211219_100011214892 [0,0,0,0,0,2|2,0,0]=4 4781 B12R0.268 CC(C)CCCOCCSC(C)C 34a_100000210774_100000730970 [0,0,0,0,0,2|2,0,0]=4 4782 B12R0.268 CC(C)CCCOCCSC(C)C 34a_200011212901_100011214892 [0,0,0,0,0,2|2,0,0]=4 4783 B12R0.268 CC(C)CCCOCCSC(C)C 7a_100000210774_100000730970 [0,0,0,0,0,2|2,0,0]=4 4784 B12R0.268 CC(C)CCCOCCSC(C)C 7a_200011212901_100011214892 [0,0,0,0,0,2|2,0,0]=4 4785 B12R0.268 CC(C)CCCSCCCC(C)O 62a_100011214892_200000718107 [0,0,0,0,0,2|1,1,0]=4 4786 B12R0.268 CC(C)CCCSCCCC(C)O 62a_200000718107_100011214892 [0,0,0,0,0,2|1,1,0]=4 4787 B12R0.268 CC(C)CCOCCCNC(C)C 34a_100000182298_100000210312 [0,0,0,0,0,2|2,0,0]=4 4788 B12R0.268 CC(C)CCOCCNCC(C)C 34a_100015185251_100000210312 [0,0,0,0,0,2|2,0,0]=4 4789 B12R0.268 CC(C)CCOCCOCC(C)C 34a_100000703358_100000210312 [0,0,0,0,0,2|2,0,0]=4 4790 B12R0.268 CC(C)CCOCCOCC(C)C 7a_100000703358_100000210626 [0,0,0,0,0,2|2,0,0]=4 4791 B12R0.268 CC(C)CCOCCSCC(C)C 34a_200000230437_100000210312 [0,0,0,0,0,2|2,0,0]=4 4792 B12R0.268 CC(C)CCOCCSCC(C)C 7a_200000230437_100000210626 [0,0,0,0,0,2|2,0,0]=4 4793 B12R0.268 CC(C)CNCCOCCC(C)O 34a_100015185251_100012276601 [0,0,0,0,0,2|1,0,0]=3 4794 B12R0.268 CC(C)COCCCNCC(C)O 2230a_100000205972_100011218427 [0,0,0,0,0,2|2,0,0]=4 4795 B12R0.268 CC(C)COCCCNCC(C)O 34a_100000205972_100011218427 [0,0,0,0,0,2|2,0,0]=4 4796 B12R0.268 CC(C)COCCCNC[C@@H](C)O 2230a_100000205972_100009817552 [0,0,0,0,0,2|2,0,0]=4 4797 B12R0.268 CC(C)COCCCNC[C@@H](C)O 34a_100000205972_100009817552 [0,0,0,0,0,2|2,0,0]=4 4798 B12R0.268 CC(C)COCCOCCC(C)O 34a_100000703358_100012276601 [0,0,0,0,0,2|1,0,0]=3 4799 B12R0.268 CC(C)COCCOCCC(C)O 7a_100000703358_100012276601 [0,0,0,0,0,2|1,0,0]=3 4800 B12R0.268 CC(C)CSCCOCCC(C)O 34a_200000230437_100012276601 [0,0,0,0,0,2|1,0,0]=3 4801 B12R0.268 CC(C)CSCCOCCC(C)O 7a_200000230437_100012276601 [0,0,0,0,0,2|1,0,0]=3 4802 B12R0.268 CC(C)NCCCCOC[C@@H](C)O 34a_100011521146_100009817552 [0,0,0,0,0,2|2,0,0]=4 4803 B12R0.268 CC(C)NCCOCCOC(C)C 34a_100000224655_100000211751 [0,0,0,0,0,2|2,0,0]=4 4804 B12R0.268 CC(C)NCCOCCSC(C)C 34a_100000224655_100000730970 [0,0,0,0,0,2|2,0,0]=4 4805 B12R0.268 CC(C)OCCOCCOC(C)C 34a_100000211219_100000211751 [0,0,0,0,0,2|2,0,0]=4 4806 B12R0.268 CC(C)OCCOCCOC(C)C 7a_100000211219_100000211751 [0,0,0,0,0,2|2,0,0]=4 4807 B12R0.268 CC(C)OCCOCCSC(C)C 34a_100000211219_100000730970 [0,0,0,0,0,2|2,0,0]=4 4808 B12R0.268 CC(C)OCCOCCSC(C)C 34a_200011212901_100000211751 [0,0,0,0,0,2|2,0,0]=4 4809 B12R0.268 CC(C)OCCOCCSC(C)C 7a_100000211219_100000730970 [0,0,0,0,0,2|2,0,0]=4 4810 B12R0.268 CC(C)OCCOCCSC(C)C 7a_200011212901_100000211751 [0,0,0,0,0,2|2,0,0]=4 4811 B12R0.268 CC(C)SCCOCCSC(C)C 34a_200011212901_100000730970 [0,0,0,0,0,2|2,0,0]=4 4812 B12R0.268 CC(C)SCCOCCSC(C)C 7a_200011212901_100000730970 [0,0,0,0,0,2|2,0,0]=4 4813 B12R0.268 CC(O)CCCNCCOC(C)C 2230a_100000701111_200000718107 [0,0,0,0,0,2|2,0,0]=4 4814 B12R0.268 CC(O)CCCNCCOC(C)C 34a_100000701111_200000718107 [0,0,0,0,0,2|2,0,0]=4 4815 B12R0.268 CC(O)CCCNCCSC(C)C 2230a_100000731138_200000718107 [0,0,0,0,0,2|2,0,0]=4 4816 B12R0.268 CC(O)CCCNCCSC(C)C 34a_100000731138_200000718107 [0,0,0,0,0,2|2,0,0]=4 4817 B12R0.268 CC(O)CCCOCCNC(C)C 34a_100000224655_200000718107 [0,0,0,0,0,2|1,0,0]=3 4818 B12R0.268 CC(O)CCCOCCOC(C)C 34a_100000211219_200000718107 [0,0,0,0,0,2|1,0,0]=3 4819 B12R0.268 CC(O)CCCOCCOC(C)C 7a_100000211219_200000718107 [0,0,0,0,0,2|1,0,0]=3 4820 B12R0.268 CC(O)CCCOCCSC(C)C 34a_200011212901_200000718107 [0,0,0,0,0,2|1,0,0]=3 4821 B12R0.268 CC(O)CCCOCCSC(C)C 7a_200011212901_200000718107 [0,0,0,0,0,2|1,0,0]=3 4822 B12R0.268 CC(O)CCCSCCCC(C)O 62a_200000718107_200000718107 [0,0,0,0,0,2|0,1,0]=3 4823 B12R0.268 CC(O)CCCSCCOC(C)C 62a_100000211751_200000718107 [0,0,0,0,0,2|1,1,0]=4 4824 B12R0.268 CC(O)CCCSCCOC(C)C 62a_200000718107_100000211751 [0,0,0,0,0,2|1,1,0]=4 4825 B12R0.268 CC(O)CCCSCCSC(C)C 62a_100000730970_200000718107 [0,0,0,0,0,2|1,1,0]=4 4826 B12R0.268 CC(O)CCCSCCSC(C)C 62a_200000718107_100000730970 [0,0,0,0,0,2|1,1,0]=4 4827 B12R0.268 CC(O)CCNCCCOC(C)C 2230a_100000737246_100012276601 [0,0,0,0,0,2|2,0,0]=4 4828 B12R0.268 CC(O)CCNCCCOC(C)C 34a_100000737246_100012276601 [0,0,0,0,0,2|2,0,0]=4 4829 B12R0.268 CC(O)CCOCCCNC(C)C 34a_100000182298_100012276601 [0,0,0,0,0,2|1,0,0]=3 4830 B12R0.268 CC(O)CCOCCOCC(F)F 34a_100000704375_100012276601 [0,0,0,0,0,2|2,0,0]=4 4831 B12R0.268 CC(O)CCOCCOCC(F)F 7a_100000704375_100012276601 [0,0,0,0,0,2|2,0,0]=4 4832 B12R0.268 CC(O)COCCCCNC(C)C 34a_100011521146_100011218427 [0,0,0,0,0,2|2,0,0]=4