0 B11R1.742 C=C(C)CN1CCCCCC1 2230a_100000185865_100000748629 [0,0,0,0,0,0|1,0,1]=2 1 B11R1.742 C=C(C)CN1CCCCCC1 269982a_100000185865_100000748629 [0,0,0,0,0,0|1,0,1]=2 2 B11R1.742 C=C(C)CN1CCCCCC1 34a_100000185865_100000748629 [0,0,0,0,0,0|1,0,1]=2 3 B11R1.742 C=C(C)CN1CCCOCC1 2230a_100000685342_100000748629 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.742 C=C(C)CN1CCCOCC1 269982a_100000685342_100000748629 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.742 C=C(C)CN1CCCOCC1 34a_100000685342_100000748629 [0,0,0,0,0,0|2,0,1]=3 6 B11R1.742 C=C(F)CN1CCCCCC1 2230a_100000185865_100009893438 [0,0,0,0,0,0|1,0,2]=3 7 B11R1.742 C=C(F)CN1CCCCCC1 269982a_100000185865_100009893438 [0,0,0,0,0,0|1,0,2]=3 8 B11R1.742 C=C(F)CN1CCCCCC1 34a_100000185865_100009893438 [0,0,0,0,0,0|1,0,2]=3 9 B11R1.742 C=C(F)CN1CCCOCC1 2230a_100000685342_100009893438 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.742 C=C(F)CN1CCCOCC1 269982a_100000685342_100009893438 [0,0,0,0,0,0|2,0,2]=4 11 B11R1.742 C=C(F)CN1CCCOCC1 34a_100000685342_100009893438 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.742 CC(=O)C=C1CCCCCC1 1458a_100011240665_200000210301 [0,0,0,0,0,0|1,0,3]=4 13 B11R1.742 CC(=O)CC1CCCCCC1 1458a_100000070787_200000696569 [0,0,0,0,0,0|1,0,2]=3 14 B11R1.742 CC(=O)CC1CCCCCC1 1458a_100000685095_200000210301 [0,0,0,0,0,0|1,0,2]=3 15 B11R1.742 CC(=O)CN1CCCCCC1 1458a_100000740298_200000210301 [0,0,0,0,0,0|0,0,2]=2 16 B11R1.742 CC(=O)NC1CCCCCC1 11a_100000210984_100015343762 [0,0,0,0,0,0|2,0,2]=4 17 B11R1.742 CC(=O)NC1CCCCCC1 1626a_100000210984_100015343762 [0,0,0,0,0,0|2,0,2]=4 18 B11R1.742 CC(=O)NC1CCCCCC1 240690a_100000210984_100015343762 [0,0,0,0,0,0|2,0,2]=4 19 B11R1.742 CC(=O)NC1CCCCCC1 527a_100000210984_100103153847 [0,0,0,0,0,0|2,0,2]=4 20 B11R1.742 CC(C)CN1CCCCCC1 2230a_100000185865_100000210760 [0,0,0,0,0,0|1,0,0]=1 21 B11R1.742 CC(C)CN1CCCCCC1 269982a_100000185865_100000210624 [0,0,0,0,0,0|1,0,0]=1 22 B11R1.742 CC(C)CN1CCCCCC1 270004a_100000185865_100000210432 [0,0,0,0,0,0|1,0,0]=1 23 B11R1.742 CC(C)CN1CCCCCC1 34a_100000185865_100000210624 [0,0,0,0,0,0|1,0,0]=1 24 B11R1.742 CC(C)CN1CCCOCC1 2230a_100000685342_100000210760 [0,0,0,0,0,0|2,0,0]=2 25 B11R1.742 CC(C)CN1CCCOCC1 269982a_100000685342_100000210624 [0,0,0,0,0,0|2,0,0]=2 26 B11R1.742 CC(C)CN1CCCOCC1 270004a_100000685342_100000210432 [0,0,0,0,0,0|2,0,0]=2 27 B11R1.742 CC(C)CN1CCCOCC1 34a_100000685342_100000210624 [0,0,0,0,0,0|2,0,0]=2 28 B11R1.742 CC(C)NC1CCCCCC1 2230a_100000210984_100000210206 [0,0,0,0,0,0|3,0,0]=3 29 B11R1.742 CC(C)NC1CCCCCC1 34a_100000210984_100000210206 [0,0,0,0,0,0|3,0,0]=3 30 B11R1.742 CC(C)NC1CCCCCC1 34a_100138425928_100011217769 [0,0,0,0,0,0|3,0,0]=3 31 B11R1.742 CC(C)OC1CCCCCC1 34a_100000210887_100000210206 [0,0,0,0,0,0|3,0,0]=3 32 B11R1.742 CC(C)OC1CCCCCC1 34a_100000212225_100011217769 [0,0,0,0,0,0|3,0,0]=3 33 B11R1.742 CC(C)OC1CCCCCC1 7a_100000210887_100000210206 [0,0,0,0,0,0|3,0,0]=3 34 B11R1.742 CC(C)SC1CCCCCC1 62a_100000210206_100011217769 [0,0,0,0,0,0|3,0,0]=3 35 B11R1.742 CC(C)SC1CCCCCC1 62a_100011217769_100000210206 [0,0,0,0,0,0|3,0,0]=3 36 B11R1.742 CC(O)CN1CCCCCC1 2230a_100000185865_100011218427 [0,0,0,0,0,0|0,0,0]=0 37 B11R1.742 CC(O)CN1CCCCCC1 269982a_100000185865_100011218427 [0,0,0,0,0,0|0,0,0]=0 38 B11R1.742 CC(O)CN1CCCCCC1 34a_100000185865_100011218427 [0,0,0,0,0,0|0,0,0]=0 39 B11R1.742 CC(O)CN1CCCOCC1 2230a_100000685342_100011218427 [0,0,0,0,0,0|1,0,0]=1 40 B11R1.742 CC(O)CN1CCCOCC1 269982a_100000685342_100011218427 [0,0,0,0,0,0|1,0,0]=1 41 B11R1.742 CC(O)CN1CCCOCC1 34a_100000685342_100011218427 [0,0,0,0,0,0|1,0,0]=1 42 B11R1.742 CN(C)CC1CCCCCC1 2230a_100102631434_200000696569 [0,0,0,0,0,0|3,0,0]=3 43 B11R1.742 CN(C)CC1CCCCCC1 269982a_100102631434_200000696569 [0,0,0,0,0,0|3,0,0]=3 44 B11R1.742 C[C@@H](O)CN1CCCCCC1 2230a_100000185865_100009817552 [0,0,0,0,0,0|0,0,0]=0 45 B11R1.742 C[C@@H](O)CN1CCCCCC1 269982a_100000185865_100009817552 [0,0,0,0,0,0|0,0,0]=0 46 B11R1.742 C[C@@H](O)CN1CCCCCC1 34a_100000185865_100009817552 [0,0,0,0,0,0|0,0,0]=0 47 B11R1.742 C[C@@H](O)CN1CCCOCC1 2230a_100000685342_100009817552 [0,0,0,0,0,0|1,0,0]=1 48 B11R1.742 C[C@@H](O)CN1CCCOCC1 269982a_100000685342_100009817552 [0,0,0,0,0,0|1,0,0]=1 49 B11R1.742 C[C@@H](O)CN1CCCOCC1 34a_100000685342_100009817552 [0,0,0,0,0,0|1,0,0]=1 50 B11R1.742 FC(F)CN1CCCCCC1 2230a_100000185865_100011934356 [0,0,0,0,0,0|2,0,0]=2 51 B11R1.742 FC(F)CN1CCCCCC1 269982a_100000185865_100011934356 [0,0,0,0,0,0|2,0,0]=2 52 B11R1.742 FC(F)CN1CCCCCC1 34a_100000185865_100011934356 [0,0,0,0,0,0|2,0,0]=2 53 B11R1.742 FC(F)CN1CCCOCC1 2230a_100000685342_100011934356 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.742 FC(F)CN1CCCOCC1 269982a_100000685342_100011934356 [0,0,0,0,0,0|3,0,0]=3 55 B11R1.742 FC(F)CN1CCCOCC1 34a_100000685342_100011934356 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.742 NC(=O)CN1CCCCCC1 2230a_100000185865_100000747473 [0,0,0,0,0,0|1,0,2]=3 57 B11R1.742 NC(=O)CN1CCCCCC1 269982a_100000185865_100000187820 [0,0,0,0,0,0|1,0,2]=3 58 B11R1.742 NC(=O)CN1CCCCCC1 34a_100000185865_100000187820 [0,0,0,0,0,0|1,0,2]=3 59 B11R1.742 NC(=O)CN1CCCOCC1 2230a_100000685342_100000747473 [0,0,0,0,0,0|2,0,2]=4 60 B11R1.742 NC(=O)CN1CCCOCC1 269982a_100000685342_100000187820 [0,0,0,0,0,0|2,0,2]=4 61 B11R1.742 NC(=O)CN1CCCOCC1 34a_100000685342_100000187820 [0,0,0,0,0,0|2,0,2]=4 62 B11R1.742 O=C([O-])CN1CCCCCC1 269982a_100000185865_100020667443 [0,0,0,0,0,0|1,0,2]=3 63 B11R1.742 O=C([O-])CN1CCCCCC1 34a_100000185865_100020667443 [0,0,0,0,0,0|1,0,2]=3 64 B11R1.742 O=C([O-])CN1CCCOCC1 269982a_100000685342_100020667443 [0,0,0,0,0,0|2,0,2]=4 65 B11R1.742 O=C([O-])CN1CCCOCC1 34a_100000685342_100020667443 [0,0,0,0,0,0|2,0,2]=4 66 B11R1.742 O=[N+]([O-])CN1CCCCCC1 269982a_100000185865_100000761209 [0,0,0,0,0,0|2,0,1]=3 67 B11R1.742 O=[N+]([O-])CN1CCCCCC1 34a_100000185865_100000761209 [0,0,0,0,0,0|2,0,1]=3 68 B11R1.742 O=[N+]([O-])CN1CCCOCC1 269982a_100000685342_100000761209 [0,0,0,0,0,0|3,0,1]=4 69 B11R1.742 O=[N+]([O-])CN1CCCOCC1 34a_100000685342_100000761209 [0,0,0,0,0,0|3,0,1]=4 70 B11R1.742 [13CH3]C(=O)C=C1CCCCCC1 1458a_100011240665_200025704644 [0,0,0,0,0,0|1,0,3]=4 71 B11R1.742 [13CH3]C(=O)CC1CCCCCC1 1458a_100000685095_200025704644 [0,0,0,0,0,0|1,0,2]=3 72 B11R1.742 [13CH3]C(=O)CN1CCCCCC1 1458a_100000740298_200025704644 [0,0,0,0,0,0|0,0,2]=2 73 B10R1.85 C#CCN1CCCCCC1 2230a_100000185865_100000038162 [1,0,0,0,0,0|0,0,2]=3 74 B10R1.85 C#CCN1CCCCCC1 34a_100000185865_100000184674 [1,0,0,0,0,0|0,0,2]=3 75 B10R1.85 C#CCN1CCCOCC1 2230a_100000685342_100000038162 [1,0,0,0,0,0|1,0,2]=4 76 B10R1.85 C#CCN1CCCOCC1 34a_100000685342_100000184674 [1,0,0,0,0,0|1,0,2]=4 77 B10R1.85 C=CCN1CCCCCC1 2230a_100000185865_100000210623 [1,0,0,0,0,0|0,0,2]=3 78 B10R1.85 C=CCN1CCCCCC1 269982a_100000185865_100000210623 [1,0,0,0,0,0|0,0,2]=3 79 B10R1.85 C=CCN1CCCCCC1 34a_100000185865_100015514636 [1,0,0,0,0,0|0,0,2]=3 80 B10R1.85 C=CCN1CCCOCC1 2230a_100000685342_100000210623 [1,0,0,0,0,0|1,0,2]=4 81 B10R1.85 C=CCN1CCCOCC1 269982a_100000685342_100000210623 [1,0,0,0,0,0|1,0,2]=4 82 B10R1.85 C=CCN1CCCOCC1 34a_100000685342_100015514636 [1,0,0,0,0,0|1,0,2]=4 83 B10R1.85 CCCN1CCCCCC1 2230a_100000185865_100000210303 [1,0,0,0,0,0|0,0,0]=1 84 B10R1.85 CCCN1CCCCCC1 269982a_100000185865_100000210303 [1,0,0,0,0,0|0,0,0]=1 85 B10R1.85 CCCN1CCCCCC1 34a_100000185865_100000210303 [1,0,0,0,0,0|0,0,0]=1 86 B10R1.85 CCCN1CCCOCC1 2230a_100000685342_100000210303 [1,0,0,0,0,0|1,0,0]=2 87 B10R1.85 CCCN1CCCOCC1 269982a_100000685342_100000210303 [1,0,0,0,0,0|1,0,0]=2 88 B10R1.85 CCCN1CCCOCC1 34a_100000685342_100000210303 [1,0,0,0,0,0|1,0,0]=2 89 B10R1.85 CCNC1CCCCCC1 2230a_100000210984_100000210202 [1,0,0,0,0,0|2,0,0]=3 90 B10R1.85 CCNC1CCCCCC1 270004a_100015525214_100000210131 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.85 CCNC1CCCCCC1 34a_100000210984_100000210202 [1,0,0,0,0,0|2,0,0]=3 92 B10R1.85 CCNC1CCCNCC1 270004a_100015525214_100015187895 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.85 CCOC1CCCCCC1 34a_100000210887_100000210202 [1,0,0,0,0,0|2,0,0]=3 94 B10R1.85 CCOC1CCCCCC1 34a_100121572206_100011217769 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.85 CCOC1CCCCCC1 7a_100000210887_100000210202 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.85 CCSC1CCCCCC1 62a_100000210202_100011217769 [1,0,0,0,0,0|2,0,0]=3 97 B10R1.85 CCSC1CCCCCC1 62a_100011217769_100000210202 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.85 CNCC1CCCCCC1 2230a_100015204231_200000210301 [1,0,0,0,0,0|2,0,0]=3 99 B10R1.85 CNCC1CCCCCC1 2230a_106832991635_200000696569 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.85 CNCC1CCCCCC1 269862a_106832991636_200000763224 [1,0,0,0,0,0|2,0,0]=3 101 B10R1.85 CNCC1CCCCCC1 34a_100015204231_200000210301 [1,0,0,0,0,0|2,0,0]=3 102 B10R1.85 CNCC1CCCCCC1 34a_100102657272_200000696569 [1,0,0,0,0,0|2,0,0]=3 103 B10R1.85 CNCC1CCCCCC1 7a_106832991635_200000696569 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.85 COCC1CCCCCC1 34a_100000699130_200000210301 [1,0,0,0,0,0|2,0,0]=3 105 B10R1.85 COCC1CCCCCC1 34a_100138415774_200000696569 [1,0,0,0,0,0|2,0,0]=3 106 B10R1.85 COCC1CCCCCC1 7a_100000699130_200000210301 [1,0,0,0,0,0|2,0,0]=3 107 B10R1.85 COCN1CCCCCC1 2230a_100000185865_100000766300 [1,0,0,0,0,0|1,0,0]=2 108 B10R1.85 COCN1CCCCCC1 269982a_100000185865_100000766300 [1,0,0,0,0,0|1,0,0]=2 109 B10R1.85 COCN1CCCOCC1 2230a_100000685342_100000766300 [1,0,0,0,0,0|2,0,0]=3 110 B10R1.85 COCN1CCCOCC1 269982a_100000685342_100000766300 [1,0,0,0,0,0|2,0,0]=3 111 B10R1.85 CSCC1CCCCCC1 62a_200000210301_200000696569 [1,0,0,0,0,0|2,0,0]=3 112 B10R1.85 CSCC1CCCCCC1 62a_200000696569_200000210301 [1,0,0,0,0,0|2,0,0]=3 113 B10R1.85 CSCN1CCCCCC1 2230a_100000185865_100011218213 [1,0,0,0,0,0|1,0,0]=2 114 B10R1.85 CSCN1CCCCCC1 269982a_100000185865_100011218213 [1,0,0,0,0,0|1,0,0]=2 115 B10R1.85 CSCN1CCCCCC1 34a_100000185865_100011218213 [1,0,0,0,0,0|1,0,0]=2 116 B10R1.85 CSCN1CCCOCC1 2230a_100000685342_100011218213 [1,0,0,0,0,0|2,0,0]=3 117 B10R1.85 CSCN1CCCOCC1 269982a_100000685342_100011218213 [1,0,0,0,0,0|2,0,0]=3 118 B10R1.85 CSCN1CCCOCC1 34a_100000685342_100011218213 [1,0,0,0,0,0|2,0,0]=3 119 B10R1.85 FCCN1CCCCCC1 2230a_100000185865_100011217306 [1,0,0,0,0,0|1,0,0]=2 120 B10R1.85 FCCN1CCCCCC1 269982a_100000185865_100011217306 [1,0,0,0,0,0|1,0,0]=2 121 B10R1.85 FCCN1CCCCCC1 34a_100000185865_100011217306 [1,0,0,0,0,0|1,0,0]=2 122 B10R1.85 FCCN1CCCOCC1 2230a_100000685342_100011217306 [1,0,0,0,0,0|2,0,0]=3 123 B10R1.85 FCCN1CCCOCC1 269982a_100000685342_100011217306 [1,0,0,0,0,0|2,0,0]=3 124 B10R1.85 FCCN1CCCOCC1 34a_100000685342_100011217306 [1,0,0,0,0,0|2,0,0]=3 125 B10R1.85 FCNC1CCCCCC1 34a_100000210984_100015361967 [1,0,0,0,0,0|3,0,0]=4 126 B10R1.85 FCOC1CCCCCC1 34a_100000210887_100015361967 [1,0,0,0,0,0|3,0,0]=4 127 B10R1.85 FCOC1CCCCCC1 7a_100000210887_100015361967 [1,0,0,0,0,0|3,0,0]=4 128 B10R1.85 FCSC1CCCCCC1 62a_100011217769_100015361967 [1,0,0,0,0,0|3,0,0]=4 129 B10R1.85 FCSC1CCCCCC1 62a_100015361967_100011217769 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.85 N#CCN1CCCCCC1 2230a_100000185865_100011215382 [1,0,0,0,0,0|1,0,1]=3 131 B10R1.85 N#CCN1CCCCCC1 269982a_100000185865_100011214920 [1,0,0,0,0,0|1,0,1]=3 132 B10R1.85 N#CCN1CCCOCC1 2230a_100000685342_100011215382 [1,0,0,0,0,0|2,0,1]=4 133 B10R1.85 N#CCN1CCCOCC1 269982a_100000685342_100011214920 [1,0,0,0,0,0|2,0,1]=4 134 B10R1.85 O=CCN1CCCCCC1 2230a_100000185865_200015260668 [1,0,0,0,0,0|0,0,2]=3 135 B10R1.85 O=CCN1CCCCCC1 269982a_100000185865_200015260668 [1,0,0,0,0,0|0,0,2]=3 136 B10R1.85 O=CCN1CCCCCC1 34a_100000185865_200009817547 [1,0,0,0,0,0|0,0,2]=3 137 B10R1.85 O=CCN1CCCOCC1 2230a_100000685342_200015260668 [1,0,0,0,0,0|1,0,2]=4 138 B10R1.85 O=CCN1CCCOCC1 269982a_100000685342_200015260668 [1,0,0,0,0,0|1,0,2]=4 139 B10R1.85 O=CCN1CCCOCC1 34a_100000685342_200009817547 [1,0,0,0,0,0|1,0,2]=4 140 B10R1.85 OCCN1CCCCCC1 2230a_100000185865_100000211926 [1,0,0,0,0,0|0,0,0]=1 141 B10R1.85 OCCN1CCCCCC1 269982a_100000185865_100000211926 [1,0,0,0,0,0|0,0,0]=1 142 B10R1.85 OCCN1CCCCCC1 34a_100000185865_100000211926 [1,0,0,0,0,0|0,0,0]=1 143 B10R1.85 OCCN1CCCOCC1 2230a_100000685342_100000211926 [1,0,0,0,0,0|1,0,0]=2 144 B10R1.85 OCCN1CCCOCC1 269982a_100000685342_100000211926 [1,0,0,0,0,0|1,0,0]=2 145 B10R1.85 OCCN1CCCOCC1 34a_100000685342_100000211926 [1,0,0,0,0,0|1,0,0]=2 146 B10R1.85 [13CH3]NCC1CCCCCC1 2230a_100015204231_200025704644 [1,0,0,0,0,0|2,0,0]=3 147 B10R1.85 [13CH3]NCC1CCCCCC1 34a_100015204231_200025704644 [1,0,0,0,0,0|2,0,0]=3 148 B10R1.85 [13CH3]OCC1CCCCCC1 34a_100000699130_200025704644 [1,0,0,0,0,0|2,0,0]=3 149 B10R1.85 [13CH3]OCC1CCCCCC1 7a_100000699130_200025704644 [1,0,0,0,0,0|2,0,0]=3 150 B10R1.85 [13CH3]SCC1CCCCCC1 62a_200000696569_200025704644 [1,0,0,0,0,0|2,0,0]=3 151 B10R1.85 [13CH3]SCC1CCCCCC1 62a_200025704644_200000696569 [1,0,0,0,0,0|2,0,0]=3 152 B12R1.210 CC(=O)CN1CCCCCC1=O 1458a_100000181294_200000210301 [0,1,0,0,0,0|0,0,3]=4 153 B12R1.210 CC(C)CC1CCCCCN1C 2230a_100000759364_200000210301 [0,1,0,0,0,0|3,0,0]=4 154 B12R1.210 CC(C)CC1CCCCCN1C 269982a_100000759364_200000210301 [0,1,0,0,0,0|3,0,0]=4 155 B12R1.210 CC(C)CC1CCCCCN1C 34a_100000759364_200000210301 [0,1,0,0,0,0|3,0,0]=4 156 B12R1.210 CC(C)CC1CCCCCN1[13CH3] 2230a_100000759364_200025704644 [0,1,0,0,0,0|3,0,0]=4 157 B12R1.210 CC(C)CC1CCCCCN1[13CH3] 269982a_100000759364_200025704644 [0,1,0,0,0,0|3,0,0]=4 158 B12R1.210 CC(C)CC1CCCCCN1[13CH3] 34a_100000759364_200025704644 [0,1,0,0,0,0|3,0,0]=4 159 B12R1.210 [13CH3]C(=O)CN1CCCCCC1=O 1458a_100000181294_200025704644 [0,1,0,0,0,0|0,0,3]=4 160 B12R1.874 C=C(C)CN1CCCCC(C1)O 2230a_100025706797_100000748629 [0,1,0,0,0,0|1,0,1]=3 161 B12R1.874 C=C(C)CN1CCCCC(C1)O 269982a_100025706797_100000748629 [0,1,0,0,0,0|1,0,1]=3 162 B12R1.874 C=C(C)CN1CCOC[C@@H](C1)O 2230a_100016073750_100000748629 [0,1,0,0,0,0|2,0,1]=4 163 B12R1.874 C=C(C)CN1CCOC[C@@H](C1)O 269982a_100016073750_100000748629 [0,1,0,0,0,0|2,0,1]=4 164 B12R1.874 C=C(F)CN1CCCCC(C1)O 2230a_100025706797_100009893438 [0,1,0,0,0,0|1,0,2]=4 165 B12R1.874 C=C(F)CN1CCCCC(C1)O 269982a_100025706797_100009893438 [0,1,0,0,0,0|1,0,2]=4 166 B12R1.874 CC(C)CN1CCCCC(C1)O 2230a_100025706797_100000210760 [0,1,0,0,0,0|1,0,0]=2 167 B12R1.874 CC(C)CN1CCCCC(C1)O 269982a_100025706797_100000210624 [0,1,0,0,0,0|1,0,0]=2 168 B12R1.874 CC(C)CN1CCCCC(C1)O 270004a_100025706797_100000210432 [0,1,0,0,0,0|1,0,0]=2 169 B12R1.874 CC(C)CN1CCCNC(=O)C1 2230a_100015190381_100000210760 [0,1,0,0,0,0|2,0,1]=4 170 B12R1.874 CC(C)CN1CCCNC(=O)C1 270004a_100015190381_100000210432 [0,1,0,0,0,0|2,0,1]=4 171 B12R1.874 CC(C)CN1CCOC[C@@H](C1)O 2230a_100016073750_100000210760 [0,1,0,0,0,0|2,0,0]=3 172 B12R1.874 CC(C)CN1CCOC[C@@H](C1)O 269982a_100016073750_100000210624 [0,1,0,0,0,0|2,0,0]=3 173 B12R1.874 CC(C)CN1CCOC[C@@H](C1)O 270004a_100016073750_100000210432 [0,1,0,0,0,0|2,0,0]=3 174 B12R1.874 CC(O)CN1CCCCC(C1)O 2230a_100025706797_100011218427 [0,1,0,0,0,0|0,0,0]=1 175 B12R1.874 CC(O)CN1CCCCC(C1)O 269982a_100025706797_100011218427 [0,1,0,0,0,0|0,0,0]=1 176 B12R1.874 CC(O)CN1CCCNC(=O)C1 2230a_100015190381_100011218427 [0,1,0,0,0,0|1,0,1]=3 177 B12R1.874 CC(O)CN1CCOC[C@@H](C1)O 2230a_100016073750_100011218427 [0,1,0,0,0,0|1,0,0]=2 178 B12R1.874 CC(O)CN1CCOC[C@@H](C1)O 269982a_100016073750_100011218427 [0,1,0,0,0,0|1,0,0]=2 179 B12R1.874 C[C@@H](O)CN1CCCCC(C1)O 2230a_100025706797_100009817552 [0,1,0,0,0,0|0,0,0]=1 180 B12R1.874 C[C@@H](O)CN1CCCCC(C1)O 269982a_100025706797_100009817552 [0,1,0,0,0,0|0,0,0]=1 181 B12R1.874 C[C@@H](O)CN1CCCNC(=O)C1 2230a_100015190381_100009817552 [0,1,0,0,0,0|1,0,1]=3 182 B12R1.874 C[C@@H](O)CN1CCOC[C@@H](C1)O 2230a_100016073750_100009817552 [0,1,0,0,0,0|1,0,0]=2 183 B12R1.874 C[C@@H](O)CN1CCOC[C@@H](C1)O 269982a_100016073750_100009817552 [0,1,0,0,0,0|1,0,0]=2 184 B12R1.874 NC(=O)CN1CCCCC(C1)O 2230a_100025706797_100000747473 [0,1,0,0,0,0|1,0,2]=4 185 B12R1.874 NC(=O)CN1CCCCC(C1)O 269982a_100025706797_100000187820 [0,1,0,0,0,0|1,0,2]=4 186 B12R1.874 O=C([O-])CN1CCCCC(C1)O 269982a_100025706797_100020667443 [0,1,0,0,0,0|1,0,2]=4 187 B12R1.874 O=[N+]([O-])CN1CCCCC(C1)O 269982a_100025706797_100000761209 [0,1,0,0,0,0|2,0,1]=4 188 B12R1.874 OC1CCCCN(C1)CC(F)F 2230a_100025706797_100011934356 [0,1,0,0,0,0|2,0,0]=3 189 B12R1.874 OC1CCCCN(C1)CC(F)F 269982a_100025706797_100011934356 [0,1,0,0,0,0|2,0,0]=3 190 B12R1.874 O[C@H]1COCCN(C1)CC(F)F 2230a_100016073750_100011934356 [0,1,0,0,0,0|3,0,0]=4 191 B12R1.874 O[C@H]1COCCN(C1)CC(F)F 269982a_100016073750_100011934356 [0,1,0,0,0,0|3,0,0]=4 192 B12R1.1020 C=C(C)CN1CCCC(CC1)C 2230a_100025706717_100000748629 [0,1,0,0,0,0|1,0,1]=3 193 B12R1.1020 C=C(C)CN1CCCC(CC1)C 269982a_100025706717_100000748629 [0,1,0,0,0,0|1,0,1]=3 194 B12R1.1020 C=C(C)CN1CCCC(CC1)C 34a_100025706717_100000748629 [0,1,0,0,0,0|1,0,1]=3 195 B12R1.1020 C=C(C)CN1CCCC(CC1)O 2230a_100015186869_100000748629 [0,1,0,0,0,0|1,0,1]=3 196 B12R1.1020 C=C(C)CN1CCCC(CC1)O 269982a_100015186869_100000748629 [0,1,0,0,0,0|1,0,1]=3 197 B12R1.1020 C=C(C)CN1CCCN(CC1)C 2230a_100000211313_100000748629 [0,1,0,0,0,0|2,0,1]=4 198 B12R1.1020 C=C(C)CN1CCCN(CC1)C 269982a_100000211313_100000748629 [0,1,0,0,0,0|2,0,1]=4 199 B12R1.1020 C=C(F)CN1CCCC(CC1)C 2230a_100025706717_100009893438 [0,1,0,0,0,0|1,0,2]=4 200 B12R1.1020 C=C(F)CN1CCCC(CC1)C 269982a_100025706717_100009893438 [0,1,0,0,0,0|1,0,2]=4 201 B12R1.1020 C=C(F)CN1CCCC(CC1)C 34a_100025706717_100009893438 [0,1,0,0,0,0|1,0,2]=4 202 B12R1.1020 C=C(F)CN1CCCC(CC1)O 2230a_100015186869_100009893438 [0,1,0,0,0,0|1,0,2]=4 203 B12R1.1020 C=C(F)CN1CCCC(CC1)O 269982a_100015186869_100009893438 [0,1,0,0,0,0|1,0,2]=4 204 B12R1.1020 CC(C)CN1CCCC(CC1)C 2230a_100025706717_100000210760 [0,1,0,0,0,0|1,0,0]=2 205 B12R1.1020 CC(C)CN1CCCC(CC1)C 269982a_100025706717_100000210624 [0,1,0,0,0,0|1,0,0]=2 206 B12R1.1020 CC(C)CN1CCCC(CC1)C 270004a_100025706717_100000210432 [0,1,0,0,0,0|1,0,0]=2 207 B12R1.1020 CC(C)CN1CCCC(CC1)C 34a_100025706717_100000210624 [0,1,0,0,0,0|1,0,0]=2 208 B12R1.1020 CC(C)CN1CCCC(CC1)O 2230a_100015186869_100000210760 [0,1,0,0,0,0|1,0,0]=2 209 B12R1.1020 CC(C)CN1CCCC(CC1)O 269982a_100015186869_100000210624 [0,1,0,0,0,0|1,0,0]=2 210 B12R1.1020 CC(C)CN1CCCC(CC1)O 270004a_100015186869_100000210432 [0,1,0,0,0,0|1,0,0]=2 211 B12R1.1020 CC(C)CN1CCCN(CC1)C 2230a_100000211313_100000210760 [0,1,0,0,0,0|2,0,0]=3 212 B12R1.1020 CC(C)CN1CCCN(CC1)C 2230a_100015187271_200000210301 [0,1,0,0,0,0|2,0,0]=3 213 B12R1.1020 CC(C)CN1CCCN(CC1)C 269982a_100000211313_100000210624 [0,1,0,0,0,0|2,0,0]=3 214 B12R1.1020 CC(C)CN1CCCN(CC1)C 269982a_100015187271_200000210301 [0,1,0,0,0,0|2,0,0]=3 215 B12R1.1020 CC(C)CN1CCCN(CC1)C 270004a_100000211313_100000210432 [0,1,0,0,0,0|2,0,0]=3 216 B12R1.1020 CC(C)CN1CCCN(CC1)[13CH3] 2230a_100015187271_200025704644 [0,1,0,0,0,0|2,0,0]=3 217 B12R1.1020 CC(C)CN1CCCN(CC1)[13CH3] 269982a_100015187271_200025704644 [0,1,0,0,0,0|2,0,0]=3 218 B12R1.1020 CC(C)CN1CCNC(=O)CC1 2230a_100000698595_100000210760 [0,1,0,0,0,0|2,0,1]=4 219 B12R1.1020 CC(C)CN1CCNC(=O)CC1 269982a_100000698595_100000210624 [0,1,0,0,0,0|2,0,1]=4 220 B12R1.1020 CC(C)CN1CCNC(=O)CC1 270004a_100000698595_100000210432 [0,1,0,0,0,0|2,0,1]=4 221 B12R1.1020 CC(O)CN1CCCC(CC1)C 2230a_100025706717_100011218427 [0,1,0,0,0,0|0,0,0]=1 222 B12R1.1020 CC(O)CN1CCCC(CC1)C 269982a_100025706717_100011218427 [0,1,0,0,0,0|0,0,0]=1 223 B12R1.1020 CC(O)CN1CCCC(CC1)C 34a_100025706717_100011218427 [0,1,0,0,0,0|0,0,0]=1 224 B12R1.1020 CC(O)CN1CCCC(CC1)O 2230a_100015186869_100011218427 [0,1,0,0,0,0|0,0,0]=1 225 B12R1.1020 CC(O)CN1CCCC(CC1)O 269982a_100015186869_100011218427 [0,1,0,0,0,0|0,0,0]=1 226 B12R1.1020 CC(O)CN1CCCN(CC1)C 2230a_100000211313_100011218427 [0,1,0,0,0,0|1,0,0]=2 227 B12R1.1020 CC(O)CN1CCCN(CC1)C 269982a_100000211313_100011218427 [0,1,0,0,0,0|1,0,0]=2 228 B12R1.1020 CC(O)CN1CCNC(=O)CC1 2230a_100000698595_100011218427 [0,1,0,0,0,0|1,0,1]=3 229 B12R1.1020 CC(O)CN1CCNC(=O)CC1 269982a_100000698595_100011218427 [0,1,0,0,0,0|1,0,1]=3 230 B12R1.1020 CC1CCCN(CC1)CC(=O)N 2230a_100025706717_100000747473 [0,1,0,0,0,0|1,0,2]=4 231 B12R1.1020 CC1CCCN(CC1)CC(=O)N 269982a_100025706717_100000187820 [0,1,0,0,0,0|1,0,2]=4 232 B12R1.1020 CC1CCCN(CC1)CC(=O)N 34a_100025706717_100000187820 [0,1,0,0,0,0|1,0,2]=4 233 B12R1.1020 CC1CCCN(CC1)CC(=O)[O-] 269982a_100025706717_100020667443 [0,1,0,0,0,0|1,0,2]=4 234 B12R1.1020 CC1CCCN(CC1)CC(=O)[O-] 34a_100025706717_100020667443 [0,1,0,0,0,0|1,0,2]=4 235 B12R1.1020 CC1CCCN(CC1)CC(F)F 2230a_100025706717_100011934356 [0,1,0,0,0,0|2,0,0]=3 236 B12R1.1020 CC1CCCN(CC1)CC(F)F 269982a_100025706717_100011934356 [0,1,0,0,0,0|2,0,0]=3 237 B12R1.1020 CC1CCCN(CC1)CC(F)F 34a_100025706717_100011934356 [0,1,0,0,0,0|2,0,0]=3 238 B12R1.1020 CC1CCCN(CC1)C[C@@H](C)O 2230a_100025706717_100009817552 [0,1,0,0,0,0|0,0,0]=1 239 B12R1.1020 CC1CCCN(CC1)C[C@@H](C)O 269982a_100025706717_100009817552 [0,1,0,0,0,0|0,0,0]=1 240 B12R1.1020 CC1CCCN(CC1)C[C@@H](C)O 34a_100025706717_100009817552 [0,1,0,0,0,0|0,0,0]=1 241 B12R1.1020 CC1CCCN(CC1)C[N+](=O)[O-] 269982a_100025706717_100000761209 [0,1,0,0,0,0|2,0,1]=4 242 B12R1.1020 CC1CCCN(CC1)C[N+](=O)[O-] 34a_100025706717_100000761209 [0,1,0,0,0,0|2,0,1]=4 243 B12R1.1020 CN1CCCN(CC1)CC(F)F 2230a_100000211313_100011934356 [0,1,0,0,0,0|3,0,0]=4 244 B12R1.1020 CN1CCCN(CC1)CC(F)F 269982a_100000211313_100011934356 [0,1,0,0,0,0|3,0,0]=4 245 B12R1.1020 C[C@@H](O)CN1CCCC(CC1)O 2230a_100015186869_100009817552 [0,1,0,0,0,0|0,0,0]=1 246 B12R1.1020 C[C@@H](O)CN1CCCC(CC1)O 269982a_100015186869_100009817552 [0,1,0,0,0,0|0,0,0]=1 247 B12R1.1020 C[C@@H](O)CN1CCCN(CC1)C 2230a_100000211313_100009817552 [0,1,0,0,0,0|1,0,0]=2 248 B12R1.1020 C[C@@H](O)CN1CCCN(CC1)C 269982a_100000211313_100009817552 [0,1,0,0,0,0|1,0,0]=2 249 B12R1.1020 C[C@@H](O)CN1CCNC(=O)CC1 2230a_100000698595_100009817552 [0,1,0,0,0,0|1,0,1]=3 250 B12R1.1020 C[C@@H](O)CN1CCNC(=O)CC1 269982a_100000698595_100009817552 [0,1,0,0,0,0|1,0,1]=3 251 B12R1.1020 NC(=O)CN1CCCC(CC1)O 2230a_100015186869_100000747473 [0,1,0,0,0,0|1,0,2]=4 252 B12R1.1020 NC(=O)CN1CCCC(CC1)O 269982a_100015186869_100000187820 [0,1,0,0,0,0|1,0,2]=4 253 B12R1.1020 O=C([O-])CN1CCCC(CC1)O 269982a_100015186869_100020667443 [0,1,0,0,0,0|1,0,2]=4 254 B12R1.1020 O=[N+]([O-])CN1CCCC(CC1)O 269982a_100015186869_100000761209 [0,1,0,0,0,0|2,0,1]=4 255 B12R1.1020 OC1CCCN(CC1)CC(F)F 2230a_100015186869_100011934356 [0,1,0,0,0,0|2,0,0]=3 256 B12R1.1020 OC1CCCN(CC1)CC(F)F 269982a_100015186869_100011934356 [0,1,0,0,0,0|2,0,0]=3 257 B12R1.1748 C#CC(C)NC1CCCCCC1 270004a_100000707721_100000210131 [0,1,0,0,0,0|3,0,0]=4 258 B12R1.1748 C#CC(C)NC1CCCCCC1 34a_100000210984_200000035995 [0,1,0,0,0,0|3,0,0]=4 259 B12R1.1748 C#CC(C)NC1CCCCCC1 34a_100000707721_100011217769 [0,1,0,0,0,0|3,0,0]=4 260 B12R1.1748 C#CC(C)OC1CCCCCC1 34a_100000210887_200000035995 [0,1,0,0,0,0|3,0,0]=4 261 B12R1.1748 C#CC(C)SC1CCCCCC1 62a_200000035995_100011217769 [0,1,0,0,0,0|3,0,0]=4 262 B12R1.1748 C#C[C@@H](C)OC1CCCCCC1 34a_100009815206_100011217769 [0,1,0,0,0,0|3,0,0]=4 263 B12R1.1748 C=C(C#N)CN1CCCCCC1 2230a_100000185865_100000694840 [0,1,0,0,0,0|1,0,2]=4 264 B12R1.1748 C=C(C#N)CN1CCCCCC1 269982a_100000185865_100000694840 [0,1,0,0,0,0|1,0,2]=4 265 B12R1.1748 C=C(C#N)CN1CCCCCC1 34a_100000185865_100000694840 [0,1,0,0,0,0|1,0,2]=4 266 B12R1.1748 C=CC(C)OC1CCCCCC1 34a_100000695699_100011217769 [0,1,0,0,0,0|3,0,0]=4 267 B12R1.1748 C=CC(C)SC1CCCCCC1 62a_100011215867_100011217769 [0,1,0,0,0,0|3,0,0]=4 268 B12R1.1748 C=CC(O)CN1CCCCCC1 2230a_100000185865_100000730141 [0,1,0,0,0,0|0,0,1]=2 269 B12R1.1748 C=CC(O)CN1CCCCCC1 34a_100000185865_100000730141 [0,1,0,0,0,0|0,0,1]=2 270 B12R1.1748 C=CC(O)CN1CCCOCC1 2230a_100000685342_100000730141 [0,1,0,0,0,0|1,0,1]=3 271 B12R1.1748 C=CC(O)CN1CCCOCC1 34a_100000685342_100000730141 [0,1,0,0,0,0|1,0,1]=3 272 B12R1.1748 CC(C#N)NC1CCCCCC1 2230a_100000210984_100000184139 [0,1,0,0,0,0|3,0,0]=4 273 B12R1.1748 CC(C#N)OC1CCCCCC1 34a_100011218135_100011217769 [0,1,0,0,0,0|3,0,0]=4 274 B12R1.1748 CC(C#N)OC1CCCCCC1 7a_100000210887_100000703298 [0,1,0,0,0,0|3,0,0]=4 275 B12R1.1748 CC(C#N)SC1CCCCCC1 62a_100000703298_100011217769 [0,1,0,0,0,0|3,0,0]=4 276 B12R1.1748 CC(C#N)SC1CCCCCC1 62a_100011217769_100000703298 [0,1,0,0,0,0|3,0,0]=4 277 B12R1.1748 CC(CF)OC1CCCCCC1 34a_100016041109_100011217769 [0,1,0,0,0,0|3,0,0]=4 278 B12R1.1748 CC(CN)OC1CCCCCC1 34a_100000210904_100011217769 [0,1,0,0,0,0|3,0,0]=4 279 B12R1.1748 CC(CO)NC1CCCCCC1 2230a_100000210984_100012180447 [0,1,0,0,0,0|2,0,0]=3 280 B12R1.1748 CC(CO)NC1CCCCCC1 34a_100000210984_100012180447 [0,1,0,0,0,0|2,0,0]=3 281 B12R1.1748 CC(CO)OC1CCCCCC1 34a_100000210887_100012180447 [0,1,0,0,0,0|2,0,0]=3 282 B12R1.1748 CC(CO)OC1CCCCCC1 7a_100000210887_100012180447 [0,1,0,0,0,0|2,0,0]=3 283 B12R1.1748 CC(CO)SC1CCCCCC1 62a_100012180447_100011217769 [0,1,0,0,0,0|2,0,0]=3 284 B12R1.1748 CCC(=O)CC1CCCCCC1 1458a_100000210414_200000696569 [0,1,0,0,0,0|1,0,2]=4 285 B12R1.1748 CCC(=O)CC1CCCCCC1 1458a_100000685095_100000210202 [0,1,0,0,0,0|1,0,2]=4 286 B12R1.1748 CCC(=O)CN1CCCCCC1 1458a_100000740298_100000210202 [0,1,0,0,0,0|0,0,2]=3 287 B12R1.1748 CCC(=O)CN1CCCCCC1 269982a_100000185865_100000747405 [0,1,0,0,0,0|0,0,2]=3 288 B12R1.1748 CCC(=O)CN1CCCOCC1 269982a_100000685342_100000747405 [0,1,0,0,0,0|1,0,2]=4 289 B12R1.1748 CCC(C)CN1CCCCCC1 2230a_100000185865_100000748023 [0,1,0,0,0,0|1,0,0]=2 290 B12R1.1748 CCC(C)CN1CCCCCC1 269982a_100000185865_100000748023 [0,1,0,0,0,0|1,0,0]=2 291 B12R1.1748 CCC(C)CN1CCCCCC1 270004a_100000185865_100000243153 [0,1,0,0,0,0|1,0,0]=2 292 B12R1.1748 CCC(C)CN1CCCCCC1 34a_100000185865_100000748023 [0,1,0,0,0,0|1,0,0]=2 293 B12R1.1748 CCC(C)CN1CCCOCC1 2230a_100000685342_100000748023 [0,1,0,0,0,0|2,0,0]=3 294 B12R1.1748 CCC(C)CN1CCCOCC1 269982a_100000685342_100000748023 [0,1,0,0,0,0|2,0,0]=3 295 B12R1.1748 CCC(C)CN1CCCOCC1 270004a_100000685342_100000243153 [0,1,0,0,0,0|2,0,0]=3 296 B12R1.1748 CCC(C)CN1CCCOCC1 34a_100000685342_100000748023 [0,1,0,0,0,0|2,0,0]=3 297 B12R1.1748 CCC(C)NC1CCCCCC1 2230a_100000210984_100000758301 [0,1,0,0,0,0|3,0,0]=4 298 B12R1.1748 CCC(C)NC1CCCCCC1 270004a_100000209981_100000210131 [0,1,0,0,0,0|3,0,0]=4 299 B12R1.1748 CCC(C)NC1CCCCCC1 34a_100000210984_100011215416 [0,1,0,0,0,0|3,0,0]=4 300 B12R1.1748 CCC(C)OC1CCCCCC1 34a_100000210887_100011215416 [0,1,0,0,0,0|3,0,0]=4 301 B12R1.1748 CCC(C)OC1CCCCCC1 7a_100000210887_100000758301 [0,1,0,0,0,0|3,0,0]=4 302 B12R1.1748 CCC(C)SC1CCCCCC1 62a_100000758301_100011217769 [0,1,0,0,0,0|3,0,0]=4 303 B12R1.1748 CCC(C)SC1CCCCCC1 62a_100011217769_100000758301 [0,1,0,0,0,0|3,0,0]=4 304 B12R1.1748 CCC(O)CN1CCCCCC1 2230a_100000185865_100011218378 [0,1,0,0,0,0|0,0,0]=1 305 B12R1.1748 CCC(O)CN1CCCCCC1 269982a_100000185865_100011218378 [0,1,0,0,0,0|0,0,0]=1 306 B12R1.1748 CCC(O)CN1CCCCCC1 34a_100000185865_100011218378 [0,1,0,0,0,0|0,0,0]=1 307 B12R1.1748 CCC(O)CN1CCCOCC1 2230a_100000685342_100011218378 [0,1,0,0,0,0|1,0,0]=2 308 B12R1.1748 CCC(O)CN1CCCOCC1 269982a_100000685342_100011218378 [0,1,0,0,0,0|1,0,0]=2 309 B12R1.1748 CCC(O)CN1CCCOCC1 34a_100000685342_100011218378 [0,1,0,0,0,0|1,0,0]=2 310 B12R1.1748 CCN(C)CC1CCCCCC1 2230a_100000225621_200000696569 [0,1,0,0,0,0|3,0,0]=4 311 B12R1.1748 CCN(C)CC1CCCCCC1 269982a_100000225621_200000696569 [0,1,0,0,0,0|3,0,0]=4 312 B12R1.1748 CC[C@H](C)CN1CCCCCC1 2230a_100000185865_100009816398 [0,1,0,0,0,0|1,0,0]=2 313 B12R1.1748 CC[C@H](C)CN1CCCCCC1 269982a_100000185865_100009816398 [0,1,0,0,0,0|1,0,0]=2 314 B12R1.1748 CC[C@H](C)CN1CCCCCC1 34a_100000185865_100009816398 [0,1,0,0,0,0|1,0,0]=2 315 B12R1.1748 CC[C@H](C)CN1CCCOCC1 2230a_100000685342_100009816398 [0,1,0,0,0,0|2,0,0]=3 316 B12R1.1748 CC[C@H](C)CN1CCCOCC1 269982a_100000685342_100009816398 [0,1,0,0,0,0|2,0,0]=3 317 B12R1.1748 CC[C@H](C)CN1CCCOCC1 34a_100000685342_100009816398 [0,1,0,0,0,0|2,0,0]=3 318 B12R1.1748 CNC(=O)CC1CCCCCC1 11a_106832991635_100000685095 [0,1,0,0,0,0|1,0,2]=4 319 B12R1.1748 CNC(=O)CC1CCCCCC1 1626a_100102657272_100000685095 [0,1,0,0,0,0|1,0,2]=4 320 B12R1.1748 CNC(=O)CC1CCCCCC1 240690a_100102657272_100000685095 [0,1,0,0,0,0|1,0,2]=4 321 B12R1.1748 CNC(=O)CC1CCCCCC1 527a_100102657272_100000685095 [0,1,0,0,0,0|1,0,2]=4 322 B12R1.1748 CNC(=O)CN1CCCCCC1 11a_106832991635_100000740298 [0,1,0,0,0,0|0,0,2]=3 323 B12R1.1748 CNC(=O)CN1CCCCCC1 2230a_100000185865_100000183359 [0,1,0,0,0,0|0,0,2]=3 324 B12R1.1748 CNC(=O)CN1CCCCCC1 240690a_100102657272_100000740298 [0,1,0,0,0,0|0,0,2]=3 325 B12R1.1748 CNC(=O)CN1CCCCCC1 269982a_100000185865_100000183359 [0,1,0,0,0,0|0,0,2]=3 326 B12R1.1748 CNC(=O)CN1CCCCCC1 34a_100000185865_100000183359 [0,1,0,0,0,0|0,0,2]=3 327 B12R1.1748 CNC(=O)CN1CCCCCC1 527a_100102657272_100000740298 [0,1,0,0,0,0|0,0,2]=3 328 B12R1.1748 CNC(=O)CN1CCCOCC1 2230a_100000685342_100000183359 [0,1,0,0,0,0|1,0,2]=4 329 B12R1.1748 CNC(=O)CN1CCCOCC1 269982a_100000685342_100000183359 [0,1,0,0,0,0|1,0,2]=4 330 B12R1.1748 CNC(=O)CN1CCCOCC1 34a_100000685342_100000183359 [0,1,0,0,0,0|1,0,2]=4 331 B12R1.1748 COC(=O)CN1CCCCCC1 2230a_100000185865_100000747449 [0,1,0,0,0,0|0,0,2]=3 332 B12R1.1748 COC(=O)CN1CCCCCC1 269982a_100000185865_100000747449 [0,1,0,0,0,0|0,0,2]=3 333 B12R1.1748 COC(=O)CN1CCCCCC1 34a_100000185865_100000747449 [0,1,0,0,0,0|0,0,2]=3 334 B12R1.1748 COC(=O)CN1CCCOCC1 2230a_100000685342_100000747449 [0,1,0,0,0,0|1,0,2]=4 335 B12R1.1748 COC(=O)CN1CCCOCC1 269982a_100000685342_100000747449 [0,1,0,0,0,0|1,0,2]=4 336 B12R1.1748 COC(=O)CN1CCCOCC1 34a_100000685342_100000747449 [0,1,0,0,0,0|1,0,2]=4 337 B12R1.1748 COC(C)SC1CCCCCC1 62a_100009879195_100011217769 [0,1,0,0,0,0|2,0,0]=3 338 B12R1.1748 COC(C)SC1CCCCCC1 62a_100011217769_100009879195 [0,1,0,0,0,0|2,0,0]=3 339 B12R1.1748 C[C@@H](CO)CN1CCCCCC1 2230a_100000185865_100000059175 [0,1,0,0,0,0|0,0,0]=1 340 B12R1.1748 C[C@@H](CO)CN1CCCCCC1 269982a_100000185865_100000059175 [0,1,0,0,0,0|0,0,0]=1 341 B12R1.1748 C[C@@H](CO)CN1CCCCCC1 34a_100000185865_100000059175 [0,1,0,0,0,0|0,0,0]=1 342 B12R1.1748 C[C@@H](CO)CN1CCCOCC1 2230a_100000685342_100000059175 [0,1,0,0,0,0|1,0,0]=2 343 B12R1.1748 C[C@@H](CO)CN1CCCOCC1 269982a_100000685342_100000059175 [0,1,0,0,0,0|1,0,0]=2 344 B12R1.1748 C[C@@H](CO)CN1CCCOCC1 34a_100000685342_100000059175 [0,1,0,0,0,0|1,0,0]=2 345 B12R1.1748 C[C@H](CF)NC1CCCCCC1 270004a_100102880703_100000210131 [0,1,0,0,0,0|3,0,0]=4 346 B12R1.1748 C[C@H](CO)NC1CCCCCC1 270004a_100000737577_100000210131 [0,1,0,0,0,0|2,0,0]=3 347 B12R1.1748 C[C@H](CO)NC1CCCNCC1 270004a_100000737577_100015187895 [0,1,0,0,0,0|3,0,0]=4 348 B12R1.1748 C[C@H](CO)SC1CCCCCC1 62a_100011217769_100016084084 [0,1,0,0,0,0|2,0,0]=3 349 B12R1.1748 C[C@H](CO)SC1CCCCCC1 62a_100016084084_100011217769 [0,1,0,0,0,0|2,0,0]=3 350 B12R1.1748 O=C(CF)CC1CCCCCC1 1458a_100000685095_100015361967 [0,1,0,0,0,0|1,0,2]=4 351 B12R1.1748 O=C(CF)CN1CCCCCC1 1458a_100000740298_100015361967 [0,1,0,0,0,0|0,0,2]=3 352 B12R1.1748 O=C(CO)CC1CCCCCC1 1458a_100000210174_200000696569 [0,1,0,0,0,0|1,0,2]=4 353 B12R1.1748 OCC(O)CN1CCCCCC1 2230a_100000185865_100011219619 [0,1,0,0,0,0|0,0,0]=1 354 B12R1.1748 OCC(O)CN1CCCCCC1 34a_100000185865_100011219619 [0,1,0,0,0,0|0,0,0]=1 355 B12R1.1748 OCC(O)CN1CCCOCC1 2230a_100000685342_100011219619 [0,1,0,0,0,0|1,0,0]=2 356 B12R1.1748 OCC(O)CN1CCCOCC1 34a_100000685342_100011219619 [0,1,0,0,0,0|1,0,0]=2 357 B12R1.1748 OC[C@H](O)CN1CCCCCC1 2230a_100000185865_100009815848 [0,1,0,0,0,0|0,0,0]=1 358 B12R1.1748 OC[C@H](O)CN1CCCCCC1 34a_100000185865_100009815848 [0,1,0,0,0,0|0,0,0]=1 359 B12R1.1748 OC[C@H](O)CN1CCCOCC1 2230a_100000685342_100009815848 [0,1,0,0,0,0|1,0,0]=2 360 B12R1.1748 OC[C@H](O)CN1CCCOCC1 34a_100000685342_100009815848 [0,1,0,0,0,0|1,0,0]=2 361 B12R1.1748 O[C@@H](CF)CN1CCCCCC1 2230a_100000185865_100015614560 [0,1,0,0,0,0|0,0,0]=1 362 B12R1.1748 O[C@@H](CF)CN1CCCCCC1 34a_100000185865_100015614560 [0,1,0,0,0,0|0,0,0]=1 363 B12R1.1748 O[C@@H](CF)CN1CCCOCC1 2230a_100000685342_100015614560 [0,1,0,0,0,0|1,0,0]=2 364 B12R1.1748 O[C@@H](CF)CN1CCCOCC1 34a_100000685342_100015614560 [0,1,0,0,0,0|1,0,0]=2 365 B12R1.1829 CC(C)NC1(CCCCCC1)C 2230a_100000704638_100000210206 [0,1,0,0,0,0|3,0,0]=4 366 B12R1.1829 CC(C)NC1(CCCCCC1)C 34a_100000704638_100000210206 [0,1,0,0,0,0|3,0,0]=4 367 B12R1.1829 CC(C)OC1(CCCCCC1)C 34a_100000708895_100000210206 [0,1,0,0,0,0|3,0,0]=4 368 B12R1.1829 CC(C)OC1(CCCCCC1)C 7a_100000708895_100000210206 [0,1,0,0,0,0|3,0,0]=4 369 B12R1.2197 C=C(C)C(=O)N1CCCCCC1 11a_100000185865_100000185857 [0,1,0,0,0,0|1,0,2]=4 370 B12R1.2197 C=C(C)C(=O)N1CCCCCC1 1626a_100000185865_100000185857 [0,1,0,0,0,0|1,0,2]=4 371 B12R1.2197 CC(=O)C(C)N1CCCCCC1 1458a_100000755792_200000210301 [0,1,0,0,0,0|0,0,2]=3 372 B12R1.2197 CC(=O)C(C)N1CCCCCC1 2230a_100000185865_100009814033 [0,1,0,0,0,0|0,0,2]=3 373 B12R1.2197 CC(=O)C(C)N1CCCCCC1 269982a_100000185865_100009814033 [0,1,0,0,0,0|0,0,2]=3 374 B12R1.2197 CC(=O)C(C)N1CCCOCC1 2230a_100000685342_100009814033 [0,1,0,0,0,0|1,0,2]=4 375 B12R1.2197 CC(=O)C(C)N1CCCOCC1 269982a_100000685342_100009814033 [0,1,0,0,0,0|1,0,2]=4 376 B12R1.2197 CC(C(=O)N)N1CCCCCC1 2230a_100000185865_100000702099 [0,1,0,0,0,0|1,0,2]=4 377 B12R1.2197 CC(C(=O)N)N1CCCCCC1 269982a_100000185865_100000184083 [0,1,0,0,0,0|1,0,2]=4 378 B12R1.2197 CC(C(=O)N)N1CCCCCC1 34a_100000185865_100000702099 [0,1,0,0,0,0|1,0,2]=4 379 B12R1.2197 CC(C(=O)[13CH3])N1CCCCCC1 1458a_100000755792_200025704644 [0,1,0,0,0,0|0,0,2]=3 380 B12R1.2197 CC(C)C(=O)C1CCCCCC1 1458a_100000210198_100011217769 [0,1,0,0,0,0|2,0,1]=4 381 B12R1.2197 CC(C)C(=O)C1CCCCCC1 1458a_100000749507_100000210206 [0,1,0,0,0,0|2,0,1]=4 382 B12R1.2197 CC(C)C(=O)N1CCCCCC1 11a_100000185865_100000210198 [0,1,0,0,0,0|1,0,1]=3 383 B12R1.2197 CC(C)C(=O)N1CCCCCC1 1626a_100000185865_100000210198 [0,1,0,0,0,0|1,0,1]=3 384 B12R1.2197 CC(C)C(=O)N1CCCCCC1 240690a_100000185865_100000210198 [0,1,0,0,0,0|1,0,1]=3 385 B12R1.2197 CC(C)C(=O)N1CCCCCC1 527a_100000185865_100000210198 [0,1,0,0,0,0|1,0,1]=3 386 B12R1.2197 CC(C)C(=O)N1CCCOCC1 11a_100000685342_100000210198 [0,1,0,0,0,0|2,0,1]=4 387 B12R1.2197 CC(C)C(=O)N1CCCOCC1 1626a_100000685342_100000210198 [0,1,0,0,0,0|2,0,1]=4 388 B12R1.2197 CC(C)C(=O)N1CCCOCC1 240690a_100000685342_100000210198 [0,1,0,0,0,0|2,0,1]=4 389 B12R1.2197 CC(C)C(=O)N1CCCOCC1 527a_100000685342_100000210198 [0,1,0,0,0,0|2,0,1]=4 390 B12R1.2197 CC(C)N(C)C1CCCCCC1 2230a_100015185097_100000210206 [0,1,0,0,0,0|3,0,0]=4 391 B12R1.2197 CC(C)N(C)C1CCCCCC1 269982a_100000200198_200000210301 [0,1,0,0,0,0|3,0,0]=4 392 B12R1.2197 CC(C)N(C)C1CCCCCC1 269982a_100015185097_100000210206 [0,1,0,0,0,0|3,0,0]=4 393 B12R1.2197 CC(C)N(C)C1CCCCCC1 269982a_200000211004_100011217769 [0,1,0,0,0,0|3,0,0]=4 394 B12R1.2197 CC(C)N(C)C1CCCCCC1 270004a_200000211004_100000210131 [0,1,0,0,0,0|3,0,0]=4 395 B12R1.2197 CC(C)N(C)C1CCCCCC1 34a_100000200198_200000210301 [0,1,0,0,0,0|3,0,0]=4 396 B12R1.2197 CC(C)N(C)C1CCCCCC1 34a_100015185097_100000210206 [0,1,0,0,0,0|3,0,0]=4 397 B12R1.2197 CC(C)N([13CH3])C1CCCCCC1 269982a_100000200198_200025704644 [0,1,0,0,0,0|3,0,0]=4 398 B12R1.2197 CC(C)N([13CH3])C1CCCCCC1 34a_100000200198_200025704644 [0,1,0,0,0,0|3,0,0]=4 399 B12R1.2197 CC(F)C(=O)C1CCCCCC1 1458a_100000062450_100011217769 [0,1,0,0,0,0|2,0,1]=4 400 B12R1.2197 CC(F)C(=O)N1CCCCCC1 11a_100000185865_100000062450 [0,1,0,0,0,0|1,0,1]=3 401 B12R1.2197 CC(F)C(=O)N1CCCCCC1 1626a_100000185865_100000062450 [0,1,0,0,0,0|1,0,1]=3 402 B12R1.2197 CC(F)C(=O)N1CCCCCC1 240690a_100000185865_100000062450 [0,1,0,0,0,0|1,0,1]=3 403 B12R1.2197 CC(F)C(=O)N1CCCCCC1 527a_100000185865_100000062450 [0,1,0,0,0,0|1,0,1]=3 404 B12R1.2197 CC(F)C(=O)N1CCCOCC1 11a_100000685342_100000062450 [0,1,0,0,0,0|2,0,1]=4 405 B12R1.2197 CC(F)C(=O)N1CCCOCC1 1626a_100000685342_100000062450 [0,1,0,0,0,0|2,0,1]=4 406 B12R1.2197 CC(F)C(=O)N1CCCOCC1 240690a_100000685342_100000062450 [0,1,0,0,0,0|2,0,1]=4 407 B12R1.2197 CC(F)C(=O)N1CCCOCC1 527a_100000685342_100000062450 [0,1,0,0,0,0|2,0,1]=4 408 B12R1.2197 C[C@@H](O)C(=O)C1CCCCCC1 1458a_100000717761_100011217769 [0,1,0,0,0,0|1,0,1]=3 409 B12R1.2197 C[C@@H](O)C(=O)N1CCCCCC1 240690a_100000185865_100000717761 [0,1,0,0,0,0|0,0,1]=2 410 B12R1.2197 C[C@@H](O)C(=O)N1CCCOCC1 240690a_100000685342_100000717761 [0,1,0,0,0,0|1,0,1]=3 411 B12R1.2197 C[C@H](O)C(=O)C1CCCCCC1 1458a_217856618621_100011217769 [0,1,0,0,0,0|1,0,1]=3 412 B12R1.2197 C[C@H](O)C(=O)N1CCCCCC1 1626a_100000185865_217856618621 [0,1,0,0,0,0|0,0,1]=2 413 B12R1.2197 C[C@H](O)C(=O)N1CCCCCC1 240690a_100000185865_217856618621 [0,1,0,0,0,0|0,0,1]=2 414 B12R1.2197 C[C@H](O)C(=O)N1CCCOCC1 1626a_100000685342_217856618621 [0,1,0,0,0,0|1,0,1]=3 415 B12R1.2197 C[C@H](O)C(=O)N1CCCOCC1 240690a_100000685342_217856618621 [0,1,0,0,0,0|1,0,1]=3 416 B12R1.2197 NC(=O)C(F)N1CCCCCC1 2230a_100000185865_100009813875 [0,1,0,0,0,0|1,0,2]=4 417 B12R1.2197 NC(=O)C(F)N1CCCCCC1 269982a_100000185865_100009813875 [0,1,0,0,0,0|1,0,2]=4 418 B12R1.2197 NC(=O)C(F)N1CCCCCC1 34a_100000185865_100009813875 [0,1,0,0,0,0|1,0,2]=4 419 B12R1.2197 O=C(C(F)F)N1CCCCCC1 11a_100000185865_100000210393 [0,1,0,0,0,0|2,0,1]=4 420 B12R1.2197 O=C(C(F)F)N1CCCCCC1 1626a_100000185865_100000210393 [0,1,0,0,0,0|2,0,1]=4 421 B12R1.2197 O=C(C(F)F)N1CCCCCC1 240690a_100000185865_100000210393 [0,1,0,0,0,0|2,0,1]=4 422 B12R1.2197 O=C(C(F)F)N1CCCCCC1 527a_100000185865_100000210393 [0,1,0,0,0,0|2,0,1]=4 423 B12R1.2197 O=C(C(O)O)C1CCCCCC1 1458a_100000233687_100011217769 [0,1,0,0,0,0|2,0,1]=4 424 B12R1.2197 O=C(C(O)O)N1CCCCCC1 240690a_100000185865_100000233687 [0,1,0,0,0,0|1,0,1]=3 425 B12R1.2197 O=C(C(O)O)N1CCCOCC1 240690a_100000685342_100000233687 [0,1,0,0,0,0|2,0,1]=4 426 B12R1.2197 O=C([O-])C(F)N1CCCCCC1 34a_100000185865_100020610796 [0,1,0,0,0,0|1,0,2]=4 427 B12R1.2240 CC(C)(C)CN1CCCCCC1 270004a_100000185865_100011204126 [0,1,0,0,0,0|1,0,0]=2 428 B12R1.2240 CC(C)(C)CN1CCCCCC1 34a_100000185865_100011219605 [0,1,0,0,0,0|1,0,0]=2 429 B12R1.2240 CC(C)(C)CN1CCCOCC1 270004a_100000685342_100011204126 [0,1,0,0,0,0|2,0,0]=3 430 B12R1.2240 CC(C)(C)CN1CCCOCC1 34a_100000685342_100011219605 [0,1,0,0,0,0|2,0,0]=3 431 B12R1.2240 CC(C)(C)NC1CCCCCC1 34a_100000210984_100000210625 [0,1,0,0,0,0|3,0,0]=4 432 B12R1.2240 CC(C)(C)OC1CCCCCC1 34a_100000210887_100000210625 [0,1,0,0,0,0|3,0,0]=4 433 B12R1.2240 CC(C)(C)OC1CCCCCC1 34a_100015890283_100011217769 [0,1,0,0,0,0|3,0,0]=4 434 B12R1.2240 CC(C)(C)SC1CCCCCC1 62a_100000211941_100011217769 [0,1,0,0,0,0|3,0,0]=4 435 B12R1.2240 CC(C)(C)SC1CCCCCC1 62a_100011217769_100000211941 [0,1,0,0,0,0|3,0,0]=4 436 B12R1.2240 CC(C)(F)CN1CCCCCC1 34a_100000185865_100011997219 [0,1,0,0,0,0|1,0,0]=2 437 B12R1.2240 CC(C)(F)CN1CCCOCC1 34a_100000685342_100011997219 [0,1,0,0,0,0|2,0,0]=3 438 B12R1.2240 CC(C)(O)CN1CCCCCC1 34a_100000185865_100000764493 [0,1,0,0,0,0|0,0,0]=1 439 B12R1.2240 CC(C)(O)CN1CCCOCC1 34a_100000685342_100000764493 [0,1,0,0,0,0|1,0,0]=2 440 B12R1.2240 C[N+](C)(C)CN1CCCCCC1 269982a_100000185865_200000036245 [0,1,0,0,0,0|2,0,0]=3 441 B12R1.2240 C[N+](C)(C)CN1CCCOCC1 269982a_100000685342_200000036245 [0,1,0,0,0,0|3,0,0]=4 442 B12R1.2240 C[Si](C)(C)CN1CCCCCC1 2230a_100000185865_100000037933 [0,1,0,0,0,0|1,1,0]=3 443 B12R1.2240 C[Si](C)(C)CN1CCCOCC1 2230a_100000685342_100000037933 [0,1,0,0,0,0|2,1,0]=4 444 B12R1.2240 FC(F)(F)CN1CCCCCC1 2230a_100000185865_100000763148 [0,1,0,0,0,0|2,0,0]=3 445 B12R1.2240 FC(F)(F)CN1CCCOCC1 2230a_100000685342_100000763148 [0,1,0,0,0,0|3,0,0]=4 446 B12R1.2240 O=S(=O)([O-])CN1CCCCCC1 34a_100000185865_100009817235 [0,1,0,0,0,0|2,0,1]=4 447 B10R0.4 C#CCCCCNCC(C)C 2230a_100000210953_100010269958 [0,0,1,0,0,0|1,0,2]=4 448 B10R0.4 C#CCCCCNCC(C)C 2230a_100000706060_100000210760 [0,0,1,0,0,0|1,0,2]=4 449 B10R0.4 C#CCCCCNCC(C)C 34a_100000210953_100010269958 [0,0,1,0,0,0|1,0,2]=4 450 B10R0.4 C#CCCCCNCC(C)C 34a_100000706060_100000210624 [0,0,1,0,0,0|1,0,2]=4 451 B10R0.4 C#CCCCCNCC(C)O 2230a_100000210904_100010269958 [0,0,1,0,0,0|0,0,2]=3 452 B10R0.4 C#CCCCCNCC(C)O 2230a_100000706060_100011218427 [0,0,1,0,0,0|0,0,2]=3 453 B10R0.4 C#CCCCCNCC(C)O 34a_100000210904_100010269958 [0,0,1,0,0,0|0,0,2]=3 454 B10R0.4 C#CCCCCNCC(C)O 34a_100000706060_100011218427 [0,0,1,0,0,0|0,0,2]=3 455 B10R0.4 C#CCCCCNC[C@@H](C)O 2230a_100000706060_100009817552 [0,0,1,0,0,0|0,0,2]=3 456 B10R0.4 C#CCCCCNC[C@@H](C)O 34a_100000706060_100009817552 [0,0,1,0,0,0|0,0,2]=3 457 B10R0.4 C#CCCCCOCC(C)O 34a_100000766709_100011218427 [0,0,1,0,0,0|1,0,2]=4 458 B10R0.4 C#CCCCCOCC(C)O 7a_100000766709_100011218427 [0,0,1,0,0,0|1,0,2]=4 459 B10R0.4 C#CCCCCOC[C@@H](C)O 34a_100000766709_100009817552 [0,0,1,0,0,0|1,0,2]=4 460 B10R0.4 C#CCCCCOC[C@@H](C)O 7a_100000766709_100009817552 [0,0,1,0,0,0|1,0,2]=4 461 B10R0.4 C#CCCCCSCC(C)O 62a_100010269958_100011218427 [0,0,1,0,0,0|1,0,2]=4 462 B10R0.4 C#CCCCCSCC(C)O 62a_100011218427_100010269958 [0,0,1,0,0,0|1,0,2]=4 463 B10R0.4 C#CCCCCSC[C@@H](C)O 62a_100009817552_100010269958 [0,0,1,0,0,0|1,0,2]=4 464 B10R0.4 C#CCCCCSC[C@@H](C)O 62a_100010269958_100009817552 [0,0,1,0,0,0|1,0,2]=4 465 B10R0.4 C#CCOCCNCC(C)O 2230a_100000210904_100010402529 [0,0,1,0,0,0|1,0,2]=4 466 B10R0.4 C#CCOCCNCC(C)O 2230a_100000700922_100011218427 [0,0,1,0,0,0|1,0,2]=4 467 B10R0.4 C#CCOCCNCC(C)O 34a_100000210904_100010402529 [0,0,1,0,0,0|1,0,2]=4 468 B10R0.4 C#CCOCCNCC(C)O 34a_100000700922_100011218427 [0,0,1,0,0,0|1,0,2]=4 469 B10R0.4 C#CCOCCNC[C@@H](C)O 2230a_100000700922_100009817552 [0,0,1,0,0,0|1,0,2]=4 470 B10R0.4 C#CCOCCNC[C@@H](C)O 34a_100000700922_100009817552 [0,0,1,0,0,0|1,0,2]=4 471 B10R0.4 C=C(C)CNCCCCCC 2230a_100000210581_100000748629 [0,0,1,0,0,0|1,0,1]=3 472 B10R0.4 C=C(C)CNCCCCCO 2230a_100000762737_100000748629 [0,0,1,0,0,0|2,0,1]=4 473 B10R0.4 C=C(C)CNCCCCCO 34a_100000762737_100000748629 [0,0,1,0,0,0|2,0,1]=4 474 B10R0.4 C=C(C)CNCCCOCC 2230a_100000210961_100000748629 [0,0,1,0,0,0|2,0,1]=4 475 B10R0.4 C=C(C)CNCCCOCC 34a_100000210961_100000748629 [0,0,1,0,0,0|2,0,1]=4 476 B10R0.4 C=C(C)CNCCOCCC 2230a_100161115042_100000748629 [0,0,1,0,0,0|2,0,1]=4 477 B10R0.4 C=C(C)CNCCOCCC 34a_100161115042_100000748629 [0,0,1,0,0,0|2,0,1]=4 478 B10R0.4 C=C(C)CNCCSCCC 2230a_100020603323_100000748629 [0,0,1,0,0,0|2,0,1]=4 479 B10R0.4 C=C(C)COCCCCCC 34a_100000210245_100000210314 [0,0,1,0,0,0|2,0,1]=4 480 B10R0.4 C=C(C)COCCCCCC 34a_100000210259_100000748629 [0,0,1,0,0,0|2,0,1]=4 481 B10R0.4 C=C(C)COCCCCCC 7a_100000210259_100000748629 [0,0,1,0,0,0|2,0,1]=4 482 B10R0.4 C=C(C)CSCCCCCC 62a_100000210314_100000211660 [0,0,1,0,0,0|2,0,1]=4 483 B10R0.4 C=C(C)CSCCCCCC 62a_100000748629_100000210757 [0,0,1,0,0,0|2,0,1]=4 484 B10R0.4 C=C(F)CNCCCCCC 2230a_100000210581_100009893438 [0,0,1,0,0,0|1,0,2]=4 485 B10R0.4 C=CCCCCNCC(C)C 2230a_100000210953_100011215482 [0,0,1,0,0,0|1,0,2]=4 486 B10R0.4 C=CCCCCNCC(C)C 2230a_100000703577_100000210760 [0,0,1,0,0,0|1,0,2]=4 487 B10R0.4 C=CCCCCNCC(C)C 270004a_100000703577_100000210432 [0,0,1,0,0,0|1,0,2]=4 488 B10R0.4 C=CCCCCNCC(C)C 34a_100000210953_100011215482 [0,0,1,0,0,0|1,0,2]=4 489 B10R0.4 C=CCCCCNCC(C)C 34a_100000703577_100000210624 [0,0,1,0,0,0|1,0,2]=4 490 B10R0.4 C=CCCCCNCC(C)O 2230a_100000210904_100011215482 [0,0,1,0,0,0|0,0,2]=3 491 B10R0.4 C=CCCCCNCC(C)O 2230a_100000703577_100011218427 [0,0,1,0,0,0|0,0,2]=3 492 B10R0.4 C=CCCCCNCC(C)O 34a_100000210904_100011215482 [0,0,1,0,0,0|0,0,2]=3 493 B10R0.4 C=CCCCCNCC(C)O 34a_100000703577_100011218427 [0,0,1,0,0,0|0,0,2]=3 494 B10R0.4 C=CCCCCNC[C@@H](C)O 2230a_100000703577_100009817552 [0,0,1,0,0,0|0,0,2]=3 495 B10R0.4 C=CCCCCNC[C@@H](C)O 34a_100000703577_100009817552 [0,0,1,0,0,0|0,0,2]=3 496 B10R0.4 C=CCCCCOCC(C)O 34a_100000766645_100011218427 [0,0,1,0,0,0|1,0,2]=4 497 B10R0.4 C=CCCCCOCC(C)O 7a_100000766645_100011218427 [0,0,1,0,0,0|1,0,2]=4 498 B10R0.4 C=CCCCCOC[C@@H](C)O 34a_100000766645_100009817552 [0,0,1,0,0,0|1,0,2]=4 499 B10R0.4 C=CCCCCOC[C@@H](C)O 7a_100000766645_100009817552 [0,0,1,0,0,0|1,0,2]=4 500 B10R0.4 C=CCCCCSCC(C)O 62a_100011215482_100011218427 [0,0,1,0,0,0|1,0,2]=4 501 B10R0.4 C=CCCCCSCC(C)O 62a_100011218427_100011215482 [0,0,1,0,0,0|1,0,2]=4 502 B10R0.4 C=CCCCCSC[C@@H](C)O 62a_100009817552_100011215482 [0,0,1,0,0,0|1,0,2]=4 503 B10R0.4 C=CCCCCSC[C@@H](C)O 62a_100011215482_100009817552 [0,0,1,0,0,0|1,0,2]=4 504 B10R0.4 C=COCCCNCC(C)O 2230a_100000210767_100011218427 [0,0,1,0,0,0|1,0,2]=4 505 B10R0.4 C=COCCCNCC(C)O 34a_100000210767_100011218427 [0,0,1,0,0,0|1,0,2]=4 506 B10R0.4 C=COCCCNC[C@@H](C)O 2230a_100000210767_100009817552 [0,0,1,0,0,0|1,0,2]=4 507 B10R0.4 C=COCCCNC[C@@H](C)O 34a_100000210767_100009817552 [0,0,1,0,0,0|1,0,2]=4 508 B10R0.4 CC(Br)COCCCCCF 34a_100012180447_100000729378 [0,0,1,0,0,0|3,0,0]=4 509 B10R0.4 CC(Br)COCCCCCO 34a_100012180447_100000746330 [0,0,1,0,0,0|3,0,0]=4 510 B10R0.4 CC(C)CCCCCCN[13CH3] 2230a_100000211014_200025704644 [0,0,1,0,0,0|3,0,0]=4 511 B10R0.4 CC(C)CCCCCCN[13CH3] 34a_100000211014_200025704644 [0,0,1,0,0,0|3,0,0]=4 512 B10R0.4 CC(C)CNCCCCC#N 2230a_100000210953_100000211819 [0,0,1,0,0,0|2,0,1]=4 513 B10R0.4 CC(C)CNCCCCC#N 270004a_100000751965_100000210432 [0,0,1,0,0,0|2,0,1]=4 514 B10R0.4 CC(C)CNCCCCC=O 2230a_100000210953_100000139335 [0,0,1,0,0,0|2,0,1]=4 515 B10R0.4 CC(C)CNCCCCCF 2230a_100000210953_100000729378 [0,0,1,0,0,0|2,0,0]=3 516 B10R0.4 CC(C)CNCCCCCF 34a_100000210953_100000729378 [0,0,1,0,0,0|2,0,0]=3 517 B10R0.4 CC(C)CNCCCCCO 2230a_100000210953_100000746330 [0,0,1,0,0,0|2,0,0]=3 518 B10R0.4 CC(C)CNCCCCCO 2230a_100000762737_100000210760 [0,0,1,0,0,0|2,0,0]=3 519 B10R0.4 CC(C)CNCCCCCO 270004a_100000762737_100000210432 [0,0,1,0,0,0|2,0,0]=3 520 B10R0.4 CC(C)CNCCCCCO 34a_100000210953_100000746330 [0,0,1,0,0,0|2,0,0]=3 521 B10R0.4 CC(C)CNCCCCCO 34a_100000762737_100000210624 [0,0,1,0,0,0|2,0,0]=3 522 B10R0.4 CC(C)CNCCOCCF 34a_100015185251_100011217306 [0,0,1,0,0,0|3,0,0]=4 523 B10R0.4 CC(C)CNCCOCCO 2230a_100000210953_100011215305 [0,0,1,0,0,0|3,0,0]=4 524 B10R0.4 CC(C)CNCCOCCO 2230a_100000211614_100000210760 [0,0,1,0,0,0|3,0,0]=4 525 B10R0.4 CC(C)CNCCOCCO 270004a_100000211614_100000210432 [0,0,1,0,0,0|3,0,0]=4 526 B10R0.4 CC(C)CNCCOCCO 34a_100000210953_100000692535 [0,0,1,0,0,0|3,0,0]=4 527 B10R0.4 CC(C)CNCCOCCO 34a_100000211614_100000210624 [0,0,1,0,0,0|3,0,0]=4 528 B10R0.4 CC(C)CNCCOCCO 34a_100015185251_100000211926 [0,0,1,0,0,0|3,0,0]=4 529 B10R0.4 CC(C)CNCCSCCO 2230a_100011219999_100000210760 [0,0,1,0,0,0|3,0,0]=4 530 B10R0.4 CC(C)CNCCSCCO 270004a_100011219999_100000210432 [0,0,1,0,0,0|3,0,0]=4 531 B10R0.4 CC(C)COCCCCCBr 34a_100000746331_100000210624 [0,0,1,0,0,0|3,0,0]=4 532 B10R0.4 CC(C)COCCCCCBr 7a_100000746331_100000210760 [0,0,1,0,0,0|3,0,0]=4 533 B10R0.4 CC(C)COCCCCCCl 34a_100000746330_100000210624 [0,0,1,0,0,0|3,0,0]=4 534 B10R0.4 CC(C)COCCCCCCl 7a_100000746330_100000210760 [0,0,1,0,0,0|3,0,0]=4 535 B10R0.4 CC(C)COCCCCCF 34a_100000210257_100000729378 [0,0,1,0,0,0|3,0,0]=4 536 B10R0.4 CC(C)COCCCCCI 34a_200012148887_100000210624 [0,0,1,0,0,0|3,0,0]=4 537 B10R0.4 CC(C)COCCCCCI 7a_200012148887_100000210760 [0,0,1,0,0,0|3,0,0]=4 538 B10R0.4 CC(C)COCCCCCN 34a_100000762737_100000210624 [0,0,1,0,0,0|3,0,0]=4 539 B10R0.4 CC(C)COCCCCCO 34a_100000210257_100000746330 [0,0,1,0,0,0|3,0,0]=4 540 B10R0.4 CC(C)CSCCCCCF 62a_100000210624_100000729378 [0,0,1,0,0,0|3,0,0]=4 541 B10R0.4 CC(C)CSCCCCCF 62a_100000729378_100000210760 [0,0,1,0,0,0|3,0,0]=4 542 B10R0.4 CC(C)CSCCCCCO 62a_100000210624_100000746330 [0,0,1,0,0,0|3,0,0]=4 543 B10R0.4 CC(C)CSCCCCCO 62a_100000746330_100000210760 [0,0,1,0,0,0|3,0,0]=4 544 B10R0.4 CC(F)COCCCCCF 34a_100015925927_100000729378 [0,0,1,0,0,0|3,0,0]=4 545 B10R0.4 CC(F)COCCCCCO 34a_100015925927_100000746330 [0,0,1,0,0,0|3,0,0]=4 546 B10R0.4 CC(O)CCCNCCCF 2230a_100015189416_200000718107 [0,0,1,0,0,0|3,0,0]=4 547 B10R0.4 CC(O)CCCNCCCF 34a_100015189416_200000718107 [0,0,1,0,0,0|3,0,0]=4 548 B10R0.4 CC(O)CCCOCCCBr 34a_100011217188_200000718107 [0,0,1,0,0,0|3,0,0]=4 549 B10R0.4 CC(O)CCCOCCCCl 34a_100000230001_200000718107 [0,0,1,0,0,0|3,0,0]=4 550 B10R0.4 CC(O)CCCOCCCF 34a_100000759539_200000718107 [0,0,1,0,0,0|3,0,0]=4 551 B10R0.4 CC(O)CCCOCCCN 34a_100000182051_200000718107 [0,0,1,0,0,0|3,0,0]=4 552 B10R0.4 CC(O)CCCSCCCF 62a_100011934791_200000718107 [0,0,1,0,0,0|3,0,0]=4 553 B10R0.4 CC(O)CCCSCCCF 62a_200000718107_100011934791 [0,0,1,0,0,0|3,0,0]=4 554 B10R0.4 CC(O)CCCSCCCO 62a_100011215043_200000718107 [0,0,1,0,0,0|3,0,0]=4 555 B10R0.4 CC(O)CCCSCCCO 62a_200000718107_100011215043 [0,0,1,0,0,0|3,0,0]=4 556 B10R0.4 CC(O)CCNCCCCF 2230a_200000755665_100000729493 [0,0,1,0,0,0|3,0,0]=4 557 B10R0.4 CC(O)CCNCCCCO 2230a_100000750430_100012276601 [0,0,1,0,0,0|3,0,0]=4 558 B10R0.4 CC(O)CCNCCCCO 2230a_200000755665_100000210776 [0,0,1,0,0,0|3,0,0]=4 559 B10R0.4 CC(O)CCNCCCCO 34a_100000750430_100012276601 [0,0,1,0,0,0|3,0,0]=4 560 B10R0.4 CC(O)CCOCCCCBr 34a_100011216708_100012276601 [0,0,1,0,0,0|3,0,0]=4 561 B10R0.4 CC(O)CCOCCCCCl 34a_100000210776_100012276601 [0,0,1,0,0,0|3,0,0]=4 562 B10R0.4 CC(O)CCOCCCCCl 7a_100000210776_100012276601 [0,0,1,0,0,0|3,0,0]=4 563 B10R0.4 CC(O)CCOCCCCF 34a_100011995726_100012276601 [0,0,1,0,0,0|3,0,0]=4 564 B10R0.4 CC(O)CCOCCCCF 7a_100011995726_100012276601 [0,0,1,0,0,0|3,0,0]=4 565 B10R0.4 CC(O)CCOCCCCI 34a_200012148704_100012276601 [0,0,1,0,0,0|3,0,0]=4 566 B10R0.4 CC(O)CCOCCCCN 34a_100000750430_100012276601 [0,0,1,0,0,0|3,0,0]=4 567 B10R0.4 CC(O)CCSCCCCF 62a_100000729493_100012276601 [0,0,1,0,0,0|3,0,0]=4 568 B10R0.4 CC(O)CCSCCCCF 62a_100012276601_100000729493 [0,0,1,0,0,0|3,0,0]=4 569 B10R0.4 CC(O)CCSCCCCO 62a_100000210776_100012276601 [0,0,1,0,0,0|3,0,0]=4 570 B10R0.4 CC(O)CCSCCCCO 62a_100012276601_100000210776 [0,0,1,0,0,0|3,0,0]=4 571 B10R0.4 CC(O)CNCCCCC#N 2230a_100000210904_100000211819 [0,0,1,0,0,0|1,0,1]=3 572 B10R0.4 CC(O)CNCCCCC=O 2230a_100000210904_100000139335 [0,0,1,0,0,0|1,0,1]=3 573 B10R0.4 CC(O)CNCCCCCF 2230a_100000210904_100000729378 [0,0,1,0,0,0|1,0,0]=2 574 B10R0.4 CC(O)CNCCCCCF 34a_100000210904_100000729378 [0,0,1,0,0,0|1,0,0]=2 575 B10R0.4 CC(O)CNCCCCCO 2230a_100000210904_100000746330 [0,0,1,0,0,0|1,0,0]=2 576 B10R0.4 CC(O)CNCCCCCO 2230a_100000762737_100011218427 [0,0,1,0,0,0|1,0,0]=2 577 B10R0.4 CC(O)CNCCCCCO 34a_100000210904_100000746330 [0,0,1,0,0,0|1,0,0]=2 578 B10R0.4 CC(O)CNCCCCCO 34a_100000762737_100011218427 [0,0,1,0,0,0|1,0,0]=2 579 B10R0.4 CC(O)CNCCCN=[N+]=[N-] 2230a_100000744732_100011218427 [0,0,1,0,0,0|3,0,0]=4 580 B10R0.4 CC(O)CNCCOCC#N 2230a_100000210904_200000047693 [0,0,1,0,0,0|2,0,1]=4 581 B10R0.4 CC(O)CNCCOCCO 2230a_100000210904_100011215305 [0,0,1,0,0,0|2,0,0]=3 582 B10R0.4 CC(O)CNCCOCCO 2230a_100000211614_100011218427 [0,0,1,0,0,0|2,0,0]=3 583 B10R0.4 CC(O)CNCCOCCO 34a_100000210904_100000692535 [0,0,1,0,0,0|2,0,0]=3 584 B10R0.4 CC(O)CNCCOCCO 34a_100000211614_100011218427 [0,0,1,0,0,0|2,0,0]=3 585 B10R0.4 CC(O)CNCCSCCO 2230a_100011219999_100011218427 [0,0,1,0,0,0|2,0,0]=3 586 B10R0.4 CC(O)COCCCCCBr 34a_100000746331_100011218427 [0,0,1,0,0,0|2,0,0]=3 587 B10R0.4 CC(O)COCCCCCBr 7a_100000746331_100011218427 [0,0,1,0,0,0|2,0,0]=3 588 B10R0.4 CC(O)COCCCCCCl 34a_100000746330_100011218427 [0,0,1,0,0,0|2,0,0]=3 589 B10R0.4 CC(O)COCCCCCCl 7a_100000746330_100011218427 [0,0,1,0,0,0|2,0,0]=3 590 B10R0.4 CC(O)COCCCCCI 34a_200012148887_100011218427 [0,0,1,0,0,0|2,0,0]=3 591 B10R0.4 CC(O)COCCCCCI 7a_200012148887_100011218427 [0,0,1,0,0,0|2,0,0]=3 592 B10R0.4 CC(O)COCCCCCN 34a_100000762737_100011218427 [0,0,1,0,0,0|2,0,0]=3 593 B10R0.4 CC(O)COCCOCCBr 34a_100000692535_100011218427 [0,0,1,0,0,0|3,0,0]=4 594 B10R0.4 CC(O)COCCOCCBr 7a_100000692535_100011218427 [0,0,1,0,0,0|3,0,0]=4 595 B10R0.4 CC(O)COCCOCCCl 34a_100011215305_100011218427 [0,0,1,0,0,0|3,0,0]=4 596 B10R0.4 CC(O)COCCOCCCl 7a_100011215305_100011218427 [0,0,1,0,0,0|3,0,0]=4 597 B10R0.4 CC(O)COCCOCCF 34a_200015357709_100011218427 [0,0,1,0,0,0|3,0,0]=4 598 B10R0.4 CC(O)COCCOCCF 7a_200015357709_100011218427 [0,0,1,0,0,0|3,0,0]=4 599 B10R0.4 CC(O)COCCOCCI 34a_100012149058_100011218427 [0,0,1,0,0,0|3,0,0]=4 600 B10R0.4 CC(O)COCCOCCI 7a_100012149058_100011218427 [0,0,1,0,0,0|3,0,0]=4 601 B10R0.4 CC(O)COCCOCCN 34a_100000211614_100011218427 [0,0,1,0,0,0|3,0,0]=4 602 B10R0.4 CC(O)CSCCCCC#N 62a_100011218427_100000211819 [0,0,1,0,0,0|2,0,1]=4 603 B10R0.4 CC(O)CSCCCCC#N 62a_100011219923_100011218427 [0,0,1,0,0,0|2,0,1]=4 604 B10R0.4 CC(O)CSCCCCC=O 62a_100000139335_100011218427 [0,0,1,0,0,0|2,0,1]=4 605 B10R0.4 CC(O)CSCCCCC=O 62a_100011218427_100000139335 [0,0,1,0,0,0|2,0,1]=4 606 B10R0.4 CC(O)CSCCCCCF 62a_100000729378_100011218427 [0,0,1,0,0,0|2,0,0]=3 607 B10R0.4 CC(O)CSCCCCCF 62a_100011218427_100000729378 [0,0,1,0,0,0|2,0,0]=3 608 B10R0.4 CC(O)CSCCCCCO 62a_100000746330_100011218427 [0,0,1,0,0,0|2,0,0]=3 609 B10R0.4 CC(O)CSCCCCCO 62a_100011218427_100000746330 [0,0,1,0,0,0|2,0,0]=3 610 B10R0.4 CC(O)CSCCOCCO 62a_100011215305_100011218427 [0,0,1,0,0,0|3,0,0]=4 611 B10R0.4 CC(O)CSCCOCCO 62a_100011218427_100011215305 [0,0,1,0,0,0|3,0,0]=4 612 B10R0.4 CC/C=C\CCNCC(C)C 2230a_100000210953_100015370543 [0,0,1,0,0,0|1,0,2]=4 613 B10R0.4 CC/C=C\CCNCC(C)C 34a_100000210953_100015370543 [0,0,1,0,0,0|1,0,2]=4 614 B10R0.4 CC/C=C\CCNCC(C)O 2230a_100000210904_100015370543 [0,0,1,0,0,0|0,0,2]=3 615 B10R0.4 CC/C=C\CCNCC(C)O 34a_100000210904_100015370543 [0,0,1,0,0,0|0,0,2]=3 616 B10R0.4 CC/C=C\CCOCC(C)O 34a_100016288707_100011218427 [0,0,1,0,0,0|1,0,2]=4 617 B10R0.4 CC/C=C\CCOCC(C)O 7a_100016288707_100011218427 [0,0,1,0,0,0|1,0,2]=4 618 B10R0.4 CC/C=C\CCOC[C@@H](C)O 34a_100016288707_100009817552 [0,0,1,0,0,0|1,0,2]=4 619 B10R0.4 CC/C=C\CCOC[C@@H](C)O 7a_100016288707_100009817552 [0,0,1,0,0,0|1,0,2]=4 620 B10R0.4 CC/C=C\CCSCC(C)O 62a_100011218427_100015370543 [0,0,1,0,0,0|1,0,2]=4 621 B10R0.4 CC/C=C\CCSCC(C)O 62a_100015370543_100011218427 [0,0,1,0,0,0|1,0,2]=4 622 B10R0.4 CC/C=C\CCSC[C@@H](C)O 62a_100009817552_100015370543 [0,0,1,0,0,0|1,0,2]=4 623 B10R0.4 CC/C=C\CCSC[C@@H](C)O 62a_100015370543_100009817552 [0,0,1,0,0,0|1,0,2]=4 624 B10R0.4 CC=CCCCOCC(C)O 34a_100020645299_100011218427 [0,0,1,0,0,0|1,0,2]=4 625 B10R0.4 CC=CCCCOC[C@@H](C)O 34a_100020645299_100009817552 [0,0,1,0,0,0|1,0,2]=4 626 B10R0.4 CCC#CCCOCC(C)O 34a_100000036655_100011218427 [0,0,1,0,0,0|1,0,2]=4 627 B10R0.4 CCC#CCCOCC(C)O 7a_100000036655_100011218427 [0,0,1,0,0,0|1,0,2]=4 628 B10R0.4 CCC#CCCOC[C@@H](C)O 34a_100000036655_100009817552 [0,0,1,0,0,0|1,0,2]=4 629 B10R0.4 CCC#CCCOC[C@@H](C)O 7a_100000036655_100009817552 [0,0,1,0,0,0|1,0,2]=4 630 B10R0.4 CCC/C=C/COCC(C)O 34a_100016278788_100011218427 [0,0,1,0,0,0|1,0,2]=4 631 B10R0.4 CCC/C=C/COCC(C)O 7a_100016278788_100011218427 [0,0,1,0,0,0|1,0,2]=4 632 B10R0.4 CCC/C=C/COC[C@@H](C)O 34a_100016278788_100009817552 [0,0,1,0,0,0|1,0,2]=4 633 B10R0.4 CCC/C=C/COC[C@@H](C)O 7a_100016278788_100009817552 [0,0,1,0,0,0|1,0,2]=4 634 B10R0.4 CCCC#CCOCC(C)O 34a_100000034806_100011218427 [0,0,1,0,0,0|1,0,2]=4 635 B10R0.4 CCCC#CCOCC(C)O 7a_100000034806_100011218427 [0,0,1,0,0,0|1,0,2]=4 636 B10R0.4 CCCC#CCOC[C@@H](C)O 34a_100000034806_100009817552 [0,0,1,0,0,0|1,0,2]=4 637 B10R0.4 CCCC#CCOC[C@@H](C)O 7a_100000034806_100009817552 [0,0,1,0,0,0|1,0,2]=4 638 B10R0.4 CCCCC=NNCC(C)O 4a_200000730056_100000210104 [0,0,1,0,0,0|1,0,1]=3 639 B10R0.4 CCCCCCCCC(=O)C 1458a_100000070787_100000210759 [0,0,1,0,0,0|1,0,2]=4 640 B10R0.4 CCCCCCCCC(=O)C 1458a_100000210188_200000210301 [0,0,1,0,0,0|1,0,2]=4 641 B10R0.4 CCCCCCCCC(=O)[13CH3] 1458a_100000210188_200025704644 [0,0,1,0,0,0|1,0,2]=4 642 B10R0.4 CCCCCCCCN(C)C 2230a_100000207567_200000210301 [0,0,1,0,0,0|3,0,0]=4 643 B10R0.4 CCCCCCCCN(C)C 2230a_100102631434_100000210759 [0,0,1,0,0,0|3,0,0]=4 644 B10R0.4 CCCCCCCCN(C)C 269982a_100000207567_200000210301 [0,0,1,0,0,0|3,0,0]=4 645 B10R0.4 CCCCCCCCN(C)C 269982a_100102631434_100000210759 [0,0,1,0,0,0|3,0,0]=4 646 B10R0.4 CCCCCCCCN(C)[13CH3] 2230a_100000207567_200025704644 [0,0,1,0,0,0|3,0,0]=4 647 B10R0.4 CCCCCCCCN(C)[13CH3] 269982a_100000207567_200025704644 [0,0,1,0,0,0|3,0,0]=4 648 B10R0.4 CCCCCCCNC(C)C 2230a_100000229938_100000210206 [0,0,1,0,0,0|3,0,0]=4 649 B10R0.4 CCCCCCCNC(C)C 2230a_100138425928_100000210681 [0,0,1,0,0,0|3,0,0]=4 650 B10R0.4 CCCCCCCNC(C)C 34a_100138425928_100000210614 [0,0,1,0,0,0|3,0,0]=4 651 B10R0.4 CCCCCCCOC(C)C 34a_100000210272_100000210206 [0,0,1,0,0,0|3,0,0]=4 652 B10R0.4 CCCCCCCOC(C)C 34a_100000212225_100000210614 [0,0,1,0,0,0|3,0,0]=4 653 B10R0.4 CCCCCCCOC(C)C 7a_100000210272_100000210206 [0,0,1,0,0,0|3,0,0]=4 654 B10R0.4 CCCCCCCSC(C)C 62a_100000210206_100000210316 [0,0,1,0,0,0|3,0,0]=4 655 B10R0.4 CCCCCCCSC(C)C 62a_100000210614_100000210206 [0,0,1,0,0,0|3,0,0]=4 656 B10R0.4 CCCCCCNCC(=O)N 2230a_100000210581_100000747473 [0,0,1,0,0,0|1,0,2]=4 657 B10R0.4 CCCCCCNCC(=O)N 2230a_100000711301_100000210314 [0,0,1,0,0,0|1,0,2]=4 658 B10R0.4 CCCCCCNCC(=O)O 269956a_100016091260_100000210757 [0,0,1,0,0,0|1,0,1]=3 659 B10R0.4 CCCCCCNCC(C)C 2230a_100000210581_100000210760 [0,0,1,0,0,0|1,0,0]=2 660 B10R0.4 CCCCCCNCC(C)C 2230a_100000210953_100000210314 [0,0,1,0,0,0|1,0,0]=2 661 B10R0.4 CCCCCCNCC(C)C 270004a_100000210581_100000210432 [0,0,1,0,0,0|1,0,0]=2 662 B10R0.4 CCCCCCNCC(C)C 34a_100000210953_100000210314 [0,0,1,0,0,0|1,0,0]=2 663 B10R0.4 CCCCCCNCC(C)O 2230a_100000210581_100011218427 [0,0,1,0,0,0|0,0,0]=1 664 B10R0.4 CCCCCCNCC(C)O 2230a_100000210904_100000210314 [0,0,1,0,0,0|0,0,0]=1 665 B10R0.4 CCCCCCNCC(C)O 34a_100000210904_100000210314 [0,0,1,0,0,0|0,0,0]=1 666 B10R0.4 CCCCCCNCC(F)F 2230a_100000210581_100011934356 [0,0,1,0,0,0|2,0,0]=3 667 B10R0.4 CCCCCCNCC(F)F 34a_100000765723_100000210314 [0,0,1,0,0,0|2,0,0]=3 668 B10R0.4 CCCCCCNC[C@@H](C)O 2230a_100000210581_100009817552 [0,0,1,0,0,0|0,0,0]=1 669 B10R0.4 CCCCCCOCC(=O)C 34a_100000211253_100000210314 [0,0,1,0,0,0|1,0,2]=4 670 B10R0.4 CCCCCCOCC(C)Br 34a_100012180447_100000210314 [0,0,1,0,0,0|2,0,0]=3 671 B10R0.4 CCCCCCOCC(C)C 34a_100000210257_100000210314 [0,0,1,0,0,0|2,0,0]=3 672 B10R0.4 CCCCCCOCC(C)C 34a_100000210259_100000210624 [0,0,1,0,0,0|2,0,0]=3 673 B10R0.4 CCCCCCOCC(C)C 7a_100000210259_100000210760 [0,0,1,0,0,0|2,0,0]=3 674 B10R0.4 CCCCCCOCC(C)F 34a_100015925927_100000210314 [0,0,1,0,0,0|2,0,0]=3 675 B10R0.4 CCCCCCOCC(C)O 34a_100000210259_100011218427 [0,0,1,0,0,0|1,0,0]=2 676 B10R0.4 CCCCCCOCC(C)O 7a_100000210259_100011218427 [0,0,1,0,0,0|1,0,0]=2 677 B10R0.4 CCCCCCOCC(F)F 34a_100000210259_100011934356 [0,0,1,0,0,0|3,0,0]=4 678 B10R0.4 CCCCCCOCC(F)F 34a_100000743014_100000210314 [0,0,1,0,0,0|3,0,0]=4 679 B10R0.4 CCCCCCOCC(F)F 7a_100000210259_100011934356 [0,0,1,0,0,0|3,0,0]=4 680 B10R0.4 CCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210314 [0,0,1,0,0,0|2,0,0]=3 681 B10R0.4 CCCCCCOC[C@@H](C)N 34a_100000737577_100000210314 [0,0,1,0,0,0|2,0,0]=3 682 B10R0.4 CCCCCCOC[C@@H](C)O 34a_100000210259_100009817552 [0,0,1,0,0,0|1,0,0]=2 683 B10R0.4 CCCCCCOC[C@@H](C)O 7a_100000210259_100009817552 [0,0,1,0,0,0|1,0,0]=2 684 B10R0.4 CCCCCCSCC(C)C 62a_100000210314_100000210760 [0,0,1,0,0,0|2,0,0]=3 685 B10R0.4 CCCCCCSCC(C)C 62a_100000210624_100000210757 [0,0,1,0,0,0|2,0,0]=3 686 B10R0.4 CCCCCCSCC(C)O 62a_100000210314_100011218427 [0,0,1,0,0,0|1,0,0]=2 687 B10R0.4 CCCCCCSCC(C)O 62a_100011218427_100000210757 [0,0,1,0,0,0|1,0,0]=2 688 B10R0.4 CCCCCCSCC(F)F 62a_100000210314_100011934356 [0,0,1,0,0,0|3,0,0]=4 689 B10R0.4 CCCCCCSCC(F)F 62a_100011934356_100000210757 [0,0,1,0,0,0|3,0,0]=4 690 B10R0.4 CCCCCCSC[C@@H](C)O 62a_100000210314_100009817552 [0,0,1,0,0,0|1,0,0]=2 691 B10R0.4 CCCCCCSC[C@@H](C)O 62a_100009817552_100000210757 [0,0,1,0,0,0|1,0,0]=2 692 B10R0.4 CCCCCNCCC(C)C 2230a_100000209983_100000210312 [0,0,1,0,0,0|3,0,0]=4 693 B10R0.4 CCCCCNCCC(C)C 269862a_100000209983_100000185833 [0,0,1,0,0,0|3,0,0]=4 694 B10R0.4 CCCCCNCCC(C)O 2230a_100000209983_100012276601 [0,0,1,0,0,0|2,0,0]=3 695 B10R0.4 CCCCCNCCC(C)O 2230a_200000755665_100000210326 [0,0,1,0,0,0|2,0,0]=3 696 B10R0.4 CCCCCOCCC(C)Br 34a_100009893172_100000718602 [0,0,1,0,0,0|3,0,0]=4 697 B10R0.4 CCCCCOCCC(C)C 34a_100000210253_100000210312 [0,0,1,0,0,0|3,0,0]=4 698 B10R0.4 CCCCCOCCC(C)C 34a_100000210254_100000718602 [0,0,1,0,0,0|3,0,0]=4 699 B10R0.4 CCCCCOCCC(C)C 7a_100000210253_100000210626 [0,0,1,0,0,0|3,0,0]=4 700 B10R0.4 CCCCCOCCC(C)C 7a_100000210254_100000210326 [0,0,1,0,0,0|3,0,0]=4 701 B10R0.4 CCCCCOCCC(C)O 34a_100000210253_100012276601 [0,0,1,0,0,0|2,0,0]=3 702 B10R0.4 CCCCCOCCC(C)O 7a_100000210253_100012276601 [0,0,1,0,0,0|2,0,0]=3 703 B10R0.4 CCCCCOCC[C@@H](C)N 34a_100000706166_100000718602 [0,0,1,0,0,0|3,0,0]=4 704 B10R0.4 CCCCCSCCC(C)C 62a_100000210312_100000210326 [0,0,1,0,0,0|3,0,0]=4 705 B10R0.4 CCCCCSCCC(C)C 62a_100000210326_100000210312 [0,0,1,0,0,0|3,0,0]=4 706 B10R0.4 CCCCCSCCC(C)O 62a_100000210326_100012276601 [0,0,1,0,0,0|2,0,0]=3 707 B10R0.4 CCCCCSCCC(C)O 62a_100012276601_100000210326 [0,0,1,0,0,0|2,0,0]=3 708 B10R0.4 CCCCNCCCC(C)C 2230a_100000102301_100011214892 [0,0,1,0,0,0|3,0,0]=4 709 B10R0.4 CCCCNCCCC(C)C 2230a_200000737386_100000210211 [0,0,1,0,0,0|3,0,0]=4 710 B10R0.4 CCCCNCCCC(C)C 34a_200000737386_100000210210 [0,0,1,0,0,0|3,0,0]=4 711 B10R0.4 CCCCNCCCC(C)C 7a_106832991798_100011214892 [0,0,1,0,0,0|3,0,0]=4 712 B10R0.4 CCCCNCCCC(C)O 2230a_100000102301_200000718107 [0,0,1,0,0,0|2,0,0]=3 713 B10R0.4 CCCCNCCCC(C)O 7a_106832991798_200000718107 [0,0,1,0,0,0|2,0,0]=3 714 B10R0.4 CCCCOCCCC(C)C 34a_100000210227_100011214892 [0,0,1,0,0,0|3,0,0]=4 715 B10R0.4 CCCCOCCCC(C)C 34a_100000210774_100000210210 [0,0,1,0,0,0|3,0,0]=4 716 B10R0.4 CCCCOCCCC(C)C 7a_100000210227_100011214892 [0,0,1,0,0,0|3,0,0]=4 717 B10R0.4 CCCCOCCCC(C)C 7a_100000210774_100000210211 [0,0,1,0,0,0|3,0,0]=4 718 B10R0.4 CCCCOCCCC(C)O 34a_100000210227_200000718107 [0,0,1,0,0,0|2,0,0]=3 719 B10R0.4 CCCCOCCCC(C)O 7a_100000210227_200000718107 [0,0,1,0,0,0|2,0,0]=3 720 B10R0.4 CCCCOCNCC(=O)O 269956a_100016091260_100011995733 [0,0,1,0,0,0|2,0,1]=4 721 B10R0.4 CCCCOCNCC(C)C 2230a_100000210953_100011995733 [0,0,1,0,0,0|2,0,0]=3 722 B10R0.4 CCCCOCNCC(C)C 34a_100000210953_100011995733 [0,0,1,0,0,0|2,0,0]=3 723 B10R0.4 CCCCOCNCC(C)O 2230a_100000210904_100011995733 [0,0,1,0,0,0|1,0,0]=2 724 B10R0.4 CCCCOCNCC(C)O 34a_100000210904_100011995733 [0,0,1,0,0,0|1,0,0]=2 725 B10R0.4 CCCCOCNCC(F)F 34a_100000765723_100011995733 [0,0,1,0,0,0|3,0,0]=4 726 B10R0.4 CCCCOCOCC(C)Br 34a_100012180447_100011995733 [0,0,1,0,0,0|3,0,0]=4 727 B10R0.4 CCCCOCOCC(C)C 34a_100000210257_100011995733 [0,0,1,0,0,0|3,0,0]=4 728 B10R0.4 CCCCOCOCC(C)F 34a_100015925927_100011995733 [0,0,1,0,0,0|3,0,0]=4 729 B10R0.4 CCCCOCOC[C@@H](C)Cl 34a_100016084084_100011995733 [0,0,1,0,0,0|3,0,0]=4 730 B10R0.4 CCCCOCOC[C@@H](C)N 34a_100000737577_100011995733 [0,0,1,0,0,0|3,0,0]=4 731 B10R0.4 CCCCOCSCC(C)C 62a_100000210624_100011995733 [0,0,1,0,0,0|3,0,0]=4 732 B10R0.4 CCCCOCSCC(C)C 62a_100011995733_100000210760 [0,0,1,0,0,0|3,0,0]=4 733 B10R0.4 CCCCOCSCC(C)O 62a_100011218427_100011995733 [0,0,1,0,0,0|2,0,0]=3 734 B10R0.4 CCCCOCSCC(C)O 62a_100011995733_100011218427 [0,0,1,0,0,0|2,0,0]=3 735 B10R0.4 CCCCOCSC[C@@H](C)O 62a_100009817552_100011995733 [0,0,1,0,0,0|2,0,0]=3 736 B10R0.4 CCCCOCSC[C@@H](C)O 62a_100011995733_100009817552 [0,0,1,0,0,0|2,0,0]=3 737 B10R0.4 CCCCSCCCC(C)C 62a_100000210211_100011214892 [0,0,1,0,0,0|3,0,0]=4 738 B10R0.4 CCCCSCCCC(C)C 62a_100011214892_100000210210 [0,0,1,0,0,0|3,0,0]=4 739 B10R0.4 CCCCSCCCC(C)O 62a_100000210211_200000718107 [0,0,1,0,0,0|2,0,0]=3 740 B10R0.4 CCCCSCCCC(C)O 62a_200000718107_100000210210 [0,0,1,0,0,0|2,0,0]=3 741 B10R0.4 CCCOCCCCC(C)C 34a_100000210258_100011216152 [0,0,1,0,0,0|3,0,0]=4 742 B10R0.4 CCCOCCCCC(C)C 34a_100011214890_100000210303 [0,0,1,0,0,0|3,0,0]=4 743 B10R0.4 CCCOCCCCC(C)C 7a_100011214890_100000210303 [0,0,1,0,0,0|3,0,0]=4 744 B10R0.4 CCCOCCNCC(=O)O 269956a_100016091260_100011215938 [0,0,1,0,0,0|2,0,1]=4 745 B10R0.4 CCCOCCNCC(C)C 2230a_100000210953_100011215938 [0,0,1,0,0,0|2,0,0]=3 746 B10R0.4 CCCOCCNCC(C)C 2230a_100161115042_100000210760 [0,0,1,0,0,0|2,0,0]=3 747 B10R0.4 CCCOCCNCC(C)C 270004a_100161115042_100000210432 [0,0,1,0,0,0|2,0,0]=3 748 B10R0.4 CCCOCCNCC(C)C 34a_100000210953_100011215938 [0,0,1,0,0,0|2,0,0]=3 749 B10R0.4 CCCOCCNCC(C)C 34a_100015185251_100000210303 [0,0,1,0,0,0|2,0,0]=3 750 B10R0.4 CCCOCCNCC(C)C 34a_100161115042_100000210624 [0,0,1,0,0,0|2,0,0]=3 751 B10R0.4 CCCOCCNCC(C)O 2230a_100000210904_100011215938 [0,0,1,0,0,0|1,0,0]=2 752 B10R0.4 CCCOCCNCC(C)O 2230a_100161115042_100011218427 [0,0,1,0,0,0|1,0,0]=2 753 B10R0.4 CCCOCCNCC(C)O 34a_100000210904_100011215938 [0,0,1,0,0,0|1,0,0]=2 754 B10R0.4 CCCOCCNCC(C)O 34a_100161115042_100011218427 [0,0,1,0,0,0|1,0,0]=2 755 B10R0.4 CCCOCCNCC(F)F 2230a_100161115042_100011934356 [0,0,1,0,0,0|3,0,0]=4 756 B10R0.4 CCCOCCNCC(F)F 34a_100000765723_100011215938 [0,0,1,0,0,0|3,0,0]=4 757 B10R0.4 CCCOCCNCC(F)F 34a_100161115042_100011934356 [0,0,1,0,0,0|3,0,0]=4 758 B10R0.4 CCCOCCNC[C@@H](C)O 2230a_100161115042_100009817552 [0,0,1,0,0,0|1,0,0]=2 759 B10R0.4 CCCOCCNC[C@@H](C)O 34a_100161115042_100009817552 [0,0,1,0,0,0|1,0,0]=2 760 B10R0.4 CCCOCCOCC(C)Br 34a_100012180447_100011215938 [0,0,1,0,0,0|3,0,0]=4 761 B10R0.4 CCCOCCOCC(C)C 34a_100000210257_100011215938 [0,0,1,0,0,0|3,0,0]=4 762 B10R0.4 CCCOCCOCC(C)C 34a_100000703358_100000210303 [0,0,1,0,0,0|3,0,0]=4 763 B10R0.4 CCCOCCOCC(C)C 34a_100000752267_100000210624 [0,0,1,0,0,0|3,0,0]=4 764 B10R0.4 CCCOCCOCC(C)C 7a_100000703358_100000210303 [0,0,1,0,0,0|3,0,0]=4 765 B10R0.4 CCCOCCOCC(C)C 7a_100000752267_100000210760 [0,0,1,0,0,0|3,0,0]=4 766 B10R0.4 CCCOCCOCC(C)F 34a_100015925927_100011215938 [0,0,1,0,0,0|3,0,0]=4 767 B10R0.4 CCCOCCOCC(C)O 34a_100000752267_100011218427 [0,0,1,0,0,0|2,0,0]=3 768 B10R0.4 CCCOCCOCC(C)O 7a_100000752267_100011218427 [0,0,1,0,0,0|2,0,0]=3 769 B10R0.4 CCCOCCOC[C@@H](C)Cl 34a_100016084084_100011215938 [0,0,1,0,0,0|3,0,0]=4 770 B10R0.4 CCCOCCOC[C@@H](C)N 34a_100000737577_100011215938 [0,0,1,0,0,0|3,0,0]=4 771 B10R0.4 CCCOCCOC[C@@H](C)O 34a_100000752267_100009817552 [0,0,1,0,0,0|2,0,0]=3 772 B10R0.4 CCCOCCOC[C@@H](C)O 7a_100000752267_100009817552 [0,0,1,0,0,0|2,0,0]=3 773 B10R0.4 CCCOCCSCC(C)C 34a_200000230437_100000210303 [0,0,1,0,0,0|3,0,0]=4 774 B10R0.4 CCCOCCSCC(C)C 62a_100000210624_100011215938 [0,0,1,0,0,0|3,0,0]=4 775 B10R0.4 CCCOCCSCC(C)C 62a_100011215938_100000210760 [0,0,1,0,0,0|3,0,0]=4 776 B10R0.4 CCCOCCSCC(C)C 7a_200000230437_100000210303 [0,0,1,0,0,0|3,0,0]=4 777 B10R0.4 CCCOCCSCC(C)O 62a_100011215938_100011218427 [0,0,1,0,0,0|2,0,0]=3 778 B10R0.4 CCCOCCSCC(C)O 62a_100011218427_100011215938 [0,0,1,0,0,0|2,0,0]=3 779 B10R0.4 CCCOCCSC[C@@H](C)O 62a_100009817552_100011215938 [0,0,1,0,0,0|2,0,0]=3 780 B10R0.4 CCCOCCSC[C@@H](C)O 62a_100011215938_100009817552 [0,0,1,0,0,0|2,0,0]=3 781 B10R0.4 CCCSCCCCC(C)C 62a_100000210303_100011216152 [0,0,1,0,0,0|3,0,0]=4 782 B10R0.4 CCCSCCCCC(C)C 62a_100011216152_100000210303 [0,0,1,0,0,0|3,0,0]=4 783 B10R0.4 CCCSCCNCC(C)C 2230a_100020603323_100000210760 [0,0,1,0,0,0|2,0,0]=3 784 B10R0.4 CCCSCCNCC(C)C 270004a_100020603323_100000210432 [0,0,1,0,0,0|2,0,0]=3 785 B10R0.4 CCCSCCNCC(C)O 2230a_100020603323_100011218427 [0,0,1,0,0,0|1,0,0]=2 786 B10R0.4 CCCSCCNCC(F)F 2230a_100020603323_100011934356 [0,0,1,0,0,0|3,0,0]=4 787 B10R0.4 CCCSCCNC[C@@H](C)O 2230a_100020603323_100009817552 [0,0,1,0,0,0|1,0,0]=2 788 B10R0.4 CCCSCCOCC(C)C 34a_200000230433_100000210624 [0,0,1,0,0,0|3,0,0]=4 789 B10R0.4 CCCSCCOCC(C)C 7a_200000230433_100000210760 [0,0,1,0,0,0|3,0,0]=4 790 B10R0.4 CCCSCCOCC(C)O 34a_200000230433_100011218427 [0,0,1,0,0,0|2,0,0]=3 791 B10R0.4 CCCSCCOCC(C)O 7a_200000230433_100011218427 [0,0,1,0,0,0|2,0,0]=3 792 B10R0.4 CCCSCCOC[C@@H](C)O 34a_200000230433_100009817552 [0,0,1,0,0,0|2,0,0]=3 793 B10R0.4 CCCSCCOC[C@@H](C)O 7a_200000230433_100009817552 [0,0,1,0,0,0|2,0,0]=3 794 B10R0.4 CCNCCCCCC(C)C 2230a_100011290863_100000210202 [0,0,1,0,0,0|3,0,0]=4 795 B10R0.4 CCNCCCCCC(C)C 2230a_100015525214_100000210682 [0,0,1,0,0,0|3,0,0]=4 796 B10R0.4 CCNCCCCCC(C)C 34a_100011290863_100000210202 [0,0,1,0,0,0|3,0,0]=4 797 B10R0.4 CCNCCCOCC(C)C 2230a_100000205972_100000210202 [0,0,1,0,0,0|3,0,0]=4 798 B10R0.4 CCNCCCOCC(C)C 34a_100000205972_100000210202 [0,0,1,0,0,0|3,0,0]=4 799 B10R0.4 CCOCCCCCC(C)C 34a_100011995859_100000210202 [0,0,1,0,0,0|3,0,0]=4 800 B10R0.4 CCOCCCCCC(C)C 34a_100121572206_100000210682 [0,0,1,0,0,0|3,0,0]=4 801 B10R0.4 CCOCCCCCC(C)C 7a_100011995859_100000210202 [0,0,1,0,0,0|3,0,0]=4 802 B10R0.4 CCOCCCNCC(=O)O 269956a_100016091260_100012232248 [0,0,1,0,0,0|2,0,1]=4 803 B10R0.4 CCOCCCNCC(C)C 2230a_100000210953_100012232248 [0,0,1,0,0,0|2,0,0]=3 804 B10R0.4 CCOCCCNCC(C)C 2230a_100000210961_100000210760 [0,0,1,0,0,0|2,0,0]=3 805 B10R0.4 CCOCCCNCC(C)C 270004a_100000210961_100000210432 [0,0,1,0,0,0|2,0,0]=3 806 B10R0.4 CCOCCCNCC(C)C 34a_100000210953_100012232248 [0,0,1,0,0,0|2,0,0]=3 807 B10R0.4 CCOCCCNCC(C)C 34a_100000210961_100000210624 [0,0,1,0,0,0|2,0,0]=3 808 B10R0.4 CCOCCCNCC(C)O 2230a_100000210904_100012232248 [0,0,1,0,0,0|1,0,0]=2 809 B10R0.4 CCOCCCNCC(C)O 2230a_100000210961_100011218427 [0,0,1,0,0,0|1,0,0]=2 810 B10R0.4 CCOCCCNCC(C)O 34a_100000210904_100012232248 [0,0,1,0,0,0|1,0,0]=2 811 B10R0.4 CCOCCCNCC(C)O 34a_100000210961_100011218427 [0,0,1,0,0,0|1,0,0]=2 812 B10R0.4 CCOCCCNCC(F)F 2230a_100000210961_100011934356 [0,0,1,0,0,0|3,0,0]=4 813 B10R0.4 CCOCCCNCC(F)F 34a_100000210961_100011934356 [0,0,1,0,0,0|3,0,0]=4 814 B10R0.4 CCOCCCNCC(F)F 34a_100000765723_100012232248 [0,0,1,0,0,0|3,0,0]=4 815 B10R0.4 CCOCCCNC[C@@H](C)O 2230a_100000210961_100009817552 [0,0,1,0,0,0|1,0,0]=2 816 B10R0.4 CCOCCCNC[C@@H](C)O 34a_100000210961_100009817552 [0,0,1,0,0,0|1,0,0]=2 817 B10R0.4 CCOCCCOCC(C)Br 34a_100012180447_100012232248 [0,0,1,0,0,0|3,0,0]=4 818 B10R0.4 CCOCCCOCC(C)C 34a_100000210257_100012232248 [0,0,1,0,0,0|3,0,0]=4 819 B10R0.4 CCOCCCOCC(C)C 34a_100000757476_100000210624 [0,0,1,0,0,0|3,0,0]=4 820 B10R0.4 CCOCCCOCC(C)C 7a_100000757476_100000210760 [0,0,1,0,0,0|3,0,0]=4 821 B10R0.4 CCOCCCOCC(C)F 34a_100015925927_100012232248 [0,0,1,0,0,0|3,0,0]=4 822 B10R0.4 CCOCCCOCC(C)O 34a_100000757476_100011218427 [0,0,1,0,0,0|2,0,0]=3 823 B10R0.4 CCOCCCOCC(C)O 7a_100000757476_100011218427 [0,0,1,0,0,0|2,0,0]=3 824 B10R0.4 CCOCCCOC[C@@H](C)Cl 34a_100016084084_100012232248 [0,0,1,0,0,0|3,0,0]=4 825 B10R0.4 CCOCCCOC[C@@H](C)N 34a_100000737577_100012232248 [0,0,1,0,0,0|3,0,0]=4 826 B10R0.4 CCOCCCOC[C@@H](C)O 34a_100000757476_100009817552 [0,0,1,0,0,0|2,0,0]=3 827 B10R0.4 CCOCCCOC[C@@H](C)O 7a_100000757476_100009817552 [0,0,1,0,0,0|2,0,0]=3 828 B10R0.4 CCOCCCSCC(C)C 62a_100000210624_100012232248 [0,0,1,0,0,0|3,0,0]=4 829 B10R0.4 CCOCCCSCC(C)C 62a_100012232248_100000210760 [0,0,1,0,0,0|3,0,0]=4 830 B10R0.4 CCOCCCSCC(C)O 62a_100011218427_100012232248 [0,0,1,0,0,0|2,0,0]=3 831 B10R0.4 CCOCCCSCC(C)O 62a_100012232248_100011218427 [0,0,1,0,0,0|2,0,0]=3 832 B10R0.4 CCOCCCSC[C@@H](C)O 62a_100009817552_100012232248 [0,0,1,0,0,0|2,0,0]=3 833 B10R0.4 CCOCCCSC[C@@H](C)O 62a_100012232248_100009817552 [0,0,1,0,0,0|2,0,0]=3 834 B10R0.4 CCOCCNCCC(C)O 2230a_102516460346_100012276601 [0,0,1,0,0,0|3,0,0]=4 835 B10R0.4 CCOCCNCCC(C)O 2230a_200000755665_100011215890 [0,0,1,0,0,0|3,0,0]=4 836 B10R0.4 CCOCCNCCC(C)O 34a_102516460346_100012276601 [0,0,1,0,0,0|3,0,0]=4 837 B10R0.4 CCOCCOCCC(C)O 34a_100000210136_100012276601 [0,0,1,0,0,0|3,0,0]=4 838 B10R0.4 CCOCCOCCC(C)O 7a_100000210136_100012276601 [0,0,1,0,0,0|3,0,0]=4 839 B10R0.4 CCOCCSCCC(C)O 62a_100000210147_100012276601 [0,0,1,0,0,0|3,0,0]=4 840 B10R0.4 CCOCCSCCC(C)O 62a_100012276601_100011215890 [0,0,1,0,0,0|3,0,0]=4 841 B10R0.4 CCOCSCCCC(C)O 62a_100000739092_200000718107 [0,0,1,0,0,0|3,0,0]=4 842 B10R0.4 CCOCSCCCC(C)O 62a_200000718107_100000739092 [0,0,1,0,0,0|3,0,0]=4 843 B10R0.4 CCSCCCCCC(C)C 62a_100000210202_100000210682 [0,0,1,0,0,0|3,0,0]=4 844 B10R0.4 CCSCCCCCC(C)C 62a_100000210682_100000210202 [0,0,1,0,0,0|3,0,0]=4 845 B10R0.4 CCSCCCOCC(C)C 34a_100011216438_100000210624 [0,0,1,0,0,0|3,0,0]=4 846 B10R0.4 CCSCCCOCC(C)C 7a_100011216438_100000210760 [0,0,1,0,0,0|3,0,0]=4 847 B10R0.4 CCSCCCOCC(C)O 34a_100011216438_100011218427 [0,0,1,0,0,0|2,0,0]=3 848 B10R0.4 CCSCCCOCC(C)O 7a_100011216438_100011218427 [0,0,1,0,0,0|2,0,0]=3 849 B10R0.4 CCSCCCOC[C@@H](C)O 34a_100011216438_100009817552 [0,0,1,0,0,0|2,0,0]=3 850 B10R0.4 CCSCCCOC[C@@H](C)O 7a_100011216438_100009817552 [0,0,1,0,0,0|2,0,0]=3 851 B10R0.4 CCSCCNCCC(C)O 2230a_100000106463_100012276601 [0,0,1,0,0,0|3,0,0]=4 852 B10R0.4 CCSCCNCCC(C)O 2230a_200000755665_100000757381 [0,0,1,0,0,0|3,0,0]=4 853 B10R0.4 CCSCCOCCC(C)O 34a_100000212035_100012276601 [0,0,1,0,0,0|3,0,0]=4 854 B10R0.4 CCSCCOCCC(C)O 7a_100000212035_100012276601 [0,0,1,0,0,0|3,0,0]=4 855 B10R0.4 CCSCCSCCC(C)O 62a_100000757381_100012276601 [0,0,1,0,0,0|3,0,0]=4 856 B10R0.4 CCSCCSCCC(C)O 62a_100012276601_100000757381 [0,0,1,0,0,0|3,0,0]=4 857 B10R0.4 CNCCCCCCC(C)C 2230a_100000211014_200000210301 [0,0,1,0,0,0|3,0,0]=4 858 B10R0.4 CNCCCCCCC(C)C 34a_100000211014_200000210301 [0,0,1,0,0,0|3,0,0]=4 859 B10R0.4 CNCCCOCCC(C)O 34a_100000213112_100012276601 [0,0,1,0,0,0|3,0,0]=4 860 B10R0.4 COCCCCNCC(=O)O 269956a_100016091260_100000730899 [0,0,1,0,0,0|2,0,1]=4 861 B10R0.4 COCCCCNCC(C)C 2230a_100000210953_100000730899 [0,0,1,0,0,0|2,0,0]=3 862 B10R0.4 COCCCCNCC(C)C 34a_100000210953_100000755781 [0,0,1,0,0,0|2,0,0]=3 863 B10R0.4 COCCCCNCC(C)O 2230a_100000210904_100000730899 [0,0,1,0,0,0|1,0,0]=2 864 B10R0.4 COCCCCNCC(C)O 34a_100000210904_100000755781 [0,0,1,0,0,0|1,0,0]=2 865 B10R0.4 COCCCCNCC(F)F 34a_100000765723_100000755781 [0,0,1,0,0,0|3,0,0]=4 866 B10R0.4 COCCCCOCC(C)Br 34a_100012180447_100000755781 [0,0,1,0,0,0|3,0,0]=4 867 B10R0.4 COCCCCOCC(C)C 34a_100000210257_100000755781 [0,0,1,0,0,0|3,0,0]=4 868 B10R0.4 COCCCCOCC(C)C 34a_100000740925_100000210624 [0,0,1,0,0,0|3,0,0]=4 869 B10R0.4 COCCCCOCC(C)F 34a_100015925927_100000755781 [0,0,1,0,0,0|3,0,0]=4 870 B10R0.4 COCCCCOCC(C)O 34a_100000740925_100011218427 [0,0,1,0,0,0|2,0,0]=3 871 B10R0.4 COCCCCOC[C@@H](C)Cl 34a_100016084084_100000755781 [0,0,1,0,0,0|3,0,0]=4 872 B10R0.4 COCCCCOC[C@@H](C)N 34a_100000737577_100000755781 [0,0,1,0,0,0|3,0,0]=4 873 B10R0.4 COCCCCOC[C@@H](C)O 34a_100000740925_100009817552 [0,0,1,0,0,0|2,0,0]=3 874 B10R0.4 COCCCCSCC(C)C 62a_100000210624_100000730899 [0,0,1,0,0,0|3,0,0]=4 875 B10R0.4 COCCCCSCC(C)C 62a_100000730899_100000210760 [0,0,1,0,0,0|3,0,0]=4 876 B10R0.4 COCCCCSCC(C)O 62a_100000730899_100011218427 [0,0,1,0,0,0|2,0,0]=3 877 B10R0.4 COCCCCSCC(C)O 62a_100011218427_100000730899 [0,0,1,0,0,0|2,0,0]=3 878 B10R0.4 COCCCCSC[C@@H](C)O 62a_100000730899_100009817552 [0,0,1,0,0,0|2,0,0]=3 879 B10R0.4 COCCCCSC[C@@H](C)O 62a_100009817552_100000730899 [0,0,1,0,0,0|2,0,0]=3 880 B10R0.4 COCCCNCCC(C)O 2230a_200000755665_100000740836 [0,0,1,0,0,0|3,0,0]=4 881 B10R0.4 COCCCNCCC(C)O 34a_100150723488_100012276601 [0,0,1,0,0,0|3,0,0]=4 882 B10R0.4 COCCCOCCC(C)O 34a_100000740835_100012276601 [0,0,1,0,0,0|3,0,0]=4 883 B10R0.4 COCCCSCCC(C)O 62a_100000709357_100012276601 [0,0,1,0,0,0|3,0,0]=4 884 B10R0.4 COCCCSCCC(C)O 62a_100012276601_100000709357 [0,0,1,0,0,0|3,0,0]=4 885 B10R0.4 COCCNCCCC(C)O 2230a_100000209980_200000718107 [0,0,1,0,0,0|3,0,0]=4 886 B10R0.4 COCCOCCCC(C)O 34a_100000210237_200000718107 [0,0,1,0,0,0|3,0,0]=4 887 B10R0.4 COCCOCNCC(C)C 2230a_100000210953_100000231047 [0,0,1,0,0,0|3,0,0]=4 888 B10R0.4 COCCOCNCC(C)O 2230a_100000210904_100000231047 [0,0,1,0,0,0|2,0,0]=3 889 B10R0.4 COCCOCSCC(C)O 62a_100000231047_100011218427 [0,0,1,0,0,0|3,0,0]=4 890 B10R0.4 COCCOCSCC(C)O 62a_100011218427_100000231047 [0,0,1,0,0,0|3,0,0]=4 891 B10R0.4 COCCOCSC[C@@H](C)O 62a_100000231047_100009817552 [0,0,1,0,0,0|3,0,0]=4 892 B10R0.4 COCCOCSC[C@@H](C)O 62a_100009817552_100000231047 [0,0,1,0,0,0|3,0,0]=4 893 B10R0.4 COCCSCCCC(C)O 62a_100000233755_200000718107 [0,0,1,0,0,0|3,0,0]=4 894 B10R0.4 COCCSCCCC(C)O 62a_200000718107_100000233755 [0,0,1,0,0,0|3,0,0]=4 895 B10R0.4 CSCCC=NNCC(C)O 4a_200000730056_100000210997 [0,0,1,0,0,0|2,0,1]=4 896 B10R0.4 CSCCCCOCC(C)C 34a_100011217163_100000210624 [0,0,1,0,0,0|3,0,0]=4 897 B10R0.4 CSCCCCOCC(C)C 7a_100011217163_100000210760 [0,0,1,0,0,0|3,0,0]=4 898 B10R0.4 CSCCCCOCC(C)O 34a_100011217163_100011218427 [0,0,1,0,0,0|2,0,0]=3 899 B10R0.4 CSCCCCOCC(C)O 7a_100011217163_100011218427 [0,0,1,0,0,0|2,0,0]=3 900 B10R0.4 CSCCCCOC[C@@H](C)O 34a_100011217163_100009817552 [0,0,1,0,0,0|2,0,0]=3 901 B10R0.4 CSCCCCOC[C@@H](C)O 7a_100011217163_100009817552 [0,0,1,0,0,0|2,0,0]=3 902 B10R0.4 CSCCCNCCC(C)O 2230a_100000749238_100012276601 [0,0,1,0,0,0|3,0,0]=4 903 B10R0.4 CSCCCOCCC(C)O 34a_100000690336_100012276601 [0,0,1,0,0,0|3,0,0]=4 904 B10R0.4 CSCCCOCCC(C)O 7a_100000690336_100012276601 [0,0,1,0,0,0|3,0,0]=4 905 B10R0.4 CSCCNCCCC(C)O 2230a_100020590264_200000718107 [0,0,1,0,0,0|3,0,0]=4 906 B10R0.4 CSCCOCCCC(C)O 34a_100000230434_200000718107 [0,0,1,0,0,0|3,0,0]=4 907 B10R0.4 CSCCOCCCC(C)O 7a_100000230434_200000718107 [0,0,1,0,0,0|3,0,0]=4 908 B10R0.4 CSCCSCCCC(C)O 62a_100000212216_200000718107 [0,0,1,0,0,0|3,0,0]=4 909 B10R0.4 CSCCSCCCC(C)O 62a_200000718107_100000751147 [0,0,1,0,0,0|3,0,0]=4 910 B10R0.4 CSCOCCNCC(C)C 34a_100015185251_100011218213 [0,0,1,0,0,0|3,0,0]=4 911 B10R0.4 C[C@@H](Cl)COCCCCCF 34a_100016084084_100000729378 [0,0,1,0,0,0|3,0,0]=4 912 B10R0.4 C[C@@H](Cl)COCCCCCO 34a_100016084084_100000746330 [0,0,1,0,0,0|3,0,0]=4 913 B10R0.4 C[C@@H](N)COCCCCCF 34a_100000737577_100000729378 [0,0,1,0,0,0|3,0,0]=4 914 B10R0.4 C[C@@H](N)COCCCCCO 34a_100000737577_100000746330 [0,0,1,0,0,0|3,0,0]=4 915 B10R0.4 C[C@@H](O)CNCCCCCO 2230a_100000762737_100009817552 [0,0,1,0,0,0|1,0,0]=2 916 B10R0.4 C[C@@H](O)CNCCCCCO 34a_100000762737_100009817552 [0,0,1,0,0,0|1,0,0]=2 917 B10R0.4 C[C@@H](O)CNCCCN=[N+]=[N-] 2230a_100000744732_100009817552 [0,0,1,0,0,0|3,0,0]=4 918 B10R0.4 C[C@@H](O)CNCCOCCO 2230a_100000211614_100009817552 [0,0,1,0,0,0|2,0,0]=3 919 B10R0.4 C[C@@H](O)CNCCOCCO 34a_100000211614_100009817552 [0,0,1,0,0,0|2,0,0]=3 920 B10R0.4 C[C@@H](O)CNCCSCCO 2230a_100011219999_100009817552 [0,0,1,0,0,0|2,0,0]=3 921 B10R0.4 C[C@@H](O)COCCCCCBr 34a_100000746331_100009817552 [0,0,1,0,0,0|2,0,0]=3 922 B10R0.4 C[C@@H](O)COCCCCCBr 7a_100000746331_100009817552 [0,0,1,0,0,0|2,0,0]=3 923 B10R0.4 C[C@@H](O)COCCCCCCl 34a_100000746330_100009817552 [0,0,1,0,0,0|2,0,0]=3 924 B10R0.4 C[C@@H](O)COCCCCCCl 7a_100000746330_100009817552 [0,0,1,0,0,0|2,0,0]=3 925 B10R0.4 C[C@@H](O)COCCCCCI 34a_200012148887_100009817552 [0,0,1,0,0,0|2,0,0]=3 926 B10R0.4 C[C@@H](O)COCCCCCI 7a_200012148887_100009817552 [0,0,1,0,0,0|2,0,0]=3 927 B10R0.4 C[C@@H](O)COCCCCCN 34a_100000762737_100009817552 [0,0,1,0,0,0|2,0,0]=3 928 B10R0.4 C[C@@H](O)COCCOCCBr 34a_100000692535_100009817552 [0,0,1,0,0,0|3,0,0]=4 929 B10R0.4 C[C@@H](O)COCCOCCBr 7a_100000692535_100009817552 [0,0,1,0,0,0|3,0,0]=4 930 B10R0.4 C[C@@H](O)COCCOCCCl 34a_100011215305_100009817552 [0,0,1,0,0,0|3,0,0]=4 931 B10R0.4 C[C@@H](O)COCCOCCCl 7a_100011215305_100009817552 [0,0,1,0,0,0|3,0,0]=4 932 B10R0.4 C[C@@H](O)COCCOCCF 34a_200015357709_100009817552 [0,0,1,0,0,0|3,0,0]=4 933 B10R0.4 C[C@@H](O)COCCOCCF 7a_200015357709_100009817552 [0,0,1,0,0,0|3,0,0]=4 934 B10R0.4 C[C@@H](O)COCCOCCI 34a_100012149058_100009817552 [0,0,1,0,0,0|3,0,0]=4 935 B10R0.4 C[C@@H](O)COCCOCCI 7a_100012149058_100009817552 [0,0,1,0,0,0|3,0,0]=4 936 B10R0.4 C[C@@H](O)COCCOCCN 34a_100000211614_100009817552 [0,0,1,0,0,0|3,0,0]=4 937 B10R0.4 C[C@@H](O)CSCCCCC#N 62a_100009817552_100000211819 [0,0,1,0,0,0|2,0,1]=4 938 B10R0.4 C[C@@H](O)CSCCCCC#N 62a_100011219923_100009817552 [0,0,1,0,0,0|2,0,1]=4 939 B10R0.4 C[C@@H](O)CSCCCCC=O 62a_100000139335_100009817552 [0,0,1,0,0,0|2,0,1]=4 940 B10R0.4 C[C@@H](O)CSCCCCC=O 62a_100009817552_100000139335 [0,0,1,0,0,0|2,0,1]=4 941 B10R0.4 C[C@@H](O)CSCCCCCF 62a_100000729378_100009817552 [0,0,1,0,0,0|2,0,0]=3 942 B10R0.4 C[C@@H](O)CSCCCCCF 62a_100009817552_100000729378 [0,0,1,0,0,0|2,0,0]=3 943 B10R0.4 C[C@@H](O)CSCCCCCO 62a_100000746330_100009817552 [0,0,1,0,0,0|2,0,0]=3 944 B10R0.4 C[C@@H](O)CSCCCCCO 62a_100009817552_100000746330 [0,0,1,0,0,0|2,0,0]=3 945 B10R0.4 C[C@@H](O)CSCCOCCO 62a_100009817552_100011215305 [0,0,1,0,0,0|3,0,0]=4 946 B10R0.4 C[C@@H](O)CSCCOCCO 62a_100011215305_100009817552 [0,0,1,0,0,0|3,0,0]=4 947 B10R0.4 FCCCCCNCC(F)F 34a_100000765723_100000729378 [0,0,1,0,0,0|3,0,0]=4 948 B10R0.4 O=C(O)CNCCCCCF 269956a_100016091260_100000729378 [0,0,1,0,0,0|2,0,1]=4 949 B10R0.4 O=C(O)CNCCCCCO 269956a_100016091260_100000746330 [0,0,1,0,0,0|2,0,1]=4 950 B10R0.4 OCCCCCNCC(F)F 2230a_100000762737_100011934356 [0,0,1,0,0,0|3,0,0]=4 951 B10R0.4 OCCCCCNCC(F)F 34a_100000762737_100011934356 [0,0,1,0,0,0|3,0,0]=4 952 B10R0.4 OCCCCCNCC(F)F 34a_100000765723_100000746330 [0,0,1,0,0,0|3,0,0]=4 953 B10R0.6 C#CCCCN(C)CC(C)C 2230a_100000747067_100000731252 [0,0,1,0,0,0|1,0,2]=4 954 B10R0.6 C#CCCCN(C)CC(C)C 269982a_100000747067_100011215417 [0,0,1,0,0,0|1,0,2]=4 955 B10R0.6 C#CCCCN(C)CC(C)O 2230a_100000227577_100000731252 [0,0,1,0,0,0|0,0,2]=3 956 B10R0.6 C#CCCCN(C)CC(C)O 269982a_100000227577_100011215417 [0,0,1,0,0,0|0,0,2]=3 957 B10R0.6 C=C(C)CN(C)CCCCC 2230a_100000223495_100000748629 [0,0,1,0,0,0|1,0,1]=3 958 B10R0.6 C=C(C)CN(C)CCCCC 2230a_100000225649_100000210326 [0,0,1,0,0,0|1,0,1]=3 959 B10R0.6 C=C(C)CN(C)CCCCC 269982a_100000223495_100000748629 [0,0,1,0,0,0|1,0,1]=3 960 B10R0.6 C=C(C)CN(C)CCCCC 269982a_100000225649_100000210215 [0,0,1,0,0,0|1,0,1]=3 961 B10R0.6 C=C(C)CN(C)CCCCF 2230a_100000225649_100000729493 [0,0,1,0,0,0|2,0,1]=4 962 B10R0.6 C=C(C)CN(C)CCCCF 269982a_100000225649_100000729493 [0,0,1,0,0,0|2,0,1]=4 963 B10R0.6 C=C(C)CN(C)CCCCO 2230a_100000225649_100000210776 [0,0,1,0,0,0|2,0,1]=4 964 B10R0.6 C=C(C)CN(C)CCCCO 2230a_100000717598_100000748629 [0,0,1,0,0,0|2,0,1]=4 965 B10R0.6 C=C(C)CN(C)CCCCO 269982a_100000225649_100000210776 [0,0,1,0,0,0|2,0,1]=4 966 B10R0.6 C=C(C)CN(C)CCCCO 269982a_100000717598_100000748629 [0,0,1,0,0,0|2,0,1]=4 967 B10R0.6 C=C(C)CN(C)CCCOC 2230a_100000224831_100000748629 [0,0,1,0,0,0|2,0,1]=4 968 B10R0.6 C=C(C)CN(C)CCCOC 2230a_100000225649_100000740836 [0,0,1,0,0,0|2,0,1]=4 969 B10R0.6 C=C(C)CN(C)CCCOC 269982a_100000224831_100000748629 [0,0,1,0,0,0|2,0,1]=4 970 B10R0.6 C=C(C)CN(C)CCCOC 269982a_100000225649_100000740836 [0,0,1,0,0,0|2,0,1]=4 971 B10R0.6 C=C(C)CN(C)CCOCC 2230a_100000225649_100011215890 [0,0,1,0,0,0|2,0,1]=4 972 B10R0.6 C=C(C)CN(C)CCOCC 269982a_100000225649_100011215890 [0,0,1,0,0,0|2,0,1]=4 973 B10R0.6 C=C(C)CN(C)CCSCC 2230a_100000225649_100000757381 [0,0,1,0,0,0|2,0,1]=4 974 B10R0.6 C=C(C)CN(C)CCSCC 269982a_100000225649_100000757381 [0,0,1,0,0,0|2,0,1]=4 975 B10R0.6 C=C(F)CN(C)CCCCC 2230a_100000223495_100009893438 [0,0,1,0,0,0|1,0,2]=4 976 B10R0.6 C=C(F)CN(C)CCCCC 269982a_100000223495_100009893438 [0,0,1,0,0,0|1,0,2]=4 977 B10R0.6 C=CCCCN(C)CC(C)C 2230a_100000747067_100011713584 [0,0,1,0,0,0|1,0,2]=4 978 B10R0.6 C=CCCCN(C)CC(C)C 269982a_100000747067_100000757094 [0,0,1,0,0,0|1,0,2]=4 979 B10R0.6 C=CCCCN(C)CC(C)O 2230a_100000227577_100011713584 [0,0,1,0,0,0|0,0,2]=3 980 B10R0.6 C=CCCCN(C)CC(C)O 269982a_100000227577_100000757094 [0,0,1,0,0,0|0,0,2]=3 981 B10R0.6 C=COCCN(C)CC(C)O 2230a_100000227577_100000039644 [0,0,1,0,0,0|1,0,2]=4 982 B10R0.6 C=COCCN(C)CC(C)O 269982a_100000227577_100000039644 [0,0,1,0,0,0|1,0,2]=4 983 B10R0.6 CC(C)CN(C)CCCC#N 2230a_100000747067_100000687738 [0,0,1,0,0,0|2,0,1]=4 984 B10R0.6 CC(C)CN(C)CCCC#N 269982a_100000747067_100000687738 [0,0,1,0,0,0|2,0,1]=4 985 B10R0.6 CC(C)CN(C)CCCC=O 2230a_100000747067_200011292268 [0,0,1,0,0,0|2,0,1]=4 986 B10R0.6 CC(C)CN(C)CCCC=O 269982a_100000747067_200011292268 [0,0,1,0,0,0|2,0,1]=4 987 B10R0.6 CC(C)CN(C)CCCCF 2230a_100000747067_100000729493 [0,0,1,0,0,0|2,0,0]=3 988 B10R0.6 CC(C)CN(C)CCCCF 269982a_100000747067_100000729493 [0,0,1,0,0,0|2,0,0]=3 989 B10R0.6 CC(C)CN(C)CCCCO 2230a_100000717598_100000210760 [0,0,1,0,0,0|2,0,0]=3 990 B10R0.6 CC(C)CN(C)CCCCO 2230a_100000747067_100000210776 [0,0,1,0,0,0|2,0,0]=3 991 B10R0.6 CC(C)CN(C)CCCCO 269982a_100000717598_100000210624 [0,0,1,0,0,0|2,0,0]=3 992 B10R0.6 CC(C)CN(C)CCCCO 269982a_100000747067_100000210776 [0,0,1,0,0,0|2,0,0]=3 993 B10R0.6 CC(C)CN(C)CCCCO 270004a_100000717598_100000210432 [0,0,1,0,0,0|2,0,0]=3 994 B10R0.6 CC(O)CC(=O)CCCCO 1458a_100000695505_100011218427 [0,0,1,0,0,0|3,0,0]=4 995 B10R0.6 CC(O)CN(C)CC#CCO 2230a_100000227577_200000047223 [0,0,1,0,0,0|1,0,2]=4 996 B10R0.6 CC(O)CN(C)CCCC#N 2230a_100000227577_100000687738 [0,0,1,0,0,0|1,0,1]=3 997 B10R0.6 CC(O)CN(C)CCCC#N 269982a_100000227577_100000687738 [0,0,1,0,0,0|1,0,1]=3 998 B10R0.6 CC(O)CN(C)CCCC=O 2230a_100000227577_200011292268 [0,0,1,0,0,0|1,0,1]=3 999 B10R0.6 CC(O)CN(C)CCCC=O 269982a_100000227577_200011292268 [0,0,1,0,0,0|1,0,1]=3 1000 B10R0.6 CC(O)CN(C)CCCCF 2230a_100000227577_100000729493 [0,0,1,0,0,0|1,0,0]=2 1001 B10R0.6 CC(O)CN(C)CCCCF 269982a_100000227577_100000729493 [0,0,1,0,0,0|1,0,0]=2 1002 B10R0.6 CC(O)CN(C)CCCCO 2230a_100000227577_100000210776 [0,0,1,0,0,0|1,0,0]=2 1003 B10R0.6 CC(O)CN(C)CCCCO 2230a_100000717598_100011218427 [0,0,1,0,0,0|1,0,0]=2 1004 B10R0.6 CC(O)CN(C)CCCCO 269982a_100000227577_100000210776 [0,0,1,0,0,0|1,0,0]=2 1005 B10R0.6 CC(O)CN(C)CCCCO 269982a_100000717598_100011218427 [0,0,1,0,0,0|1,0,0]=2 1006 B10R0.6 CC(O)CN(C)CCSC#N 269982a_100000227577_100000034367 [0,0,1,0,0,0|2,0,1]=4 1007 B10R0.6 CC/C=C\CN(C)CC(C)C 2230a_100000747067_100103147603 [0,0,1,0,0,0|1,0,2]=4 1008 B10R0.6 CC/C=C\CN(C)CC(C)C 269982a_100000747067_100103147603 [0,0,1,0,0,0|1,0,2]=4 1009 B10R0.6 CC/C=C\CN(C)CC(C)O 2230a_100000227577_100103147603 [0,0,1,0,0,0|0,0,2]=3 1010 B10R0.6 CC/C=C\CN(C)CC(C)O 269982a_100000227577_100103147603 [0,0,1,0,0,0|0,0,2]=3 1011 B10R0.6 CCC#CCN(C)CC(C)C 2230a_100000747067_100009813939 [0,0,1,0,0,0|1,0,2]=4 1012 B10R0.6 CCC#CCN(C)CC(C)O 2230a_100000227577_100009813939 [0,0,1,0,0,0|0,0,2]=3 1013 B10R0.6 CCCCCC(=O)CC(C)C 1458a_100000210554_100000210326 [0,0,1,0,0,0|3,0,0]=4 1014 B10R0.6 CCCCCC(=O)CC(C)C 1458a_100000212188_100000210624 [0,0,1,0,0,0|3,0,0]=4 1015 B10R0.6 CCCCCC(=O)CC(C)O 1458a_100000212188_100011218427 [0,0,1,0,0,0|2,0,0]=3 1016 B10R0.6 CCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210326 [0,0,1,0,0,0|2,0,0]=3 1017 B10R0.6 CCCCCC(C)NC(C)C 2230a_100000211957_100000210206 [0,0,1,0,0,0|3,0,0]=4 1018 B10R0.6 CCCCCC(C)NC(C)C 2230a_100138425928_200011218191 [0,0,1,0,0,0|3,0,0]=4 1019 B10R0.6 CCCCCC(C)NC(C)C 34a_100138425928_200011218191 [0,0,1,0,0,0|3,0,0]=4 1020 B10R0.6 CCCCCC(C)OC(C)C 34a_100000212225_200011218191 [0,0,1,0,0,0|3,0,0]=4 1021 B10R0.6 CCCCCC(C)OC(C)C 34a_100011215632_100000210206 [0,0,1,0,0,0|3,0,0]=4 1022 B10R0.6 CCCCCC(C)OC(C)C 7a_100011215632_100000210206 [0,0,1,0,0,0|3,0,0]=4 1023 B10R0.6 CCCCCC(C)SC(C)C 62a_100000210206_200011218191 [0,0,1,0,0,0|3,0,0]=4 1024 B10R0.6 CCCCCC(C)SC(C)C 62a_200011218191_100000210206 [0,0,1,0,0,0|3,0,0]=4 1025 B10R0.6 CCCCCN(C)CC(=O)N 2230a_100000223495_100000747473 [0,0,1,0,0,0|1,0,2]=4 1026 B10R0.6 CCCCCN(C)CC(=O)N 2230a_100000739694_100000210326 [0,0,1,0,0,0|1,0,2]=4 1027 B10R0.6 CCCCCN(C)CC(=O)N 269982a_100000223495_100000187820 [0,0,1,0,0,0|1,0,2]=4 1028 B10R0.6 CCCCCN(C)CC(=O)O 269956a_100000746989_100000210326 [0,0,1,0,0,0|1,0,1]=3 1029 B10R0.6 CCCCCN(C)CC(=O)[O-] 269982a_100000223495_100020667443 [0,0,1,0,0,0|1,0,2]=4 1030 B10R0.6 CCCCCN(C)CC(C)C 2230a_100000223495_100000210760 [0,0,1,0,0,0|1,0,0]=2 1031 B10R0.6 CCCCCN(C)CC(C)C 2230a_100000747067_100000210326 [0,0,1,0,0,0|1,0,0]=2 1032 B10R0.6 CCCCCN(C)CC(C)C 269982a_100000223495_100000210624 [0,0,1,0,0,0|1,0,0]=2 1033 B10R0.6 CCCCCN(C)CC(C)C 269982a_100000747067_100000210215 [0,0,1,0,0,0|1,0,0]=2 1034 B10R0.6 CCCCCN(C)CC(C)C 270004a_100000223495_100000210432 [0,0,1,0,0,0|1,0,0]=2 1035 B10R0.6 CCCCCN(C)CC(C)O 2230a_100000223495_100011218427 [0,0,1,0,0,0|0,0,0]=1 1036 B10R0.6 CCCCCN(C)CC(C)O 2230a_100000227577_100000210326 [0,0,1,0,0,0|0,0,0]=1 1037 B10R0.6 CCCCCN(C)CC(C)O 269982a_100000223495_100011218427 [0,0,1,0,0,0|0,0,0]=1 1038 B10R0.6 CCCCCN(C)CC(C)O 269982a_100000227577_100000210215 [0,0,1,0,0,0|0,0,0]=1 1039 B10R0.6 CCCCCN(C)CC(F)F 2230a_100000223495_100011934356 [0,0,1,0,0,0|2,0,0]=3 1040 B10R0.6 CCCCCN(C)CC(F)F 269982a_100000223495_100011934356 [0,0,1,0,0,0|2,0,0]=3 1041 B10R0.6 CCCCCN(C)C[C@@H](C)O 2230a_100000223495_100009817552 [0,0,1,0,0,0|0,0,0]=1 1042 B10R0.6 CCCCCN(C)C[C@@H](C)O 269982a_100000223495_100009817552 [0,0,1,0,0,0|0,0,0]=1 1043 B10R0.6 CCCCCN(C)C[N+](=O)[O-] 269982a_100000223495_100000761209 [0,0,1,0,0,0|2,0,1]=4 1044 B10R0.6 CCCCNC(=O)C[C@@H](C)O 240690a_100000102301_100011933948 [0,0,1,0,0,0|3,0,0]=4 1045 B10R0.6 CCCCNC(C)CC(C)C 2230a_100000102301_100000731052 [0,0,1,0,0,0|3,0,0]=4 1046 B10R0.6 CCCCNC(C)CC(C)C 2230a_100000692259_100000210211 [0,0,1,0,0,0|3,0,0]=4 1047 B10R0.6 CCCCNC(C)CC(C)C 7a_106832991798_100000731052 [0,0,1,0,0,0|3,0,0]=4 1048 B10R0.6 CCCCOC(C)CC(C)C 34a_100000210227_100000731052 [0,0,1,0,0,0|3,0,0]=4 1049 B10R0.6 CCCCOC(C)CC(C)C 34a_100000211805_100000210210 [0,0,1,0,0,0|3,0,0]=4 1050 B10R0.6 CCCCOC(C)CC(C)C 7a_100000210227_100000731052 [0,0,1,0,0,0|3,0,0]=4 1051 B10R0.6 CCCCOC(C)CC(C)C 7a_100000211805_100000210211 [0,0,1,0,0,0|3,0,0]=4 1052 B10R0.6 CCCCSC(C)CC(C)C 62a_100000210211_100000731052 [0,0,1,0,0,0|3,0,0]=4 1053 B10R0.6 CCCCSC(C)CC(C)C 62a_100000731052_100000210210 [0,0,1,0,0,0|3,0,0]=4 1054 B10R0.6 CCCOCC(=O)CC(C)O 1458a_100000745993_100011218427 [0,0,1,0,0,0|3,0,0]=4 1055 B10R0.6 CCCSCC(=O)CC(C)O 1458a_100000217233_100011218427 [0,0,1,0,0,0|3,0,0]=4 1056 B10R0.6 CCOCCC(=O)CC(C)O 1458a_100000749530_100011218427 [0,0,1,0,0,0|3,0,0]=4 1057 B10R0.6 CCOCCC(=O)C[C@@H](C)O 1458a_100011933948_100011215890 [0,0,1,0,0,0|3,0,0]=4 1058 B10R0.6 CCOCCN(C)CC(=O)O 269956a_100000746989_100000210147 [0,0,1,0,0,0|2,0,1]=4 1059 B10R0.6 CCOCCN(C)CC(C)C 2230a_100000747067_100011215890 [0,0,1,0,0,0|2,0,0]=3 1060 B10R0.6 CCOCCN(C)CC(C)C 269982a_100000747067_100011215890 [0,0,1,0,0,0|2,0,0]=3 1061 B10R0.6 CCOCCN(C)CC(C)O 2230a_100000227577_100011215890 [0,0,1,0,0,0|1,0,0]=2 1062 B10R0.6 CCOCCN(C)CC(C)O 269982a_100000227577_100011215890 [0,0,1,0,0,0|1,0,0]=2 1063 B10R0.6 CCSCCC(=O)CC(C)O 1458a_100000230768_100011218427 [0,0,1,0,0,0|3,0,0]=4 1064 B10R0.6 CCSCCC(=O)C[C@@H](C)O 1458a_100011933948_100000757381 [0,0,1,0,0,0|3,0,0]=4 1065 B10R0.6 CCSCCN(C)CC(=O)O 269956a_100000746989_100000757381 [0,0,1,0,0,0|2,0,1]=4 1066 B10R0.6 CCSCCN(C)CC(C)C 2230a_100000747067_100000757381 [0,0,1,0,0,0|2,0,0]=3 1067 B10R0.6 CCSCCN(C)CC(C)C 269982a_100000747067_100000757381 [0,0,1,0,0,0|2,0,0]=3 1068 B10R0.6 CCSCCN(C)CC(C)O 2230a_100000227577_100000757381 [0,0,1,0,0,0|1,0,0]=2 1069 B10R0.6 CCSCCN(C)CC(C)O 269982a_100000227577_100000757381 [0,0,1,0,0,0|1,0,0]=2 1070 B10R0.6 CN(CCCCF)CC(=O)O 269956a_100000746989_100000729493 [0,0,1,0,0,0|2,0,1]=4 1071 B10R0.6 CN(CCCCO)CC(=O)O 269956a_100000746989_100000210776 [0,0,1,0,0,0|2,0,1]=4 1072 B10R0.6 CN(CCCCO)CC(F)F 2230a_100000717598_100011934356 [0,0,1,0,0,0|3,0,0]=4 1073 B10R0.6 CN(CCCCO)CC(F)F 269982a_100000717598_100011934356 [0,0,1,0,0,0|3,0,0]=4 1074 B10R0.6 COCCCC(=O)CC(C)O 1458a_100000741012_100011218427 [0,0,1,0,0,0|3,0,0]=4 1075 B10R0.6 COCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000740836 [0,0,1,0,0,0|3,0,0]=4 1076 B10R0.6 COCCCN(C)CC(=O)O 269956a_100000746989_100000740836 [0,0,1,0,0,0|2,0,1]=4 1077 B10R0.6 COCCCN(C)CC(C)C 2230a_100000224831_100000210760 [0,0,1,0,0,0|2,0,0]=3 1078 B10R0.6 COCCCN(C)CC(C)C 2230a_100000747067_100000740836 [0,0,1,0,0,0|2,0,0]=3 1079 B10R0.6 COCCCN(C)CC(C)C 269982a_100000224831_100000210624 [0,0,1,0,0,0|2,0,0]=3 1080 B10R0.6 COCCCN(C)CC(C)C 269982a_100000747067_100000740836 [0,0,1,0,0,0|2,0,0]=3 1081 B10R0.6 COCCCN(C)CC(C)C 270004a_100000224831_100000210432 [0,0,1,0,0,0|2,0,0]=3 1082 B10R0.6 COCCCN(C)CC(C)O 2230a_100000224831_100011218427 [0,0,1,0,0,0|1,0,0]=2 1083 B10R0.6 COCCCN(C)CC(C)O 2230a_100000227577_100000740836 [0,0,1,0,0,0|1,0,0]=2 1084 B10R0.6 COCCCN(C)CC(C)O 269982a_100000224831_100011218427 [0,0,1,0,0,0|1,0,0]=2 1085 B10R0.6 COCCCN(C)CC(C)O 269982a_100000227577_100000740836 [0,0,1,0,0,0|1,0,0]=2 1086 B10R0.6 COCCCN(C)CC(F)F 2230a_100000224831_100011934356 [0,0,1,0,0,0|3,0,0]=4 1087 B10R0.6 COCCCN(C)CC(F)F 269982a_100000224831_100011934356 [0,0,1,0,0,0|3,0,0]=4 1088 B10R0.6 COCCCN(C)C[C@@H](C)O 2230a_100000224831_100009817552 [0,0,1,0,0,0|1,0,0]=2 1089 B10R0.6 COCCCN(C)C[C@@H](C)O 269982a_100000224831_100009817552 [0,0,1,0,0,0|1,0,0]=2 1090 B10R0.6 CSCCCC(=O)CC(C)O 1458a_100000173376_100011218427 [0,0,1,0,0,0|3,0,0]=4 1091 B10R0.6 C[C@@H](O)CC(=O)CCCCF 1458a_100011933948_100000729493 [0,0,1,0,0,0|3,0,0]=4 1092 B10R0.6 C[C@@H](O)CC(=O)CCCCO 1458a_100011933948_100000210776 [0,0,1,0,0,0|3,0,0]=4 1093 B10R0.6 C[C@@H](O)CN(C)CCCCO 2230a_100000717598_100009817552 [0,0,1,0,0,0|1,0,0]=2 1094 B10R0.6 C[C@@H](O)CN(C)CCCCO 269982a_100000717598_100009817552 [0,0,1,0,0,0|1,0,0]=2 1095 B10R0.79 C#CCN(CCO)CC(C)O 2230a_100000731851_100000038162 [0,0,1,0,0,0|1,0,2]=4 1096 B10R0.79 C=C(C)CN(CCC)CCC 2230a_100000210455_100000748629 [0,0,1,0,0,0|1,0,1]=3 1097 B10R0.79 C=C(C)CN(CCC)CCC 269982a_100000210455_100000748629 [0,0,1,0,0,0|1,0,1]=3 1098 B10R0.79 C=C(C)CN(CCC)CCO 2230a_100000211420_100000748629 [0,0,1,0,0,0|2,0,1]=4 1099 B10R0.79 C=C(C)CN(CCC)CCO 269982a_100000211420_100000748629 [0,0,1,0,0,0|2,0,1]=4 1100 B10R0.79 C=C(F)CN(CCC)CCC 2230a_100000210455_100009893438 [0,0,1,0,0,0|1,0,2]=4 1101 B10R0.79 C=C(F)CN(CCC)CCC 269982a_100000210455_100009893438 [0,0,1,0,0,0|1,0,2]=4 1102 B10R0.79 C=CCN(CCO)CC(C)O 2230a_100000731851_100000210623 [0,0,1,0,0,0|1,0,2]=4 1103 B10R0.79 C=CCN(CCO)CC(C)O 269982a_100000731851_100000210623 [0,0,1,0,0,0|1,0,2]=4 1104 B10R0.79 CC(C)CN(CCO)CCF 2230a_100015185251_100011217306 [0,0,1,0,0,0|3,0,0]=4 1105 B10R0.79 CC(C)CN(CCO)CCF 269982a_100015185251_100011217306 [0,0,1,0,0,0|3,0,0]=4 1106 B10R0.79 CC(C)CN(CCO)CCO 2230a_100000210587_100000210760 [0,0,1,0,0,0|3,0,0]=4 1107 B10R0.79 CC(C)CN(CCO)CCO 2230a_100015185251_100000211926 [0,0,1,0,0,0|3,0,0]=4 1108 B10R0.79 CC(C)CN(CCO)CCO 269982a_100000210587_100000210624 [0,0,1,0,0,0|3,0,0]=4 1109 B10R0.79 CC(C)CN(CCO)CCO 269982a_100015185251_100000211926 [0,0,1,0,0,0|3,0,0]=4 1110 B10R0.79 CC(C)CN(CCO)CCO 270004a_100000210587_100000210432 [0,0,1,0,0,0|3,0,0]=4 1111 B10R0.79 CC(O)CN(CC#N)CCO 2230a_100000731851_100011215382 [0,0,1,0,0,0|2,0,1]=4 1112 B10R0.79 CC(O)CN(CC#N)CCO 269982a_100000731851_100011214920 [0,0,1,0,0,0|2,0,1]=4 1113 B10R0.79 CC(O)CN(CC=O)CCO 2230a_100000731851_200015260668 [0,0,1,0,0,0|2,0,1]=4 1114 B10R0.79 CC(O)CN(CC=O)CCO 269982a_100000731851_200015260668 [0,0,1,0,0,0|2,0,1]=4 1115 B10R0.79 CC(O)CN(CCO)CCF 2230a_100000731851_100011217306 [0,0,1,0,0,0|2,0,0]=3 1116 B10R0.79 CC(O)CN(CCO)CCF 269982a_100000731851_100011217306 [0,0,1,0,0,0|2,0,0]=3 1117 B10R0.79 CC(O)CN(CCO)CCO 2230a_100000210587_100011218427 [0,0,1,0,0,0|2,0,0]=3 1118 B10R0.79 CC(O)CN(CCO)CCO 2230a_100000731851_100000211926 [0,0,1,0,0,0|2,0,0]=3 1119 B10R0.79 CC(O)CN(CCO)CCO 269982a_100000210587_100011218427 [0,0,1,0,0,0|2,0,0]=3 1120 B10R0.79 CC(O)CN(CCO)CCO 269982a_100000731851_100000211926 [0,0,1,0,0,0|2,0,0]=3 1121 B10R0.79 CCCC(CC(C)C)OCC 34a_100011351045_100000210202 [0,0,1,0,0,0|3,0,0]=4 1122 B10R0.79 CCCC(CC(C)C)OCC 7a_100011351045_100000210202 [0,0,1,0,0,0|3,0,0]=4 1123 B10R0.79 CCCC(CCC)NC(C)C 2230a_100011207992_100000210206 [0,0,1,0,0,0|3,0,0]=4 1124 B10R0.79 CCCC(CCC)NC(C)C 34a_100011207992_100000210206 [0,0,1,0,0,0|3,0,0]=4 1125 B10R0.79 CCCC(CCC)NC(C)C 34a_100138425928_200011218217 [0,0,1,0,0,0|3,0,0]=4 1126 B10R0.79 CCCC(CCC)OC(C)C 34a_100000212225_200011218217 [0,0,1,0,0,0|3,0,0]=4 1127 B10R0.79 CCCC(CCC)OC(C)C 34a_200011218534_100000210206 [0,0,1,0,0,0|3,0,0]=4 1128 B10R0.79 CCCC(CCC)OC(C)C 7a_200011218534_100000210206 [0,0,1,0,0,0|3,0,0]=4 1129 B10R0.79 CCCC(CCC)SC(C)C 62a_100000210206_200011218217 [0,0,1,0,0,0|3,0,0]=4 1130 B10R0.79 CCCC(CCC)SC(C)C 62a_200011218217_100000210206 [0,0,1,0,0,0|3,0,0]=4 1131 B10R0.79 CCCN(CCC)CC(=O)C 1458a_200011243382_200000210301 [0,0,1,0,0,0|0,0,2]=3 1132 B10R0.79 CCCN(CCC)CC(=O)N 2230a_100000210455_100000747473 [0,0,1,0,0,0|1,0,2]=4 1133 B10R0.79 CCCN(CCC)CC(=O)N 269982a_100000210455_100000187820 [0,0,1,0,0,0|1,0,2]=4 1134 B10R0.79 CCCN(CCC)CC(=O)[13CH3] 1458a_200011243382_200025704644 [0,0,1,0,0,0|0,0,2]=3 1135 B10R0.79 CCCN(CCC)CC(=O)[O-] 269982a_100000210455_100020667443 [0,0,1,0,0,0|1,0,2]=4 1136 B10R0.79 CCCN(CCC)CC(C)C 2230a_100000210455_100000210760 [0,0,1,0,0,0|1,0,0]=2 1137 B10R0.79 CCCN(CCC)CC(C)C 269982a_100000210455_100000210624 [0,0,1,0,0,0|1,0,0]=2 1138 B10R0.79 CCCN(CCC)CC(C)C 270004a_100000210455_100000210432 [0,0,1,0,0,0|1,0,0]=2 1139 B10R0.79 CCCN(CCC)CC(C)O 2230a_100000210455_100011218427 [0,0,1,0,0,0|0,0,0]=1 1140 B10R0.79 CCCN(CCC)CC(C)O 269982a_100000210455_100011218427 [0,0,1,0,0,0|0,0,0]=1 1141 B10R0.79 CCCN(CCC)CC(F)F 2230a_100000210455_100011934356 [0,0,1,0,0,0|2,0,0]=3 1142 B10R0.79 CCCN(CCC)CC(F)F 269982a_100000210455_100011934356 [0,0,1,0,0,0|2,0,0]=3 1143 B10R0.79 CCCN(CCC)C[C@@H](C)O 2230a_100000210455_100009817552 [0,0,1,0,0,0|0,0,0]=1 1144 B10R0.79 CCCN(CCC)C[C@@H](C)O 269982a_100000210455_100009817552 [0,0,1,0,0,0|0,0,0]=1 1145 B10R0.79 CCCN(CCC)C[N+](=O)[O-] 269982a_100000210455_100000761209 [0,0,1,0,0,0|2,0,1]=4 1146 B10R0.79 CCCN(CCO)CC(=O)O 269956a_100000747938_100000210207 [0,0,1,0,0,0|2,0,1]=4 1147 B10R0.79 CCCN(CCO)CC(C)C 2230a_100000211420_100000210760 [0,0,1,0,0,0|2,0,0]=3 1148 B10R0.79 CCCN(CCO)CC(C)C 2230a_100015185251_100000210303 [0,0,1,0,0,0|2,0,0]=3 1149 B10R0.79 CCCN(CCO)CC(C)C 269982a_100000211420_100000210624 [0,0,1,0,0,0|2,0,0]=3 1150 B10R0.79 CCCN(CCO)CC(C)C 269982a_100015185251_100000210303 [0,0,1,0,0,0|2,0,0]=3 1151 B10R0.79 CCCN(CCO)CC(C)C 270004a_100000211420_100000210432 [0,0,1,0,0,0|2,0,0]=3 1152 B10R0.79 CCCN(CCO)CC(C)O 2230a_100000211420_100011218427 [0,0,1,0,0,0|1,0,0]=2 1153 B10R0.79 CCCN(CCO)CC(C)O 2230a_100000731851_100000210303 [0,0,1,0,0,0|1,0,0]=2 1154 B10R0.79 CCCN(CCO)CC(C)O 269982a_100000211420_100011218427 [0,0,1,0,0,0|1,0,0]=2 1155 B10R0.79 CCCN(CCO)CC(C)O 269982a_100000731851_100000210303 [0,0,1,0,0,0|1,0,0]=2 1156 B10R0.79 CCCN(CCO)CC(F)F 2230a_100000211420_100011934356 [0,0,1,0,0,0|3,0,0]=4 1157 B10R0.79 CCCN(CCO)CC(F)F 269982a_100000211420_100011934356 [0,0,1,0,0,0|3,0,0]=4 1158 B10R0.79 CCCN(CCO)C[C@@H](C)O 2230a_100000211420_100009817552 [0,0,1,0,0,0|1,0,0]=2 1159 B10R0.79 CCCN(CCO)C[C@@H](C)O 269982a_100000211420_100009817552 [0,0,1,0,0,0|1,0,0]=2 1160 B10R0.79 COCN(CCO)CC(C)C 2230a_100015185251_100000766300 [0,0,1,0,0,0|3,0,0]=4 1161 B10R0.79 COCN(CCO)CC(C)C 269982a_100015185251_100000766300 [0,0,1,0,0,0|3,0,0]=4 1162 B10R0.79 COCN(CCO)CC(C)O 2230a_100000731851_100000766300 [0,0,1,0,0,0|2,0,0]=3 1163 B10R0.79 COCN(CCO)CC(C)O 269982a_100000731851_100000766300 [0,0,1,0,0,0|2,0,0]=3 1164 B10R0.79 CSCN(CCO)CC(C)C 2230a_100015185251_100011218213 [0,0,1,0,0,0|3,0,0]=4 1165 B10R0.79 CSCN(CCO)CC(C)C 269982a_100015185251_100011218213 [0,0,1,0,0,0|3,0,0]=4 1166 B10R0.79 CSCN(CCO)CC(C)O 2230a_100000731851_100011218213 [0,0,1,0,0,0|2,0,0]=3 1167 B10R0.79 CSCN(CCO)CC(C)O 269982a_100000731851_100011218213 [0,0,1,0,0,0|2,0,0]=3 1168 B10R0.79 C[C@@H](O)CN(CCO)CCO 2230a_100000210587_100009817552 [0,0,1,0,0,0|2,0,0]=3 1169 B10R0.79 C[C@@H](O)CN(CCO)CCO 269982a_100000210587_100009817552 [0,0,1,0,0,0|2,0,0]=3 1170 B10R0.87 C#CCCN(CC)CC(C)C 2230a_100000738554_100000688953 [0,0,1,0,0,0|1,0,2]=4 1171 B10R0.87 C#CCCN(CC)CC(C)C 269982a_100000738554_100000730999 [0,0,1,0,0,0|1,0,2]=4 1172 B10R0.87 C#CCCN(CC)C[C@H](C)O 2230a_100000729506_100000688953 [0,0,1,0,0,0|0,0,2]=3 1173 B10R0.87 C#CCCN(CC)C[C@H](C)O 269982a_100000729506_100000730999 [0,0,1,0,0,0|0,0,2]=3 1174 B10R0.87 C/C=C/CN(CC)CC(C)C 269982a_100000738554_100102629194 [0,0,1,0,0,0|1,0,2]=4 1175 B10R0.87 C/C=C/CN(CC)C[C@H](C)O 269982a_100000729506_100102629194 [0,0,1,0,0,0|0,0,2]=3 1176 B10R0.87 C=C(C)CN(CC)CCCC 2230a_100000207695_100000748629 [0,0,1,0,0,0|1,0,1]=3 1177 B10R0.87 C=C(C)CN(CC)CCCC 2230a_100000211296_100000210211 [0,0,1,0,0,0|1,0,1]=3 1178 B10R0.87 C=C(C)CN(CC)CCCC 269982a_100000207695_100000748629 [0,0,1,0,0,0|1,0,1]=3 1179 B10R0.87 C=C(C)CN(CC)CCCC 269982a_100000211296_100000210211 [0,0,1,0,0,0|1,0,1]=3 1180 B10R0.87 C=C(C)CN(CC)CCCF 2230a_100000211296_100011934791 [0,0,1,0,0,0|2,0,1]=4 1181 B10R0.87 C=C(C)CN(CC)CCCF 269982a_100000211296_100011934791 [0,0,1,0,0,0|2,0,1]=4 1182 B10R0.87 C=C(C)CN(CC)CCCO 2230a_100000211296_100000230001 [0,0,1,0,0,0|2,0,1]=4 1183 B10R0.87 C=C(C)CN(CC)CCCO 269982a_100000211296_100011215043 [0,0,1,0,0,0|2,0,1]=4 1184 B10R0.87 C=C(C)CN(CC)CCOC 2230a_100000211296_100011201679 [0,0,1,0,0,0|2,0,1]=4 1185 B10R0.87 C=C(C)CN(CC)CCOC 2230a_100000731262_100000748629 [0,0,1,0,0,0|2,0,1]=4 1186 B10R0.87 C=C(C)CN(CC)CCOC 269982a_100000211296_100000233755 [0,0,1,0,0,0|2,0,1]=4 1187 B10R0.87 C=C(C)CN(CC)CCOC 269982a_100000731262_100000748629 [0,0,1,0,0,0|2,0,1]=4 1188 B10R0.87 C=C(C)CN(CC)CCSC 2230a_100000211296_100000751147 [0,0,1,0,0,0|2,0,1]=4 1189 B10R0.87 C=C(C)CN(CC)CCSC 269982a_100000211296_100000212216 [0,0,1,0,0,0|2,0,1]=4 1190 B10R0.87 C=C(C)CN(CC)COCC 269982a_100000211296_100000739092 [0,0,1,0,0,0|2,0,1]=4 1191 B10R0.87 C=C(F)CN(CC)CCCC 2230a_100000207695_100009893438 [0,0,1,0,0,0|1,0,2]=4 1192 B10R0.87 C=C(F)CN(CC)CCCC 269982a_100000207695_100009893438 [0,0,1,0,0,0|1,0,2]=4 1193 B10R0.87 C=CCCN(CC)CC(C)C 2230a_100000738554_100000754431 [0,0,1,0,0,0|1,0,2]=4 1194 B10R0.87 C=CCCN(CC)CC(C)C 269982a_100000738554_100000754431 [0,0,1,0,0,0|1,0,2]=4 1195 B10R0.87 C=CCCN(CC)C[C@H](C)O 2230a_100000729506_100000754431 [0,0,1,0,0,0|0,0,2]=3 1196 B10R0.87 C=CCCN(CC)C[C@H](C)O 269982a_100000729506_100000754431 [0,0,1,0,0,0|0,0,2]=3 1197 B10R0.87 CC#CCN(CC)CC(C)C 2230a_100000738554_100000748600 [0,0,1,0,0,0|1,0,2]=4 1198 B10R0.87 CC#CCN(CC)C[C@H](C)O 2230a_100000729506_100000748600 [0,0,1,0,0,0|0,0,2]=3 1199 B10R0.87 CC=CCN(CC)CC(C)C 2230a_100000738554_100000070051 [0,0,1,0,0,0|1,0,2]=4 1200 B10R0.87 CC=CCN(CC)C[C@H](C)O 2230a_100000729506_100000070051 [0,0,1,0,0,0|0,0,2]=3 1201 B10R0.87 CCCCC(CC)CC(=O)C 1458a_100000070787_100000211942 [0,0,1,0,0,0|1,0,2]=4 1202 B10R0.87 CCCCC(CC)CN(C)C 2230a_100102631434_100000211942 [0,0,1,0,0,0|3,0,0]=4 1203 B10R0.87 CCCCC(CC)CN(C)C 269982a_100102631434_100000211942 [0,0,1,0,0,0|3,0,0]=4 1204 B10R0.87 CCCCC(CC)CN(C)C 270004a_100102631434_100011219736 [0,0,1,0,0,0|3,0,0]=4 1205 B10R0.87 CCCCC(CC)NC(C)C 34a_100138425928_200011216223 [0,0,1,0,0,0|3,0,0]=4 1206 B10R0.87 CCCCC(CC)OC(C)C 34a_100000212225_200011216223 [0,0,1,0,0,0|3,0,0]=4 1207 B10R0.87 CCCCC(CC)OC(C)C 34a_100011215227_100000210206 [0,0,1,0,0,0|3,0,0]=4 1208 B10R0.87 CCCCC(CC)OC(C)C 7a_100011215227_100000210206 [0,0,1,0,0,0|3,0,0]=4 1209 B10R0.87 CCCCC(CC)SC(C)C 62a_100000210206_200011216223 [0,0,1,0,0,0|3,0,0]=4 1210 B10R0.87 CCCCC(CC)SC(C)C 62a_200011216223_100000210206 [0,0,1,0,0,0|3,0,0]=4 1211 B10R0.87 CCCCN(CC)CC(=O)N 2230a_100000207695_100000747473 [0,0,1,0,0,0|1,0,2]=4 1212 B10R0.87 CCCCN(CC)CC(=O)N 269982a_100000207695_100000187820 [0,0,1,0,0,0|1,0,2]=4 1213 B10R0.87 CCCCN(CC)CC(=O)O 269956a_100000746405_100000210211 [0,0,1,0,0,0|1,0,1]=3 1214 B10R0.87 CCCCN(CC)CC(=O)[O-] 269982a_100000207695_100020667443 [0,0,1,0,0,0|1,0,2]=4 1215 B10R0.87 CCCCN(CC)CC(C)C 2230a_100000207695_100000210760 [0,0,1,0,0,0|1,0,0]=2 1216 B10R0.87 CCCCN(CC)CC(C)C 2230a_100000738554_100000210211 [0,0,1,0,0,0|1,0,0]=2 1217 B10R0.87 CCCCN(CC)CC(C)C 269982a_100000207695_100000210624 [0,0,1,0,0,0|1,0,0]=2 1218 B10R0.87 CCCCN(CC)CC(C)C 269982a_100000738554_100000210211 [0,0,1,0,0,0|1,0,0]=2 1219 B10R0.87 CCCCN(CC)CC(C)C 270004a_100000207695_100000210432 [0,0,1,0,0,0|1,0,0]=2 1220 B10R0.87 CCCCN(CC)CC(C)O 2230a_100000207695_100011218427 [0,0,1,0,0,0|0,0,0]=1 1221 B10R0.87 CCCCN(CC)CC(C)O 269982a_100000207695_100011218427 [0,0,1,0,0,0|0,0,0]=1 1222 B10R0.87 CCCCN(CC)CC(F)F 2230a_100000207695_100011934356 [0,0,1,0,0,0|2,0,0]=3 1223 B10R0.87 CCCCN(CC)CC(F)F 269982a_100000207695_100011934356 [0,0,1,0,0,0|2,0,0]=3 1224 B10R0.87 CCCCN(CC)C[C@@H](C)O 2230a_100000207695_100009817552 [0,0,1,0,0,0|0,0,0]=1 1225 B10R0.87 CCCCN(CC)C[C@@H](C)O 269982a_100000207695_100009817552 [0,0,1,0,0,0|0,0,0]=1 1226 B10R0.87 CCCCN(CC)C[C@H](C)O 2230a_100000729506_100000210211 [0,0,1,0,0,0|0,0,0]=1 1227 B10R0.87 CCCCN(CC)C[C@H](C)O 269982a_100000729506_100000210211 [0,0,1,0,0,0|0,0,0]=1 1228 B10R0.87 CCCCN(CC)C[N+](=O)[O-] 269982a_100000207695_100000761209 [0,0,1,0,0,0|2,0,1]=4 1229 B10R0.87 CCN(CCC#N)CC(C)C 2230a_100000226048_100000210760 [0,0,1,0,0,0|2,0,1]=4 1230 B10R0.87 CCN(CCC#N)CC(C)C 2230a_100000738554_100011215226 [0,0,1,0,0,0|2,0,1]=4 1231 B10R0.87 CCN(CCC#N)CC(C)C 269982a_100000738554_100011215226 [0,0,1,0,0,0|2,0,1]=4 1232 B10R0.87 CCN(CCC#N)CC(C)C 270004a_100000226048_100000210432 [0,0,1,0,0,0|2,0,1]=4 1233 B10R0.87 CCN(CCC#N)CC(C)O 2230a_100000226048_100011218427 [0,0,1,0,0,0|1,0,1]=3 1234 B10R0.87 CCN(CCC#N)C[C@@H](C)O 2230a_100000226048_100009817552 [0,0,1,0,0,0|1,0,1]=3 1235 B10R0.87 CCN(CCC#N)C[C@H](C)O 2230a_100000729506_100011215226 [0,0,1,0,0,0|1,0,1]=3 1236 B10R0.87 CCN(CCC#N)C[C@H](C)O 269982a_100000729506_100011215226 [0,0,1,0,0,0|1,0,1]=3 1237 B10R0.87 CCN(CCCF)CC(=O)O 269956a_100000746405_100011934791 [0,0,1,0,0,0|2,0,1]=4 1238 B10R0.87 CCN(CCCF)CC(C)C 2230a_100000738554_100011934791 [0,0,1,0,0,0|2,0,0]=3 1239 B10R0.87 CCN(CCCF)CC(C)C 269982a_100000738554_100011934791 [0,0,1,0,0,0|2,0,0]=3 1240 B10R0.87 CCN(CCCF)C[C@H](C)O 2230a_100000729506_100011934791 [0,0,1,0,0,0|1,0,0]=2 1241 B10R0.87 CCN(CCCF)C[C@H](C)O 269982a_100000729506_100011934791 [0,0,1,0,0,0|1,0,0]=2 1242 B10R0.87 CCN(CCCO)CC(=O)O 269956a_100000746405_100011215043 [0,0,1,0,0,0|2,0,1]=4 1243 B10R0.87 CCN(CCCO)CC(C)C 2230a_100000738554_100000230001 [0,0,1,0,0,0|2,0,0]=3 1244 B10R0.87 CCN(CCCO)CC(C)C 269982a_100000738554_100011215043 [0,0,1,0,0,0|2,0,0]=3 1245 B10R0.87 CCN(CCCO)C[C@H](C)O 2230a_100000729506_100000230001 [0,0,1,0,0,0|1,0,0]=2 1246 B10R0.87 CCN(CCCO)C[C@H](C)O 269982a_100000729506_100011215043 [0,0,1,0,0,0|1,0,0]=2 1247 B10R0.87 CCN(CCOC)CC(=O)O 269956a_100000746405_100000233755 [0,0,1,0,0,0|2,0,1]=4 1248 B10R0.87 CCN(CCOC)CC(C)C 2230a_100000731262_100000210760 [0,0,1,0,0,0|2,0,0]=3 1249 B10R0.87 CCN(CCOC)CC(C)C 2230a_100000738554_100011201679 [0,0,1,0,0,0|2,0,0]=3 1250 B10R0.87 CCN(CCOC)CC(C)C 269982a_100000731262_100000210624 [0,0,1,0,0,0|2,0,0]=3 1251 B10R0.87 CCN(CCOC)CC(C)C 269982a_100000738554_100000233755 [0,0,1,0,0,0|2,0,0]=3 1252 B10R0.87 CCN(CCOC)CC(C)C 270004a_100000731262_100000210432 [0,0,1,0,0,0|2,0,0]=3 1253 B10R0.87 CCN(CCOC)CC(C)O 2230a_100000731262_100011218427 [0,0,1,0,0,0|1,0,0]=2 1254 B10R0.87 CCN(CCOC)CC(C)O 269982a_100000731262_100011218427 [0,0,1,0,0,0|1,0,0]=2 1255 B10R0.87 CCN(CCOC)CC(F)F 2230a_100000731262_100011934356 [0,0,1,0,0,0|3,0,0]=4 1256 B10R0.87 CCN(CCOC)CC(F)F 269982a_100000731262_100011934356 [0,0,1,0,0,0|3,0,0]=4 1257 B10R0.87 CCN(CCOC)C[C@@H](C)O 2230a_100000731262_100009817552 [0,0,1,0,0,0|1,0,0]=2 1258 B10R0.87 CCN(CCOC)C[C@@H](C)O 269982a_100000731262_100009817552 [0,0,1,0,0,0|1,0,0]=2 1259 B10R0.87 CCN(CCOC)C[C@H](C)O 2230a_100000729506_100011201679 [0,0,1,0,0,0|1,0,0]=2 1260 B10R0.87 CCN(CCOC)C[C@H](C)O 269982a_100000729506_100000233755 [0,0,1,0,0,0|1,0,0]=2 1261 B10R0.87 CCN(CCSC)CC(=O)O 269956a_100000746405_100000212216 [0,0,1,0,0,0|2,0,1]=4 1262 B10R0.87 CCN(CCSC)CC(C)C 2230a_100000738554_100000751147 [0,0,1,0,0,0|2,0,0]=3 1263 B10R0.87 CCN(CCSC)CC(C)C 269982a_100000738554_100000212216 [0,0,1,0,0,0|2,0,0]=3 1264 B10R0.87 CCN(CCSC)C[C@H](C)O 2230a_100000729506_100000751147 [0,0,1,0,0,0|1,0,0]=2 1265 B10R0.87 CCN(CCSC)C[C@H](C)O 269982a_100000729506_100000212216 [0,0,1,0,0,0|1,0,0]=2 1266 B10R0.87 CCN(CSC#N)C[C@H](C)O 269982a_100000729506_100000211825 [0,0,1,0,0,0|2,0,1]=4 1267 B10R0.87 CCOCC(CC)CC(C)C 34a_100012186708_100000210202 [0,0,1,0,0,0|3,0,0]=4 1268 B10R0.87 CCOCC(CC)CC(C)C 7a_100012186708_100000210202 [0,0,1,0,0,0|3,0,0]=4 1269 B10R0.87 CCOCN(CC)CC(=O)O 269956a_100000746405_100000739092 [0,0,1,0,0,0|2,0,1]=4 1270 B10R0.87 CCOCN(CC)CC(C)C 269982a_100000738554_100000739092 [0,0,1,0,0,0|2,0,0]=3 1271 B10R0.87 CCOCN(CC)C[C@H](C)O 269982a_100000729506_100000739092 [0,0,1,0,0,0|1,0,0]=2 1272 B12R2.3808 C1CCCC(CC1)NC2CC2 34a_100000210984_100000211595 [0,0,0,1,0,0|3,0,0]=4 1273 B12R2.3808 C1CCCC(CC1)NC2CC2 34a_100000212008_100011217769 [0,0,0,1,0,0|3,0,0]=4 1274 B12R2.3808 C1CCCC(CC1)OC2CC2 34a_100000210887_100000211595 [0,0,0,1,0,0|3,0,0]=4 1275 B12R2.3808 C1CCCC(CC1)SC2CC2 62a_100011217769_100000211595 [0,0,0,1,0,0|3,0,0]=4 1276 B12R2.3808 C1CCCN(CC1)CC2CC2 2230a_100000185865_100000742324 [0,0,0,1,0,0|1,0,0]=2 1277 B12R2.3808 C1CCCN(CC1)CC2CC2 269982a_100000185865_100000756562 [0,0,0,1,0,0|1,0,0]=2 1278 B12R2.3808 C1CCCN(CC1)CC2CC2 34a_100000185865_100000742324 [0,0,0,1,0,0|1,0,0]=2 1279 B12R2.3808 C1CCCN(CC1)CC2CO2 2230a_100000185865_100011216344 [0,0,0,1,0,0|0,0,0]=1 1280 B12R2.3808 C1CCCN(CC1)CC2CO2 269982a_100000185865_102125554688 [0,0,0,1,0,0|0,0,0]=1 1281 B12R2.3808 C1CCCN(CC1)CC2CO2 34a_100000185865_102125554688 [0,0,0,1,0,0|0,0,0]=1 1282 B12R2.3808 C1CCCN(CC1)CC2CS2 269982a_100000185865_100000031435 [0,0,0,1,0,0|0,1,0]=2 1283 B12R2.3808 C1CCCN(CC1)C[C@@H]2CO2 269982a_100000185865_100000745022 [0,0,0,1,0,0|0,0,0]=1 1284 B12R2.3808 C1COCCN(C1)CC2CC2 2230a_100000685342_100000742324 [0,0,0,1,0,0|2,0,0]=3 1285 B12R2.3808 C1COCCN(C1)CC2CC2 269982a_100000685342_100000756562 [0,0,0,1,0,0|2,0,0]=3 1286 B12R2.3808 C1COCCN(C1)CC2CC2 34a_100000685342_100000742324 [0,0,0,1,0,0|2,0,0]=3 1287 B12R2.3808 C1COCCN(C1)CC2CO2 2230a_100000685342_100011216344 [0,0,0,1,0,0|1,0,0]=2 1288 B12R2.3808 C1COCCN(C1)CC2CO2 269982a_100000685342_102125554688 [0,0,0,1,0,0|1,0,0]=2 1289 B12R2.3808 C1COCCN(C1)CC2CO2 34a_100000685342_102125554688 [0,0,0,1,0,0|1,0,0]=2 1290 B12R2.3808 C1COCCN(C1)CC2CS2 269982a_100000685342_100000031435 [0,0,0,1,0,0|1,1,0]=3 1291 B12R2.3808 C1COCCN(C1)C[C@@H]2CO2 269982a_100000685342_100000745022 [0,0,0,1,0,0|1,0,0]=2 1292 B10R1.18 C=C(C)CN1CCCOC1 2230a_100000131196_100000748629 [0,0,0,0,1,0|2,0,1]=4 1293 B10R1.18 C=C(C)CN1CCCOC1 269982a_100000131196_100000748629 [0,0,0,0,1,0|2,0,1]=4 1294 B10R1.18 C=C(C)CN1CCCOC1 34a_100000131196_100000748629 [0,0,0,0,1,0|2,0,1]=4 1295 B10R1.18 C=C(C)CN1CCOCC1 2230a_100015191051_100000748629 [0,0,0,0,1,0|2,0,1]=4 1296 B10R1.18 C=C(C)CN1CCOCC1 269982a_100015191051_100000748629 [0,0,0,0,1,0|2,0,1]=4 1297 B10R1.18 C=C(C)CN1CCOCC1 34a_100015191051_100000748629 [0,0,0,0,1,0|2,0,1]=4 1298 B10R1.18 C=C(C)CN1CCSCC1 2230a_100000737611_100000748629 [0,0,0,0,1,0|2,0,1]=4 1299 B10R1.18 C=C(C)CN1CCSCC1 269982a_100000737611_100000748629 [0,0,0,0,1,0|2,0,1]=4 1300 B10R1.18 CC(=O)CC1CCCCC1 1458a_100000070787_100000211423 [0,0,0,0,1,0|1,0,2]=4 1301 B10R1.18 CC(=O)CC1CCCCC1 1458a_100000211666_200000210301 [0,0,0,0,1,0|1,0,2]=4 1302 B10R1.18 CC(=O)CN1CCCCC1 1458a_100000740322_200000210301 [0,0,0,0,1,0|0,0,2]=3 1303 B10R1.18 CC(=O)CN1CCOCC1 1458a_100000740321_200000210301 [0,0,0,0,1,0|1,0,2]=4 1304 B10R1.18 CC(C)CN1CC=CCC1 2230a_100000698166_100000210760 [0,0,0,0,1,0|1,0,2]=4 1305 B10R1.18 CC(C)CN1CC=CCC1 269982a_100000698166_100000210624 [0,0,0,0,1,0|1,0,2]=4 1306 B10R1.18 CC(C)CN1CC=CCC1 270004a_100000698166_100000210432 [0,0,0,0,1,0|1,0,2]=4 1307 B10R1.18 CC(C)CN1CC=CCC1 34a_100000698166_100000210624 [0,0,0,0,1,0|1,0,2]=4 1308 B10R1.18 CC(C)CN1CCCOC1 2230a_100000131196_100000210760 [0,0,0,0,1,0|2,0,0]=3 1309 B10R1.18 CC(C)CN1CCCOC1 269982a_100000131196_100000210624 [0,0,0,0,1,0|2,0,0]=3 1310 B10R1.18 CC(C)CN1CCCOC1 270004a_100000131196_100000210432 [0,0,0,0,1,0|2,0,0]=3 1311 B10R1.18 CC(C)CN1CCCOC1 34a_100000131196_100000210624 [0,0,0,0,1,0|2,0,0]=3 1312 B10R1.18 CC(C)CN1CCOCC1 2230a_100015191051_100000210760 [0,0,0,0,1,0|2,0,0]=3 1313 B10R1.18 CC(C)CN1CCOCC1 269982a_100015191051_100000210624 [0,0,0,0,1,0|2,0,0]=3 1314 B10R1.18 CC(C)CN1CCOCC1 270004a_100015191051_100000210432 [0,0,0,0,1,0|2,0,0]=3 1315 B10R1.18 CC(C)CN1CCOCC1 34a_100015191051_100000210624 [0,0,0,0,1,0|2,0,0]=3 1316 B10R1.18 CC(C)CN1CCSCC1 2230a_100000737611_100000210760 [0,0,0,0,1,0|2,0,0]=3 1317 B10R1.18 CC(C)CN1CCSCC1 269982a_100000737611_100000210624 [0,0,0,0,1,0|2,0,0]=3 1318 B10R1.18 CC(C)CN1CCSCC1 270004a_100000737611_100000210432 [0,0,0,0,1,0|2,0,0]=3 1319 B10R1.18 CC(C)NC1CCCCC1 2230a_100000182618_100000210206 [0,0,0,0,1,0|3,0,0]=4 1320 B10R1.18 CC(C)NC1CCCCC1 34a_100000182618_100000210206 [0,0,0,0,1,0|3,0,0]=4 1321 B10R1.18 CC(C)NC1CCCCC1 34a_100138425928_100000210327 [0,0,0,0,1,0|3,0,0]=4 1322 B10R1.18 CC(C)OC1CCCCC1 34a_100000210231_100000210206 [0,0,0,0,1,0|3,0,0]=4 1323 B10R1.18 CC(C)OC1CCCCC1 34a_100000212225_100000210327 [0,0,0,0,1,0|3,0,0]=4 1324 B10R1.18 CC(C)OC1CCCCC1 7a_100000210231_100000210206 [0,0,0,0,1,0|3,0,0]=4 1325 B10R1.18 CC(C)SC1CCCCC1 62a_100000210206_100000210327 [0,0,0,0,1,0|3,0,0]=4 1326 B10R1.18 CC(C)SC1CCCCC1 62a_100000210327_100000210206 [0,0,0,0,1,0|3,0,0]=4 1327 B10R1.18 CC(O)CN1CC=CCC1 2230a_100000698166_100011218427 [0,0,0,0,1,0|0,0,2]=3 1328 B10R1.18 CC(O)CN1CC=CCC1 269982a_100000698166_100011218427 [0,0,0,0,1,0|0,0,2]=3 1329 B10R1.18 CC(O)CN1CC=CCC1 34a_100000698166_100011218427 [0,0,0,0,1,0|0,0,2]=3 1330 B10R1.18 CC(O)CN1CCCOC1 2230a_100000131196_100011218427 [0,0,0,0,1,0|1,0,0]=2 1331 B10R1.18 CC(O)CN1CCCOC1 269982a_100000131196_100011218427 [0,0,0,0,1,0|1,0,0]=2 1332 B10R1.18 CC(O)CN1CCCOC1 34a_100000131196_100011218427 [0,0,0,0,1,0|1,0,0]=2 1333 B10R1.18 CC(O)CN1CCOCC1 2230a_100015191051_100011218427 [0,0,0,0,1,0|1,0,0]=2 1334 B10R1.18 CC(O)CN1CCOCC1 269982a_100015191051_100011218427 [0,0,0,0,1,0|1,0,0]=2 1335 B10R1.18 CC(O)CN1CCOCC1 34a_100015191051_100011218427 [0,0,0,0,1,0|1,0,0]=2 1336 B10R1.18 CC(O)CN1CCSCC1 2230a_100000737611_100011218427 [0,0,0,0,1,0|1,0,0]=2 1337 B10R1.18 CC(O)CN1CCSCC1 269982a_100000737611_100011218427 [0,0,0,0,1,0|1,0,0]=2 1338 B10R1.18 CN(C)CC1CCCCC1 2230a_100000736448_200000210301 [0,0,0,0,1,0|3,0,0]=4 1339 B10R1.18 CN(C)CC1CCCCC1 2230a_100102631434_100000211423 [0,0,0,0,1,0|3,0,0]=4 1340 B10R1.18 CN(C)CC1CCCCC1 269982a_100000736448_200000210301 [0,0,0,0,1,0|3,0,0]=4 1341 B10R1.18 CN(C)CC1CCCCC1 269982a_100102631434_100000211423 [0,0,0,0,1,0|3,0,0]=4 1342 B10R1.18 CN(C)CC1CCCCC1 34a_100000736448_200000210301 [0,0,0,0,1,0|3,0,0]=4 1343 B10R1.18 CN([13CH3])CC1CCCCC1 2230a_100000736448_200025704644 [0,0,0,0,1,0|3,0,0]=4 1344 B10R1.18 CN([13CH3])CC1CCCCC1 269982a_100000736448_200025704644 [0,0,0,0,1,0|3,0,0]=4 1345 B10R1.18 CN([13CH3])CC1CCCCC1 34a_100000736448_200025704644 [0,0,0,0,1,0|3,0,0]=4 1346 B10R1.18 C[C@@H](O)CN1CC=CCC1 2230a_100000698166_100009817552 [0,0,0,0,1,0|0,0,2]=3 1347 B10R1.18 C[C@@H](O)CN1CC=CCC1 269982a_100000698166_100009817552 [0,0,0,0,1,0|0,0,2]=3 1348 B10R1.18 C[C@@H](O)CN1CC=CCC1 34a_100000698166_100009817552 [0,0,0,0,1,0|0,0,2]=3 1349 B10R1.18 C[C@@H](O)CN1CCCOC1 2230a_100000131196_100009817552 [0,0,0,0,1,0|1,0,0]=2 1350 B10R1.18 C[C@@H](O)CN1CCCOC1 269982a_100000131196_100009817552 [0,0,0,0,1,0|1,0,0]=2 1351 B10R1.18 C[C@@H](O)CN1CCCOC1 34a_100000131196_100009817552 [0,0,0,0,1,0|1,0,0]=2 1352 B10R1.18 C[C@@H](O)CN1CCOCC1 2230a_100015191051_100009817552 [0,0,0,0,1,0|1,0,0]=2 1353 B10R1.18 C[C@@H](O)CN1CCOCC1 269982a_100015191051_100009817552 [0,0,0,0,1,0|1,0,0]=2 1354 B10R1.18 C[C@@H](O)CN1CCOCC1 34a_100015191051_100009817552 [0,0,0,0,1,0|1,0,0]=2 1355 B10R1.18 C[C@@H](O)CN1CCSCC1 2230a_100000737611_100009817552 [0,0,0,0,1,0|1,0,0]=2 1356 B10R1.18 C[C@@H](O)CN1CCSCC1 269982a_100000737611_100009817552 [0,0,0,0,1,0|1,0,0]=2 1357 B10R1.18 FC(F)CN1CCCOC1 2230a_100000131196_100011934356 [0,0,0,0,1,0|3,0,0]=4 1358 B10R1.18 FC(F)CN1CCCOC1 269982a_100000131196_100011934356 [0,0,0,0,1,0|3,0,0]=4 1359 B10R1.18 FC(F)CN1CCCOC1 34a_100000131196_100011934356 [0,0,0,0,1,0|3,0,0]=4 1360 B10R1.18 FC(F)CN1CCOCC1 2230a_100015191051_100011934356 [0,0,0,0,1,0|3,0,0]=4 1361 B10R1.18 FC(F)CN1CCOCC1 269982a_100015191051_100011934356 [0,0,0,0,1,0|3,0,0]=4 1362 B10R1.18 FC(F)CN1CCOCC1 34a_100015191051_100011934356 [0,0,0,0,1,0|3,0,0]=4 1363 B10R1.18 FC(F)CN1CCSCC1 2230a_100000737611_100011934356 [0,0,0,0,1,0|3,0,0]=4 1364 B10R1.18 FC(F)CN1CCSCC1 269982a_100000737611_100011934356 [0,0,0,0,1,0|3,0,0]=4 1365 B10R1.18 [13CH3]C(=O)CC1CCCCC1 1458a_100000211666_200025704644 [0,0,0,0,1,0|1,0,2]=4 1366 B10R1.18 [13CH3]C(=O)CN1CCCCC1 1458a_100000740322_200025704644 [0,0,0,0,1,0|0,0,2]=3 1367 B10R1.18 [13CH3]C(=O)CN1CCOCC1 1458a_100000740321_200025704644 [0,0,0,0,1,0|1,0,2]=4 1368 B10R1.348 CC(=O)C1CCCCCC1 1458a_100000070787_100011217769 [0,0,0,0,1,0|1,0,2]=4 1369 B10R1.348 CC(=O)C1CCCCCC1 1458a_100000749507_200000210301 [0,0,0,0,1,0|1,0,2]=4 1370 B10R1.348 CC(=O)N1CCCCCC1 11a_100000185865_100015343762 [0,0,0,0,1,0|0,0,2]=3 1371 B10R1.348 CC(=O)N1CCCCCC1 1626a_100000185865_100015343762 [0,0,0,0,1,0|0,0,2]=3 1372 B10R1.348 CC(=O)N1CCCCCC1 240690a_100000185865_100015343762 [0,0,0,0,1,0|0,0,2]=3 1373 B10R1.348 CC(=O)N1CCCCCC1 527a_100000185865_100103153847 [0,0,0,0,1,0|0,0,2]=3 1374 B10R1.348 CC(=O)N1CCCOCC1 11a_100000685342_100015343762 [0,0,0,0,1,0|1,0,2]=4 1375 B10R1.348 CC(=O)N1CCCOCC1 1626a_100000685342_100015343762 [0,0,0,0,1,0|1,0,2]=4 1376 B10R1.348 CC(=O)N1CCCOCC1 240690a_100000685342_100015343762 [0,0,0,0,1,0|1,0,2]=4 1377 B10R1.348 CC(=O)N1CCCOCC1 527a_100000685342_100103153847 [0,0,0,0,1,0|1,0,2]=4 1378 B10R1.348 CC(C)N1CCCCCC1 2230a_100000185865_100000210206 [0,0,0,0,1,0|1,0,0]=2 1379 B10R1.348 CC(C)N1CCCCCC1 269982a_100000185865_100000210206 [0,0,0,0,1,0|1,0,0]=2 1380 B10R1.348 CC(C)N1CCCCCC1 34a_100000185865_100000210206 [0,0,0,0,1,0|1,0,0]=2 1381 B10R1.348 CC(C)N1CCCOCC1 2230a_100000685342_100000210206 [0,0,0,0,1,0|2,0,0]=3 1382 B10R1.348 CC(C)N1CCCOCC1 269982a_100000685342_100000210206 [0,0,0,0,1,0|2,0,0]=3 1383 B10R1.348 CC(C)N1CCCOCC1 34a_100000685342_100000210206 [0,0,0,0,1,0|2,0,0]=3 1384 B10R1.348 CN(C)C1CCCCCC1 2230a_100015185097_200000210301 [0,0,0,0,1,0|3,0,0]=4 1385 B10R1.348 CN(C)C1CCCCCC1 269982a_100015185097_200000210301 [0,0,0,0,1,0|3,0,0]=4 1386 B10R1.348 CN(C)C1CCCCCC1 269982a_100102631434_100011217769 [0,0,0,0,1,0|3,0,0]=4 1387 B10R1.348 CN(C)C1CCCCCC1 270004a_100102631434_100000210131 [0,0,0,0,1,0|3,0,0]=4 1388 B10R1.348 CN(C)C1CCCCCC1 34a_100015185097_200000210301 [0,0,0,0,1,0|3,0,0]=4 1389 B10R1.348 CN([13CH3])C1CCCCCC1 2230a_100015185097_200025704644 [0,0,0,0,1,0|3,0,0]=4 1390 B10R1.348 CN([13CH3])C1CCCCCC1 269982a_100015185097_200025704644 [0,0,0,0,1,0|3,0,0]=4 1391 B10R1.348 CN([13CH3])C1CCCCCC1 34a_100015185097_200025704644 [0,0,0,0,1,0|3,0,0]=4 1392 B10R1.348 [13CH3]C(=O)C1CCCCCC1 1458a_100000749507_200025704644 [0,0,0,0,1,0|1,0,2]=4 1393 B12R1.1343 C=C(C)CCN1CCCCCC1 2230a_100000185865_100000730704 [0,0,0,0,0,1|1,0,1]=3 1394 B12R1.1343 C=C(C)CCN1CCCCCC1 269982a_100000185865_100000730704 [0,0,0,0,0,1|1,0,1]=3 1395 B12R1.1343 C=C(C)CCN1CCCCCC1 34a_100000185865_100000730704 [0,0,0,0,0,1|1,0,1]=3 1396 B12R1.1343 C=C(C)CCN1CCCOCC1 2230a_100000685342_100000730704 [0,0,0,0,0,1|2,0,1]=4 1397 B12R1.1343 C=C(C)CCN1CCCOCC1 269982a_100000685342_100000730704 [0,0,0,0,0,1|2,0,1]=4 1398 B12R1.1343 C=C(C)CCN1CCCOCC1 34a_100000685342_100000730704 [0,0,0,0,0,1|2,0,1]=4 1399 B12R1.1343 C=C(C)CNC1CCCCCC1 2230a_100000210984_100000748629 [0,0,0,0,0,1|2,0,1]=4 1400 B12R1.1343 C=C(C)CNC1CCCCCC1 34a_100000210984_100000748629 [0,0,0,0,0,1|2,0,1]=4 1401 B12R1.1343 C=C(C)COC1CCCCCC1 34a_100000210245_100011217769 [0,0,0,0,0,1|2,0,1]=4 1402 B12R1.1343 C=C(C)COC1CCCCCC1 34a_100000210887_100000748629 [0,0,0,0,0,1|2,0,1]=4 1403 B12R1.1343 C=C(C)COC1CCCCCC1 7a_100000210887_100000748629 [0,0,0,0,0,1|2,0,1]=4 1404 B12R1.1343 C=C(C)CSC1CCCCCC1 62a_100000748629_100011217769 [0,0,0,0,0,1|2,0,1]=4 1405 B12R1.1343 C=C(C)CSC1CCCCCC1 62a_100011217769_100000211660 [0,0,0,0,0,1|2,0,1]=4 1406 B12R1.1343 CC(=CCN1CCCCCC1)C 2230a_100000185865_100000761012 [0,0,0,0,0,1|1,0,1]=3 1407 B12R1.1343 CC(=CCN1CCCCCC1)C 269982a_100000185865_100000761012 [0,0,0,0,0,1|1,0,1]=3 1408 B12R1.1343 CC(=CCN1CCCCCC1)C 34a_100000185865_100000761012 [0,0,0,0,0,1|1,0,1]=3 1409 B12R1.1343 CC(=CCN1CCCOCC1)C 2230a_100000685342_100000761012 [0,0,0,0,0,1|2,0,1]=4 1410 B12R1.1343 CC(=CCN1CCCOCC1)C 269982a_100000685342_100000761012 [0,0,0,0,0,1|2,0,1]=4 1411 B12R1.1343 CC(=CCN1CCCOCC1)C 34a_100000685342_100000761012 [0,0,0,0,0,1|2,0,1]=4 1412 B12R1.1343 CC(=O)CCN1CCCCCC1 1458a_100000070787_100000722644 [0,0,0,0,0,1|0,0,2]=3 1413 B12R1.1343 CC(=O)CCN1CCCCCC1 1458a_100000740320_200000210301 [0,0,0,0,0,1|0,0,2]=3 1414 B12R1.1343 CC(=O)CCN1CCCCCC1 269982a_100000185865_100000053229 [0,0,0,0,0,1|0,0,2]=3 1415 B12R1.1343 CC(=O)CCN1CCCOCC1 269982a_100000685342_100000053229 [0,0,0,0,0,1|1,0,2]=4 1416 B12R1.1343 CC(=O)COC1CCCCCC1 34a_100000211253_100011217769 [0,0,0,0,0,1|1,0,2]=4 1417 B12R1.1343 CC(=O)NCC1CCCCCC1 11a_100015204231_100015343762 [0,0,0,0,0,1|1,0,2]=4 1418 B12R1.1343 CC(=O)NCC1CCCCCC1 1626a_100015204231_100015343762 [0,0,0,0,0,1|1,0,2]=4 1419 B12R1.1343 CC(=O)NCC1CCCCCC1 240690a_100015204231_100015343762 [0,0,0,0,0,1|1,0,2]=4 1420 B12R1.1343 CC(=O)NCC1CCCCCC1 527a_100015204231_100103153847 [0,0,0,0,0,1|1,0,2]=4 1421 B12R1.1343 CC(=O)OCN1CCCCCC1 269982a_100000185865_100000076356 [0,0,0,0,0,1|0,0,2]=3 1422 B12R1.1343 CC(=O)OCN1CCCCCC1 34a_100000185865_100009813279 [0,0,0,0,0,1|0,0,2]=3 1423 B12R1.1343 CC(=O)OCN1CCCOCC1 269982a_100000685342_100000076356 [0,0,0,0,0,1|1,0,2]=4 1424 B12R1.1343 CC(=O)OCN1CCCOCC1 34a_100000685342_100009813279 [0,0,0,0,0,1|1,0,2]=4 1425 B12R1.1343 CC(Br)COC1CCCCCC1 34a_100012180447_100011217769 [0,0,0,0,0,1|2,0,0]=3 1426 B12R1.1343 CC(C)CCN1CCCCCC1 2230a_100000185865_100000210312 [0,0,0,0,0,1|1,0,0]=2 1427 B12R1.1343 CC(C)CCN1CCCCCC1 269982a_100000185865_100000210312 [0,0,0,0,0,1|1,0,0]=2 1428 B12R1.1343 CC(C)CCN1CCCCCC1 34a_100000185865_100000210312 [0,0,0,0,0,1|1,0,0]=2 1429 B12R1.1343 CC(C)CCN1CCCOCC1 2230a_100000685342_100000210312 [0,0,0,0,0,1|2,0,0]=3 1430 B12R1.1343 CC(C)CCN1CCCOCC1 269982a_100000685342_100000210312 [0,0,0,0,0,1|2,0,0]=3 1431 B12R1.1343 CC(C)CCN1CCCOCC1 34a_100000685342_100000210312 [0,0,0,0,0,1|2,0,0]=3 1432 B12R1.1343 CC(C)CNC1CCCCCC1 2230a_100000210984_100000210760 [0,0,0,0,0,1|2,0,0]=3 1433 B12R1.1343 CC(C)CNC1CCCCCC1 270004a_100000210953_100000210131 [0,0,0,0,0,1|2,0,0]=3 1434 B12R1.1343 CC(C)CNC1CCCCCC1 270004a_100000210984_100000210432 [0,0,0,0,0,1|2,0,0]=3 1435 B12R1.1343 CC(C)CNC1CCCCCC1 34a_100000210953_100011217769 [0,0,0,0,0,1|2,0,0]=3 1436 B12R1.1343 CC(C)CNC1CCCCCC1 34a_100000210984_100000210624 [0,0,0,0,0,1|2,0,0]=3 1437 B12R1.1343 CC(C)CNC1CCCNCC1 270004a_100000210953_100015187895 [0,0,0,0,0,1|3,0,0]=4 1438 B12R1.1343 CC(C)COC1CCCCCC1 34a_100000210257_100011217769 [0,0,0,0,0,1|2,0,0]=3 1439 B12R1.1343 CC(C)COC1CCCCCC1 34a_100000210887_100000210624 [0,0,0,0,0,1|2,0,0]=3 1440 B12R1.1343 CC(C)COC1CCCCCC1 7a_100000210887_100000210760 [0,0,0,0,0,1|2,0,0]=3 1441 B12R1.1343 CC(C)CSC1CCCCCC1 62a_100000210624_100011217769 [0,0,0,0,0,1|2,0,0]=3 1442 B12R1.1343 CC(C)CSC1CCCCCC1 62a_100011217769_100000210760 [0,0,0,0,0,1|2,0,0]=3 1443 B12R1.1343 CC(C)NCC1CCCCCC1 2230a_100015204231_100000210206 [0,0,0,0,0,1|2,0,0]=3 1444 B12R1.1343 CC(C)NCC1CCCCCC1 2230a_100138425928_200000696569 [0,0,0,0,0,1|2,0,0]=3 1445 B12R1.1343 CC(C)NCC1CCCCCC1 34a_100015204231_100000210206 [0,0,0,0,0,1|2,0,0]=3 1446 B12R1.1343 CC(C)NCC1CCCCCC1 34a_100138425928_200000696569 [0,0,0,0,0,1|2,0,0]=3 1447 B12R1.1343 CC(C)NN=C1CCCCCC1 4a_100000741168_100000210131 [0,0,0,0,0,1|3,0,0]=4 1448 B12R1.1343 CC(C)OCC1CCCCCC1 34a_100000212225_200000696569 [0,0,0,0,0,1|2,0,0]=3 1449 B12R1.1343 CC(C)OCC1CCCCCC1 34a_100000699130_100000210206 [0,0,0,0,0,1|2,0,0]=3 1450 B12R1.1343 CC(C)OCC1CCCCCC1 7a_100000699130_100000210206 [0,0,0,0,0,1|2,0,0]=3 1451 B12R1.1343 CC(C)OCN1CCCCCC1 2230a_100000185865_100000709892 [0,0,0,0,0,1|1,0,0]=2 1452 B12R1.1343 CC(C)OCN1CCCCCC1 269982a_100000185865_100000709892 [0,0,0,0,0,1|1,0,0]=2 1453 B12R1.1343 CC(C)OCN1CCCCCC1 34a_100000185865_100000709892 [0,0,0,0,0,1|1,0,0]=2 1454 B12R1.1343 CC(C)OCN1CCCOCC1 2230a_100000685342_100000709892 [0,0,0,0,0,1|2,0,0]=3 1455 B12R1.1343 CC(C)OCN1CCCOCC1 269982a_100000685342_100000709892 [0,0,0,0,0,1|2,0,0]=3 1456 B12R1.1343 CC(C)OCN1CCCOCC1 34a_100000685342_100000709892 [0,0,0,0,0,1|2,0,0]=3 1457 B12R1.1343 CC(C)SCC1CCCCCC1 62a_100000210206_200000696569 [0,0,0,0,0,1|2,0,0]=3 1458 B12R1.1343 CC(C)SCC1CCCCCC1 62a_200000696569_100000210206 [0,0,0,0,0,1|2,0,0]=3 1459 B12R1.1343 CC(F)COC1CCCCCC1 34a_100015925927_100011217769 [0,0,0,0,0,1|2,0,0]=3 1460 B12R1.1343 CC(O)CCN1CCCCCC1 2230a_100000185865_100012276601 [0,0,0,0,0,1|0,0,0]=1 1461 B12R1.1343 CC(O)CCN1CCCCCC1 269982a_100000185865_100012276601 [0,0,0,0,0,1|0,0,0]=1 1462 B12R1.1343 CC(O)CCN1CCCCCC1 34a_100000185865_100012276601 [0,0,0,0,0,1|0,0,0]=1 1463 B12R1.1343 CC(O)CCN1CCCOCC1 2230a_100000685342_100012276601 [0,0,0,0,0,1|1,0,0]=2 1464 B12R1.1343 CC(O)CCN1CCCOCC1 269982a_100000685342_100012276601 [0,0,0,0,0,1|1,0,0]=2 1465 B12R1.1343 CC(O)CCN1CCCOCC1 34a_100000685342_100012276601 [0,0,0,0,0,1|1,0,0]=2 1466 B12R1.1343 CC(O)CNC1CCCCCC1 2230a_100000210984_100011218427 [0,0,0,0,0,1|1,0,0]=2 1467 B12R1.1343 CC(O)CNC1CCCCCC1 270004a_100000210904_100000210131 [0,0,0,0,0,1|1,0,0]=2 1468 B12R1.1343 CC(O)CNC1CCCCCC1 34a_100000210904_100011217769 [0,0,0,0,0,1|1,0,0]=2 1469 B12R1.1343 CC(O)CNC1CCCCCC1 34a_100000210984_100011218427 [0,0,0,0,0,1|1,0,0]=2 1470 B12R1.1343 CC(O)CNC1CCCNCC1 270004a_100000210904_100015187895 [0,0,0,0,0,1|2,0,0]=3 1471 B12R1.1343 CC(O)CNC1CSCCSC1 270004a_100000210904_100000068409 [0,0,0,0,0,1|3,0,0]=4 1472 B12R1.1343 CC(O)COC1CCCCCC1 34a_100000210887_100011218427 [0,0,0,0,0,1|1,0,0]=2 1473 B12R1.1343 CC(O)COC1CCCCCC1 7a_100000210887_100011218427 [0,0,0,0,0,1|1,0,0]=2 1474 B12R1.1343 CC(O)CSC1CCCCCC1 62a_100011217769_100011218427 [0,0,0,0,0,1|1,0,0]=2 1475 B12R1.1343 CC(O)CSC1CCCCCC1 62a_100011218427_100011217769 [0,0,0,0,0,1|1,0,0]=2 1476 B12R1.1343 CN(C)CCN1CCCCCC1 269982a_100000185865_100000755713 [0,0,0,0,0,1|2,0,0]=3 1477 B12R1.1343 CN(C)CCN1CCCCCC1 269982a_100102631434_100000722644 [0,0,0,0,0,1|2,0,0]=3 1478 B12R1.1343 CN(C)CCN1CCCCCC1 269982a_106744473495_200000210301 [0,0,0,0,0,1|2,0,0]=3 1479 B12R1.1343 CN(C)CCN1CCCOCC1 269982a_100000685342_100000755713 [0,0,0,0,0,1|3,0,0]=4 1480 B12R1.1343 CN([13CH3])CCN1CCCCCC1 269982a_106744473495_200025704644 [0,0,0,0,0,1|2,0,0]=3 1481 B12R1.1343 C[C@@H](Cl)COC1CCCCCC1 34a_100016084084_100011217769 [0,0,0,0,0,1|2,0,0]=3 1482 B12R1.1343 C[C@@H](N)COC1CCCCCC1 34a_100000737577_100011217769 [0,0,0,0,0,1|2,0,0]=3 1483 B12R1.1343 C[C@@H](O)CNC1CCCCCC1 2230a_100000210984_100009817552 [0,0,0,0,0,1|1,0,0]=2 1484 B12R1.1343 C[C@@H](O)CNC1CCCCCC1 34a_100000210984_100009817552 [0,0,0,0,0,1|1,0,0]=2 1485 B12R1.1343 C[C@@H](O)COC1CCCCCC1 34a_100000210887_100009817552 [0,0,0,0,0,1|1,0,0]=2 1486 B12R1.1343 C[C@@H](O)COC1CCCCCC1 7a_100000210887_100009817552 [0,0,0,0,0,1|1,0,0]=2 1487 B12R1.1343 C[C@@H](O)CSC1CCCCCC1 62a_100009817552_100011217769 [0,0,0,0,0,1|1,0,0]=2 1488 B12R1.1343 C[C@@H](O)CSC1CCCCCC1 62a_100011217769_100009817552 [0,0,0,0,0,1|1,0,0]=2 1489 B12R1.1343 FC(F)CNC1CCCCCC1 2230a_100000210984_100011934356 [0,0,0,0,0,1|3,0,0]=4 1490 B12R1.1343 FC(F)CNC1CCCCCC1 270004a_100000765723_100000210131 [0,0,0,0,0,1|3,0,0]=4 1491 B12R1.1343 FC(F)CNC1CCCCCC1 34a_100000210984_100011934356 [0,0,0,0,0,1|3,0,0]=4 1492 B12R1.1343 FC(F)CNC1CCCCCC1 34a_100000765723_100011217769 [0,0,0,0,0,1|3,0,0]=4 1493 B12R1.1343 FC(F)COC1CCCCCC1 34a_100000210887_100011934356 [0,0,0,0,0,1|3,0,0]=4 1494 B12R1.1343 FC(F)COC1CCCCCC1 34a_100000743014_100011217769 [0,0,0,0,0,1|3,0,0]=4 1495 B12R1.1343 FC(F)COC1CCCCCC1 7a_100000210887_100011934356 [0,0,0,0,0,1|3,0,0]=4 1496 B12R1.1343 FC(F)CSC1CCCCCC1 62a_100011217769_100011934356 [0,0,0,0,0,1|3,0,0]=4 1497 B12R1.1343 FC(F)CSC1CCCCCC1 62a_100011934356_100011217769 [0,0,0,0,0,1|3,0,0]=4 1498 B12R1.1343 NC(=O)CCN1CCCCCC1 2230a_100000185865_100000744528 [0,0,0,0,0,1|1,0,2]=4 1499 B12R1.1343 NC(=O)CCN1CCCCCC1 269982a_100000185865_100000744528 [0,0,0,0,0,1|1,0,2]=4 1500 B12R1.1343 NC(=O)CCN1CCCCCC1 34a_100000185865_100000731001 [0,0,0,0,0,1|1,0,2]=4 1501 B12R1.1343 O=C(O)CNC1CCCCCC1 269956a_100016091260_100011217769 [0,0,0,0,0,1|2,0,1]=4 1502 B12R1.1343 [13CH3]C(=O)CCN1CCCCCC1 1458a_100000740320_200025704644 [0,0,0,0,0,1|0,0,2]=3 1503 B12R1.1392 C=C(C)CN1CCCCCCC1 2230a_100000211400_100000748629 [0,0,0,0,0,1|1,0,1]=3 1504 B12R1.1392 C=C(C)CN1CCCCCCC1 269982a_100000211400_100000748629 [0,0,0,0,0,1|1,0,1]=3 1505 B12R1.1392 C=C(C)CN1CCCCCCC1 34a_100000211400_100000748629 [0,0,0,0,0,1|1,0,1]=3 1506 B12R1.1392 C=C(F)CN1CCCCCCC1 2230a_100000211400_100009893438 [0,0,0,0,0,1|1,0,2]=4 1507 B12R1.1392 C=C(F)CN1CCCCCCC1 269982a_100000211400_100009893438 [0,0,0,0,0,1|1,0,2]=4 1508 B12R1.1392 C=C(F)CN1CCCCCCC1 34a_100000211400_100009893438 [0,0,0,0,0,1|1,0,2]=4 1509 B12R1.1392 CC(C)CN1CCCCCCC1 2230a_100000211400_100000210760 [0,0,0,0,0,1|1,0,0]=2 1510 B12R1.1392 CC(C)CN1CCCCCCC1 269982a_100000211400_100000210624 [0,0,0,0,0,1|1,0,0]=2 1511 B12R1.1392 CC(C)CN1CCCCCCC1 270004a_100000211400_100000210432 [0,0,0,0,0,1|1,0,0]=2 1512 B12R1.1392 CC(C)CN1CCCCCCC1 34a_100000211400_100000210624 [0,0,0,0,0,1|1,0,0]=2 1513 B12R1.1392 CC(C)NC1CCCCCCC1 2230a_100000211152_100000210206 [0,0,0,0,0,1|3,0,0]=4 1514 B12R1.1392 CC(C)NC1CCCCCCC1 34a_100000211152_100000210206 [0,0,0,0,0,1|3,0,0]=4 1515 B12R1.1392 CC(C)OC1CCCCCCC1 34a_100000210054_100000210206 [0,0,0,0,0,1|3,0,0]=4 1516 B12R1.1392 CC(C)OC1CCCCCCC1 7a_100000210054_100000210206 [0,0,0,0,0,1|3,0,0]=4 1517 B12R1.1392 CC(O)CN1CCCCCCC1 2230a_100000211400_100011218427 [0,0,0,0,0,1|0,0,0]=1 1518 B12R1.1392 CC(O)CN1CCCCCCC1 269982a_100000211400_100011218427 [0,0,0,0,0,1|0,0,0]=1 1519 B12R1.1392 CC(O)CN1CCCCCCC1 34a_100000211400_100011218427 [0,0,0,0,0,1|0,0,0]=1 1520 B12R1.1392 C[C@@H](O)CN1CCCCCCC1 2230a_100000211400_100009817552 [0,0,0,0,0,1|0,0,0]=1 1521 B12R1.1392 C[C@@H](O)CN1CCCCCCC1 269982a_100000211400_100009817552 [0,0,0,0,0,1|0,0,0]=1 1522 B12R1.1392 C[C@@H](O)CN1CCCCCCC1 34a_100000211400_100009817552 [0,0,0,0,0,1|0,0,0]=1 1523 B12R1.1392 FC(F)CN1CCCCCCC1 2230a_100000211400_100011934356 [0,0,0,0,0,1|2,0,0]=3 1524 B12R1.1392 FC(F)CN1CCCCCCC1 269982a_100000211400_100011934356 [0,0,0,0,0,1|2,0,0]=3 1525 B12R1.1392 FC(F)CN1CCCCCCC1 34a_100000211400_100011934356 [0,0,0,0,0,1|2,0,0]=3 1526 B12R1.1392 NC(=O)CN1CCCCCCC1 2230a_100000211400_100000747473 [0,0,0,0,0,1|1,0,2]=4 1527 B12R1.1392 NC(=O)CN1CCCCCCC1 269982a_100000211400_100000187820 [0,0,0,0,0,1|1,0,2]=4 1528 B12R1.1392 NC(=O)CN1CCCCCCC1 34a_100000211400_100000187820 [0,0,0,0,0,1|1,0,2]=4 1529 B12R1.1392 O=C([O-])CN1CCCCCCC1 269982a_100000211400_100020667443 [0,0,0,0,0,1|1,0,2]=4 1530 B12R1.1392 O=C([O-])CN1CCCCCCC1 34a_100000211400_100020667443 [0,0,0,0,0,1|1,0,2]=4 1531 B12R1.1392 O=[N+]([O-])CN1CCCCCCC1 269982a_100000211400_100000761209 [0,0,0,0,0,1|2,0,1]=4 1532 B12R1.1392 O=[N+]([O-])CN1CCCCCCC1 34a_100000211400_100000761209 [0,0,0,0,0,1|2,0,1]=4 1533 B9R0.2 C#CCCCNCC(C)O 2230a_100000210904_100000731252 [1,0,1,0,0,0|0,0,2]=4 1534 B9R0.2 C#CCCCNCC(C)O 34a_100000210904_100000695029 [1,0,1,0,0,0|0,0,2]=4 1535 B9R0.2 C#CCCCNCC(C)O 34a_100000718082_100011218427 [1,0,1,0,0,0|0,0,2]=4 1536 B9R0.2 C#CCCCNC[C@@H](C)O 34a_100000718082_100009817552 [1,0,1,0,0,0|0,0,2]=4 1537 B9R0.2 C=C(C)CNCCCCC 2230a_100000209983_100000748629 [1,0,1,0,0,0|1,0,1]=4 1538 B9R0.2 C=CCCCNCC(C)O 2230a_100000210904_100011713584 [1,0,1,0,0,0|0,0,2]=4 1539 B9R0.2 C=CCCCNCC(C)O 2230a_100000700776_100011218427 [1,0,1,0,0,0|0,0,2]=4 1540 B9R0.2 C=CCCCNCC(C)O 34a_100000210904_100000757094 [1,0,1,0,0,0|0,0,2]=4 1541 B9R0.2 C=CCCCNCC(C)O 34a_100000700776_100011218427 [1,0,1,0,0,0|0,0,2]=4 1542 B9R0.2 C=CCCCNC[C@@H](C)O 2230a_100000700776_100009817552 [1,0,1,0,0,0|0,0,2]=4 1543 B9R0.2 C=CCCCNC[C@@H](C)O 34a_100000700776_100009817552 [1,0,1,0,0,0|0,0,2]=4 1544 B9R0.2 CC(C)CCCCCN[13CH3] 2230a_100011290863_200025704644 [1,0,1,0,0,0|2,0,0]=4 1545 B9R0.2 CC(C)CCCCCN[13CH3] 34a_100011290863_200025704644 [1,0,1,0,0,0|2,0,0]=4 1546 B9R0.2 CC(C)CCCCCO[13CH3] 34a_100011995859_200025704644 [1,0,1,0,0,0|2,0,0]=4 1547 B9R0.2 CC(C)CCCCCO[13CH3] 7a_100011995859_200025704644 [1,0,1,0,0,0|2,0,0]=4 1548 B9R0.2 CC(C)CCCCCS[13CH3] 62a_100000210682_200025704644 [1,0,1,0,0,0|2,0,0]=4 1549 B9R0.2 CC(C)CCCCCS[13CH3] 62a_200025704644_100000210682 [1,0,1,0,0,0|2,0,0]=4 1550 B9R0.2 CC(C)CNCCCCF 2230a_100000210953_100000729493 [1,0,1,0,0,0|2,0,0]=4 1551 B9R0.2 CC(C)CNCCCCF 34a_100000210953_100000729493 [1,0,1,0,0,0|2,0,0]=4 1552 B9R0.2 CC(C)CNCCCCO 2230a_100000210953_100000210776 [1,0,1,0,0,0|2,0,0]=4 1553 B9R0.2 CC(C)CNCCCCO 2230a_100000750430_100000210760 [1,0,1,0,0,0|2,0,0]=4 1554 B9R0.2 CC(C)CNCCCCO 270004a_100000750430_100000210432 [1,0,1,0,0,0|2,0,0]=4 1555 B9R0.2 CC(C)CNCCCCO 34a_100000210953_100011216708 [1,0,1,0,0,0|2,0,0]=4 1556 B9R0.2 CC(C)CNCCCCO 34a_100000750430_100000210624 [1,0,1,0,0,0|2,0,0]=4 1557 B9R0.2 CC(C)NCCCCCF 2230a_100138425928_100000729378 [1,0,1,0,0,0|2,0,0]=4 1558 B9R0.2 CC(C)NCCCCCF 34a_100138425928_100000729378 [1,0,1,0,0,0|2,0,0]=4 1559 B9R0.2 CC(C)NCCCCCO 2230a_100000762737_100000210206 [1,0,1,0,0,0|2,0,0]=4 1560 B9R0.2 CC(C)NCCCCCO 2230a_100138425928_100000746330 [1,0,1,0,0,0|2,0,0]=4 1561 B9R0.2 CC(C)NCCCCCO 34a_100000762737_100000210206 [1,0,1,0,0,0|2,0,0]=4 1562 B9R0.2 CC(C)NCCCCCO 34a_100138425928_100000746330 [1,0,1,0,0,0|2,0,0]=4 1563 B9R0.2 CC(C)NCCCCO[13CH3] 34a_100011521146_200025704644 [1,0,1,0,0,0|2,0,0]=4 1564 B9R0.2 CC(O)CCCNCCF 34a_100000724931_200000718107 [1,0,1,0,0,0|2,0,0]=4 1565 B9R0.2 CC(O)CCCNCCO 2230a_100016997473_200000718107 [1,0,1,0,0,0|2,0,0]=4 1566 B9R0.2 CC(O)CCCNCCO 34a_100016990907_200000718107 [1,0,1,0,0,0|2,0,0]=4 1567 B9R0.2 CC(O)CCCOCCBr 34a_100000211926_200000718107 [1,0,1,0,0,0|2,0,0]=4 1568 B9R0.2 CC(O)CCCOCCN 34a_100000210304_200000718107 [1,0,1,0,0,0|2,0,0]=4 1569 B9R0.2 CC(O)CCCSCCF 62a_100011217306_200000718107 [1,0,1,0,0,0|2,0,0]=4 1570 B9R0.2 CC(O)CCCSCCF 62a_200000718107_100011217306 [1,0,1,0,0,0|2,0,0]=4 1571 B9R0.2 CC(O)CCCSCCO 62a_100000211926_200000718107 [1,0,1,0,0,0|2,0,0]=4 1572 B9R0.2 CC(O)CCCSCCO 62a_200000718107_100000211926 [1,0,1,0,0,0|2,0,0]=4 1573 B9R0.2 CC(O)CCNCCCF 2230a_100015189416_100012276601 [1,0,1,0,0,0|2,0,0]=4 1574 B9R0.2 CC(O)CCNCCCF 2230a_200000755665_100011934791 [1,0,1,0,0,0|2,0,0]=4 1575 B9R0.2 CC(O)CCNCCCF 34a_100015189416_100012276601 [1,0,1,0,0,0|2,0,0]=4 1576 B9R0.2 CC(O)CCNCCCO 2230a_200000755665_100000230001 [1,0,1,0,0,0|2,0,0]=4 1577 B9R0.2 CC(O)CCOCCCBr 34a_100011217188_100012276601 [1,0,1,0,0,0|2,0,0]=4 1578 B9R0.2 CC(O)CCOCCCCl 34a_100000230001_100012276601 [1,0,1,0,0,0|2,0,0]=4 1579 B9R0.2 CC(O)CCOCCCF 34a_100000759539_100012276601 [1,0,1,0,0,0|2,0,0]=4 1580 B9R0.2 CC(O)CCOCCCN 34a_100000182051_100012276601 [1,0,1,0,0,0|2,0,0]=4 1581 B9R0.2 CC(O)CCSCCCF 62a_100011934791_100012276601 [1,0,1,0,0,0|2,0,0]=4 1582 B9R0.2 CC(O)CCSCCCF 62a_100012276601_100011934791 [1,0,1,0,0,0|2,0,0]=4 1583 B9R0.2 CC(O)CCSCCCO 62a_100011215043_100012276601 [1,0,1,0,0,0|2,0,0]=4 1584 B9R0.2 CC(O)CCSCCCO 62a_100012276601_100011215043 [1,0,1,0,0,0|2,0,0]=4 1585 B9R0.2 CC(O)CNCCCC#N 2230a_100000210904_100000687738 [1,0,1,0,0,0|1,0,1]=4 1586 B9R0.2 CC(O)CNCCCC=O 2230a_100000210904_200011292268 [1,0,1,0,0,0|1,0,1]=4 1587 B9R0.2 CC(O)CNCCCCF 2230a_100000210904_100000729493 [1,0,1,0,0,0|1,0,0]=3 1588 B9R0.2 CC(O)CNCCCCF 34a_100000210904_100000729493 [1,0,1,0,0,0|1,0,0]=3 1589 B9R0.2 CC(O)CNCCCCO 2230a_100000210904_100000210776 [1,0,1,0,0,0|1,0,0]=3 1590 B9R0.2 CC(O)CNCCCCO 2230a_100000750430_100011218427 [1,0,1,0,0,0|1,0,0]=3 1591 B9R0.2 CC(O)CNCCCCO 34a_100000210904_100011216708 [1,0,1,0,0,0|1,0,0]=3 1592 B9R0.2 CC(O)CNCCCCO 34a_100000750430_100011218427 [1,0,1,0,0,0|1,0,0]=3 1593 B9R0.2 CC(O)COCCCCBr 34a_100011216708_100011218427 [1,0,1,0,0,0|2,0,0]=4 1594 B9R0.2 CC(O)COCCCCCl 34a_100000210776_100011218427 [1,0,1,0,0,0|2,0,0]=4 1595 B9R0.2 CC(O)COCCCCCl 7a_100000210776_100011218427 [1,0,1,0,0,0|2,0,0]=4 1596 B9R0.2 CC(O)COCCCCF 34a_100011995726_100011218427 [1,0,1,0,0,0|2,0,0]=4 1597 B9R0.2 CC(O)COCCCCF 7a_100011995726_100011218427 [1,0,1,0,0,0|2,0,0]=4 1598 B9R0.2 CC(O)COCCCCI 34a_200012148704_100011218427 [1,0,1,0,0,0|2,0,0]=4 1599 B9R0.2 CC(O)COCCCCN 34a_100000750430_100011218427 [1,0,1,0,0,0|2,0,0]=4 1600 B9R0.2 CC(O)CSCCCCF 62a_100000729493_100011218427 [1,0,1,0,0,0|2,0,0]=4 1601 B9R0.2 CC(O)CSCCCCF 62a_100011218427_100000729493 [1,0,1,0,0,0|2,0,0]=4 1602 B9R0.2 CC(O)CSCCCCO 62a_100000210776_100011218427 [1,0,1,0,0,0|2,0,0]=4 1603 B9R0.2 CC(O)CSCCCCO 62a_100011218427_100000210776 [1,0,1,0,0,0|2,0,0]=4 1604 B9R0.2 CC/C=C\CNCC(C)O 2230a_100000210904_100103147603 [1,0,1,0,0,0|0,0,2]=4 1605 B9R0.2 CC/C=C\CNCC(C)O 34a_100000210904_100103147603 [1,0,1,0,0,0|0,0,2]=4 1606 B9R0.2 CCC#CCNCC(C)O 2230a_100000210904_100009813939 [1,0,1,0,0,0|0,0,2]=4 1607 B9R0.2 CCC#CCNCC(C)O 34a_100000210904_100009813939 [1,0,1,0,0,0|0,0,2]=4 1608 B9R0.2 CCCC=NNCC(C)O 4a_200000730056_100000185831 [1,0,1,0,0,0|1,0,1]=4 1609 B9R0.2 CCCCCCCC(=O)C 1458a_100000070787_100000210614 [1,0,1,0,0,0|0,0,2]=4 1610 B9R0.2 CCCCCCCC(=O)C 1458a_100000211969_200000210301 [1,0,1,0,0,0|0,0,2]=4 1611 B9R0.2 CCCCCCCC(=O)[13CH3] 1458a_100000211969_200025704644 [1,0,1,0,0,0|0,0,2]=4 1612 B9R0.2 CCCCCCCN(C)C 2230a_100000228206_200000210301 [1,0,1,0,0,0|2,0,0]=4 1613 B9R0.2 CCCCCCCN(C)C 2230a_100102631434_100000210681 [1,0,1,0,0,0|2,0,0]=4 1614 B9R0.2 CCCCCCCN(C)C 269982a_100000228206_200000210301 [1,0,1,0,0,0|2,0,0]=4 1615 B9R0.2 CCCCCCCN(C)C 269982a_100102631434_100000210681 [1,0,1,0,0,0|2,0,0]=4 1616 B9R0.2 CCCCCCCN(C)[13CH3] 2230a_100000228206_200025704644 [1,0,1,0,0,0|2,0,0]=4 1617 B9R0.2 CCCCCCCN(C)[13CH3] 269982a_100000228206_200025704644 [1,0,1,0,0,0|2,0,0]=4 1618 B9R0.2 CCCCCCNC(=O)C 11a_100000210581_100015343762 [1,0,1,0,0,0|0,0,2]=4 1619 B9R0.2 CCCCCCNC(=O)C 1626a_100000210581_100015343762 [1,0,1,0,0,0|0,0,2]=4 1620 B9R0.2 CCCCCCNC(=O)C 240690a_100000210581_100015343762 [1,0,1,0,0,0|0,0,2]=4 1621 B9R0.2 CCCCCCNC(=O)C 527a_100000210581_100103153847 [1,0,1,0,0,0|0,0,2]=4 1622 B9R0.2 CCCCCCNC(C)C 2230a_100000210581_100000210206 [1,0,1,0,0,0|1,0,0]=3 1623 B9R0.2 CCCCCCNC(C)C 2230a_100138425928_100000210314 [1,0,1,0,0,0|1,0,0]=3 1624 B9R0.2 CCCCCCNC(C)C 34a_100138425928_100000210314 [1,0,1,0,0,0|1,0,0]=3 1625 B9R0.2 CCCCCCOC(C)C 34a_100000210259_100000210206 [1,0,1,0,0,0|2,0,0]=4 1626 B9R0.2 CCCCCCOC(C)C 34a_100000212225_100000210314 [1,0,1,0,0,0|2,0,0]=4 1627 B9R0.2 CCCCCCOC(C)C 7a_100000210259_100000210206 [1,0,1,0,0,0|2,0,0]=4 1628 B9R0.2 CCCCCCSC(C)C 62a_100000210206_100000210757 [1,0,1,0,0,0|2,0,0]=4 1629 B9R0.2 CCCCCCSC(C)C 62a_100000210314_100000210206 [1,0,1,0,0,0|2,0,0]=4 1630 B9R0.2 CCCCCNCC(=O)O 269956a_100016091260_100000210326 [1,0,1,0,0,0|1,0,1]=4 1631 B9R0.2 CCCCCNCC(C)C 2230a_100000209983_100000210760 [1,0,1,0,0,0|1,0,0]=3 1632 B9R0.2 CCCCCNCC(C)C 2230a_100000210953_100000210326 [1,0,1,0,0,0|1,0,0]=3 1633 B9R0.2 CCCCCNCC(C)C 270004a_100000209983_100000210432 [1,0,1,0,0,0|1,0,0]=3 1634 B9R0.2 CCCCCNCC(C)C 34a_100000210953_100000718602 [1,0,1,0,0,0|1,0,0]=3 1635 B9R0.2 CCCCCNCC(C)O 2230a_100000209983_100011218427 [1,0,1,0,0,0|0,0,0]=2 1636 B9R0.2 CCCCCNCC(C)O 2230a_100000210904_100000210326 [1,0,1,0,0,0|0,0,0]=2 1637 B9R0.2 CCCCCNCC(C)O 34a_100000210904_100000718602 [1,0,1,0,0,0|0,0,0]=2 1638 B9R0.2 CCCCCNCC(F)F 2230a_100000209983_100011934356 [1,0,1,0,0,0|2,0,0]=4 1639 B9R0.2 CCCCCNCC(F)F 34a_100000765723_100000718602 [1,0,1,0,0,0|2,0,0]=4 1640 B9R0.2 CCCCCNC[C@@H](C)O 2230a_100000209983_100009817552 [1,0,1,0,0,0|0,0,0]=2 1641 B9R0.2 CCCCCOCC(C)Br 34a_100012180447_100000718602 [1,0,1,0,0,0|2,0,0]=4 1642 B9R0.2 CCCCCOCC(C)C 34a_100000210253_100000210624 [1,0,1,0,0,0|2,0,0]=4 1643 B9R0.2 CCCCCOCC(C)C 34a_100000210257_100000718602 [1,0,1,0,0,0|2,0,0]=4 1644 B9R0.2 CCCCCOCC(C)C 7a_100000210253_100000210760 [1,0,1,0,0,0|2,0,0]=4 1645 B9R0.2 CCCCCOCC(C)F 34a_100015925927_100000718602 [1,0,1,0,0,0|2,0,0]=4 1646 B9R0.2 CCCCCOCC(C)O 34a_100000210253_100011218427 [1,0,1,0,0,0|1,0,0]=3 1647 B9R0.2 CCCCCOCC(C)O 7a_100000210253_100011218427 [1,0,1,0,0,0|1,0,0]=3 1648 B9R0.2 CCCCCOC[C@@H](C)Cl 34a_100016084084_100000718602 [1,0,1,0,0,0|2,0,0]=4 1649 B9R0.2 CCCCCOC[C@@H](C)N 34a_100000737577_100000718602 [1,0,1,0,0,0|2,0,0]=4 1650 B9R0.2 CCCCCOC[C@@H](C)O 34a_100000210253_100009817552 [1,0,1,0,0,0|1,0,0]=3 1651 B9R0.2 CCCCCOC[C@@H](C)O 7a_100000210253_100009817552 [1,0,1,0,0,0|1,0,0]=3 1652 B9R0.2 CCCCCSCC(C)C 62a_100000210326_100000210760 [1,0,1,0,0,0|2,0,0]=4 1653 B9R0.2 CCCCCSCC(C)C 62a_100000210624_100000210326 [1,0,1,0,0,0|2,0,0]=4 1654 B9R0.2 CCCCCSCC(C)O 62a_100000210326_100011218427 [1,0,1,0,0,0|1,0,0]=3 1655 B9R0.2 CCCCCSCC(C)O 62a_100011218427_100000210326 [1,0,1,0,0,0|1,0,0]=3 1656 B9R0.2 CCCCCSC[C@@H](C)O 62a_100000210326_100009817552 [1,0,1,0,0,0|1,0,0]=3 1657 B9R0.2 CCCCCSC[C@@H](C)O 62a_100009817552_100000210326 [1,0,1,0,0,0|1,0,0]=3 1658 B9R0.2 CCCCNCCC(C)C 2230a_100000102301_100000210312 [1,0,1,0,0,0|2,0,0]=4 1659 B9R0.2 CCCCNCCC(C)C 269862a_100000102301_100000185833 [1,0,1,0,0,0|2,0,0]=4 1660 B9R0.2 CCCCNCCC(C)C 7a_106832991798_100000210626 [1,0,1,0,0,0|2,0,0]=4 1661 B9R0.2 CCCCNCCC(C)O 2230a_100000102301_100012276601 [1,0,1,0,0,0|1,0,0]=3 1662 B9R0.2 CCCCNCCC(C)O 2230a_200000755665_100000210211 [1,0,1,0,0,0|1,0,0]=3 1663 B9R0.2 CCCCNCCC(C)O 7a_106832991798_100012276601 [1,0,1,0,0,0|1,0,0]=3 1664 B9R0.2 CCCCOCCC(C)Br 34a_100009893172_100000210210 [1,0,1,0,0,0|2,0,0]=4 1665 B9R0.2 CCCCOCCC(C)C 34a_100000210227_100000210312 [1,0,1,0,0,0|2,0,0]=4 1666 B9R0.2 CCCCOCCC(C)C 34a_100000210254_100000210210 [1,0,1,0,0,0|2,0,0]=4 1667 B9R0.2 CCCCOCCC(C)C 7a_100000210227_100000210626 [1,0,1,0,0,0|2,0,0]=4 1668 B9R0.2 CCCCOCCC(C)C 7a_100000210254_100000210211 [1,0,1,0,0,0|2,0,0]=4 1669 B9R0.2 CCCCOCCC(C)O 34a_100000210227_100012276601 [1,0,1,0,0,0|1,0,0]=3 1670 B9R0.2 CCCCOCCC(C)O 7a_100000210227_100012276601 [1,0,1,0,0,0|1,0,0]=3 1671 B9R0.2 CCCCOCC[C@@H](C)N 34a_100000706166_100000210210 [1,0,1,0,0,0|2,0,0]=4 1672 B9R0.2 CCCCOCNC(C)C 2230a_100138425928_100011995733 [1,0,1,0,0,0|2,0,0]=4 1673 B9R0.2 CCCCOCNC(C)C 34a_100138425928_100011995733 [1,0,1,0,0,0|2,0,0]=4 1674 B9R0.2 CCCCSCCC(C)C 62a_100000210211_100000210312 [1,0,1,0,0,0|2,0,0]=4 1675 B9R0.2 CCCCSCCC(C)C 62a_100000210312_100000210210 [1,0,1,0,0,0|2,0,0]=4 1676 B9R0.2 CCCCSCCC(C)O 62a_100000210211_100012276601 [1,0,1,0,0,0|1,0,0]=3 1677 B9R0.2 CCCCSCCC(C)O 62a_100012276601_100000210210 [1,0,1,0,0,0|1,0,0]=3 1678 B9R0.2 CCCNCCCC(C)C 2230a_200000737386_100000210303 [1,0,1,0,0,0|2,0,0]=4 1679 B9R0.2 CCCNCCCC(C)C 34a_200000737386_100000210303 [1,0,1,0,0,0|2,0,0]=4 1680 B9R0.2 CCCOCCCC(C)C 34a_100000210258_100011214892 [1,0,1,0,0,0|2,0,0]=4 1681 B9R0.2 CCCOCCCC(C)C 34a_100000210774_100000210303 [1,0,1,0,0,0|2,0,0]=4 1682 B9R0.2 CCCOCCCC(C)C 7a_100000210774_100000210303 [1,0,1,0,0,0|2,0,0]=4 1683 B9R0.2 CCCOCCCC(C)O 34a_100000210258_200000718107 [1,0,1,0,0,0|1,0,0]=3 1684 B9R0.2 CCCOCCNC(C)C 2230a_100138425928_100011215938 [1,0,1,0,0,0|2,0,0]=4 1685 B9R0.2 CCCOCCNC(C)C 2230a_100161115042_100000210206 [1,0,1,0,0,0|2,0,0]=4 1686 B9R0.2 CCCOCCNC(C)C 34a_100000224655_100000210303 [1,0,1,0,0,0|2,0,0]=4 1687 B9R0.2 CCCOCCNC(C)C 34a_100138425928_100011215938 [1,0,1,0,0,0|2,0,0]=4 1688 B9R0.2 CCCOCCNC(C)C 34a_100161115042_100000210206 [1,0,1,0,0,0|2,0,0]=4 1689 B9R0.2 CCCSCCCC(C)C 62a_100000210303_100011214892 [1,0,1,0,0,0|2,0,0]=4 1690 B9R0.2 CCCSCCCC(C)C 62a_100011214892_100000210303 [1,0,1,0,0,0|2,0,0]=4 1691 B9R0.2 CCCSCCCC(C)O 62a_100000210303_200000718107 [1,0,1,0,0,0|1,0,0]=3 1692 B9R0.2 CCCSCCCC(C)O 62a_200000718107_100000210303 [1,0,1,0,0,0|1,0,0]=3 1693 B9R0.2 CCCSCCNC(C)C 2230a_100020603323_100000210206 [1,0,1,0,0,0|2,0,0]=4 1694 B9R0.2 CCNCCCCC(C)C 2230a_100015525214_100011216152 [1,0,1,0,0,0|2,0,0]=4 1695 B9R0.2 CCOCCCCC(C)C 34a_100011214890_100000210202 [1,0,1,0,0,0|2,0,0]=4 1696 B9R0.2 CCOCCCCC(C)C 34a_100121572206_100011216152 [1,0,1,0,0,0|2,0,0]=4 1697 B9R0.2 CCOCCCCC(C)C 7a_100011214890_100000210202 [1,0,1,0,0,0|2,0,0]=4 1698 B9R0.2 CCOCCCNC(C)C 2230a_100000210961_100000210206 [1,0,1,0,0,0|2,0,0]=4 1699 B9R0.2 CCOCCCNC(C)C 2230a_100138425928_100012232248 [1,0,1,0,0,0|2,0,0]=4 1700 B9R0.2 CCOCCCNC(C)C 34a_100000182298_100000210202 [1,0,1,0,0,0|2,0,0]=4 1701 B9R0.2 CCOCCCNC(C)C 34a_100000210961_100000210206 [1,0,1,0,0,0|2,0,0]=4 1702 B9R0.2 CCOCCCNC(C)C 34a_100138425928_100012232248 [1,0,1,0,0,0|2,0,0]=4 1703 B9R0.2 CCOCCNCC(C)C 2230a_100000210953_100011215890 [1,0,1,0,0,0|2,0,0]=4 1704 B9R0.2 CCOCCNCC(C)C 2230a_102516460346_100000210760 [1,0,1,0,0,0|2,0,0]=4 1705 B9R0.2 CCOCCNCC(C)C 270004a_102516460346_100000210432 [1,0,1,0,0,0|2,0,0]=4 1706 B9R0.2 CCOCCNCC(C)C 34a_100000210953_100000210147 [1,0,1,0,0,0|2,0,0]=4 1707 B9R0.2 CCOCCNCC(C)C 34a_100015185251_100000210202 [1,0,1,0,0,0|2,0,0]=4 1708 B9R0.2 CCOCCNCC(C)C 34a_102516460346_100000210624 [1,0,1,0,0,0|2,0,0]=4 1709 B9R0.2 CCOCCNCC(C)O 2230a_100000210904_100011215890 [1,0,1,0,0,0|1,0,0]=3 1710 B9R0.2 CCOCCNCC(C)O 2230a_102516460346_100011218427 [1,0,1,0,0,0|1,0,0]=3 1711 B9R0.2 CCOCCNCC(C)O 34a_100000210904_100000210147 [1,0,1,0,0,0|1,0,0]=3 1712 B9R0.2 CCOCCNCC(C)O 34a_102516460346_100011218427 [1,0,1,0,0,0|1,0,0]=3 1713 B9R0.2 CCOCCNC[C@@H](C)O 2230a_102516460346_100009817552 [1,0,1,0,0,0|1,0,0]=3 1714 B9R0.2 CCOCCNC[C@@H](C)O 34a_102516460346_100009817552 [1,0,1,0,0,0|1,0,0]=3 1715 B9R0.2 CCOCCOCC(C)O 34a_100000210136_100011218427 [1,0,1,0,0,0|2,0,0]=4 1716 B9R0.2 CCOCCOCC(C)O 7a_100000210136_100011218427 [1,0,1,0,0,0|2,0,0]=4 1717 B9R0.2 CCOCCOC[C@@H](C)O 34a_100000210136_100009817552 [1,0,1,0,0,0|2,0,0]=4 1718 B9R0.2 CCOCCOC[C@@H](C)O 7a_100000210136_100009817552 [1,0,1,0,0,0|2,0,0]=4 1719 B9R0.2 CCOCCSCC(C)O 62a_100000210147_100011218427 [1,0,1,0,0,0|2,0,0]=4 1720 B9R0.2 CCOCCSCC(C)O 62a_100011218427_100011215890 [1,0,1,0,0,0|2,0,0]=4 1721 B9R0.2 CCOCCSC[C@@H](C)O 62a_100000210147_100009817552 [1,0,1,0,0,0|2,0,0]=4 1722 B9R0.2 CCOCCSC[C@@H](C)O 62a_100009817552_100011215890 [1,0,1,0,0,0|2,0,0]=4 1723 B9R0.2 CCOCSCCC(C)O 62a_100000739092_100012276601 [1,0,1,0,0,0|2,0,0]=4 1724 B9R0.2 CCOCSCCC(C)O 62a_100012276601_100000739092 [1,0,1,0,0,0|2,0,0]=4 1725 B9R0.2 CCSCCCCC(C)C 62a_100000210202_100011216152 [1,0,1,0,0,0|2,0,0]=4 1726 B9R0.2 CCSCCCCC(C)C 62a_100011216152_100000210202 [1,0,1,0,0,0|2,0,0]=4 1727 B9R0.2 CCSCCNCC(C)C 2230a_100000106463_100000210760 [1,0,1,0,0,0|2,0,0]=4 1728 B9R0.2 CCSCCNCC(C)C 2230a_100000210953_100000757381 [1,0,1,0,0,0|2,0,0]=4 1729 B9R0.2 CCSCCNCC(C)C 270004a_100000106463_100000210432 [1,0,1,0,0,0|2,0,0]=4 1730 B9R0.2 CCSCCNCC(C)C 34a_100000210953_100000757381 [1,0,1,0,0,0|2,0,0]=4 1731 B9R0.2 CCSCCNCC(C)O 2230a_100000106463_100011218427 [1,0,1,0,0,0|1,0,0]=3 1732 B9R0.2 CCSCCNCC(C)O 2230a_100000210904_100000757381 [1,0,1,0,0,0|1,0,0]=3 1733 B9R0.2 CCSCCNCC(C)O 34a_100000210904_100000757381 [1,0,1,0,0,0|1,0,0]=3 1734 B9R0.2 CCSCCNC[C@@H](C)O 2230a_100000106463_100009817552 [1,0,1,0,0,0|1,0,0]=3 1735 B9R0.2 CCSCCOCC(C)O 34a_100000212035_100011218427 [1,0,1,0,0,0|2,0,0]=4 1736 B9R0.2 CCSCCOCC(C)O 7a_100000212035_100011218427 [1,0,1,0,0,0|2,0,0]=4 1737 B9R0.2 CCSCCOC[C@@H](C)O 34a_100000212035_100009817552 [1,0,1,0,0,0|2,0,0]=4 1738 B9R0.2 CCSCCOC[C@@H](C)O 7a_100000212035_100009817552 [1,0,1,0,0,0|2,0,0]=4 1739 B9R0.2 CCSCCSCC(C)O 62a_100000757381_100011218427 [1,0,1,0,0,0|2,0,0]=4 1740 B9R0.2 CCSCCSCC(C)O 62a_100011218427_100000757381 [1,0,1,0,0,0|2,0,0]=4 1741 B9R0.2 CCSCCSC[C@@H](C)O 62a_100000757381_100009817552 [1,0,1,0,0,0|2,0,0]=4 1742 B9R0.2 CCSCCSC[C@@H](C)O 62a_100009817552_100000757381 [1,0,1,0,0,0|2,0,0]=4 1743 B9R0.2 CNCCCCCC(C)C 2230a_100011290863_200000210301 [1,0,1,0,0,0|2,0,0]=4 1744 B9R0.2 CNCCCCCC(C)C 2230a_106832991635_100000210682 [1,0,1,0,0,0|2,0,0]=4 1745 B9R0.2 CNCCCCCC(C)C 34a_100011290863_200000210301 [1,0,1,0,0,0|2,0,0]=4 1746 B9R0.2 CNCCCCCC(C)C 34a_100102657272_100000210682 [1,0,1,0,0,0|2,0,0]=4 1747 B9R0.2 CNCCCCCC(C)C 7a_106832991635_100000210682 [1,0,1,0,0,0|2,0,0]=4 1748 B9R0.2 CNCCCOCC(C)O 34a_100000213112_100011218427 [1,0,1,0,0,0|2,0,0]=4 1749 B9R0.2 CNCCCOC[C@@H](C)O 34a_100000213112_100009817552 [1,0,1,0,0,0|2,0,0]=4 1750 B9R0.2 COCCCCCC(C)C 34a_100011995859_200000210301 [1,0,1,0,0,0|2,0,0]=4 1751 B9R0.2 COCCCCCC(C)C 34a_100138415774_100000210682 [1,0,1,0,0,0|2,0,0]=4 1752 B9R0.2 COCCCCCC(C)C 7a_100011995859_200000210301 [1,0,1,0,0,0|2,0,0]=4 1753 B9R0.2 COCCCCNC(C)C 2230a_100138425928_100000730899 [1,0,1,0,0,0|2,0,0]=4 1754 B9R0.2 COCCCCNC(C)C 34a_100011521146_200000210301 [1,0,1,0,0,0|2,0,0]=4 1755 B9R0.2 COCCCCNC(C)C 34a_100138425928_100000755781 [1,0,1,0,0,0|2,0,0]=4 1756 B9R0.2 COCCCNCC(C)C 2230a_100000210953_100000740836 [1,0,1,0,0,0|2,0,0]=4 1757 B9R0.2 COCCCNCC(C)C 270004a_100150723488_100000210432 [1,0,1,0,0,0|2,0,0]=4 1758 B9R0.2 COCCCNCC(C)C 34a_100000210953_100000740836 [1,0,1,0,0,0|2,0,0]=4 1759 B9R0.2 COCCCNCC(C)C 34a_100150723488_100000210624 [1,0,1,0,0,0|2,0,0]=4 1760 B9R0.2 COCCCNCC(C)O 2230a_100000210904_100000740836 [1,0,1,0,0,0|1,0,0]=3 1761 B9R0.2 COCCCNCC(C)O 34a_100000210904_100000740836 [1,0,1,0,0,0|1,0,0]=3 1762 B9R0.2 COCCCNCC(C)O 34a_100150723488_100011218427 [1,0,1,0,0,0|1,0,0]=3 1763 B9R0.2 COCCCNC[C@@H](C)O 34a_100150723488_100009817552 [1,0,1,0,0,0|1,0,0]=3 1764 B9R0.2 COCCCOCC(C)O 34a_100000740835_100011218427 [1,0,1,0,0,0|2,0,0]=4 1765 B9R0.2 COCCCOC[C@@H](C)O 34a_100000740835_100009817552 [1,0,1,0,0,0|2,0,0]=4 1766 B9R0.2 COCCCSCC(C)O 62a_100000709357_100011218427 [1,0,1,0,0,0|2,0,0]=4 1767 B9R0.2 COCCCSCC(C)O 62a_100011218427_100000709357 [1,0,1,0,0,0|2,0,0]=4 1768 B9R0.2 COCCCSC[C@@H](C)O 62a_100000709357_100009817552 [1,0,1,0,0,0|2,0,0]=4 1769 B9R0.2 COCCCSC[C@@H](C)O 62a_100009817552_100000709357 [1,0,1,0,0,0|2,0,0]=4 1770 B9R0.2 COCCNCCC(C)O 2230a_100000209980_100012276601 [1,0,1,0,0,0|2,0,0]=4 1771 B9R0.2 COCCNCCC(C)O 2230a_200000755665_100011201679 [1,0,1,0,0,0|2,0,0]=4 1772 B9R0.2 COCCOCCC(C)O 34a_100000210237_100012276601 [1,0,1,0,0,0|2,0,0]=4 1773 B9R0.2 COCCSCCC(C)O 62a_100000233755_100012276601 [1,0,1,0,0,0|2,0,0]=4 1774 B9R0.2 COCCSCCC(C)O 62a_100012276601_100000233755 [1,0,1,0,0,0|2,0,0]=4 1775 B9R0.2 COCSCCCC(C)O 62a_100000766300_200000718107 [1,0,1,0,0,0|2,0,0]=4 1776 B9R0.2 COCSCCCC(C)O 62a_200000718107_100000766300 [1,0,1,0,0,0|2,0,0]=4 1777 B9R0.2 CSCCCCCC(C)C 62a_100000210682_200000210301 [1,0,1,0,0,0|2,0,0]=4 1778 B9R0.2 CSCCCCCC(C)C 62a_200000210301_100000210682 [1,0,1,0,0,0|2,0,0]=4 1779 B9R0.2 CSCCCNCC(C)C 2230a_100000749238_100000210760 [1,0,1,0,0,0|2,0,0]=4 1780 B9R0.2 CSCCCNCC(C)C 270004a_100000749238_100000210432 [1,0,1,0,0,0|2,0,0]=4 1781 B9R0.2 CSCCCNCC(C)O 2230a_100000749238_100011218427 [1,0,1,0,0,0|1,0,0]=3 1782 B9R0.2 CSCCCNC[C@@H](C)O 2230a_100000749238_100009817552 [1,0,1,0,0,0|1,0,0]=3 1783 B9R0.2 CSCCCOCC(C)O 34a_100000690336_100011218427 [1,0,1,0,0,0|2,0,0]=4 1784 B9R0.2 CSCCCOCC(C)O 7a_100000690336_100011218427 [1,0,1,0,0,0|2,0,0]=4 1785 B9R0.2 CSCCCOC[C@@H](C)O 34a_100000690336_100009817552 [1,0,1,0,0,0|2,0,0]=4 1786 B9R0.2 CSCCCOC[C@@H](C)O 7a_100000690336_100009817552 [1,0,1,0,0,0|2,0,0]=4 1787 B9R0.2 CSCCNCCC(C)O 2230a_100020590264_100012276601 [1,0,1,0,0,0|2,0,0]=4 1788 B9R0.2 CSCCNCCC(C)O 2230a_200000755665_100000751147 [1,0,1,0,0,0|2,0,0]=4 1789 B9R0.2 CSCCOCCC(C)O 34a_100000230434_100012276601 [1,0,1,0,0,0|2,0,0]=4 1790 B9R0.2 CSCCOCCC(C)O 7a_100000230434_100012276601 [1,0,1,0,0,0|2,0,0]=4 1791 B9R0.2 CSCCSCCC(C)O 62a_100000212216_100012276601 [1,0,1,0,0,0|2,0,0]=4 1792 B9R0.2 CSCCSCCC(C)O 62a_100012276601_100000751147 [1,0,1,0,0,0|2,0,0]=4 1793 B9R0.2 CSCSCCCC(C)O 62a_100011218213_200000718107 [1,0,1,0,0,0|2,0,0]=4 1794 B9R0.2 CSCSCCCC(C)O 62a_200000718107_100011218213 [1,0,1,0,0,0|2,0,0]=4 1795 B9R0.2 C[C@@H](O)CNCCCCO 2230a_100000750430_100009817552 [1,0,1,0,0,0|1,0,0]=3 1796 B9R0.2 C[C@@H](O)CNCCCCO 34a_100000750430_100009817552 [1,0,1,0,0,0|1,0,0]=3 1797 B9R0.2 C[C@@H](O)COCCCCBr 34a_100011216708_100009817552 [1,0,1,0,0,0|2,0,0]=4 1798 B9R0.2 C[C@@H](O)COCCCCCl 34a_100000210776_100009817552 [1,0,1,0,0,0|2,0,0]=4 1799 B9R0.2 C[C@@H](O)COCCCCCl 7a_100000210776_100009817552 [1,0,1,0,0,0|2,0,0]=4 1800 B9R0.2 C[C@@H](O)COCCCCF 34a_100011995726_100009817552 [1,0,1,0,0,0|2,0,0]=4 1801 B9R0.2 C[C@@H](O)COCCCCF 7a_100011995726_100009817552 [1,0,1,0,0,0|2,0,0]=4 1802 B9R0.2 C[C@@H](O)COCCCCI 34a_200012148704_100009817552 [1,0,1,0,0,0|2,0,0]=4 1803 B9R0.2 C[C@@H](O)COCCCCN 34a_100000750430_100009817552 [1,0,1,0,0,0|2,0,0]=4 1804 B9R0.2 C[C@@H](O)CSCCCCF 62a_100000729493_100009817552 [1,0,1,0,0,0|2,0,0]=4 1805 B9R0.2 C[C@@H](O)CSCCCCF 62a_100009817552_100000729493 [1,0,1,0,0,0|2,0,0]=4 1806 B9R0.2 C[C@@H](O)CSCCCCO 62a_100000210776_100009817552 [1,0,1,0,0,0|2,0,0]=4 1807 B9R0.2 C[C@@H](O)CSCCCCO 62a_100009817552_100000210776 [1,0,1,0,0,0|2,0,0]=4 1808 B9R0.45 C#CCCCCNCCC 2230a_100000706060_100000210303 [1,0,1,0,0,0|0,0,2]=4 1809 B9R0.45 C#CCCCCNCCC 34a_100000706060_100000210303 [1,0,1,0,0,0|0,0,2]=4 1810 B9R0.45 C#CCCCCNCCO 2230a_100000706060_100000211926 [1,0,1,0,0,0|0,0,2]=4 1811 B9R0.45 C#CCCCCNCCO 2230a_100016997473_100010269958 [1,0,1,0,0,0|0,0,2]=4 1812 B9R0.45 C#CCCCCNCCO 34a_100000706060_100000211926 [1,0,1,0,0,0|0,0,2]=4 1813 B9R0.45 C#CCCCCNCCO 34a_100016990907_100010269958 [1,0,1,0,0,0|0,0,2]=4 1814 B9R0.45 C#CCNCCCCCC 2230a_100000210581_100000038162 [1,0,1,0,0,0|0,0,2]=4 1815 B9R0.45 C#CCNCCCCCC 34a_100000212058_100000210314 [1,0,1,0,0,0|0,0,2]=4 1816 B9R0.45 C=CCCCCNCCC 2230a_100000703577_100000210303 [1,0,1,0,0,0|0,0,2]=4 1817 B9R0.45 C=CCCCCNCCC 34a_100000703577_100000210303 [1,0,1,0,0,0|0,0,2]=4 1818 B9R0.45 C=CCCCCNCCO 2230a_100000703577_100000211926 [1,0,1,0,0,0|0,0,2]=4 1819 B9R0.45 C=CCCCCNCCO 2230a_100016997473_100011215482 [1,0,1,0,0,0|0,0,2]=4 1820 B9R0.45 C=CCCCCNCCO 34a_100000703577_100000211926 [1,0,1,0,0,0|0,0,2]=4 1821 B9R0.45 C=CCCCCNCCO 34a_100016990907_100011215482 [1,0,1,0,0,0|0,0,2]=4 1822 B9R0.45 C=CCNCCCCCC 2230a_100000210581_100000210623 [1,0,1,0,0,0|0,0,2]=4 1823 B9R0.45 C=CCNCCCCCC 2230a_100020586998_100000210314 [1,0,1,0,0,0|0,0,2]=4 1824 B9R0.45 CC/C=C\CCNCCO 2230a_100016997473_100015370543 [1,0,1,0,0,0|0,0,2]=4 1825 B9R0.45 CC/C=C\CCNCCO 34a_100016990907_100015370543 [1,0,1,0,0,0|0,0,2]=4 1826 B9R0.45 CCCCC=NNCCC 4a_100000740057_100000210104 [1,0,1,0,0,0|1,0,1]=4 1827 B9R0.45 CCCCC=NNCCO 4a_100000210001_100000210104 [1,0,1,0,0,0|1,0,1]=4 1828 B9R0.45 CCCCCCCCNC 2230a_100000229939_200000210301 [1,0,1,0,0,0|2,0,0]=4 1829 B9R0.45 CCCCCCCCNC 2230a_106832991635_100000210759 [1,0,1,0,0,0|2,0,0]=4 1830 B9R0.45 CCCCCCCCNC 34a_100000229939_200000210301 [1,0,1,0,0,0|2,0,0]=4 1831 B9R0.45 CCCCCCCCNC 34a_100102657272_100000210759 [1,0,1,0,0,0|2,0,0]=4 1832 B9R0.45 CCCCCCCCNC 7a_106832991635_100000210759 [1,0,1,0,0,0|2,0,0]=4 1833 B9R0.45 CCCCCCCCN[13CH3] 2230a_100000229939_200025704644 [1,0,1,0,0,0|2,0,0]=4 1834 B9R0.45 CCCCCCCCN[13CH3] 34a_100000229939_200025704644 [1,0,1,0,0,0|2,0,0]=4 1835 B9R0.45 CCCCCCCCOC 34a_100000210232_200000210301 [1,0,1,0,0,0|2,0,0]=4 1836 B9R0.45 CCCCCCCCOC 34a_100138415774_100000210759 [1,0,1,0,0,0|2,0,0]=4 1837 B9R0.45 CCCCCCCCOC 7a_100000210232_200000210301 [1,0,1,0,0,0|2,0,0]=4 1838 B9R0.45 CCCCCCCCO[13CH3] 34a_100000210232_200025704644 [1,0,1,0,0,0|2,0,0]=4 1839 B9R0.45 CCCCCCCCO[13CH3] 7a_100000210232_200025704644 [1,0,1,0,0,0|2,0,0]=4 1840 B9R0.45 CCCCCCCCSC 62a_100000210759_200000210301 [1,0,1,0,0,0|2,0,0]=4 1841 B9R0.45 CCCCCCCCSC 62a_200000210301_100000210317 [1,0,1,0,0,0|2,0,0]=4 1842 B9R0.45 CCCCCCCCS[13CH3] 62a_100000210759_200025704644 [1,0,1,0,0,0|2,0,0]=4 1843 B9R0.45 CCCCCCCCS[13CH3] 62a_200025704644_100000210317 [1,0,1,0,0,0|2,0,0]=4 1844 B9R0.45 CCCCCCCNCC 2230a_100000229938_100000210202 [1,0,1,0,0,0|2,0,0]=4 1845 B9R0.45 CCCCCCCNCC 2230a_100015525214_100000210681 [1,0,1,0,0,0|2,0,0]=4 1846 B9R0.45 CCCCCCCOCC 34a_100000210272_100000210202 [1,0,1,0,0,0|2,0,0]=4 1847 B9R0.45 CCCCCCCOCC 34a_100121572206_100000210614 [1,0,1,0,0,0|2,0,0]=4 1848 B9R0.45 CCCCCCCOCC 7a_100000210272_100000210202 [1,0,1,0,0,0|2,0,0]=4 1849 B9R0.45 CCCCCCCSCC 62a_100000210202_100000210316 [1,0,1,0,0,0|2,0,0]=4 1850 B9R0.45 CCCCCCCSCC 62a_100000210614_100000210202 [1,0,1,0,0,0|2,0,0]=4 1851 B9R0.45 CCCCCCNCC#N 2230a_100000210581_100011215382 [1,0,1,0,0,0|1,0,1]=4 1852 B9R0.45 CCCCCCNCC=O 2230a_100000210581_200015260668 [1,0,1,0,0,0|0,0,2]=4 1853 B9R0.45 CCCCCCNCCC 2230a_100000210581_100000210303 [1,0,1,0,0,0|0,0,0]=2 1854 B9R0.45 CCCCCCNCCF 2230a_100000210581_100011217306 [1,0,1,0,0,0|1,0,0]=3 1855 B9R0.45 CCCCCCNCCF 34a_100000724931_100000210314 [1,0,1,0,0,0|1,0,0]=3 1856 B9R0.45 CCCCCCNCCO 2230a_100000210581_100000211926 [1,0,1,0,0,0|0,0,0]=2 1857 B9R0.45 CCCCCCNCCO 2230a_100016997473_100000210314 [1,0,1,0,0,0|0,0,0]=2 1858 B9R0.45 CCCCCCNCCO 34a_100016990907_100000210314 [1,0,1,0,0,0|0,0,0]=2 1859 B9R0.45 CCCCCCNCOC 2230a_100000210581_100000766300 [1,0,1,0,0,0|1,0,0]=3 1860 B9R0.45 CCCCCCNCSC 2230a_100000210581_100011218213 [1,0,1,0,0,0|1,0,0]=3 1861 B9R0.45 CCCCCCOCCBr 34a_100000211926_100000210314 [1,0,1,0,0,0|2,0,0]=4 1862 B9R0.45 CCCCCCOCCC 34a_100000210258_100000210314 [1,0,1,0,0,0|1,0,0]=3 1863 B9R0.45 CCCCCCOCCC 34a_100000210259_100000210303 [1,0,1,0,0,0|1,0,0]=3 1864 B9R0.45 CCCCCCOCCC 7a_100000210259_100000210303 [1,0,1,0,0,0|1,0,0]=3 1865 B9R0.45 CCCCCCOCCF 34a_100000210259_100011217306 [1,0,1,0,0,0|2,0,0]=4 1866 B9R0.45 CCCCCCOCCF 7a_100000210259_100011217306 [1,0,1,0,0,0|2,0,0]=4 1867 B9R0.45 CCCCCCOCCN 34a_100000210304_100000210314 [1,0,1,0,0,0|2,0,0]=4 1868 B9R0.45 CCCCCCOCCO 34a_100000210259_100000211926 [1,0,1,0,0,0|1,0,0]=3 1869 B9R0.45 CCCCCCOCCO 7a_100000210259_100000211926 [1,0,1,0,0,0|1,0,0]=3 1870 B9R0.45 CCCCCCOCSC 34a_100000210259_100011218213 [1,0,1,0,0,0|2,0,0]=4 1871 B9R0.45 CCCCCCSCCC 62a_100000210303_100000210757 [1,0,1,0,0,0|1,0,0]=3 1872 B9R0.45 CCCCCCSCCC 62a_100000210314_100000210303 [1,0,1,0,0,0|1,0,0]=3 1873 B9R0.45 CCCCCCSCCF 62a_100000210314_100011217306 [1,0,1,0,0,0|2,0,0]=4 1874 B9R0.45 CCCCCCSCCF 62a_100011217306_100000210757 [1,0,1,0,0,0|2,0,0]=4 1875 B9R0.45 CCCCCCSCCO 62a_100000210314_100000211926 [1,0,1,0,0,0|1,0,0]=3 1876 B9R0.45 CCCCCCSCCO 62a_100000211926_100000210757 [1,0,1,0,0,0|1,0,0]=3 1877 B9R0.45 CCCCCCSCOC 62a_100000210314_100000766300 [1,0,1,0,0,0|2,0,0]=4 1878 B9R0.45 CCCCCCSCOC 62a_100000766300_100000210757 [1,0,1,0,0,0|2,0,0]=4 1879 B9R0.45 CCCCCCSCSC 62a_100000210314_100011218213 [1,0,1,0,0,0|2,0,0]=4 1880 B9R0.45 CCCCCCSCSC 62a_100011218213_100000210757 [1,0,1,0,0,0|2,0,0]=4 1881 B9R0.45 CCCCCNCCCC 2230a_100000102301_100000210326 [1,0,1,0,0,0|2,0,0]=4 1882 B9R0.45 CCCCCNCCCC 2230a_100000209983_100000210211 [1,0,1,0,0,0|2,0,0]=4 1883 B9R0.45 CCCCCNCCCC 7a_106832991798_100000210326 [1,0,1,0,0,0|2,0,0]=4 1884 B9R0.45 CCCCCNCCCO 2230a_100000209983_100000230001 [1,0,1,0,0,0|2,0,0]=4 1885 B9R0.45 CCCCCOCCCC 34a_100000210227_100000718602 [1,0,1,0,0,0|2,0,0]=4 1886 B9R0.45 CCCCCOCCCC 34a_100000210253_100000210210 [1,0,1,0,0,0|2,0,0]=4 1887 B9R0.45 CCCCCOCCCC 7a_100000210227_100000210326 [1,0,1,0,0,0|2,0,0]=4 1888 B9R0.45 CCCCCOCCCC 7a_100000210253_100000210211 [1,0,1,0,0,0|2,0,0]=4 1889 B9R0.45 CCCCCOCCCO 34a_100000210253_100000230001 [1,0,1,0,0,0|2,0,0]=4 1890 B9R0.45 CCCCCOCCCO 7a_100000210253_100011215043 [1,0,1,0,0,0|2,0,0]=4 1891 B9R0.45 CCCCCSCCCC 62a_100000210211_100000210326 [1,0,1,0,0,0|2,0,0]=4 1892 B9R0.45 CCCCCSCCCC 62a_100000210326_100000210210 [1,0,1,0,0,0|2,0,0]=4 1893 B9R0.45 CCCCCSCCCO 62a_100000210326_100011215043 [1,0,1,0,0,0|2,0,0]=4 1894 B9R0.45 CCCCCSCCCO 62a_100011215043_100000210326 [1,0,1,0,0,0|2,0,0]=4 1895 B9R0.45 CCCCNCCCCO 2230a_100000102301_100000210776 [1,0,1,0,0,0|2,0,0]=4 1896 B9R0.45 CCCCNCCCCO 2230a_100000750430_100000210211 [1,0,1,0,0,0|2,0,0]=4 1897 B9R0.45 CCCCNCCCCO 34a_100000750430_100000210210 [1,0,1,0,0,0|2,0,0]=4 1898 B9R0.45 CCCCNCCCCO 7a_106832991798_100000210776 [1,0,1,0,0,0|2,0,0]=4 1899 B9R0.45 CCCCOCCCCO 34a_100000210227_100011216708 [1,0,1,0,0,0|2,0,0]=4 1900 B9R0.45 CCCCOCCCCO 7a_100000210227_100000210776 [1,0,1,0,0,0|2,0,0]=4 1901 B9R0.45 CCCCOCNCCF 34a_100000724931_100011995733 [1,0,1,0,0,0|2,0,0]=4 1902 B9R0.45 CCCCOCNCCO 2230a_100016997473_100011995733 [1,0,1,0,0,0|1,0,0]=3 1903 B9R0.45 CCCCOCNCCO 34a_100016990907_100011995733 [1,0,1,0,0,0|1,0,0]=3 1904 B9R0.45 CCCCOCOCCC 34a_100000210258_100011995733 [1,0,1,0,0,0|2,0,0]=4 1905 B9R0.45 CCCCOCSCCC 62a_100000210303_100011995733 [1,0,1,0,0,0|2,0,0]=4 1906 B9R0.45 CCCCOCSCCC 62a_100011995733_100000210303 [1,0,1,0,0,0|2,0,0]=4 1907 B9R0.45 CCCCOCSCCO 62a_100000211926_100011995733 [1,0,1,0,0,0|2,0,0]=4 1908 B9R0.45 CCCCOCSCCO 62a_100011995733_100000211926 [1,0,1,0,0,0|2,0,0]=4 1909 B9R0.45 CCCCSCCCCO 62a_100000210211_100000210776 [1,0,1,0,0,0|2,0,0]=4 1910 B9R0.45 CCCCSCCCCO 62a_100000210776_100000210210 [1,0,1,0,0,0|2,0,0]=4 1911 B9R0.45 CCCNCCCCCO 2230a_100000762737_100000210303 [1,0,1,0,0,0|1,0,0]=3 1912 B9R0.45 CCCNCCCCCO 34a_100000762737_100000210303 [1,0,1,0,0,0|1,0,0]=3 1913 B9R0.45 CCCNCCCOCC 2230a_100000210961_100000210303 [1,0,1,0,0,0|1,0,0]=3 1914 B9R0.45 CCCNCCCOCC 34a_100000210961_100000210303 [1,0,1,0,0,0|1,0,0]=3 1915 B9R0.45 CCCNCCOCCC 2230a_100161115042_100000210303 [1,0,1,0,0,0|1,0,0]=3 1916 B9R0.45 CCCNCCOCCC 34a_100161115042_100000210303 [1,0,1,0,0,0|1,0,0]=3 1917 B9R0.45 CCCNCCOCCO 2230a_100000211614_100000210303 [1,0,1,0,0,0|2,0,0]=4 1918 B9R0.45 CCCNCCOCCO 34a_100000211614_100000210303 [1,0,1,0,0,0|2,0,0]=4 1919 B9R0.45 CCCNCCSCCC 2230a_100020603323_100000210303 [1,0,1,0,0,0|1,0,0]=3 1920 B9R0.45 CCCNCCSCCO 2230a_100011219999_100000210303 [1,0,1,0,0,0|2,0,0]=4 1921 B9R0.45 CCCOCCCCCBr 34a_100000746331_100000210303 [1,0,1,0,0,0|2,0,0]=4 1922 B9R0.45 CCCOCCCCCBr 7a_100000746331_100000210303 [1,0,1,0,0,0|2,0,0]=4 1923 B9R0.45 CCCOCCCCCCl 34a_100000746330_100000210303 [1,0,1,0,0,0|2,0,0]=4 1924 B9R0.45 CCCOCCCCCCl 7a_100000746330_100000210303 [1,0,1,0,0,0|2,0,0]=4 1925 B9R0.45 CCCOCCCCCF 34a_100000210258_100000729378 [1,0,1,0,0,0|2,0,0]=4 1926 B9R0.45 CCCOCCCCCI 34a_200012148887_100000210303 [1,0,1,0,0,0|2,0,0]=4 1927 B9R0.45 CCCOCCCCCI 7a_200012148887_100000210303 [1,0,1,0,0,0|2,0,0]=4 1928 B9R0.45 CCCOCCCCCN 34a_100000762737_100000210303 [1,0,1,0,0,0|2,0,0]=4 1929 B9R0.45 CCCOCCCCCO 34a_100000210258_100000746330 [1,0,1,0,0,0|2,0,0]=4 1930 B9R0.45 CCCOCCCCOC 34a_100000210258_100000755781 [1,0,1,0,0,0|2,0,0]=4 1931 B9R0.45 CCCOCCCCOC 34a_100000740925_100000210303 [1,0,1,0,0,0|2,0,0]=4 1932 B9R0.45 CCCOCCCCSC 34a_100011217163_100000210303 [1,0,1,0,0,0|2,0,0]=4 1933 B9R0.45 CCCOCCCCSC 7a_100011217163_100000210303 [1,0,1,0,0,0|2,0,0]=4 1934 B9R0.45 CCCOCCCNCC 2230a_100011217757_100000210202 [1,0,1,0,0,0|2,0,0]=4 1935 B9R0.45 CCCOCCCNCC 34a_100011217757_100000210202 [1,0,1,0,0,0|2,0,0]=4 1936 B9R0.45 CCCOCCCOCC 34a_100000210258_100012232248 [1,0,1,0,0,0|2,0,0]=4 1937 B9R0.45 CCCOCCCOCC 34a_100000757476_100000210303 [1,0,1,0,0,0|2,0,0]=4 1938 B9R0.45 CCCOCCCOCC 7a_100000757476_100000210303 [1,0,1,0,0,0|2,0,0]=4 1939 B9R0.45 CCCOCCCSCC 34a_100011216438_100000210303 [1,0,1,0,0,0|2,0,0]=4 1940 B9R0.45 CCCOCCCSCC 7a_100011216438_100000210303 [1,0,1,0,0,0|2,0,0]=4 1941 B9R0.45 CCCOCCNCCF 2230a_100161115042_100011217306 [1,0,1,0,0,0|2,0,0]=4 1942 B9R0.45 CCCOCCNCCF 34a_100000724931_100011215938 [1,0,1,0,0,0|2,0,0]=4 1943 B9R0.45 CCCOCCNCCF 34a_100161115042_100011217306 [1,0,1,0,0,0|2,0,0]=4 1944 B9R0.45 CCCOCCNCCO 2230a_100016997473_100011215938 [1,0,1,0,0,0|1,0,0]=3 1945 B9R0.45 CCCOCCNCCO 2230a_100161115042_100000211926 [1,0,1,0,0,0|1,0,0]=3 1946 B9R0.45 CCCOCCNCCO 34a_100016990907_100011215938 [1,0,1,0,0,0|1,0,0]=3 1947 B9R0.45 CCCOCCNCCO 34a_100161115042_100000211926 [1,0,1,0,0,0|1,0,0]=3 1948 B9R0.45 CCCOCCNCOC 2230a_100161115042_100000766300 [1,0,1,0,0,0|2,0,0]=4 1949 B9R0.45 CCCOCCNCSC 2230a_100161115042_100011218213 [1,0,1,0,0,0|2,0,0]=4 1950 B9R0.45 CCCOCCNCSC 34a_100161115042_100011218213 [1,0,1,0,0,0|2,0,0]=4 1951 B9R0.45 CCCOCCOCCC 34a_100000210258_100011215938 [1,0,1,0,0,0|2,0,0]=4 1952 B9R0.45 CCCOCCOCCC 34a_100000752267_100000210303 [1,0,1,0,0,0|2,0,0]=4 1953 B9R0.45 CCCOCCOCCC 7a_100000752267_100000210303 [1,0,1,0,0,0|2,0,0]=4 1954 B9R0.45 CCCOCCOCCO 34a_100000210258_100000692535 [1,0,1,0,0,0|2,0,0]=4 1955 B9R0.45 CCCOCCOCCO 34a_100000752267_100000211926 [1,0,1,0,0,0|2,0,0]=4 1956 B9R0.45 CCCOCCOCCO 7a_100000752267_100000211926 [1,0,1,0,0,0|2,0,0]=4 1957 B9R0.45 CCCOCCSCCC 34a_200000230433_100000210303 [1,0,1,0,0,0|2,0,0]=4 1958 B9R0.45 CCCOCCSCCC 62a_100000210303_100011215938 [1,0,1,0,0,0|2,0,0]=4 1959 B9R0.45 CCCOCCSCCC 62a_100011215938_100000210303 [1,0,1,0,0,0|2,0,0]=4 1960 B9R0.45 CCCOCCSCCC 7a_200000230433_100000210303 [1,0,1,0,0,0|2,0,0]=4 1961 B9R0.45 CCCOCCSCCO 62a_100000211926_100011215938 [1,0,1,0,0,0|2,0,0]=4 1962 B9R0.45 CCCOCCSCCO 62a_100011215938_100000211926 [1,0,1,0,0,0|2,0,0]=4 1963 B9R0.45 CCCSCCCCCF 62a_100000210303_100000729378 [1,0,1,0,0,0|2,0,0]=4 1964 B9R0.45 CCCSCCCCCF 62a_100000729378_100000210303 [1,0,1,0,0,0|2,0,0]=4 1965 B9R0.45 CCCSCCCCCO 62a_100000210303_100000746330 [1,0,1,0,0,0|2,0,0]=4 1966 B9R0.45 CCCSCCCCCO 62a_100000746330_100000210303 [1,0,1,0,0,0|2,0,0]=4 1967 B9R0.45 CCCSCCCCOC 62a_100000210303_100000730899 [1,0,1,0,0,0|2,0,0]=4 1968 B9R0.45 CCCSCCCCOC 62a_100000730899_100000210303 [1,0,1,0,0,0|2,0,0]=4 1969 B9R0.45 CCCSCCCOCC 62a_100000210303_100012232248 [1,0,1,0,0,0|2,0,0]=4 1970 B9R0.45 CCCSCCCOCC 62a_100012232248_100000210303 [1,0,1,0,0,0|2,0,0]=4 1971 B9R0.45 CCCSCCNCCF 2230a_100020603323_100011217306 [1,0,1,0,0,0|2,0,0]=4 1972 B9R0.45 CCCSCCNCCO 2230a_100020603323_100000211926 [1,0,1,0,0,0|1,0,0]=3 1973 B9R0.45 CCCSCCNCOC 2230a_100020603323_100000766300 [1,0,1,0,0,0|2,0,0]=4 1974 B9R0.45 CCCSCCNCSC 2230a_100020603323_100011218213 [1,0,1,0,0,0|2,0,0]=4 1975 B9R0.45 CCCSCCOCCO 34a_200000230433_100000211926 [1,0,1,0,0,0|2,0,0]=4 1976 B9R0.45 CCCSCCOCCO 62a_100000210303_100011215305 [1,0,1,0,0,0|2,0,0]=4 1977 B9R0.45 CCCSCCOCCO 62a_100011215305_100000210303 [1,0,1,0,0,0|2,0,0]=4 1978 B9R0.45 CCCSCCOCCO 7a_200000230433_100000211926 [1,0,1,0,0,0|2,0,0]=4 1979 B9R0.45 CCNCCCCCCO 2230a_100000686447_100000210202 [1,0,1,0,0,0|2,0,0]=4 1980 B9R0.45 CCNCCCCCCO 2230a_100015525214_100000766143 [1,0,1,0,0,0|2,0,0]=4 1981 B9R0.45 CCNCCCCCCO 34a_100000686447_100000210202 [1,0,1,0,0,0|2,0,0]=4 1982 B9R0.45 CCOCCCCCCO 34a_100121572206_100000766143 [1,0,1,0,0,0|2,0,0]=4 1983 B9R0.45 CCOCCCNCCF 2230a_100000210961_100011217306 [1,0,1,0,0,0|2,0,0]=4 1984 B9R0.45 CCOCCCNCCF 34a_100000210961_100011217306 [1,0,1,0,0,0|2,0,0]=4 1985 B9R0.45 CCOCCCNCCF 34a_100000724931_100012232248 [1,0,1,0,0,0|2,0,0]=4 1986 B9R0.45 CCOCCCNCCO 2230a_100000210961_100000211926 [1,0,1,0,0,0|1,0,0]=3 1987 B9R0.45 CCOCCCNCCO 2230a_100016997473_100012232248 [1,0,1,0,0,0|1,0,0]=3 1988 B9R0.45 CCOCCCNCCO 34a_100000210961_100000211926 [1,0,1,0,0,0|1,0,0]=3 1989 B9R0.45 CCOCCCNCCO 34a_100016990907_100012232248 [1,0,1,0,0,0|1,0,0]=3 1990 B9R0.45 CCOCCCNCOC 2230a_100000210961_100000766300 [1,0,1,0,0,0|2,0,0]=4 1991 B9R0.45 CCOCCCNCSC 2230a_100000210961_100011218213 [1,0,1,0,0,0|2,0,0]=4 1992 B9R0.45 CCOCCCNCSC 34a_100000210961_100011218213 [1,0,1,0,0,0|2,0,0]=4 1993 B9R0.45 CCOCCCOCCO 34a_100000757476_100000211926 [1,0,1,0,0,0|2,0,0]=4 1994 B9R0.45 CCOCCCOCCO 7a_100000757476_100000211926 [1,0,1,0,0,0|2,0,0]=4 1995 B9R0.45 CCOCCCSCCO 62a_100000211926_100012232248 [1,0,1,0,0,0|2,0,0]=4 1996 B9R0.45 CCOCCCSCCO 62a_100012232248_100000211926 [1,0,1,0,0,0|2,0,0]=4 1997 B9R0.45 CCSCCCCCCO 62a_100000210202_100000766143 [1,0,1,0,0,0|2,0,0]=4 1998 B9R0.45 CCSCCCCCCO 62a_100000766143_100000210202 [1,0,1,0,0,0|2,0,0]=4 1999 B9R0.45 CCSCCCOCCO 34a_100011216438_100000211926 [1,0,1,0,0,0|2,0,0]=4 2000 B9R0.45 CCSCCCOCCO 7a_100011216438_100000211926 [1,0,1,0,0,0|2,0,0]=4 2001 B9R0.45 CNCCCCCCCO 2230a_100011996573_200000210301 [1,0,1,0,0,0|2,0,0]=4 2002 B9R0.45 CNCCCCCCCO 2230a_106832991635_100000760002 [1,0,1,0,0,0|2,0,0]=4 2003 B9R0.45 CNCCCCCCCO 34a_100011996573_200000210301 [1,0,1,0,0,0|2,0,0]=4 2004 B9R0.45 CNCCCCCCCO 34a_100102657272_100000760002 [1,0,1,0,0,0|2,0,0]=4 2005 B9R0.45 CNCCCCCCCO 7a_106832991635_100000760002 [1,0,1,0,0,0|2,0,0]=4 2006 B9R0.45 COCCCCCCCO 34a_100138415774_100000760002 [1,0,1,0,0,0|2,0,0]=4 2007 B9R0.45 COCCCCNCCF 34a_100000724931_100000755781 [1,0,1,0,0,0|2,0,0]=4 2008 B9R0.45 COCCCCNCCO 2230a_100016997473_100000730899 [1,0,1,0,0,0|1,0,0]=3 2009 B9R0.45 COCCCCNCCO 34a_100016990907_100000755781 [1,0,1,0,0,0|1,0,0]=3 2010 B9R0.45 COCCCCOCCO 34a_100000740925_100000211926 [1,0,1,0,0,0|2,0,0]=4 2011 B9R0.45 COCCCCSCCO 62a_100000211926_100000730899 [1,0,1,0,0,0|2,0,0]=4 2012 B9R0.45 COCCCCSCCO 62a_100000730899_100000211926 [1,0,1,0,0,0|2,0,0]=4 2013 B9R0.45 COCCOCNCCO 2230a_100016997473_100000231047 [1,0,1,0,0,0|2,0,0]=4 2014 B9R0.45 COCNCCCCCO 2230a_100000762737_100000766300 [1,0,1,0,0,0|2,0,0]=4 2015 B9R0.45 CSCCCCCCCO 62a_100000760002_200000210301 [1,0,1,0,0,0|2,0,0]=4 2016 B9R0.45 CSCCCCCCCO 62a_200000210301_100000760002 [1,0,1,0,0,0|2,0,0]=4 2017 B9R0.45 CSCCCCOCCO 34a_100011217163_100000211926 [1,0,1,0,0,0|2,0,0]=4 2018 B9R0.45 CSCCCCOCCO 7a_100011217163_100000211926 [1,0,1,0,0,0|2,0,0]=4 2019 B9R0.45 CSCNCCCCCO 2230a_100000762737_100011218213 [1,0,1,0,0,0|2,0,0]=4 2020 B9R0.45 CSCNCCCCCO 34a_100000762737_100011218213 [1,0,1,0,0,0|2,0,0]=4 2021 B9R0.45 FCCCCCNCCF 34a_100000724931_100000729378 [1,0,1,0,0,0|2,0,0]=4 2022 B9R0.45 N#CCCCCNCCO 2230a_100016997473_100000211819 [1,0,1,0,0,0|1,0,1]=4 2023 B9R0.45 NCCCCCOCCO 34a_100000762737_100000211926 [1,0,1,0,0,0|2,0,0]=4 2024 B9R0.45 O=CCCCCNCCO 2230a_100016997473_100000139335 [1,0,1,0,0,0|1,0,1]=4 2025 B9R0.45 OCCCCCNCCF 2230a_100000762737_100011217306 [1,0,1,0,0,0|2,0,0]=4 2026 B9R0.45 OCCCCCNCCF 34a_100000724931_100000746330 [1,0,1,0,0,0|2,0,0]=4 2027 B9R0.45 OCCCCCNCCF 34a_100000762737_100011217306 [1,0,1,0,0,0|2,0,0]=4 2028 B9R0.45 OCCCCCNCCO 2230a_100000762737_100000211926 [1,0,1,0,0,0|1,0,0]=3 2029 B9R0.45 OCCCCCNCCO 2230a_100016997473_100000746330 [1,0,1,0,0,0|1,0,0]=3 2030 B9R0.45 OCCCCCNCCO 34a_100000762737_100000211926 [1,0,1,0,0,0|1,0,0]=3 2031 B9R0.45 OCCCCCNCCO 34a_100016990907_100000746330 [1,0,1,0,0,0|1,0,0]=3 2032 B9R0.45 OCCCCCSCCO 62a_100000211926_100000746330 [1,0,1,0,0,0|2,0,0]=4 2033 B9R0.45 OCCCCCSCCO 62a_100000746330_100000211926 [1,0,1,0,0,0|2,0,0]=4 2034 B9R0.45 OCCNCCCCCF 2230a_100016997473_100000729378 [1,0,1,0,0,0|1,0,0]=3 2035 B9R0.45 OCCNCCCCCF 34a_100016990907_100000729378 [1,0,1,0,0,0|1,0,0]=3 2036 B9R0.45 OCCNCCOCCO 2230a_100000211614_100000211926 [1,0,1,0,0,0|2,0,0]=4 2037 B9R0.45 OCCNCCOCCO 2230a_100016997473_100011215305 [1,0,1,0,0,0|2,0,0]=4 2038 B9R0.45 OCCNCCOCCO 34a_100000211614_100000211926 [1,0,1,0,0,0|2,0,0]=4 2039 B9R0.45 OCCNCCOCCO 34a_100016990907_100000692535 [1,0,1,0,0,0|2,0,0]=4 2040 B9R0.45 OCCNCCSCCO 2230a_100011219999_100000211926 [1,0,1,0,0,0|2,0,0]=4 2041 B9R0.45 OCCOCCCCCBr 34a_100000746331_100000211926 [1,0,1,0,0,0|2,0,0]=4 2042 B9R0.45 OCCOCCCCCBr 7a_100000746331_100000211926 [1,0,1,0,0,0|2,0,0]=4 2043 B9R0.45 OCCOCCCCCCl 34a_100000746330_100000211926 [1,0,1,0,0,0|2,0,0]=4 2044 B9R0.45 OCCOCCCCCCl 7a_100000746330_100000211926 [1,0,1,0,0,0|2,0,0]=4 2045 B9R0.45 OCCOCCCCCI 34a_200012148887_100000211926 [1,0,1,0,0,0|2,0,0]=4 2046 B9R0.45 OCCOCCCCCI 7a_200012148887_100000211926 [1,0,1,0,0,0|2,0,0]=4 2047 B9R0.45 OCCSCCCCCF 62a_100000211926_100000729378 [1,0,1,0,0,0|2,0,0]=4 2048 B9R0.45 OCCSCCCCCF 62a_100000729378_100000211926 [1,0,1,0,0,0|2,0,0]=4 2049 B9R0.45 [13CH3]NCCCCCCCO 2230a_100011996573_200025704644 [1,0,1,0,0,0|2,0,0]=4 2050 B9R0.45 [13CH3]NCCCCCCCO 34a_100011996573_200025704644 [1,0,1,0,0,0|2,0,0]=4 2051 B9R0.45 [13CH3]SCCCCCCCO 62a_100000760002_200025704644 [1,0,1,0,0,0|2,0,0]=4 2052 B9R0.45 [13CH3]SCCCCCCCO 62a_200025704644_100000760002 [1,0,1,0,0,0|2,0,0]=4 2053 B9R0.4 C#CCCN(C)CC(C)O 2230a_100000227577_100000688953 [1,0,1,0,0,0|0,0,2]=4 2054 B9R0.4 C#CCCN(C)CC(C)O 269982a_100000227577_100000730999 [1,0,1,0,0,0|0,0,2]=4 2055 B9R0.4 C/C=C/CN(C)CC(C)O 269982a_100000227577_100102629194 [1,0,1,0,0,0|0,0,2]=4 2056 B9R0.4 C=C(C)CN(C)CCCC 2230a_100000207549_100000748629 [1,0,1,0,0,0|1,0,1]=4 2057 B9R0.4 C=C(C)CN(C)CCCC 2230a_100000225649_100000210211 [1,0,1,0,0,0|1,0,1]=4 2058 B9R0.4 C=C(C)CN(C)CCCC 269982a_100000207549_100000748629 [1,0,1,0,0,0|1,0,1]=4 2059 B9R0.4 C=C(C)CN(C)CCCC 269982a_100000225649_100000210211 [1,0,1,0,0,0|1,0,1]=4 2060 B9R0.4 C=CCCN(C)CC(C)O 2230a_100000227577_100000754431 [1,0,1,0,0,0|0,0,2]=4 2061 B9R0.4 C=CCCN(C)CC(C)O 2230a_100020639649_100011218427 [1,0,1,0,0,0|0,0,2]=4 2062 B9R0.4 C=CCCN(C)CC(C)O 269982a_100000227577_100000754431 [1,0,1,0,0,0|0,0,2]=4 2063 B9R0.4 C=CCCN(C)CC(C)O 269982a_100020639649_100011218427 [1,0,1,0,0,0|0,0,2]=4 2064 B9R0.4 C=CCCN(C)C[C@@H](C)O 2230a_100020639649_100009817552 [1,0,1,0,0,0|0,0,2]=4 2065 B9R0.4 C=CCCN(C)C[C@@H](C)O 269982a_100020639649_100009817552 [1,0,1,0,0,0|0,0,2]=4 2066 B9R0.4 CC#CCN(C)CC(C)O 2230a_100000227577_100000748600 [1,0,1,0,0,0|0,0,2]=4 2067 B9R0.4 CC(C)CN(C)CCCF 2230a_100000747067_100011934791 [1,0,1,0,0,0|2,0,0]=4 2068 B9R0.4 CC(C)CN(C)CCCF 269982a_100000747067_100011934791 [1,0,1,0,0,0|2,0,0]=4 2069 B9R0.4 CC(C)CN(C)CCCO 2230a_100000213112_100000210760 [1,0,1,0,0,0|2,0,0]=4 2070 B9R0.4 CC(C)CN(C)CCCO 2230a_100000747067_100000230001 [1,0,1,0,0,0|2,0,0]=4 2071 B9R0.4 CC(C)CN(C)CCCO 269982a_100000213112_100000210624 [1,0,1,0,0,0|2,0,0]=4 2072 B9R0.4 CC(C)CN(C)CCCO 269982a_100000747067_100011215043 [1,0,1,0,0,0|2,0,0]=4 2073 B9R0.4 CC(C)CN(C)CCCO 270004a_100000213112_100000210432 [1,0,1,0,0,0|2,0,0]=4 2074 B9R0.4 CC(O)CN(C)CCC#N 2230a_100000184479_100011218427 [1,0,1,0,0,0|1,0,1]=4 2075 B9R0.4 CC(O)CN(C)CCC#N 2230a_100000227577_100011215226 [1,0,1,0,0,0|1,0,1]=4 2076 B9R0.4 CC(O)CN(C)CCC#N 269982a_100000227577_100011215226 [1,0,1,0,0,0|1,0,1]=4 2077 B9R0.4 CC(O)CN(C)CCCF 2230a_100000227577_100011934791 [1,0,1,0,0,0|1,0,0]=3 2078 B9R0.4 CC(O)CN(C)CCCF 269982a_100000227577_100011934791 [1,0,1,0,0,0|1,0,0]=3 2079 B9R0.4 CC(O)CN(C)CCCO 2230a_100000213112_100011218427 [1,0,1,0,0,0|1,0,0]=3 2080 B9R0.4 CC(O)CN(C)CCCO 2230a_100000227577_100000230001 [1,0,1,0,0,0|1,0,0]=3 2081 B9R0.4 CC(O)CN(C)CCCO 269982a_100000213112_100011218427 [1,0,1,0,0,0|1,0,0]=3 2082 B9R0.4 CC(O)CN(C)CCCO 269982a_100000227577_100011215043 [1,0,1,0,0,0|1,0,0]=3 2083 B9R0.4 CC=CCN(C)CC(C)O 2230a_100000227577_100000070051 [1,0,1,0,0,0|0,0,2]=4 2084 B9R0.4 CCCCC(=O)CC(C)O 1458a_100000210183_100011218427 [1,0,1,0,0,0|2,0,0]=4 2085 B9R0.4 CCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210211 [1,0,1,0,0,0|2,0,0]=4 2086 B9R0.4 CCCCN(C)CC(=O)O 269956a_100000746989_100000210211 [1,0,1,0,0,0|1,0,1]=4 2087 B9R0.4 CCCCN(C)CC(C)C 2230a_100000207549_100000210760 [1,0,1,0,0,0|1,0,0]=3 2088 B9R0.4 CCCCN(C)CC(C)C 2230a_100000747067_100000210211 [1,0,1,0,0,0|1,0,0]=3 2089 B9R0.4 CCCCN(C)CC(C)C 269982a_100000207549_100000210624 [1,0,1,0,0,0|1,0,0]=3 2090 B9R0.4 CCCCN(C)CC(C)C 269982a_100000747067_100000210211 [1,0,1,0,0,0|1,0,0]=3 2091 B9R0.4 CCCCN(C)CC(C)C 270004a_100000207549_100000210432 [1,0,1,0,0,0|1,0,0]=3 2092 B9R0.4 CCCCN(C)CC(C)O 2230a_100000207549_100011218427 [1,0,1,0,0,0|0,0,0]=2 2093 B9R0.4 CCCCN(C)CC(C)O 2230a_100000227577_100000210211 [1,0,1,0,0,0|0,0,0]=2 2094 B9R0.4 CCCCN(C)CC(C)O 269982a_100000207549_100011218427 [1,0,1,0,0,0|0,0,0]=2 2095 B9R0.4 CCCCN(C)CC(C)O 269982a_100000227577_100000210211 [1,0,1,0,0,0|0,0,0]=2 2096 B9R0.4 CCCCN(C)CC(F)F 2230a_100000207549_100011934356 [1,0,1,0,0,0|2,0,0]=4 2097 B9R0.4 CCCCN(C)CC(F)F 269982a_100000207549_100011934356 [1,0,1,0,0,0|2,0,0]=4 2098 B9R0.4 CCCCN(C)C[C@@H](C)O 2230a_100000207549_100009817552 [1,0,1,0,0,0|0,0,0]=2 2099 B9R0.4 CCCCN(C)C[C@@H](C)O 269982a_100000207549_100009817552 [1,0,1,0,0,0|0,0,0]=2 2100 B9R0.4 CCOCN(C)CC(C)C 269982a_100000747067_100000739092 [1,0,1,0,0,0|2,0,0]=4 2101 B9R0.4 CCOCN(C)CC(C)O 269982a_100000227577_100000739092 [1,0,1,0,0,0|1,0,0]=3 2102 B9R0.4 COCCN(C)CC(C)C 2230a_100000743101_100000210760 [1,0,1,0,0,0|2,0,0]=4 2103 B9R0.4 COCCN(C)CC(C)C 2230a_100000747067_100011201679 [1,0,1,0,0,0|2,0,0]=4 2104 B9R0.4 COCCN(C)CC(C)C 269982a_100000743101_100000210624 [1,0,1,0,0,0|2,0,0]=4 2105 B9R0.4 COCCN(C)CC(C)C 269982a_100000747067_100000233755 [1,0,1,0,0,0|2,0,0]=4 2106 B9R0.4 COCCN(C)CC(C)C 270004a_100000743101_100000210432 [1,0,1,0,0,0|2,0,0]=4 2107 B9R0.4 COCCN(C)CC(C)O 2230a_100000227577_100011201679 [1,0,1,0,0,0|1,0,0]=3 2108 B9R0.4 COCCN(C)CC(C)O 2230a_100000743101_100011218427 [1,0,1,0,0,0|1,0,0]=3 2109 B9R0.4 COCCN(C)CC(C)O 269982a_100000227577_100000233755 [1,0,1,0,0,0|1,0,0]=3 2110 B9R0.4 COCCN(C)CC(C)O 269982a_100000743101_100011218427 [1,0,1,0,0,0|1,0,0]=3 2111 B9R0.4 COCCN(C)C[C@@H](C)O 2230a_100000743101_100009817552 [1,0,1,0,0,0|1,0,0]=3 2112 B9R0.4 COCCN(C)C[C@@H](C)O 269982a_100000743101_100009817552 [1,0,1,0,0,0|1,0,0]=3 2113 B9R0.4 CSCCN(C)CC(C)C 2230a_100000686725_100000210760 [1,0,1,0,0,0|2,0,0]=4 2114 B9R0.4 CSCCN(C)CC(C)C 2230a_100000747067_100000751147 [1,0,1,0,0,0|2,0,0]=4 2115 B9R0.4 CSCCN(C)CC(C)C 269982a_100000686725_100000210624 [1,0,1,0,0,0|2,0,0]=4 2116 B9R0.4 CSCCN(C)CC(C)C 269982a_100000747067_100000212216 [1,0,1,0,0,0|2,0,0]=4 2117 B9R0.4 CSCCN(C)CC(C)C 270004a_100000686725_100000210432 [1,0,1,0,0,0|2,0,0]=4 2118 B9R0.4 CSCCN(C)CC(C)O 2230a_100000227577_100000751147 [1,0,1,0,0,0|1,0,0]=3 2119 B9R0.4 CSCCN(C)CC(C)O 2230a_100000686725_100011218427 [1,0,1,0,0,0|1,0,0]=3 2120 B9R0.4 CSCCN(C)CC(C)O 269982a_100000227577_100000212216 [1,0,1,0,0,0|1,0,0]=3 2121 B9R0.4 CSCCN(C)CC(C)O 269982a_100000686725_100011218427 [1,0,1,0,0,0|1,0,0]=3 2122 B9R0.4 CSCCN(C)C[C@@H](C)O 2230a_100000686725_100009817552 [1,0,1,0,0,0|1,0,0]=3 2123 B9R0.4 CSCCN(C)C[C@@H](C)O 269982a_100000686725_100009817552 [1,0,1,0,0,0|1,0,0]=3 2124 B9R0.4 C[C@@H](O)CN(C)CCC#N 2230a_100000184479_100009817552 [1,0,1,0,0,0|1,0,1]=4 2125 B9R0.4 C[C@@H](O)CN(C)CCCO 2230a_100000213112_100009817552 [1,0,1,0,0,0|1,0,0]=3 2126 B9R0.4 C[C@@H](O)CN(C)CCCO 269982a_100000213112_100009817552 [1,0,1,0,0,0|1,0,0]=3 2127 B9R0.5 C#CCCCN(C)CCC 2230a_100000747261_100000731252 [1,0,1,0,0,0|0,0,2]=4 2128 B9R0.5 C#CCCCN(C)CCC 269982a_100000747261_100011215417 [1,0,1,0,0,0|0,0,2]=4 2129 B9R0.5 C#CCCCN(C)CCO 2230a_100000210263_100000731252 [1,0,1,0,0,0|0,0,2]=4 2130 B9R0.5 C#CCCCN(C)CCO 269982a_100000210263_100011215417 [1,0,1,0,0,0|0,0,2]=4 2131 B9R0.5 C#CCN(C)CCCCC 2230a_100000223495_100000038162 [1,0,1,0,0,0|0,0,2]=4 2132 B9R0.5 C#CCN(C)CCCCC 2230a_100000225692_100000210326 [1,0,1,0,0,0|0,0,2]=4 2133 B9R0.5 C#CCN(C)CCCCC 34a_100000225692_100000718602 [1,0,1,0,0,0|0,0,2]=4 2134 B9R0.5 C=CCCCN(C)CCC 2230a_100000747261_100011713584 [1,0,1,0,0,0|0,0,2]=4 2135 B9R0.5 C=CCCCN(C)CCC 269982a_100000747261_100000757094 [1,0,1,0,0,0|0,0,2]=4 2136 B9R0.5 C=CCCCN(C)CCO 2230a_100000210263_100011713584 [1,0,1,0,0,0|0,0,2]=4 2137 B9R0.5 C=CCCCN(C)CCO 269982a_100000210263_100000757094 [1,0,1,0,0,0|0,0,2]=4 2138 B9R0.5 C=CCN(C)CCCCC 2230a_100000223495_100000210623 [1,0,1,0,0,0|0,0,2]=4 2139 B9R0.5 C=CCN(C)CCCCC 2230a_100000225617_100000210326 [1,0,1,0,0,0|0,0,2]=4 2140 B9R0.5 C=CCN(C)CCCCC 269982a_100000223495_100000210623 [1,0,1,0,0,0|0,0,2]=4 2141 B9R0.5 C=CCN(C)CCCCC 269982a_100000225617_100000210215 [1,0,1,0,0,0|0,0,2]=4 2142 B9R0.5 CC/C=C\CN(C)CCC 2230a_100000747261_100103147603 [1,0,1,0,0,0|0,0,2]=4 2143 B9R0.5 CC/C=C\CN(C)CCC 269982a_100000747261_100103147603 [1,0,1,0,0,0|0,0,2]=4 2144 B9R0.5 CC/C=C\CN(C)CCO 2230a_100000210263_100103147603 [1,0,1,0,0,0|0,0,2]=4 2145 B9R0.5 CC/C=C\CN(C)CCO 269982a_100000210263_100103147603 [1,0,1,0,0,0|0,0,2]=4 2146 B9R0.5 CCC#CCN(C)CCC 2230a_100000747261_100009813939 [1,0,1,0,0,0|0,0,2]=4 2147 B9R0.5 CCC#CCN(C)CCO 2230a_100000210263_100009813939 [1,0,1,0,0,0|0,0,2]=4 2148 B9R0.5 CCCC(C)CCCOC 34a_100011713154_200000210301 [1,0,1,0,0,0|2,0,0]=4 2149 B9R0.5 CCCC(C)CCCOC 7a_100011713154_200000210301 [1,0,1,0,0,0|2,0,0]=4 2150 B9R0.5 CCCC(C)CCCO[13CH3] 34a_100011713154_200025704644 [1,0,1,0,0,0|2,0,0]=4 2151 B9R0.5 CCCC(C)CCCO[13CH3] 7a_100011713154_200025704644 [1,0,1,0,0,0|2,0,0]=4 2152 B9R0.5 CCCC(C)CCOCC 34a_100011217855_100000210202 [1,0,1,0,0,0|2,0,0]=4 2153 B9R0.5 CCCC(C)CCOCC 7a_100011217855_100000210202 [1,0,1,0,0,0|2,0,0]=4 2154 B9R0.5 CCCCCC(=O)CCC 1458a_100000211992_100000210326 [1,0,1,0,0,0|2,0,0]=4 2155 B9R0.5 CCCCCC(=O)CCC 1458a_100000212188_100000210303 [1,0,1,0,0,0|2,0,0]=4 2156 B9R0.5 CCCCCC(=O)CCO 1458a_100000212188_100000211926 [1,0,1,0,0,0|2,0,0]=4 2157 B9R0.5 CCCCCC(=O)CCO 1458a_100011216618_100000210326 [1,0,1,0,0,0|2,0,0]=4 2158 B9R0.5 CCCCCC(C)NCC 2230a_100000211957_100000210202 [1,0,1,0,0,0|2,0,0]=4 2159 B9R0.5 CCCCCC(C)NCC 2230a_100015525214_200011218191 [1,0,1,0,0,0|2,0,0]=4 2160 B9R0.5 CCCCCC(C)NCC 270004a_100015525214_100000211708 [1,0,1,0,0,0|2,0,0]=4 2161 B9R0.5 CCCCCC(C)OCC 34a_100011215632_100000210202 [1,0,1,0,0,0|2,0,0]=4 2162 B9R0.5 CCCCCC(C)OCC 34a_100121572206_200011218191 [1,0,1,0,0,0|2,0,0]=4 2163 B9R0.5 CCCCCC(C)OCC 7a_100011215632_100000210202 [1,0,1,0,0,0|2,0,0]=4 2164 B9R0.5 CCCCCC(C)SCC 62a_100000210202_200011218191 [1,0,1,0,0,0|2,0,0]=4 2165 B9R0.5 CCCCCC(C)SCC 62a_200011218191_100000210202 [1,0,1,0,0,0|2,0,0]=4 2166 B9R0.5 CCCCCN(C)CC#N 2230a_100000223495_100011215382 [1,0,1,0,0,0|1,0,1]=4 2167 B9R0.5 CCCCCN(C)CC#N 2230a_100000748184_100000210326 [1,0,1,0,0,0|1,0,1]=4 2168 B9R0.5 CCCCCN(C)CC#N 269982a_100000223495_100011214920 [1,0,1,0,0,0|1,0,1]=4 2169 B9R0.5 CCCCCN(C)CC=O 2230a_100000223495_200015260668 [1,0,1,0,0,0|0,0,2]=4 2170 B9R0.5 CCCCCN(C)CC=O 269982a_100000223495_200015260668 [1,0,1,0,0,0|0,0,2]=4 2171 B9R0.5 CCCCCN(C)CCC 2230a_100000223495_100000210303 [1,0,1,0,0,0|0,0,0]=2 2172 B9R0.5 CCCCCN(C)CCC 2230a_100000747261_100000210326 [1,0,1,0,0,0|0,0,0]=2 2173 B9R0.5 CCCCCN(C)CCC 2230a_200000226819_200000210301 [1,0,1,0,0,0|0,0,0]=2 2174 B9R0.5 CCCCCN(C)CCC 269982a_100000223495_100000210303 [1,0,1,0,0,0|0,0,0]=2 2175 B9R0.5 CCCCCN(C)CCC 269982a_100000747261_100000210215 [1,0,1,0,0,0|0,0,0]=2 2176 B9R0.5 CCCCCN(C)CCC 269982a_200000226819_200000210301 [1,0,1,0,0,0|0,0,0]=2 2177 B9R0.5 CCCCCN(C)CCF 2230a_100000223495_100011217306 [1,0,1,0,0,0|1,0,0]=3 2178 B9R0.5 CCCCCN(C)CCF 269982a_100000223495_100011217306 [1,0,1,0,0,0|1,0,0]=3 2179 B9R0.5 CCCCCN(C)CCO 2230a_100000210263_100000210326 [1,0,1,0,0,0|0,0,0]=2 2180 B9R0.5 CCCCCN(C)CCO 2230a_100000223495_100000211926 [1,0,1,0,0,0|0,0,0]=2 2181 B9R0.5 CCCCCN(C)CCO 2230a_100000224656_200000210301 [1,0,1,0,0,0|0,0,0]=2 2182 B9R0.5 CCCCCN(C)CCO 269982a_100000210263_100000210215 [1,0,1,0,0,0|0,0,0]=2 2183 B9R0.5 CCCCCN(C)CCO 269982a_100000223495_100000211926 [1,0,1,0,0,0|0,0,0]=2 2184 B9R0.5 CCCCCN(C)CCO 269982a_100000224656_200000210301 [1,0,1,0,0,0|0,0,0]=2 2185 B9R0.5 CCCCCN(C)COC 2230a_100000223495_100000766300 [1,0,1,0,0,0|1,0,0]=3 2186 B9R0.5 CCCCCN(C)COC 269982a_100000223495_100000766300 [1,0,1,0,0,0|1,0,0]=3 2187 B9R0.5 CCCCCN(C)CSC 2230a_100000223495_100011218213 [1,0,1,0,0,0|1,0,0]=3 2188 B9R0.5 CCCCCN(C)CSC 269982a_100000223495_100011218213 [1,0,1,0,0,0|1,0,0]=3 2189 B9R0.5 CCCCCN([13CH3])CCC 2230a_200000226819_200025704644 [1,0,1,0,0,0|0,0,0]=2 2190 B9R0.5 CCCCCN([13CH3])CCC 269982a_200000226819_200025704644 [1,0,1,0,0,0|0,0,0]=2 2191 B9R0.5 CCCCCN([13CH3])CCO 2230a_100000224656_200025704644 [1,0,1,0,0,0|0,0,0]=2 2192 B9R0.5 CCCCCN([13CH3])CCO 269982a_100000224656_200025704644 [1,0,1,0,0,0|0,0,0]=2 2193 B9R0.5 CCCCNC(C)CCC 2230a_100000102301_100000766640 [1,0,1,0,0,0|2,0,0]=4 2194 B9R0.5 CCCCNC(C)CCC 2230a_100000741246_100000210211 [1,0,1,0,0,0|2,0,0]=4 2195 B9R0.5 CCCCNC(C)CCC 270004a_100000102301_100000211909 [1,0,1,0,0,0|2,0,0]=4 2196 B9R0.5 CCCCNC(C)CCC 7a_106832991798_100000766640 [1,0,1,0,0,0|2,0,0]=4 2197 B9R0.5 CCCCNC(C)CCO 2230a_100000102301_100009893172 [1,0,1,0,0,0|2,0,0]=4 2198 B9R0.5 CCCCNC(C)CCO 7a_106832991798_100009893172 [1,0,1,0,0,0|2,0,0]=4 2199 B9R0.5 CCCCN[C@H](C)CCO 2230a_100000706166_100000210211 [1,0,1,0,0,0|2,0,0]=4 2200 B9R0.5 CCCCN[C@H](C)CCO 34a_100000706166_100000210210 [1,0,1,0,0,0|2,0,0]=4 2201 B9R0.5 CCCCOC(C)CCC 34a_100000210227_100000766640 [1,0,1,0,0,0|2,0,0]=4 2202 B9R0.5 CCCCOC(C)CCC 34a_100000764384_100000210210 [1,0,1,0,0,0|2,0,0]=4 2203 B9R0.5 CCCCOC(C)CCC 7a_100000210227_100000766640 [1,0,1,0,0,0|2,0,0]=4 2204 B9R0.5 CCCCOC(C)CCC 7a_100000764384_100000210211 [1,0,1,0,0,0|2,0,0]=4 2205 B9R0.5 CCCCOC(C)CCO 34a_100000210227_100009893172 [1,0,1,0,0,0|2,0,0]=4 2206 B9R0.5 CCCCOC(C)CCO 7a_100000210227_100009893172 [1,0,1,0,0,0|2,0,0]=4 2207 B9R0.5 CCCCSC(C)CCC 62a_100000210211_100000766640 [1,0,1,0,0,0|2,0,0]=4 2208 B9R0.5 CCCCSC(C)CCC 62a_100000766640_100000210210 [1,0,1,0,0,0|2,0,0]=4 2209 B9R0.5 CCCCSC(C)CCO 62a_100000210211_100009893172 [1,0,1,0,0,0|2,0,0]=4 2210 B9R0.5 CCCCSC(C)CCO 62a_100009893172_100000210210 [1,0,1,0,0,0|2,0,0]=4 2211 B9R0.5 CCCN(C)CCCC#N 2230a_100000747261_100000687738 [1,0,1,0,0,0|1,0,1]=4 2212 B9R0.5 CCCN(C)CCCC#N 269982a_100000747261_100000687738 [1,0,1,0,0,0|1,0,1]=4 2213 B9R0.5 CCCN(C)CCCC=O 2230a_100000747261_200011292268 [1,0,1,0,0,0|1,0,1]=4 2214 B9R0.5 CCCN(C)CCCC=O 269982a_100000747261_200011292268 [1,0,1,0,0,0|1,0,1]=4 2215 B9R0.5 CCCN(C)CCCCF 2230a_100000747261_100000729493 [1,0,1,0,0,0|1,0,0]=3 2216 B9R0.5 CCCN(C)CCCCF 269982a_100000747261_100000729493 [1,0,1,0,0,0|1,0,0]=3 2217 B9R0.5 CCCN(C)CCCCO 2230a_100000717598_100000210303 [1,0,1,0,0,0|1,0,0]=3 2218 B9R0.5 CCCN(C)CCCCO 2230a_100000747261_100000210776 [1,0,1,0,0,0|1,0,0]=3 2219 B9R0.5 CCCN(C)CCCCO 269982a_100000717598_100000210303 [1,0,1,0,0,0|1,0,0]=3 2220 B9R0.5 CCCN(C)CCCCO 269982a_100000747261_100000210776 [1,0,1,0,0,0|1,0,0]=3 2221 B9R0.5 CCCN(C)CCCOC 2230a_100000224831_100000210303 [1,0,1,0,0,0|1,0,0]=3 2222 B9R0.5 CCCN(C)CCCOC 2230a_100000747261_100000740836 [1,0,1,0,0,0|1,0,0]=3 2223 B9R0.5 CCCN(C)CCCOC 269982a_100000224831_100000210303 [1,0,1,0,0,0|1,0,0]=3 2224 B9R0.5 CCCN(C)CCCOC 269982a_100000747261_100000740836 [1,0,1,0,0,0|1,0,0]=3 2225 B9R0.5 CCCN(C)CCOCC 2230a_100000747261_100011215890 [1,0,1,0,0,0|1,0,0]=3 2226 B9R0.5 CCCN(C)CCOCC 269982a_100000747261_100011215890 [1,0,1,0,0,0|1,0,0]=3 2227 B9R0.5 CCCN(C)CCSCC 2230a_100000747261_100000757381 [1,0,1,0,0,0|1,0,0]=3 2228 B9R0.5 CCCN(C)CCSCC 269982a_100000747261_100000757381 [1,0,1,0,0,0|1,0,0]=3 2229 B9R0.5 CCCNCC(C)CCC 270004a_100020643023_100000243154 [1,0,1,0,0,0|2,0,0]=4 2230 B9R0.5 CCCOCC(C)CCC 34a_100000210258_100011216630 [1,0,1,0,0,0|2,0,0]=4 2231 B9R0.5 CCCOCC(C)CCC 34a_100000688023_100000210303 [1,0,1,0,0,0|2,0,0]=4 2232 B9R0.5 CCCOCC(C)CCC 7a_100000688023_100000210303 [1,0,1,0,0,0|2,0,0]=4 2233 B9R0.5 CCCSCC(C)CCC 62a_100000210303_100011216630 [1,0,1,0,0,0|2,0,0]=4 2234 B9R0.5 CCCSCC(C)CCC 62a_100011216630_100000210303 [1,0,1,0,0,0|2,0,0]=4 2235 B9R0.5 CCOCCN(C)CCO 2230a_100000210263_100011215890 [1,0,1,0,0,0|1,0,0]=3 2236 B9R0.5 CCOCCN(C)CCO 269982a_100000210263_100011215890 [1,0,1,0,0,0|1,0,0]=3 2237 B9R0.5 CCSCCN(C)CCO 2230a_100000210263_100000757381 [1,0,1,0,0,0|1,0,0]=3 2238 B9R0.5 CCSCCN(C)CCO 269982a_100000210263_100000757381 [1,0,1,0,0,0|1,0,0]=3 2239 B9R0.5 CN(CCF)CCCCO 2230a_100000717598_100011217306 [1,0,1,0,0,0|2,0,0]=4 2240 B9R0.5 CN(CCF)CCCCO 269982a_100000717598_100011217306 [1,0,1,0,0,0|2,0,0]=4 2241 B9R0.5 CN(CCO)CCCC#N 2230a_100000210263_100000687738 [1,0,1,0,0,0|1,0,1]=4 2242 B9R0.5 CN(CCO)CCCC#N 269982a_100000210263_100000687738 [1,0,1,0,0,0|1,0,1]=4 2243 B9R0.5 CN(CCO)CCCC=O 2230a_100000210263_200011292268 [1,0,1,0,0,0|1,0,1]=4 2244 B9R0.5 CN(CCO)CCCC=O 269982a_100000210263_200011292268 [1,0,1,0,0,0|1,0,1]=4 2245 B9R0.5 CN(CCO)CCCCF 2230a_100000210263_100000729493 [1,0,1,0,0,0|1,0,0]=3 2246 B9R0.5 CN(CCO)CCCCF 269982a_100000210263_100000729493 [1,0,1,0,0,0|1,0,0]=3 2247 B9R0.5 CN(CCO)CCCCO 2230a_100000210263_100000210776 [1,0,1,0,0,0|1,0,0]=3 2248 B9R0.5 CN(CCO)CCCCO 2230a_100000717598_100000211926 [1,0,1,0,0,0|1,0,0]=3 2249 B9R0.5 CN(CCO)CCCCO 269982a_100000210263_100000210776 [1,0,1,0,0,0|1,0,0]=3 2250 B9R0.5 CN(CCO)CCCCO 269982a_100000717598_100000211926 [1,0,1,0,0,0|1,0,0]=3 2251 B9R0.5 COCCCN(C)CCF 2230a_100000224831_100011217306 [1,0,1,0,0,0|2,0,0]=4 2252 B9R0.5 COCCCN(C)CCF 269982a_100000224831_100011217306 [1,0,1,0,0,0|2,0,0]=4 2253 B9R0.5 COCCCN(C)CCO 2230a_100000210263_100000740836 [1,0,1,0,0,0|1,0,0]=3 2254 B9R0.5 COCCCN(C)CCO 2230a_100000224831_100000211926 [1,0,1,0,0,0|1,0,0]=3 2255 B9R0.5 COCCCN(C)CCO 269982a_100000210263_100000740836 [1,0,1,0,0,0|1,0,0]=3 2256 B9R0.5 COCCCN(C)CCO 269982a_100000224831_100000211926 [1,0,1,0,0,0|1,0,0]=3 2257 B9R0.5 COCCCN(C)COC 2230a_100000224831_100000766300 [1,0,1,0,0,0|2,0,0]=4 2258 B9R0.5 COCCCN(C)COC 269982a_100000224831_100000766300 [1,0,1,0,0,0|2,0,0]=4 2259 B9R0.5 COCCCN(C)CSC 2230a_100000224831_100011218213 [1,0,1,0,0,0|2,0,0]=4 2260 B9R0.5 COCCCN(C)CSC 269982a_100000224831_100011218213 [1,0,1,0,0,0|2,0,0]=4 2261 B9R0.5 COCN(C)CCCCO 2230a_100000717598_100000766300 [1,0,1,0,0,0|2,0,0]=4 2262 B9R0.5 COCN(C)CCCCO 269982a_100000717598_100000766300 [1,0,1,0,0,0|2,0,0]=4 2263 B9R0.5 CSCN(C)CCCCO 2230a_100000717598_100011218213 [1,0,1,0,0,0|2,0,0]=4 2264 B9R0.5 CSCN(C)CCCCO 269982a_100000717598_100011218213 [1,0,1,0,0,0|2,0,0]=4 2265 B9R0.14 C#CCN(CC)CC(C)O 2230a_100000744766_100011218427 [1,0,1,0,0,0|0,0,2]=4 2266 B9R0.14 C#CCN(CC)CC(C)O 269982a_100000744766_100011218427 [1,0,1,0,0,0|0,0,2]=4 2267 B9R0.14 C#CCN(CC)C[C@@H](C)O 2230a_100000744766_100009817552 [1,0,1,0,0,0|0,0,2]=4 2268 B9R0.14 C#CCN(CC)C[C@@H](C)O 269982a_100000744766_100009817552 [1,0,1,0,0,0|0,0,2]=4 2269 B9R0.14 C#CCN(CC)C[C@H](C)O 2230a_100000729506_100000038162 [1,0,1,0,0,0|0,0,2]=4 2270 B9R0.14 C=C(C)CN(CC)CCC 2230a_100000211296_100000210303 [1,0,1,0,0,0|1,0,1]=4 2271 B9R0.14 C=C(C)CN(CC)CCC 2230a_100000226822_100000748629 [1,0,1,0,0,0|1,0,1]=4 2272 B9R0.14 C=C(C)CN(CC)CCC 269982a_100000211296_100000210303 [1,0,1,0,0,0|1,0,1]=4 2273 B9R0.14 C=C(C)CN(CC)CCC 269982a_100000226822_100000748629 [1,0,1,0,0,0|1,0,1]=4 2274 B9R0.14 C=CCN(CC)C[C@H](C)O 2230a_100000729506_100000210623 [1,0,1,0,0,0|0,0,2]=4 2275 B9R0.14 C=CCN(CC)C[C@H](C)O 269982a_100000729506_100000210623 [1,0,1,0,0,0|0,0,2]=4 2276 B9R0.14 CC(O)CN(CF)CCO 269982a_100000731851_100015361967 [1,0,1,0,0,0|2,0,0]=4 2277 B9R0.14 CCCN(CC)CC(=O)O 269956a_100000746405_100000210207 [1,0,1,0,0,0|1,0,1]=4 2278 B9R0.14 CCCN(CC)CC(C)C 2230a_100000226822_100000210760 [1,0,1,0,0,0|1,0,0]=3 2279 B9R0.14 CCCN(CC)CC(C)C 2230a_100000738554_100000210303 [1,0,1,0,0,0|1,0,0]=3 2280 B9R0.14 CCCN(CC)CC(C)C 269982a_100000226822_100000210624 [1,0,1,0,0,0|1,0,0]=3 2281 B9R0.14 CCCN(CC)CC(C)C 269982a_100000738554_100000210303 [1,0,1,0,0,0|1,0,0]=3 2282 B9R0.14 CCCN(CC)CC(C)C 270004a_100000226822_100000210432 [1,0,1,0,0,0|1,0,0]=3 2283 B9R0.14 CCCN(CC)CC(C)O 2230a_100000226822_100011218427 [1,0,1,0,0,0|0,0,0]=2 2284 B9R0.14 CCCN(CC)CC(C)O 269982a_100000226822_100011218427 [1,0,1,0,0,0|0,0,0]=2 2285 B9R0.14 CCCN(CC)CC(F)F 2230a_100000226822_100011934356 [1,0,1,0,0,0|2,0,0]=4 2286 B9R0.14 CCCN(CC)CC(F)F 269982a_100000226822_100011934356 [1,0,1,0,0,0|2,0,0]=4 2287 B9R0.14 CCCN(CC)C[C@@H](C)O 2230a_100000226822_100009817552 [1,0,1,0,0,0|0,0,0]=2 2288 B9R0.14 CCCN(CC)C[C@@H](C)O 269982a_100000226822_100009817552 [1,0,1,0,0,0|0,0,0]=2 2289 B9R0.14 CCCN(CC)C[C@H](C)O 2230a_100000729506_100000210303 [1,0,1,0,0,0|0,0,0]=2 2290 B9R0.14 CCCN(CC)C[C@H](C)O 269982a_100000729506_100000210303 [1,0,1,0,0,0|0,0,0]=2 2291 B9R0.14 CCN(CC#N)C[C@H](C)O 2230a_100000729506_100011215382 [1,0,1,0,0,0|1,0,1]=4 2292 B9R0.14 CCN(CC#N)C[C@H](C)O 269982a_100000729506_100011214920 [1,0,1,0,0,0|1,0,1]=4 2293 B9R0.14 CCN(CC=O)C[C@H](C)O 2230a_100000729506_200015260668 [1,0,1,0,0,0|1,0,1]=4 2294 B9R0.14 CCN(CC=O)C[C@H](C)O 269982a_100000729506_200015260668 [1,0,1,0,0,0|1,0,1]=4 2295 B9R0.14 CCN(CCF)CC(C)C 2230a_100000738554_100011217306 [1,0,1,0,0,0|2,0,0]=4 2296 B9R0.14 CCN(CCF)CC(C)C 269982a_100000738554_100011217306 [1,0,1,0,0,0|2,0,0]=4 2297 B9R0.14 CCN(CCF)C[C@H](C)O 2230a_100000729506_100011217306 [1,0,1,0,0,0|1,0,0]=3 2298 B9R0.14 CCN(CCF)C[C@H](C)O 269982a_100000729506_100011217306 [1,0,1,0,0,0|1,0,0]=3 2299 B9R0.14 CCN(CCO)CC(C)C 2230a_100000210973_100000210760 [1,0,1,0,0,0|2,0,0]=4 2300 B9R0.14 CCN(CCO)CC(C)C 2230a_100000738554_100000211926 [1,0,1,0,0,0|2,0,0]=4 2301 B9R0.14 CCN(CCO)CC(C)C 2230a_100015185251_100000210202 [1,0,1,0,0,0|2,0,0]=4 2302 B9R0.14 CCN(CCO)CC(C)C 269982a_100000210973_100000210624 [1,0,1,0,0,0|2,0,0]=4 2303 B9R0.14 CCN(CCO)CC(C)C 269982a_100000738554_100000211926 [1,0,1,0,0,0|2,0,0]=4 2304 B9R0.14 CCN(CCO)CC(C)C 269982a_100015185251_100000204670 [1,0,1,0,0,0|2,0,0]=4 2305 B9R0.14 CCN(CCO)CC(C)C 270004a_100000210973_100000210432 [1,0,1,0,0,0|2,0,0]=4 2306 B9R0.14 CCN(CCO)CC(C)O 2230a_100000210973_100011218427 [1,0,1,0,0,0|1,0,0]=3 2307 B9R0.14 CCN(CCO)CC(C)O 2230a_100000731851_100000210202 [1,0,1,0,0,0|1,0,0]=3 2308 B9R0.14 CCN(CCO)CC(C)O 269982a_100000210973_100011218427 [1,0,1,0,0,0|1,0,0]=3 2309 B9R0.14 CCN(CCO)CC(C)O 269982a_100000731851_100000204670 [1,0,1,0,0,0|1,0,0]=3 2310 B9R0.14 CCN(CCO)C[C@@H](C)O 2230a_100000210973_100009817552 [1,0,1,0,0,0|1,0,0]=3 2311 B9R0.14 CCN(CCO)C[C@@H](C)O 269982a_100000210973_100009817552 [1,0,1,0,0,0|1,0,0]=3 2312 B9R0.14 CCN(CCO)C[C@H](C)O 2230a_100000729506_100000211926 [1,0,1,0,0,0|1,0,0]=3 2313 B9R0.14 CCN(CCO)C[C@H](C)O 269982a_100000729506_100000211926 [1,0,1,0,0,0|1,0,0]=3 2314 B9R0.14 CCN(COC)CC(C)C 2230a_100000738554_100000766300 [1,0,1,0,0,0|2,0,0]=4 2315 B9R0.14 CCN(COC)CC(C)C 269982a_100000738554_100000766300 [1,0,1,0,0,0|2,0,0]=4 2316 B9R0.14 CCN(COC)C[C@H](C)O 2230a_100000729506_100000766300 [1,0,1,0,0,0|1,0,0]=3 2317 B9R0.14 CCN(COC)C[C@H](C)O 269982a_100000729506_100000766300 [1,0,1,0,0,0|1,0,0]=3 2318 B9R0.14 CCN(CSC)CC(C)C 2230a_100000738554_100011218213 [1,0,1,0,0,0|2,0,0]=4 2319 B9R0.14 CCN(CSC)CC(C)C 269982a_100000738554_100011218213 [1,0,1,0,0,0|2,0,0]=4 2320 B9R0.14 CCN(CSC)C[C@H](C)O 2230a_100000729506_100011218213 [1,0,1,0,0,0|1,0,0]=3 2321 B9R0.14 CCN(CSC)C[C@H](C)O 269982a_100000729506_100011218213 [1,0,1,0,0,0|1,0,0]=3 2322 B9R0.17 C#CCN(CCC)CCC 2230a_100000210455_100000038162 [1,0,1,0,0,0|0,0,2]=4 2323 B9R0.17 C#CCN(CCC)CCO 2230a_100000211420_100000038162 [1,0,1,0,0,0|0,0,2]=4 2324 B9R0.17 C=CCN(CCC)CCC 2230a_100000210455_100000210623 [1,0,1,0,0,0|0,0,2]=4 2325 B9R0.17 C=CCN(CCC)CCC 269982a_100000210455_100000210623 [1,0,1,0,0,0|0,0,2]=4 2326 B9R0.17 C=CCN(CCC)CCO 2230a_100000211420_100000210623 [1,0,1,0,0,0|0,0,2]=4 2327 B9R0.17 C=CCN(CCC)CCO 269982a_100000211420_100000210623 [1,0,1,0,0,0|0,0,2]=4 2328 B9R0.17 CCCC(CCC)COC 34a_200011215456_200000210301 [1,0,1,0,0,0|2,0,0]=4 2329 B9R0.17 CCCC(CCC)COC 7a_200011215456_200000210301 [1,0,1,0,0,0|2,0,0]=4 2330 B9R0.17 CCCC(CCC)CO[13CH3] 34a_200011215456_200025704644 [1,0,1,0,0,0|2,0,0]=4 2331 B9R0.17 CCCC(CCC)CO[13CH3] 7a_200011215456_200025704644 [1,0,1,0,0,0|2,0,0]=4 2332 B9R0.17 CCCC(CCC)NCC 2230a_100011207992_100000210202 [1,0,1,0,0,0|2,0,0]=4 2333 B9R0.17 CCCC(CCC)NCC 270004a_100015525214_100000210088 [1,0,1,0,0,0|2,0,0]=4 2334 B9R0.17 CCCC(CCC)NCC 34a_100011207992_100000210202 [1,0,1,0,0,0|2,0,0]=4 2335 B9R0.17 CCCC(CCC)OCC 34a_100121572206_200011218217 [1,0,1,0,0,0|2,0,0]=4 2336 B9R0.17 CCCC(CCC)OCC 34a_200011218534_100000210202 [1,0,1,0,0,0|2,0,0]=4 2337 B9R0.17 CCCC(CCC)OCC 7a_200011218534_100000210202 [1,0,1,0,0,0|2,0,0]=4 2338 B9R0.17 CCCC(CCC)SCC 62a_100000210202_200011218217 [1,0,1,0,0,0|2,0,0]=4 2339 B9R0.17 CCCC(CCC)SCC 62a_200011218217_100000210202 [1,0,1,0,0,0|2,0,0]=4 2340 B9R0.17 CCCN(CC#N)CCC 2230a_100000210455_100011215382 [1,0,1,0,0,0|1,0,1]=4 2341 B9R0.17 CCCN(CC#N)CCC 269982a_100000210455_100011214920 [1,0,1,0,0,0|1,0,1]=4 2342 B9R0.17 CCCN(CC#N)CCO 2230a_100000211420_100011215382 [1,0,1,0,0,0|1,0,1]=4 2343 B9R0.17 CCCN(CC#N)CCO 269982a_100000211420_100011214920 [1,0,1,0,0,0|1,0,1]=4 2344 B9R0.17 CCCN(CC=O)CCC 2230a_100000210455_200015260668 [1,0,1,0,0,0|0,0,2]=4 2345 B9R0.17 CCCN(CC=O)CCC 269982a_100000210455_200015260668 [1,0,1,0,0,0|0,0,2]=4 2346 B9R0.17 CCCN(CC=O)CCO 2230a_100000211420_200015260668 [1,0,1,0,0,0|1,0,1]=4 2347 B9R0.17 CCCN(CC=O)CCO 269982a_100000211420_200015260668 [1,0,1,0,0,0|1,0,1]=4 2348 B9R0.17 CCCN(CCC)CCC 2230a_100000210455_100000210303 [1,0,1,0,0,0|0,0,0]=2 2349 B9R0.17 CCCN(CCC)CCC 269982a_100000210455_100000210303 [1,0,1,0,0,0|0,0,0]=2 2350 B9R0.17 CCCN(CCC)CCF 2230a_100000210455_100011217306 [1,0,1,0,0,0|1,0,0]=3 2351 B9R0.17 CCCN(CCC)CCF 269982a_100000210455_100011217306 [1,0,1,0,0,0|1,0,0]=3 2352 B9R0.17 CCCN(CCC)CCO 2230a_100000210455_100000211926 [1,0,1,0,0,0|0,0,0]=2 2353 B9R0.17 CCCN(CCC)CCO 2230a_100000211420_100000210303 [1,0,1,0,0,0|0,0,0]=2 2354 B9R0.17 CCCN(CCC)CCO 269982a_100000210455_100000211926 [1,0,1,0,0,0|0,0,0]=2 2355 B9R0.17 CCCN(CCC)CCO 269982a_100000211420_100000210303 [1,0,1,0,0,0|0,0,0]=2 2356 B9R0.17 CCCN(CCC)COC 2230a_100000210455_100000766300 [1,0,1,0,0,0|1,0,0]=3 2357 B9R0.17 CCCN(CCC)COC 269982a_100000210455_100000766300 [1,0,1,0,0,0|1,0,0]=3 2358 B9R0.17 CCCN(CCC)CSC 2230a_100000210455_100011218213 [1,0,1,0,0,0|1,0,0]=3 2359 B9R0.17 CCCN(CCC)CSC 269982a_100000210455_100011218213 [1,0,1,0,0,0|1,0,0]=3 2360 B9R0.17 CCCN(CCO)CCF 2230a_100000211420_100011217306 [1,0,1,0,0,0|1,0,0]=3 2361 B9R0.17 CCCN(CCO)CCF 269982a_100000211420_100011217306 [1,0,1,0,0,0|1,0,0]=3 2362 B9R0.17 CCCN(CCO)CCO 2230a_100000210587_100000210303 [1,0,1,0,0,0|1,0,0]=3 2363 B9R0.17 CCCN(CCO)CCO 2230a_100000211420_100000211926 [1,0,1,0,0,0|1,0,0]=3 2364 B9R0.17 CCCN(CCO)CCO 269982a_100000210587_100000210303 [1,0,1,0,0,0|1,0,0]=3 2365 B9R0.17 CCCN(CCO)CCO 269982a_100000211420_100000211926 [1,0,1,0,0,0|1,0,0]=3 2366 B9R0.17 CCCN(CCO)COC 2230a_100000211420_100000766300 [1,0,1,0,0,0|1,0,0]=3 2367 B9R0.17 CCCN(CCO)COC 269982a_100000211420_100000766300 [1,0,1,0,0,0|1,0,0]=3 2368 B9R0.17 CCCN(CCO)CSC 2230a_100000211420_100011218213 [1,0,1,0,0,0|1,0,0]=3 2369 B9R0.17 CCCN(CCO)CSC 269982a_100000211420_100011218213 [1,0,1,0,0,0|1,0,0]=3 2370 B9R0.17 CCC[C@@H](CCO)NCC 2230a_100015193777_100000210202 [1,0,1,0,0,0|2,0,0]=4 2371 B9R0.17 CCC[C@@H](CCO)NCC 34a_100015193777_100000210202 [1,0,1,0,0,0|2,0,0]=4 2372 B9R0.17 COCN(CCO)CCO 2230a_100000210587_100000766300 [1,0,1,0,0,0|2,0,0]=4 2373 B9R0.17 COCN(CCO)CCO 269982a_100000210587_100000766300 [1,0,1,0,0,0|2,0,0]=4 2374 B9R0.17 CSCN(CCO)CCO 2230a_100000210587_100011218213 [1,0,1,0,0,0|2,0,0]=4 2375 B9R0.17 CSCN(CCO)CCO 269982a_100000210587_100011218213 [1,0,1,0,0,0|2,0,0]=4 2376 B9R0.17 OCCN(CCO)CCF 2230a_100000210587_100011217306 [1,0,1,0,0,0|2,0,0]=4 2377 B9R0.17 OCCN(CCO)CCF 269982a_100000210587_100011217306 [1,0,1,0,0,0|2,0,0]=4 2378 B9R0.17 OCCN(CCO)CCO 2230a_100000210587_100000211926 [1,0,1,0,0,0|2,0,0]=4 2379 B9R0.17 OCCN(CCO)CCO 269982a_100000210587_100000211926 [1,0,1,0,0,0|2,0,0]=4 2380 B9R0.40 C#CCCN(CC)CCC 2230a_100000226822_100000688953 [1,0,1,0,0,0|0,0,2]=4 2381 B9R0.40 C#CCCN(CC)CCC 269982a_100000226822_100000730999 [1,0,1,0,0,0|0,0,2]=4 2382 B9R0.40 C#CCCN(CC)CCO 2230a_100000210973_100000688953 [1,0,1,0,0,0|0,0,2]=4 2383 B9R0.40 C#CCCN(CC)CCO 269982a_100000210973_100000730999 [1,0,1,0,0,0|0,0,2]=4 2384 B9R0.40 C#CCN(CC)CCCC 2230a_100000207695_100000038162 [1,0,1,0,0,0|0,0,2]=4 2385 B9R0.40 C#CCN(CC)CCCC 2230a_100000744766_100000210211 [1,0,1,0,0,0|0,0,2]=4 2386 B9R0.40 C#CCN(CC)CCCC 269982a_100000744766_100000210211 [1,0,1,0,0,0|0,0,2]=4 2387 B9R0.40 C/C=C/CN(CC)CCC 269982a_100000226822_100102629194 [1,0,1,0,0,0|0,0,2]=4 2388 B9R0.40 C/C=C/CN(CC)CCO 269982a_100000210973_100102629194 [1,0,1,0,0,0|0,0,2]=4 2389 B9R0.40 C=CCCN(CC)CCC 2230a_100000226822_100000754431 [1,0,1,0,0,0|0,0,2]=4 2390 B9R0.40 C=CCCN(CC)CCC 269982a_100000226822_100000754431 [1,0,1,0,0,0|0,0,2]=4 2391 B9R0.40 C=CCCN(CC)CCO 2230a_100000210973_100000754431 [1,0,1,0,0,0|0,0,2]=4 2392 B9R0.40 C=CCCN(CC)CCO 269982a_100000210973_100000754431 [1,0,1,0,0,0|0,0,2]=4 2393 B9R0.40 C=CCN(CC)CCCC 2230a_100000207695_100000210623 [1,0,1,0,0,0|0,0,2]=4 2394 B9R0.40 C=CCN(CC)CCCC 269982a_100000207695_100000210623 [1,0,1,0,0,0|0,0,2]=4 2395 B9R0.40 CC#CCN(CC)CCC 2230a_100000226822_100000748600 [1,0,1,0,0,0|0,0,2]=4 2396 B9R0.40 CC#CCN(CC)CCO 2230a_100000210973_100000748600 [1,0,1,0,0,0|0,0,2]=4 2397 B9R0.40 CC=CCN(CC)CCC 2230a_100000226822_100000070051 [1,0,1,0,0,0|0,0,2]=4 2398 B9R0.40 CC=CCN(CC)CCO 2230a_100000210973_100000070051 [1,0,1,0,0,0|0,0,2]=4 2399 B9R0.40 CCCCC(CC)CNC 2230a_100000209976_200000210301 [1,0,1,0,0,0|2,0,0]=4 2400 B9R0.40 CCCCC(CC)CNC 2230a_106832991635_100000211942 [1,0,1,0,0,0|2,0,0]=4 2401 B9R0.40 CCCCC(CC)CNC 269862a_106832991636_100011219736 [1,0,1,0,0,0|2,0,0]=4 2402 B9R0.40 CCCCC(CC)CNC 270004a_106832991635_100011219736 [1,0,1,0,0,0|2,0,0]=4 2403 B9R0.40 CCCCC(CC)CNC 34a_100102657272_100000211942 [1,0,1,0,0,0|2,0,0]=4 2404 B9R0.40 CCCCC(CC)CNC 7a_106832991635_100000211942 [1,0,1,0,0,0|2,0,0]=4 2405 B9R0.40 CCCCC(CC)CN[13CH3] 2230a_100000209976_200025704644 [1,0,1,0,0,0|2,0,0]=4 2406 B9R0.40 CCCCC(CC)COC 34a_100000210273_200000210301 [1,0,1,0,0,0|2,0,0]=4 2407 B9R0.40 CCCCC(CC)COC 34a_100138415774_100000211942 [1,0,1,0,0,0|2,0,0]=4 2408 B9R0.40 CCCCC(CC)COC 7a_100000210273_200000210301 [1,0,1,0,0,0|2,0,0]=4 2409 B9R0.40 CCCCC(CC)CO[13CH3] 34a_100000210273_200025704644 [1,0,1,0,0,0|2,0,0]=4 2410 B9R0.40 CCCCC(CC)CO[13CH3] 7a_100000210273_200025704644 [1,0,1,0,0,0|2,0,0]=4 2411 B9R0.40 CCCCC(CC)CSC 62a_100000211942_200000210301 [1,0,1,0,0,0|2,0,0]=4 2412 B9R0.40 CCCCC(CC)CSC 62a_200000210301_100000211942 [1,0,1,0,0,0|2,0,0]=4 2413 B9R0.40 CCCCC(CC)CS[13CH3] 62a_100000211942_200025704644 [1,0,1,0,0,0|2,0,0]=4 2414 B9R0.40 CCCCC(CC)CS[13CH3] 62a_200025704644_100000211942 [1,0,1,0,0,0|2,0,0]=4 2415 B9R0.40 CCCCC(CC)NCC 270004a_100015525214_100000753412 [1,0,1,0,0,0|2,0,0]=4 2416 B9R0.40 CCCCC(CC)OCC 34a_100011215227_100000210202 [1,0,1,0,0,0|2,0,0]=4 2417 B9R0.40 CCCCC(CC)OCC 34a_100121572206_200011216223 [1,0,1,0,0,0|2,0,0]=4 2418 B9R0.40 CCCCC(CC)OCC 7a_100011215227_100000210202 [1,0,1,0,0,0|2,0,0]=4 2419 B9R0.40 CCCCC(CC)SCC 62a_100000210202_200011216223 [1,0,1,0,0,0|2,0,0]=4 2420 B9R0.40 CCCCC(CC)SCC 62a_200011216223_100000210202 [1,0,1,0,0,0|2,0,0]=4 2421 B9R0.40 CCCCC(CCC)NC 34a_100102657272_100000211913 [1,0,1,0,0,0|2,0,0]=4 2422 B9R0.40 CCCCC(CCC)NC 7a_106832991635_100000211913 [1,0,1,0,0,0|2,0,0]=4 2423 B9R0.40 CCCCC(CCC)OC 34a_100011215800_200000210301 [1,0,1,0,0,0|2,0,0]=4 2424 B9R0.40 CCCCC(CCC)OC 34a_100138415774_100000211913 [1,0,1,0,0,0|2,0,0]=4 2425 B9R0.40 CCCCC(CCC)OC 7a_100011215800_200000210301 [1,0,1,0,0,0|2,0,0]=4 2426 B9R0.40 CCCCC(CCC)O[13CH3] 34a_100011215800_200025704644 [1,0,1,0,0,0|2,0,0]=4 2427 B9R0.40 CCCCC(CCC)O[13CH3] 7a_100011215800_200025704644 [1,0,1,0,0,0|2,0,0]=4 2428 B9R0.40 CCCCC(CCC)SC 62a_100000211913_200000210301 [1,0,1,0,0,0|2,0,0]=4 2429 B9R0.40 CCCCC(CCC)SC 62a_200000210301_100000211913 [1,0,1,0,0,0|2,0,0]=4 2430 B9R0.40 CCCCC(CCC)S[13CH3] 62a_100000211913_200025704644 [1,0,1,0,0,0|2,0,0]=4 2431 B9R0.40 CCCCC(CCC)S[13CH3] 62a_200025704644_100000211913 [1,0,1,0,0,0|2,0,0]=4 2432 B9R0.40 CCCCN(CC)CC#N 2230a_100000207695_100011215382 [1,0,1,0,0,0|1,0,1]=4 2433 B9R0.40 CCCCN(CC)CC#N 2230a_200011192266_100000210202 [1,0,1,0,0,0|1,0,1]=4 2434 B9R0.40 CCCCN(CC)CC#N 269982a_100000207695_100011214920 [1,0,1,0,0,0|1,0,1]=4 2435 B9R0.40 CCCCN(CC)CC=O 2230a_100000207695_200015260668 [1,0,1,0,0,0|0,0,2]=4 2436 B9R0.40 CCCCN(CC)CC=O 269982a_100000207695_200015260668 [1,0,1,0,0,0|0,0,2]=4 2437 B9R0.40 CCCCN(CC)CCC 2230a_100000207695_100000210303 [1,0,1,0,0,0|0,0,0]=2 2438 B9R0.40 CCCCN(CC)CCC 2230a_100000226822_100000210211 [1,0,1,0,0,0|0,0,0]=2 2439 B9R0.40 CCCCN(CC)CCC 2230a_200000207744_100000210202 [1,0,1,0,0,0|0,0,0]=2 2440 B9R0.40 CCCCN(CC)CCC 269982a_100000207695_100000210303 [1,0,1,0,0,0|0,0,0]=2 2441 B9R0.40 CCCCN(CC)CCC 269982a_100000226822_100000210211 [1,0,1,0,0,0|0,0,0]=2 2442 B9R0.40 CCCCN(CC)CCC 269982a_200000207744_100000204670 [1,0,1,0,0,0|0,0,0]=2 2443 B9R0.40 CCCCN(CC)CCF 2230a_100000207695_100011217306 [1,0,1,0,0,0|1,0,0]=3 2444 B9R0.40 CCCCN(CC)CCF 269982a_100000207695_100011217306 [1,0,1,0,0,0|1,0,0]=3 2445 B9R0.40 CCCCN(CC)CCO 2230a_100000198060_100000210202 [1,0,1,0,0,0|0,0,0]=2 2446 B9R0.40 CCCCN(CC)CCO 2230a_100000207695_100000211926 [1,0,1,0,0,0|0,0,0]=2 2447 B9R0.40 CCCCN(CC)CCO 2230a_100000210973_100000210211 [1,0,1,0,0,0|0,0,0]=2 2448 B9R0.40 CCCCN(CC)CCO 269982a_100000198060_100000204670 [1,0,1,0,0,0|0,0,0]=2 2449 B9R0.40 CCCCN(CC)CCO 269982a_100000207695_100000211926 [1,0,1,0,0,0|0,0,0]=2 2450 B9R0.40 CCCCN(CC)CCO 269982a_100000210973_100000210211 [1,0,1,0,0,0|0,0,0]=2 2451 B9R0.40 CCCCN(CC)COC 2230a_100000207695_100000766300 [1,0,1,0,0,0|1,0,0]=3 2452 B9R0.40 CCCCN(CC)COC 269982a_100000207695_100000766300 [1,0,1,0,0,0|1,0,0]=3 2453 B9R0.40 CCCCN(CC)CSC 2230a_100000207695_100011218213 [1,0,1,0,0,0|1,0,0]=3 2454 B9R0.40 CCCCN(CC)CSC 269982a_100000207695_100011218213 [1,0,1,0,0,0|1,0,0]=3 2455 B9R0.40 CCCCN(CF)CCC 269982a_200000207744_100015361967 [1,0,1,0,0,0|1,0,0]=3 2456 B9R0.40 CCCCN(CF)CCO 269982a_100000198060_100015361967 [1,0,1,0,0,0|1,0,0]=3 2457 B9R0.40 CCCN(CC)CCC#N 2230a_100000176855_100000210202 [1,0,1,0,0,0|1,0,1]=4 2458 B9R0.40 CCCN(CC)CCC#N 2230a_100000226048_100000210303 [1,0,1,0,0,0|1,0,1]=4 2459 B9R0.40 CCCN(CC)CCC#N 2230a_100000226822_100011215226 [1,0,1,0,0,0|1,0,1]=4 2460 B9R0.40 CCCN(CC)CCC#N 269982a_100000226822_100011215226 [1,0,1,0,0,0|1,0,1]=4 2461 B9R0.40 CCCN(CC)CCCF 2230a_100000226822_100011934791 [1,0,1,0,0,0|1,0,0]=3 2462 B9R0.40 CCCN(CC)CCCF 269982a_100000226822_100011934791 [1,0,1,0,0,0|1,0,0]=3 2463 B9R0.40 CCCN(CC)CCCO 2230a_100000226822_100000230001 [1,0,1,0,0,0|1,0,0]=3 2464 B9R0.40 CCCN(CC)CCCO 269982a_100000226822_100011215043 [1,0,1,0,0,0|1,0,0]=3 2465 B9R0.40 CCCN(CC)CCOC 2230a_100000226822_100011201679 [1,0,1,0,0,0|1,0,0]=3 2466 B9R0.40 CCCN(CC)CCOC 2230a_100000731262_100000210303 [1,0,1,0,0,0|1,0,0]=3 2467 B9R0.40 CCCN(CC)CCOC 2230a_200011192371_100000210202 [1,0,1,0,0,0|1,0,0]=3 2468 B9R0.40 CCCN(CC)CCOC 269982a_100000226822_100000233755 [1,0,1,0,0,0|1,0,0]=3 2469 B9R0.40 CCCN(CC)CCOC 269982a_100000731262_100000210303 [1,0,1,0,0,0|1,0,0]=3 2470 B9R0.40 CCCN(CC)CCOC 269982a_200011192371_100000204670 [1,0,1,0,0,0|1,0,0]=3 2471 B9R0.40 CCCN(CC)CCSC 2230a_100000226822_100000751147 [1,0,1,0,0,0|1,0,0]=3 2472 B9R0.40 CCCN(CC)CCSC 269982a_100000226822_100000212216 [1,0,1,0,0,0|1,0,0]=3 2473 B9R0.40 CCCN(CC)COCC 269982a_100000226822_100000739092 [1,0,1,0,0,0|1,0,0]=3 2474 B9R0.40 CCCN(CF)CCOC 269982a_200011192371_100015361967 [1,0,1,0,0,0|2,0,0]=4 2475 B9R0.40 CCCNC(CC)CCC 2230a_100000747048_100000210303 [1,0,1,0,0,0|2,0,0]=4 2476 B9R0.40 CCCNC(CC)CCC 270004a_100020643023_100000687865 [1,0,1,0,0,0|2,0,0]=4 2477 B9R0.40 CCCOC(CC)CCC 34a_100000687864_100000210303 [1,0,1,0,0,0|2,0,0]=4 2478 B9R0.40 CCCOC(CC)CCC 7a_100000687864_100000210303 [1,0,1,0,0,0|2,0,0]=4 2479 B9R0.40 CCCSC(CC)CCC 62a_100000210303_100011219200 [1,0,1,0,0,0|2,0,0]=4 2480 B9R0.40 CCCSC(CC)CCC 62a_100011219200_100000210303 [1,0,1,0,0,0|2,0,0]=4 2481 B9R0.40 CCN(CCF)CCOC 2230a_100000731262_100011217306 [1,0,1,0,0,0|2,0,0]=4 2482 B9R0.40 CCN(CCF)CCOC 269982a_100000731262_100011217306 [1,0,1,0,0,0|2,0,0]=4 2483 B9R0.40 CCN(CCO)CCC#N 2230a_100000210973_100011215226 [1,0,1,0,0,0|1,0,1]=4 2484 B9R0.40 CCN(CCO)CCC#N 2230a_100000226048_100000211926 [1,0,1,0,0,0|1,0,1]=4 2485 B9R0.40 CCN(CCO)CCC#N 269982a_100000210973_100011215226 [1,0,1,0,0,0|1,0,1]=4 2486 B9R0.40 CCN(CCO)CCCF 2230a_100000210973_100011934791 [1,0,1,0,0,0|1,0,0]=3 2487 B9R0.40 CCN(CCO)CCCF 269982a_100000210973_100011934791 [1,0,1,0,0,0|1,0,0]=3 2488 B9R0.40 CCN(CCO)CCCO 2230a_100000210973_100000230001 [1,0,1,0,0,0|1,0,0]=3 2489 B9R0.40 CCN(CCO)CCCO 2230a_200000212863_100000210202 [1,0,1,0,0,0|1,0,0]=3 2490 B9R0.40 CCN(CCO)CCCO 269982a_100000210973_100011215043 [1,0,1,0,0,0|1,0,0]=3 2491 B9R0.40 CCN(CCO)CCCO 269982a_200000212863_100000204670 [1,0,1,0,0,0|1,0,0]=3 2492 B9R0.40 CCN(CCO)CCOC 2230a_100000210973_100011201679 [1,0,1,0,0,0|1,0,0]=3 2493 B9R0.40 CCN(CCO)CCOC 2230a_100000731262_100000211926 [1,0,1,0,0,0|1,0,0]=3 2494 B9R0.40 CCN(CCO)CCOC 269982a_100000210973_100000233755 [1,0,1,0,0,0|1,0,0]=3 2495 B9R0.40 CCN(CCO)CCOC 269982a_100000731262_100000211926 [1,0,1,0,0,0|1,0,0]=3 2496 B9R0.40 CCN(CCO)CCSC 2230a_100000210973_100000751147 [1,0,1,0,0,0|1,0,0]=3 2497 B9R0.40 CCN(CCO)CCSC 269982a_100000210973_100000212216 [1,0,1,0,0,0|1,0,0]=3 2498 B9R0.40 CCN(CCOC)COC 2230a_100000731262_100000766300 [1,0,1,0,0,0|2,0,0]=4 2499 B9R0.40 CCN(CCOC)COC 269982a_100000731262_100000766300 [1,0,1,0,0,0|2,0,0]=4 2500 B9R0.40 CCN(CCOC)CSC 2230a_100000731262_100011218213 [1,0,1,0,0,0|2,0,0]=4 2501 B9R0.40 CCN(CCOC)CSC 269982a_100000731262_100011218213 [1,0,1,0,0,0|2,0,0]=4 2502 B9R0.40 CCOCN(CC)CCO 269982a_100000210973_100000739092 [1,0,1,0,0,0|1,0,0]=3 2503 B9R0.40 OCCCN(CF)CCO 269982a_200000212863_100015361967 [1,0,1,0,0,0|2,0,0]=4 2504 B9R1.89 CCN1CCCCCC1 2230a_100000185865_100000210202 [2,0,0,0,0,0|0,0,0]=2 2505 B9R1.89 CCN1CCCCCC1 269982a_100000185865_100000204670 [2,0,0,0,0,0|0,0,0]=2 2506 B9R1.89 CCN1CCCCCC1 34a_100000185865_100000210202 [2,0,0,0,0,0|0,0,0]=2 2507 B9R1.89 CCN1CCCOCC1 2230a_100000685342_100000210202 [2,0,0,0,0,0|1,0,0]=3 2508 B9R1.89 CCN1CCCOCC1 269982a_100000685342_100000204670 [2,0,0,0,0,0|1,0,0]=3 2509 B9R1.89 CCN1CCCOCC1 34a_100000685342_100000210202 [2,0,0,0,0,0|1,0,0]=3 2510 B9R1.89 CNC1CCCCCC1 2230a_100000210984_200000210301 [2,0,0,0,0,0|2,0,0]=4 2511 B9R1.89 CNC1CCCCCC1 270004a_106832991635_100000210131 [2,0,0,0,0,0|2,0,0]=4 2512 B9R1.89 CNC1CCCCCC1 34a_100000210984_200000210301 [2,0,0,0,0,0|2,0,0]=4 2513 B9R1.89 CNC1CCCCCC1 34a_100102657272_100011217769 [2,0,0,0,0,0|2,0,0]=4 2514 B9R1.89 COC1CCCCCC1 34a_100000210887_200000210301 [2,0,0,0,0,0|2,0,0]=4 2515 B9R1.89 COC1CCCCCC1 34a_100138415774_100011217769 [2,0,0,0,0,0|2,0,0]=4 2516 B9R1.89 COC1CCCCCC1 7a_100000210887_200000210301 [2,0,0,0,0,0|2,0,0]=4 2517 B9R1.89 CSC1CCCCCC1 62a_100011217769_200000210301 [2,0,0,0,0,0|2,0,0]=4 2518 B9R1.89 CSC1CCCCCC1 62a_200000210301_100011217769 [2,0,0,0,0,0|2,0,0]=4 2519 B9R1.89 FCN1CCCCCC1 269982a_100000185865_100015361967 [2,0,0,0,0,0|1,0,0]=3 2520 B9R1.89 FCN1CCCCCC1 34a_100000185865_100015361967 [2,0,0,0,0,0|1,0,0]=3 2521 B9R1.89 FCN1CCCOCC1 269982a_100000685342_100015361967 [2,0,0,0,0,0|2,0,0]=4 2522 B9R1.89 FCN1CCCOCC1 34a_100000685342_100015361967 [2,0,0,0,0,0|2,0,0]=4 2523 B9R1.89 [13CH3]NC1CCCCCC1 2230a_100000210984_200025704644 [2,0,0,0,0,0|2,0,0]=4 2524 B9R1.89 [13CH3]NC1CCCCCC1 34a_100000210984_200025704644 [2,0,0,0,0,0|2,0,0]=4 2525 B9R1.89 [13CH3]OC1CCCCCC1 34a_100000210887_200025704644 [2,0,0,0,0,0|2,0,0]=4 2526 B9R1.89 [13CH3]OC1CCCCCC1 7a_100000210887_200025704644 [2,0,0,0,0,0|2,0,0]=4 2527 B9R1.89 [13CH3]SC1CCCCCC1 62a_100011217769_200025704644 [2,0,0,0,0,0|2,0,0]=4 2528 B9R1.89 [13CH3]SC1CCCCCC1 62a_200025704644_100011217769 [2,0,0,0,0,0|2,0,0]=4 2529 B11R0.2 C#CCCCCN(C)CC(C)O 2230a_100000227577_100010269958 [0,1,1,0,0,0|0,0,2]=4 2530 B11R0.2 C#CCCCCN(C)CC(C)O 269982a_100000227577_100010269958 [0,1,1,0,0,0|0,0,2]=4 2531 B11R0.2 C=C(C)CN(C)CCCCCC 2230a_100000225649_100000210314 [0,1,1,0,0,0|1,0,1]=4 2532 B11R0.2 C=C(C)CN(C)CCCCCC 2230a_106256046315_100000748629 [0,1,1,0,0,0|1,0,1]=4 2533 B11R0.2 C=C(C)CN(C)CCCCCC 269982a_100000225649_100000210757 [0,1,1,0,0,0|1,0,1]=4 2534 B11R0.2 C=C(C)CN(C)CCCCCC 269982a_106256046315_100000748629 [0,1,1,0,0,0|1,0,1]=4 2535 B11R0.2 C=CCCCCN(C)CC(C)O 2230a_100000227577_100011215482 [0,1,1,0,0,0|0,0,2]=4 2536 B11R0.2 C=CCCCCN(C)CC(C)O 2230a_100012000471_100011218427 [0,1,1,0,0,0|0,0,2]=4 2537 B11R0.2 C=CCCCCN(C)CC(C)O 269982a_100000227577_100011215482 [0,1,1,0,0,0|0,0,2]=4 2538 B11R0.2 C=CCCCCN(C)CC(C)O 269982a_100012000471_100011218427 [0,1,1,0,0,0|0,0,2]=4 2539 B11R0.2 C=CCCCCN(C)C[C@@H](C)O 2230a_100012000471_100009817552 [0,1,1,0,0,0|0,0,2]=4 2540 B11R0.2 C=CCCCCN(C)C[C@@H](C)O 269982a_100012000471_100009817552 [0,1,1,0,0,0|0,0,2]=4 2541 B11R0.2 CC(C)CN(C)CCCCCF 2230a_100000747067_100000729378 [0,1,1,0,0,0|2,0,0]=4 2542 B11R0.2 CC(C)CN(C)CCCCCF 269982a_100000747067_100000729378 [0,1,1,0,0,0|2,0,0]=4 2543 B11R0.2 CC(C)CN(C)CCCCCO 2230a_100000722520_100000210760 [0,1,1,0,0,0|2,0,0]=4 2544 B11R0.2 CC(C)CN(C)CCCCCO 2230a_100000747067_100000746330 [0,1,1,0,0,0|2,0,0]=4 2545 B11R0.2 CC(C)CN(C)CCCCCO 269982a_100000722520_100000210624 [0,1,1,0,0,0|2,0,0]=4 2546 B11R0.2 CC(C)CN(C)CCCCCO 269982a_100000747067_100000746330 [0,1,1,0,0,0|2,0,0]=4 2547 B11R0.2 CC(C)CN(C)CCCCCO 270004a_100000722520_100000210432 [0,1,1,0,0,0|2,0,0]=4 2548 B11R0.2 CC(O)CC(=O)CCCCCO 1458a_100102619762_100011218427 [0,1,1,0,0,0|2,0,0]=4 2549 B11R0.2 CC(O)CN(C)CCCCC#N 2230a_100000227577_100000211819 [0,1,1,0,0,0|1,0,1]=4 2550 B11R0.2 CC(O)CN(C)CCCCC#N 269982a_100000227577_100011219923 [0,1,1,0,0,0|1,0,1]=4 2551 B11R0.2 CC(O)CN(C)CCCCC=O 2230a_100000227577_100000139335 [0,1,1,0,0,0|1,0,1]=4 2552 B11R0.2 CC(O)CN(C)CCCCC=O 269982a_100000227577_100000139335 [0,1,1,0,0,0|1,0,1]=4 2553 B11R0.2 CC(O)CN(C)CCCCCF 2230a_100000227577_100000729378 [0,1,1,0,0,0|1,0,0]=3 2554 B11R0.2 CC(O)CN(C)CCCCCF 269982a_100000227577_100000729378 [0,1,1,0,0,0|1,0,0]=3 2555 B11R0.2 CC(O)CN(C)CCCCCO 2230a_100000227577_100000746330 [0,1,1,0,0,0|1,0,0]=3 2556 B11R0.2 CC(O)CN(C)CCCCCO 2230a_100000722520_100011218427 [0,1,1,0,0,0|1,0,0]=3 2557 B11R0.2 CC(O)CN(C)CCCCCO 269982a_100000227577_100000746330 [0,1,1,0,0,0|1,0,0]=3 2558 B11R0.2 CC(O)CN(C)CCCCCO 269982a_100000722520_100011218427 [0,1,1,0,0,0|1,0,0]=3 2559 B11R0.2 CC(O)CN(C)CCOCCO 2230a_100000227577_100011215305 [0,1,1,0,0,0|2,0,0]=4 2560 B11R0.2 CC(O)CN(C)CCOCCO 2230a_100000228057_100011218427 [0,1,1,0,0,0|2,0,0]=4 2561 B11R0.2 CC(O)CN(C)CCOCCO 269982a_100000227577_100011215305 [0,1,1,0,0,0|2,0,0]=4 2562 B11R0.2 CC(O)CN(C)CCOCCO 269982a_100000228057_100011218427 [0,1,1,0,0,0|2,0,0]=4 2563 B11R0.2 CC/C=C\CCN(C)CC(C)O 2230a_100000227577_100015370543 [0,1,1,0,0,0|0,0,2]=4 2564 B11R0.2 CC/C=C\CCN(C)CC(C)O 269982a_100000227577_100015370543 [0,1,1,0,0,0|0,0,2]=4 2565 B11R0.2 CCCCCCC(=O)CC(C)C 1458a_100000210554_100000210757 [0,1,1,0,0,0|2,0,0]=4 2566 B11R0.2 CCCCCCC(=O)CC(C)C 1458a_100102632555_100000210624 [0,1,1,0,0,0|2,0,0]=4 2567 B11R0.2 CCCCCCC(=O)CC(C)O 1458a_100102632555_100011218427 [0,1,1,0,0,0|1,0,0]=3 2568 B11R0.2 CCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210757 [0,1,1,0,0,0|1,0,0]=3 2569 B11R0.2 CCCCCCN(C)CC(=O)O 269956a_100000746989_100000210757 [0,1,1,0,0,0|1,0,1]=4 2570 B11R0.2 CCCCCCN(C)CC(C)C 2230a_100000747067_100000210314 [0,1,1,0,0,0|1,0,0]=3 2571 B11R0.2 CCCCCCN(C)CC(C)C 2230a_106256046315_100000210760 [0,1,1,0,0,0|1,0,0]=3 2572 B11R0.2 CCCCCCN(C)CC(C)C 269982a_100000747067_100000210757 [0,1,1,0,0,0|1,0,0]=3 2573 B11R0.2 CCCCCCN(C)CC(C)C 269982a_106256046315_100000210624 [0,1,1,0,0,0|1,0,0]=3 2574 B11R0.2 CCCCCCN(C)CC(C)C 270004a_106256046315_100000210432 [0,1,1,0,0,0|1,0,0]=3 2575 B11R0.2 CCCCCCN(C)CC(C)O 2230a_100000227577_100000210314 [0,1,1,0,0,0|0,0,0]=2 2576 B11R0.2 CCCCCCN(C)CC(C)O 2230a_106256046315_100011218427 [0,1,1,0,0,0|0,0,0]=2 2577 B11R0.2 CCCCCCN(C)CC(C)O 269982a_100000227577_100000210757 [0,1,1,0,0,0|0,0,0]=2 2578 B11R0.2 CCCCCCN(C)CC(C)O 269982a_106256046315_100011218427 [0,1,1,0,0,0|0,0,0]=2 2579 B11R0.2 CCCCCCN(C)CC(F)F 2230a_106256046315_100011934356 [0,1,1,0,0,0|2,0,0]=4 2580 B11R0.2 CCCCCCN(C)CC(F)F 269982a_106256046315_100011934356 [0,1,1,0,0,0|2,0,0]=4 2581 B11R0.2 CCCCCCN(C)C[C@@H](C)O 2230a_106256046315_100009817552 [0,1,1,0,0,0|0,0,0]=2 2582 B11R0.2 CCCCCCN(C)C[C@@H](C)O 269982a_106256046315_100009817552 [0,1,1,0,0,0|0,0,0]=2 2583 B11R0.2 CCCCCNC(=O)C[C@@H](C)O 240690a_100000209983_100011933948 [0,1,1,0,0,0|2,0,0]=4 2584 B11R0.2 CCCCOCC(=O)CC(C)O 1458a_100000757543_100011218427 [0,1,1,0,0,0|2,0,0]=4 2585 B11R0.2 CCCCOCC(=O)C[C@@H](C)O 1458a_100011933948_100011995733 [0,1,1,0,0,0|2,0,0]=4 2586 B11R0.2 CCCCOCN(C)CC(C)C 2230a_100000747067_100011995733 [0,1,1,0,0,0|2,0,0]=4 2587 B11R0.2 CCCCOCN(C)CC(C)C 269982a_100000747067_100011995733 [0,1,1,0,0,0|2,0,0]=4 2588 B11R0.2 CCCCOCN(C)CC(C)O 2230a_100000227577_100011995733 [0,1,1,0,0,0|1,0,0]=3 2589 B11R0.2 CCCCOCN(C)CC(C)O 269982a_100000227577_100011995733 [0,1,1,0,0,0|1,0,0]=3 2590 B11R0.2 CCCCSCC(=O)CC(C)O 1458a_100000191162_100011218427 [0,1,1,0,0,0|2,0,0]=4 2591 B11R0.2 CCCOCCC(=O)C[C@@H](C)O 1458a_100011933948_100011215938 [0,1,1,0,0,0|2,0,0]=4 2592 B11R0.2 CCCOCCN(C)CC(C)C 2230a_100000747067_100011215938 [0,1,1,0,0,0|2,0,0]=4 2593 B11R0.2 CCCOCCN(C)CC(C)C 269982a_100000747067_100011215938 [0,1,1,0,0,0|2,0,0]=4 2594 B11R0.2 CCCOCCN(C)CC(C)O 2230a_100000227577_100011215938 [0,1,1,0,0,0|1,0,0]=3 2595 B11R0.2 CCCOCCN(C)CC(C)O 269982a_100000227577_100011215938 [0,1,1,0,0,0|1,0,0]=3 2596 B11R0.2 CCOCCCC(=O)C[C@@H](C)O 1458a_100011933948_100012232248 [0,1,1,0,0,0|2,0,0]=4 2597 B11R0.2 CCOCCCN(C)CC(C)C 2230a_100000747067_100012232248 [0,1,1,0,0,0|2,0,0]=4 2598 B11R0.2 CCOCCCN(C)CC(C)C 269982a_100000747067_100012232248 [0,1,1,0,0,0|2,0,0]=4 2599 B11R0.2 CCOCCCN(C)CC(C)O 2230a_100000227577_100012232248 [0,1,1,0,0,0|1,0,0]=3 2600 B11R0.2 CCOCCCN(C)CC(C)O 269982a_100000227577_100012232248 [0,1,1,0,0,0|1,0,0]=3 2601 B11R0.2 COCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000755781 [0,1,1,0,0,0|2,0,0]=4 2602 B11R0.2 COCCCCN(C)CC(C)C 2230a_100000747067_100000730899 [0,1,1,0,0,0|2,0,0]=4 2603 B11R0.2 COCCCCN(C)CC(C)C 269982a_100000747067_100000730899 [0,1,1,0,0,0|2,0,0]=4 2604 B11R0.2 COCCCCN(C)CC(C)O 2230a_100000227577_100000730899 [0,1,1,0,0,0|1,0,0]=3 2605 B11R0.2 COCCCCN(C)CC(C)O 269982a_100000227577_100000730899 [0,1,1,0,0,0|1,0,0]=3 2606 B11R0.2 COCCOCN(C)CC(C)O 2230a_100000227577_100000231047 [0,1,1,0,0,0|2,0,0]=4 2607 B11R0.2 COCCOCN(C)CC(C)O 269982a_100000227577_100000231047 [0,1,1,0,0,0|2,0,0]=4 2608 B11R0.2 C[C@@H](O)CC(=O)CCCCCF 1458a_100011933948_100000729378 [0,1,1,0,0,0|2,0,0]=4 2609 B11R0.2 C[C@@H](O)CC(=O)CCCCCO 1458a_100011933948_100000746330 [0,1,1,0,0,0|2,0,0]=4 2610 B11R0.2 C[C@@H](O)CN(C)CCCCCO 2230a_100000722520_100009817552 [0,1,1,0,0,0|1,0,0]=3 2611 B11R0.2 C[C@@H](O)CN(C)CCCCCO 269982a_100000722520_100009817552 [0,1,1,0,0,0|1,0,0]=3 2612 B11R0.2 C[C@@H](O)CN(C)CCOCCO 2230a_100000228057_100009817552 [0,1,1,0,0,0|2,0,0]=4 2613 B11R0.2 C[C@@H](O)CN(C)CCOCCO 269982a_100000228057_100009817552 [0,1,1,0,0,0|2,0,0]=4 2614 B11R0.30 CC(=O)CCCCNCC(C)C 34a_100000210953_100009817362 [0,1,1,0,0,0|1,0,1]=4 2615 B11R0.30 CC(=O)CCCCNCC(C)O 34a_100000210904_100009817362 [0,1,1,0,0,0|0,0,1]=3 2616 B11R0.30 CC(=O)CCCCSCC(C)O 62a_100000735457_100011218427 [0,1,1,0,0,0|1,0,1]=4 2617 B11R0.30 CC(=O)CCCCSCC(C)O 62a_100011218427_100000735457 [0,1,1,0,0,0|1,0,1]=4 2618 B11R0.30 CC(=O)CCCCSC[C@@H](C)O 62a_100000735457_100009817552 [0,1,1,0,0,0|1,0,1]=4 2619 B11R0.30 CC(=O)CCCCSC[C@@H](C)O 62a_100009817552_100000735457 [0,1,1,0,0,0|1,0,1]=4 2620 B11R0.30 CC(=O)NCCCNCC(C)O 34a_100000736810_100011218427 [0,1,1,0,0,0|1,0,1]=4 2621 B11R0.30 CC(=O)NCCCNC[C@@H](C)O 34a_100000736810_100009817552 [0,1,1,0,0,0|1,0,1]=4 2622 B11R0.30 CC(=O)OCCCNCC(C)O 34a_100000210904_100000042594 [0,1,1,0,0,0|1,0,1]=4 2623 B11R0.30 CC(=O)SCCCNCC(C)O 2230a_100000210904_100000038929 [0,1,1,0,0,0|1,0,1]=4 2624 B11R0.30 CC(=O)SCCCNCC(C)O 34a_100000210904_100000038929 [0,1,1,0,0,0|1,0,1]=4 2625 B11R0.30 CC(=S)OCCCNCC(C)O 2230a_100000210904_200135323944 [0,1,1,0,0,0|1,0,1]=4 2626 B11R0.30 CC(=S)OCCCNCC(C)O 34a_100000210904_200135323944 [0,1,1,0,0,0|1,0,1]=4 2627 B11R0.30 CC(C)CCCCNCC(=O)O 269956a_100016091260_100011216152 [0,1,1,0,0,0|1,0,1]=4 2628 B11R0.30 CC(C)CCCCNCC(C)C 2230a_100000210953_100011216152 [0,1,1,0,0,0|1,0,0]=3 2629 B11R0.30 CC(C)CCCCNCC(C)C 34a_100000210953_100011216152 [0,1,1,0,0,0|1,0,0]=3 2630 B11R0.30 CC(C)CCCCNCC(C)O 2230a_100000210904_100011216152 [0,1,1,0,0,0|0,0,0]=2 2631 B11R0.30 CC(C)CCCCNCC(C)O 34a_100000210904_100011216152 [0,1,1,0,0,0|0,0,0]=2 2632 B11R0.30 CC(C)CCCCNCC(F)F 34a_100000765723_100011216152 [0,1,1,0,0,0|2,0,0]=4 2633 B11R0.30 CC(C)CCCCOCC(C)Br 34a_100012180447_100011216152 [0,1,1,0,0,0|2,0,0]=4 2634 B11R0.30 CC(C)CCCCOCC(C)C 34a_100000210257_100011216152 [0,1,1,0,0,0|2,0,0]=4 2635 B11R0.30 CC(C)CCCCOCC(C)C 34a_100011214890_100000210624 [0,1,1,0,0,0|2,0,0]=4 2636 B11R0.30 CC(C)CCCCOCC(C)C 7a_100011214890_100000210760 [0,1,1,0,0,0|2,0,0]=4 2637 B11R0.30 CC(C)CCCCOCC(C)F 34a_100015925927_100011216152 [0,1,1,0,0,0|2,0,0]=4 2638 B11R0.30 CC(C)CCCCOCC(C)O 34a_100011214890_100011218427 [0,1,1,0,0,0|1,0,0]=3 2639 B11R0.30 CC(C)CCCCOCC(C)O 7a_100011214890_100011218427 [0,1,1,0,0,0|1,0,0]=3 2640 B11R0.30 CC(C)CCCCOC[C@@H](C)Cl 34a_100016084084_100011216152 [0,1,1,0,0,0|2,0,0]=4 2641 B11R0.30 CC(C)CCCCOC[C@@H](C)N 34a_100000737577_100011216152 [0,1,1,0,0,0|2,0,0]=4 2642 B11R0.30 CC(C)CCCCOC[C@@H](C)O 34a_100011214890_100009817552 [0,1,1,0,0,0|1,0,0]=3 2643 B11R0.30 CC(C)CCCCOC[C@@H](C)O 7a_100011214890_100009817552 [0,1,1,0,0,0|1,0,0]=3 2644 B11R0.30 CC(C)CCCCSCC(C)C 62a_100000210624_100011216152 [0,1,1,0,0,0|2,0,0]=4 2645 B11R0.30 CC(C)CCCCSCC(C)C 62a_100011216152_100000210760 [0,1,1,0,0,0|2,0,0]=4 2646 B11R0.30 CC(C)CCCCSCC(C)O 62a_100011216152_100011218427 [0,1,1,0,0,0|1,0,0]=3 2647 B11R0.30 CC(C)CCCCSCC(C)O 62a_100011218427_100011216152 [0,1,1,0,0,0|1,0,0]=3 2648 B11R0.30 CC(C)CCCCSC[C@@H](C)O 62a_100009817552_100011216152 [0,1,1,0,0,0|1,0,0]=3 2649 B11R0.30 CC(C)CCCCSC[C@@H](C)O 62a_100011216152_100009817552 [0,1,1,0,0,0|1,0,0]=3 2650 B11R0.30 CC(C)CCCNCCC(C)O 2230a_200000737386_100012276601 [0,1,1,0,0,0|2,0,0]=4 2651 B11R0.30 CC(C)CCCNCCC(C)O 2230a_200000755665_100011214892 [0,1,1,0,0,0|2,0,0]=4 2652 B11R0.30 CC(C)CCCNCCC(C)O 34a_200000737386_100012276601 [0,1,1,0,0,0|2,0,0]=4 2653 B11R0.30 CC(C)CCCOCCC(C)O 34a_100000210774_100012276601 [0,1,1,0,0,0|2,0,0]=4 2654 B11R0.30 CC(C)CCCOCCC(C)O 7a_100000210774_100012276601 [0,1,1,0,0,0|2,0,0]=4 2655 B11R0.30 CC(C)CCCSCCC(C)O 62a_100011214892_100012276601 [0,1,1,0,0,0|2,0,0]=4 2656 B11R0.30 CC(C)CCCSCCC(C)O 62a_100012276601_100011214892 [0,1,1,0,0,0|2,0,0]=4 2657 B11R0.30 CC(C)CCOCCCC(C)O 34a_100000210254_200000718107 [0,1,1,0,0,0|2,0,0]=4 2658 B11R0.30 CC(C)CCOCCCC(C)O 7a_100000210254_200000718107 [0,1,1,0,0,0|2,0,0]=4 2659 B11R0.30 CC(C)CCSCCCC(C)O 62a_100000210312_200000718107 [0,1,1,0,0,0|2,0,0]=4 2660 B11R0.30 CC(C)CCSCCCC(C)O 62a_200000718107_100000210312 [0,1,1,0,0,0|2,0,0]=4 2661 B11R0.30 CC(C)CNCCCOC(C)C 2230a_100000737246_100000210760 [0,1,1,0,0,0|2,0,0]=4 2662 B11R0.30 CC(C)CNCCCOC(C)C 270004a_100000737246_100000210432 [0,1,1,0,0,0|2,0,0]=4 2663 B11R0.30 CC(C)CNCCCOC(C)C 34a_100000737246_100000210624 [0,1,1,0,0,0|2,0,0]=4 2664 B11R0.30 CC(C)CNCCOCC(C)C 34a_100015185251_100000210624 [0,1,1,0,0,0|2,0,0]=4 2665 B11R0.30 CC(C)CNCCOCC(C)O 34a_100015185251_100011218427 [0,1,1,0,0,0|2,0,0]=4 2666 B11R0.30 CC(C)CNCCOC[C@@H](C)O 34a_100015185251_100009817552 [0,1,1,0,0,0|2,0,0]=4 2667 B11R0.30 CC(C)COCCOCC(C)O 34a_100000703358_100011218427 [0,1,1,0,0,0|2,0,0]=4 2668 B11R0.30 CC(C)COCCOCC(C)O 7a_100000703358_100011218427 [0,1,1,0,0,0|2,0,0]=4 2669 B11R0.30 CC(C)COCCOC[C@@H](C)O 34a_100000703358_100009817552 [0,1,1,0,0,0|2,0,0]=4 2670 B11R0.30 CC(C)COCCOC[C@@H](C)O 7a_100000703358_100009817552 [0,1,1,0,0,0|2,0,0]=4 2671 B11R0.30 CC(C)CSCCOCC(C)O 34a_200000230437_100011218427 [0,1,1,0,0,0|2,0,0]=4 2672 B11R0.30 CC(C)CSCCOCC(C)O 7a_200000230437_100011218427 [0,1,1,0,0,0|2,0,0]=4 2673 B11R0.30 CC(C)CSCCOC[C@@H](C)O 34a_200000230437_100009817552 [0,1,1,0,0,0|2,0,0]=4 2674 B11R0.30 CC(C)CSCCOC[C@@H](C)O 7a_200000230437_100009817552 [0,1,1,0,0,0|2,0,0]=4 2675 B11R0.30 CC(C)NCCCOC[C@@H](C)O 34a_100000182298_100009817552 [0,1,1,0,0,0|2,0,0]=4 2676 B11R0.30 CC(C)OCCCNC[C@@H](C)O 2230a_100000737246_100009817552 [0,1,1,0,0,0|1,0,0]=3 2677 B11R0.30 CC(C)OCCCNC[C@@H](C)O 34a_100000737246_100009817552 [0,1,1,0,0,0|1,0,0]=3 2678 B11R0.30 CC(O)CCCNCCC(C)O 2230a_200000755665_200000718107 [0,1,1,0,0,0|2,0,0]=4 2679 B11R0.30 CC(O)CCCOCCC(C)Br 34a_100009893172_200000718107 [0,1,1,0,0,0|2,0,0]=4 2680 B11R0.30 CC(O)CCCOCC[C@@H](C)N 34a_100000706166_200000718107 [0,1,1,0,0,0|2,0,0]=4 2681 B11R0.30 CC(O)CCCSCCC(C)O 62a_100012276601_200000718107 [0,1,1,0,0,0|2,0,0]=4 2682 B11R0.30 CC(O)CCCSCCC(C)O 62a_200000718107_100012276601 [0,1,1,0,0,0|2,0,0]=4 2683 B11R0.30 CC(O)CNCCCCB(O)O 2230a_100000210904_200009817182 [0,1,1,0,0,0|2,0,0]=4 2684 B11R0.30 CC(O)CNCCCCB(O)O 34a_100000210904_200009817182 [0,1,1,0,0,0|2,0,0]=4 2685 B11R0.30 CC(O)CNCCCCC(=O)N 34a_100000696515_100011218427 [0,1,1,0,0,0|1,0,1]=4 2686 B11R0.30 CC(O)CNCCCOC(C)C 2230a_100000737246_100011218427 [0,1,1,0,0,0|1,0,0]=3 2687 B11R0.30 CC(O)CNCCCOC(C)C 34a_100000737246_100011218427 [0,1,1,0,0,0|1,0,0]=3 2688 B11R0.30 CC(O)CNCCOCC(F)F 2230a_100000210904_200012177212 [0,1,1,0,0,0|2,0,0]=4 2689 B11R0.30 CC(O)CNCCOCC(F)F 34a_100000210904_200012177212 [0,1,1,0,0,0|2,0,0]=4 2690 B11R0.30 CC(O)COCCCNC(C)C 34a_100000182298_100011218427 [0,1,1,0,0,0|2,0,0]=4 2691 B11R0.30 CC(O)CSCCCCN(C)C 62a_100011218427_100000690147 [0,1,1,0,0,0|2,0,0]=4 2692 B11R0.30 C[C@@H](O)CNCCCCC(=O)N 34a_100000696515_100009817552 [0,1,1,0,0,0|1,0,1]=4 2693 B11R0.30 C[C@@H](O)CSCCCCN(C)C 62a_100009817552_100000690147 [0,1,1,0,0,0|2,0,0]=4 2694 B11R0.40 C#CCCCCNCC(C)CO 34a_100000744482_100010269958 [0,1,1,0,0,0|0,0,2]=4 2695 B11R0.40 C#CCCCCNCC(O)CC 2230a_100000706060_100011218378 [0,1,1,0,0,0|0,0,2]=4 2696 B11R0.40 C#CCCCCNCC(O)CC 2230a_100011218483_100010269958 [0,1,1,0,0,0|0,0,2]=4 2697 B11R0.40 C#CCCCCNCC(O)CC 34a_100000706060_100011218378 [0,1,1,0,0,0|0,0,2]=4 2698 B11R0.40 C#CCCCCNCC(O)CO 2230a_100000706060_100011219619 [0,1,1,0,0,0|0,0,2]=4 2699 B11R0.40 C#CCCCCNCC(O)CO 34a_100000706060_100011219619 [0,1,1,0,0,0|0,0,2]=4 2700 B11R0.40 C#CCCCCNC[C@@H](C)CO 2230a_100000706060_100000059175 [0,1,1,0,0,0|0,0,2]=4 2701 B11R0.40 C#CCCCCNC[C@@H](C)CO 34a_100000706060_100000059175 [0,1,1,0,0,0|0,0,2]=4 2702 B11R0.40 C#CCCCCNC[C@@H](C)OC 2230a_100020591295_100010269958 [0,1,1,0,0,0|0,0,2]=4 2703 B11R0.40 C#CCCCCNC[C@@H](O)CF 2230a_100000706060_100015614560 [0,1,1,0,0,0|0,0,2]=4 2704 B11R0.40 C#CCCCCNC[C@@H](O)CF 34a_100000706060_100015614560 [0,1,1,0,0,0|0,0,2]=4 2705 B11R0.40 C#CCCCCNC[C@@H](O)CO 2230a_100000706060_100009815848 [0,1,1,0,0,0|0,0,2]=4 2706 B11R0.40 C#CCCCCNC[C@@H](O)CO 34a_100000706060_100009815848 [0,1,1,0,0,0|0,0,2]=4 2707 B11R0.40 C#CCCCCNC[C@H](O)CO 2230a_100020644852_100010269958 [0,1,1,0,0,0|0,0,2]=4 2708 B11R0.40 C=CC(C)COCCCCCC 34a_100011215527_100000210314 [0,1,1,0,0,0|2,0,0]=4 2709 B11R0.40 C=CC(C)COCCCCCC 7a_100011215527_100000210314 [0,1,1,0,0,0|2,0,0]=4 2710 B11R0.40 C=CC(O)CNCCCCCC 2230a_100000210581_100000730141 [0,1,1,0,0,0|0,0,1]=3 2711 B11R0.40 C=CC(O)CNCCCCCO 2230a_100000762737_100000730141 [0,1,1,0,0,0|1,0,1]=4 2712 B11R0.40 C=CC(O)CNCCCCCO 34a_100000762737_100000730141 [0,1,1,0,0,0|1,0,1]=4 2713 B11R0.40 C=CC(O)CNCCCOCC 2230a_100000210961_100000730141 [0,1,1,0,0,0|1,0,1]=4 2714 B11R0.40 C=CC(O)CNCCCOCC 34a_100000210961_100000730141 [0,1,1,0,0,0|1,0,1]=4 2715 B11R0.40 C=CC(O)CNCCOCCC 2230a_100161115042_100000730141 [0,1,1,0,0,0|1,0,1]=4 2716 B11R0.40 C=CC(O)CNCCOCCC 34a_100161115042_100000730141 [0,1,1,0,0,0|1,0,1]=4 2717 B11R0.40 C=CC(O)CNCCSCCC 2230a_100020603323_100000730141 [0,1,1,0,0,0|1,0,1]=4 2718 B11R0.40 C=CC(O)COCCCCCC 34a_100000210259_100000730141 [0,1,1,0,0,0|1,0,1]=4 2719 B11R0.40 C=CC(O)COCCCCCC 7a_100000210259_100000730141 [0,1,1,0,0,0|1,0,1]=4 2720 B11R0.40 C=CC(O)CSCCCCCC 62a_100000210314_100000730141 [0,1,1,0,0,0|1,0,1]=4 2721 B11R0.40 C=CC(O)CSCCCCCC 62a_100000730141_100000210757 [0,1,1,0,0,0|1,0,1]=4 2722 B11R0.40 C=CCCCCNCC(C)CO 34a_100000744482_100011215482 [0,1,1,0,0,0|0,0,2]=4 2723 B11R0.40 C=CCCCCNCC(O)CC 2230a_100000703577_100011218378 [0,1,1,0,0,0|0,0,2]=4 2724 B11R0.40 C=CCCCCNCC(O)CC 2230a_100011218483_100011215482 [0,1,1,0,0,0|0,0,2]=4 2725 B11R0.40 C=CCCCCNCC(O)CC 34a_100000703577_100011218378 [0,1,1,0,0,0|0,0,2]=4 2726 B11R0.40 C=CCCCCNCC(O)CO 2230a_100000703577_100011219619 [0,1,1,0,0,0|0,0,2]=4 2727 B11R0.40 C=CCCCCNCC(O)CO 34a_100000703577_100011219619 [0,1,1,0,0,0|0,0,2]=4 2728 B11R0.40 C=CCCCCNC[C@@H](C)CO 2230a_100000703577_100000059175 [0,1,1,0,0,0|0,0,2]=4 2729 B11R0.40 C=CCCCCNC[C@@H](C)CO 34a_100000703577_100000059175 [0,1,1,0,0,0|0,0,2]=4 2730 B11R0.40 C=CCCCCNC[C@@H](C)OC 2230a_100020591295_100011215482 [0,1,1,0,0,0|0,0,2]=4 2731 B11R0.40 C=CCCCCNC[C@@H](O)CF 2230a_100000703577_100015614560 [0,1,1,0,0,0|0,0,2]=4 2732 B11R0.40 C=CCCCCNC[C@@H](O)CF 34a_100000703577_100015614560 [0,1,1,0,0,0|0,0,2]=4 2733 B11R0.40 C=CCCCCNC[C@@H](O)CO 2230a_100000703577_100009815848 [0,1,1,0,0,0|0,0,2]=4 2734 B11R0.40 C=CCCCCNC[C@@H](O)CO 34a_100000703577_100009815848 [0,1,1,0,0,0|0,0,2]=4 2735 B11R0.40 C=CCCCCNC[C@H](O)CO 2230a_100020644852_100011215482 [0,1,1,0,0,0|0,0,2]=4 2736 B11R0.40 CC(CO)CNCCCCCF 34a_100000744482_100000729378 [0,1,1,0,0,0|1,0,0]=3 2737 B11R0.40 CC(CO)CNCCCCCO 34a_100000744482_100000746330 [0,1,1,0,0,0|1,0,0]=3 2738 B11R0.40 CC(CO)CNCCOCCO 34a_100000744482_100000692535 [0,1,1,0,0,0|2,0,0]=4 2739 B11R0.40 CC/C=C\CCNCC(C)CO 34a_100000744482_100015370543 [0,1,1,0,0,0|0,0,2]=4 2740 B11R0.40 CC/C=C\CCNCC(O)CC 2230a_100011218483_100015370543 [0,1,1,0,0,0|0,0,2]=4 2741 B11R0.40 CC/C=C\CCNC[C@@H](C)OC 2230a_100020591295_100015370543 [0,1,1,0,0,0|0,0,2]=4 2742 B11R0.40 CC/C=C\CCNC[C@H](O)CO 2230a_100020644852_100015370543 [0,1,1,0,0,0|0,0,2]=4 2743 B11R0.40 CCC(C)CNCCCCCF 2230a_100020588543_100000729378 [0,1,1,0,0,0|2,0,0]=4 2744 B11R0.40 CCC(C)CNCCCCCO 2230a_100000762737_100000748023 [0,1,1,0,0,0|2,0,0]=4 2745 B11R0.40 CCC(C)CNCCCCCO 2230a_100020588543_100000746330 [0,1,1,0,0,0|2,0,0]=4 2746 B11R0.40 CCC(C)CNCCCCCO 270004a_100000762737_100000243153 [0,1,1,0,0,0|2,0,0]=4 2747 B11R0.40 CCC(C)CNCCCCCO 34a_100000762737_100000748023 [0,1,1,0,0,0|2,0,0]=4 2748 B11R0.40 CCC(C)CNCCCCOC 2230a_100020588543_100000730899 [0,1,1,0,0,0|2,0,0]=4 2749 B11R0.40 CCC(O)CNCCCCC#N 2230a_100011218483_100000211819 [0,1,1,0,0,0|1,0,1]=4 2750 B11R0.40 CCC(O)CNCCCCC=O 2230a_100011218483_100000139335 [0,1,1,0,0,0|1,0,1]=4 2751 B11R0.40 CCC(O)CNCCCCCF 2230a_100011218483_100000729378 [0,1,1,0,0,0|1,0,0]=3 2752 B11R0.40 CCC(O)CNCCCCCO 2230a_100000762737_100011218378 [0,1,1,0,0,0|1,0,0]=3 2753 B11R0.40 CCC(O)CNCCCCCO 2230a_100011218483_100000746330 [0,1,1,0,0,0|1,0,0]=3 2754 B11R0.40 CCC(O)CNCCCCCO 34a_100000762737_100011218378 [0,1,1,0,0,0|1,0,0]=3 2755 B11R0.40 CCC(O)CNCCCCOC 2230a_100011218483_100000730899 [0,1,1,0,0,0|1,0,0]=3 2756 B11R0.40 CCC(O)CNCCOCCO 2230a_100000211614_100011218378 [0,1,1,0,0,0|2,0,0]=4 2757 B11R0.40 CCC(O)CNCCOCCO 2230a_100011218483_100011215305 [0,1,1,0,0,0|2,0,0]=4 2758 B11R0.40 CCC(O)CNCCOCCO 34a_100000211614_100011218378 [0,1,1,0,0,0|2,0,0]=4 2759 B11R0.40 CCC(O)CNCCSCCO 2230a_100011219999_100011218378 [0,1,1,0,0,0|2,0,0]=4 2760 B11R0.40 CCC(O)CNCOCCOC 2230a_100011218483_100000231047 [0,1,1,0,0,0|2,0,0]=4 2761 B11R0.40 CCC(O)COCCCCCBr 34a_100000746331_100011218378 [0,1,1,0,0,0|2,0,0]=4 2762 B11R0.40 CCC(O)COCCCCCBr 7a_100000746331_100011218378 [0,1,1,0,0,0|2,0,0]=4 2763 B11R0.40 CCC(O)COCCCCCCl 34a_100000746330_100011218378 [0,1,1,0,0,0|2,0,0]=4 2764 B11R0.40 CCC(O)COCCCCCCl 7a_100000746330_100011218378 [0,1,1,0,0,0|2,0,0]=4 2765 B11R0.40 CCC(O)COCCCCCI 34a_200012148887_100011218378 [0,1,1,0,0,0|2,0,0]=4 2766 B11R0.40 CCC(O)COCCCCCI 7a_200012148887_100011218378 [0,1,1,0,0,0|2,0,0]=4 2767 B11R0.40 CCC(O)COCCCCCN 34a_100000762737_100011218378 [0,1,1,0,0,0|2,0,0]=4 2768 B11R0.40 CCC(O)COCCCCOC 34a_100000740925_100011218378 [0,1,1,0,0,0|2,0,0]=4 2769 B11R0.40 CCC(O)COCCCCSC 34a_100011217163_100011218378 [0,1,1,0,0,0|2,0,0]=4 2770 B11R0.40 CCC(O)COCCCCSC 7a_100011217163_100011218378 [0,1,1,0,0,0|2,0,0]=4 2771 B11R0.40 CCC(O)CSCCCCCF 62a_100000729378_100011218378 [0,1,1,0,0,0|2,0,0]=4 2772 B11R0.40 CCC(O)CSCCCCCF 62a_100011218378_100000729378 [0,1,1,0,0,0|2,0,0]=4 2773 B11R0.40 CCC(O)CSCCCCCO 62a_100000746330_100011218378 [0,1,1,0,0,0|2,0,0]=4 2774 B11R0.40 CCC(O)CSCCCCCO 62a_100011218378_100000746330 [0,1,1,0,0,0|2,0,0]=4 2775 B11R0.40 CCC(O)CSCCCCOC 62a_100000730899_100011218378 [0,1,1,0,0,0|2,0,0]=4 2776 B11R0.40 CCC(O)CSCCCCOC 62a_100011218378_100000730899 [0,1,1,0,0,0|2,0,0]=4 2777 B11R0.40 CCCCC=NNCC(O)CC 4a_100015206393_100000210104 [0,1,1,0,0,0|1,0,1]=4 2778 B11R0.40 CCCCCCCCC(C)NC 270004a_106832991635_100011216694 [0,1,1,0,0,0|2,0,0]=4 2779 B11R0.40 CCCCCCCCC(C)OC 34a_100000210740_200000210301 [0,1,1,0,0,0|1,0,0]=3 2780 B11R0.40 CCCCCCCCC(C)OC 7a_100000210740_200000210301 [0,1,1,0,0,0|1,0,0]=3 2781 B11R0.40 CCCCCCCCC(C)O[13CH3] 34a_100000210740_200025704644 [0,1,1,0,0,0|1,0,0]=3 2782 B11R0.40 CCCCCCCCC(C)O[13CH3] 7a_100000210740_200025704644 [0,1,1,0,0,0|1,0,0]=3 2783 B11R0.40 CCCCCCCNC(C)CO 2230a_100000229938_100012180447 [0,1,1,0,0,0|2,0,0]=4 2784 B11R0.40 CCCCCCCN[C@H](C)CO 2230a_100000737577_100000210681 [0,1,1,0,0,0|2,0,0]=4 2785 B11R0.40 CCCCCCCOC(C)CO 34a_100000210272_100012180447 [0,1,1,0,0,0|2,0,0]=4 2786 B11R0.40 CCCCCCCOC(C)CO 7a_100000210272_100012180447 [0,1,1,0,0,0|2,0,0]=4 2787 B11R0.40 CCCCCCCSC(C)CO 62a_100012180447_100000210316 [0,1,1,0,0,0|2,0,0]=4 2788 B11R0.40 CCCCCCCSC(C)OC 62a_100000210614_100009879195 [0,1,1,0,0,0|2,0,0]=4 2789 B11R0.40 CCCCCCCSC(C)OC 62a_100009879195_100000210316 [0,1,1,0,0,0|2,0,0]=4 2790 B11R0.40 CCCCCCCS[C@H](C)CO 62a_100000210614_100016084084 [0,1,1,0,0,0|2,0,0]=4 2791 B11R0.40 CCCCCCCS[C@H](C)CO 62a_100016084084_100000210316 [0,1,1,0,0,0|2,0,0]=4 2792 B11R0.40 CCCCCCNCC(=O)NC 2230a_100000210581_100000183359 [0,1,1,0,0,0|0,0,2]=4 2793 B11R0.40 CCCCCCNCC(=O)NC 2230a_100000693194_100000210314 [0,1,1,0,0,0|0,0,2]=4 2794 B11R0.40 CCCCCCNCC(=O)OC 2230a_100000210581_100000747449 [0,1,1,0,0,0|0,0,2]=4 2795 B11R0.40 CCCCCCNCC(C)CC 2230a_100000210581_100000748023 [0,1,1,0,0,0|1,0,0]=3 2796 B11R0.40 CCCCCCNCC(C)CC 2230a_100020588543_100000210314 [0,1,1,0,0,0|1,0,0]=3 2797 B11R0.40 CCCCCCNCC(C)CC 270004a_100000210581_100000243153 [0,1,1,0,0,0|1,0,0]=3 2798 B11R0.40 CCCCCCNCC(C)CO 34a_100000744482_100000210314 [0,1,1,0,0,0|0,0,0]=2 2799 B11R0.40 CCCCCCNCC(O)CC 2230a_100000210581_100011218378 [0,1,1,0,0,0|0,0,0]=2 2800 B11R0.40 CCCCCCNCC(O)CC 2230a_100011218483_100000210314 [0,1,1,0,0,0|0,0,0]=2 2801 B11R0.40 CCCCCCNCC(O)CO 2230a_100000210581_100011219619 [0,1,1,0,0,0|0,0,0]=2 2802 B11R0.40 CCCCCCNC[C@@H](C)CC 2230a_100000210581_100009816398 [0,1,1,0,0,0|1,0,0]=3 2803 B11R0.40 CCCCCCNC[C@@H](C)CO 2230a_100000210581_100000059175 [0,1,1,0,0,0|0,0,0]=2 2804 B11R0.40 CCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210314 [0,1,1,0,0,0|0,0,0]=2 2805 B11R0.40 CCCCCCNC[C@@H](F)CO 34a_100015665980_100000210314 [0,1,1,0,0,0|1,0,0]=3 2806 B11R0.40 CCCCCCNC[C@@H](O)CF 2230a_100000210581_100015614560 [0,1,1,0,0,0|0,0,0]=2 2807 B11R0.40 CCCCCCNC[C@@H](O)CO 2230a_100000210581_100009815848 [0,1,1,0,0,0|0,0,0]=2 2808 B11R0.40 CCCCCCNC[C@H](O)CO 2230a_100020644852_100000210314 [0,1,1,0,0,0|0,0,0]=2 2809 B11R0.40 CCCCCCOCC(C)CC 34a_100000210259_100000748023 [0,1,1,0,0,0|2,0,0]=4 2810 B11R0.40 CCCCCCOCC(C)CC 7a_100000210259_100000748023 [0,1,1,0,0,0|2,0,0]=4 2811 B11R0.40 CCCCCCOCC(C)CN 34a_100000744482_100000210314 [0,1,1,0,0,0|2,0,0]=4 2812 B11R0.40 CCCCCCOCC(C)OC 34a_100000690652_100000210314 [0,1,1,0,0,0|1,0,0]=3 2813 B11R0.40 CCCCCCOCC(Cl)CCl 34a_100000033668_100000210314 [0,1,1,0,0,0|2,0,0]=4 2814 B11R0.40 CCCCCCOCC(O)CC 34a_100000210259_100011218378 [0,1,1,0,0,0|1,0,0]=3 2815 B11R0.40 CCCCCCOCC(O)CC 7a_100000210259_100011218378 [0,1,1,0,0,0|1,0,0]=3 2816 B11R0.40 CCCCCCOCC(O)CO 34a_100000210259_100011219619 [0,1,1,0,0,0|1,0,0]=3 2817 B11R0.40 CCCCCCOCC(O)CO 7a_100000210259_100011219619 [0,1,1,0,0,0|1,0,0]=3 2818 B11R0.40 CCCCCCOC[C@@H](C)CC 34a_100000210259_100009816398 [0,1,1,0,0,0|2,0,0]=4 2819 B11R0.40 CCCCCCOC[C@@H](C)CC 7a_100000210259_100009816398 [0,1,1,0,0,0|2,0,0]=4 2820 B11R0.40 CCCCCCOC[C@@H](C)CC 7a_100009816381_100000210314 [0,1,1,0,0,0|2,0,0]=4 2821 B11R0.40 CCCCCCOC[C@@H](C)CO 34a_100000210259_100000059175 [0,1,1,0,0,0|1,0,0]=3 2822 B11R0.40 CCCCCCOC[C@@H](C)CO 7a_100000210259_100000059175 [0,1,1,0,0,0|1,0,0]=3 2823 B11R0.40 CCCCCCOC[C@@H](O)CF 34a_100000210259_100015614560 [0,1,1,0,0,0|1,0,0]=3 2824 B11R0.40 CCCCCCOC[C@@H](O)CF 7a_100000210259_100015614560 [0,1,1,0,0,0|1,0,0]=3 2825 B11R0.40 CCCCCCOC[C@@H](O)CO 34a_100000210259_100009815848 [0,1,1,0,0,0|1,0,0]=3 2826 B11R0.40 CCCCCCOC[C@@H](O)CO 7a_100000210259_100009815848 [0,1,1,0,0,0|1,0,0]=3 2827 B11R0.40 CCCCCCOC[C@H](F)CN 34a_100015665980_100000210314 [0,1,1,0,0,0|2,0,0]=4 2828 B11R0.40 CCCCCCSCC(C)CC 62a_100000210314_100000748023 [0,1,1,0,0,0|2,0,0]=4 2829 B11R0.40 CCCCCCSCC(C)CC 62a_100000748023_100000210757 [0,1,1,0,0,0|2,0,0]=4 2830 B11R0.40 CCCCCCSCC(O)CC 62a_100000210314_100011218378 [0,1,1,0,0,0|1,0,0]=3 2831 B11R0.40 CCCCCCSCC(O)CC 62a_100011218378_100000210757 [0,1,1,0,0,0|1,0,0]=3 2832 B11R0.40 CCCCCCSCC(O)CO 62a_100000210314_100011219619 [0,1,1,0,0,0|1,0,0]=3 2833 B11R0.40 CCCCCCSCC(O)CO 62a_100011219619_100000210757 [0,1,1,0,0,0|1,0,0]=3 2834 B11R0.40 CCCCCCSC[C@@H](C)CC 62a_100000210314_100009816398 [0,1,1,0,0,0|2,0,0]=4 2835 B11R0.40 CCCCCCSC[C@@H](C)CC 62a_100009816398_100000210757 [0,1,1,0,0,0|2,0,0]=4 2836 B11R0.40 CCCCCCSC[C@@H](C)CO 62a_100000059175_100000210757 [0,1,1,0,0,0|1,0,0]=3 2837 B11R0.40 CCCCCCSC[C@@H](C)CO 62a_100000210314_100000059175 [0,1,1,0,0,0|1,0,0]=3 2838 B11R0.40 CCCCCCSC[C@@H](O)CF 62a_100000210314_100015614560 [0,1,1,0,0,0|1,0,0]=3 2839 B11R0.40 CCCCCCSC[C@@H](O)CF 62a_100015614560_100000210757 [0,1,1,0,0,0|1,0,0]=3 2840 B11R0.40 CCCCCCSC[C@@H](O)CO 62a_100000210314_100009815848 [0,1,1,0,0,0|1,0,0]=3 2841 B11R0.40 CCCCCCSC[C@@H](O)CO 62a_100009815848_100000210757 [0,1,1,0,0,0|1,0,0]=3 2842 B11R0.40 CCCCCNCCC(C)CO 2230a_106354213184_100000210326 [0,1,1,0,0,0|2,0,0]=4 2843 B11R0.40 CCCCCNCCC(C)CO 34a_106354213184_100000718602 [0,1,1,0,0,0|2,0,0]=4 2844 B11R0.40 CCCCCOCCC(C)OC 7a_100000764861_100000210326 [0,1,1,0,0,0|2,0,0]=4 2845 B11R0.40 CCCCOCNCC(C)CC 2230a_100020588543_100011995733 [0,1,1,0,0,0|2,0,0]=4 2846 B11R0.40 CCCCOCNCC(C)CO 34a_100000744482_100011995733 [0,1,1,0,0,0|1,0,0]=3 2847 B11R0.40 CCCCOCNCC(O)CC 2230a_100011218483_100011995733 [0,1,1,0,0,0|1,0,0]=3 2848 B11R0.40 CCCCOCNC[C@@H](C)OC 2230a_100020591295_100011995733 [0,1,1,0,0,0|1,0,0]=3 2849 B11R0.40 CCCCOCNC[C@@H](F)CO 34a_100015665980_100011995733 [0,1,1,0,0,0|2,0,0]=4 2850 B11R0.40 CCCCOCNC[C@H](O)CO 2230a_100020644852_100011995733 [0,1,1,0,0,0|1,0,0]=3 2851 B11R0.40 CCCCOCOCC(C)OC 34a_100000690652_100011995733 [0,1,1,0,0,0|2,0,0]=4 2852 B11R0.40 CCCCOCSCC(O)CC 62a_100011218378_100011995733 [0,1,1,0,0,0|2,0,0]=4 2853 B11R0.40 CCCCOCSCC(O)CC 62a_100011995733_100011218378 [0,1,1,0,0,0|2,0,0]=4 2854 B11R0.40 CCCCOCSCC(O)CO 62a_100011219619_100011995733 [0,1,1,0,0,0|2,0,0]=4 2855 B11R0.40 CCCCOCSCC(O)CO 62a_100011995733_100011219619 [0,1,1,0,0,0|2,0,0]=4 2856 B11R0.40 CCCCOCSC[C@@H](C)CO 62a_100000059175_100011995733 [0,1,1,0,0,0|2,0,0]=4 2857 B11R0.40 CCCCOCSC[C@@H](C)CO 62a_100011995733_100000059175 [0,1,1,0,0,0|2,0,0]=4 2858 B11R0.40 CCCCOCSC[C@@H](O)CF 62a_100011995733_100015614560 [0,1,1,0,0,0|2,0,0]=4 2859 B11R0.40 CCCCOCSC[C@@H](O)CF 62a_100015614560_100011995733 [0,1,1,0,0,0|2,0,0]=4 2860 B11R0.40 CCCCOCSC[C@@H](O)CO 62a_100009815848_100011995733 [0,1,1,0,0,0|2,0,0]=4 2861 B11R0.40 CCCCOCSC[C@@H](O)CO 62a_100011995733_100009815848 [0,1,1,0,0,0|2,0,0]=4 2862 B11R0.40 CCCOCCNCC(C)CC 2230a_100020588543_100011215938 [0,1,1,0,0,0|2,0,0]=4 2863 B11R0.40 CCCOCCNCC(C)CC 2230a_100161115042_100000748023 [0,1,1,0,0,0|2,0,0]=4 2864 B11R0.40 CCCOCCNCC(C)CC 270004a_100161115042_100000243153 [0,1,1,0,0,0|2,0,0]=4 2865 B11R0.40 CCCOCCNCC(C)CC 34a_100161115042_100000748023 [0,1,1,0,0,0|2,0,0]=4 2866 B11R0.40 CCCOCCNCC(C)CO 34a_100000744482_100011215938 [0,1,1,0,0,0|1,0,0]=3 2867 B11R0.40 CCCOCCNCC(O)CC 2230a_100011218483_100011215938 [0,1,1,0,0,0|1,0,0]=3 2868 B11R0.40 CCCOCCNCC(O)CC 2230a_100161115042_100011218378 [0,1,1,0,0,0|1,0,0]=3 2869 B11R0.40 CCCOCCNCC(O)CC 34a_100161115042_100011218378 [0,1,1,0,0,0|1,0,0]=3 2870 B11R0.40 CCCOCCNCC(O)CO 2230a_100161115042_100011219619 [0,1,1,0,0,0|1,0,0]=3 2871 B11R0.40 CCCOCCNCC(O)CO 34a_100161115042_100011219619 [0,1,1,0,0,0|1,0,0]=3 2872 B11R0.40 CCCOCCNC[C@@H](C)CC 2230a_100161115042_100009816398 [0,1,1,0,0,0|2,0,0]=4 2873 B11R0.40 CCCOCCNC[C@@H](C)CC 34a_100161115042_100009816398 [0,1,1,0,0,0|2,0,0]=4 2874 B11R0.40 CCCOCCNC[C@@H](C)CO 2230a_100161115042_100000059175 [0,1,1,0,0,0|1,0,0]=3 2875 B11R0.40 CCCOCCNC[C@@H](C)CO 34a_100161115042_100000059175 [0,1,1,0,0,0|1,0,0]=3 2876 B11R0.40 CCCOCCNC[C@@H](C)OC 2230a_100020591295_100011215938 [0,1,1,0,0,0|1,0,0]=3 2877 B11R0.40 CCCOCCNC[C@@H](F)CO 34a_100015665980_100011215938 [0,1,1,0,0,0|2,0,0]=4 2878 B11R0.40 CCCOCCNC[C@@H](O)CF 2230a_100161115042_100015614560 [0,1,1,0,0,0|1,0,0]=3 2879 B11R0.40 CCCOCCNC[C@@H](O)CF 34a_100161115042_100015614560 [0,1,1,0,0,0|1,0,0]=3 2880 B11R0.40 CCCOCCNC[C@@H](O)CO 2230a_100161115042_100009815848 [0,1,1,0,0,0|1,0,0]=3 2881 B11R0.40 CCCOCCNC[C@@H](O)CO 34a_100161115042_100009815848 [0,1,1,0,0,0|1,0,0]=3 2882 B11R0.40 CCCOCCNC[C@H](O)CO 2230a_100020644852_100011215938 [0,1,1,0,0,0|1,0,0]=3 2883 B11R0.40 CCCOCCOCC(C)OC 34a_100000690652_100011215938 [0,1,1,0,0,0|2,0,0]=4 2884 B11R0.40 CCCOCCOCC(O)CC 34a_100000752267_100011218378 [0,1,1,0,0,0|2,0,0]=4 2885 B11R0.40 CCCOCCOCC(O)CC 7a_100000752267_100011218378 [0,1,1,0,0,0|2,0,0]=4 2886 B11R0.40 CCCOCCOCC(O)CO 34a_100000752267_100011219619 [0,1,1,0,0,0|2,0,0]=4 2887 B11R0.40 CCCOCCOCC(O)CO 7a_100000752267_100011219619 [0,1,1,0,0,0|2,0,0]=4 2888 B11R0.40 CCCOCCOC[C@@H](C)CO 34a_100000752267_100000059175 [0,1,1,0,0,0|2,0,0]=4 2889 B11R0.40 CCCOCCOC[C@@H](C)CO 7a_100000752267_100000059175 [0,1,1,0,0,0|2,0,0]=4 2890 B11R0.40 CCCOCCOC[C@@H](O)CF 34a_100000752267_100015614560 [0,1,1,0,0,0|2,0,0]=4 2891 B11R0.40 CCCOCCOC[C@@H](O)CF 7a_100000752267_100015614560 [0,1,1,0,0,0|2,0,0]=4 2892 B11R0.40 CCCOCCOC[C@@H](O)CO 34a_100000752267_100009815848 [0,1,1,0,0,0|2,0,0]=4 2893 B11R0.40 CCCOCCOC[C@@H](O)CO 7a_100000752267_100009815848 [0,1,1,0,0,0|2,0,0]=4 2894 B11R0.40 CCCOCCSCC(O)CC 62a_100011215938_100011218378 [0,1,1,0,0,0|2,0,0]=4 2895 B11R0.40 CCCOCCSCC(O)CC 62a_100011218378_100011215938 [0,1,1,0,0,0|2,0,0]=4 2896 B11R0.40 CCCOCCSCC(O)CO 62a_100011215938_100011219619 [0,1,1,0,0,0|2,0,0]=4 2897 B11R0.40 CCCOCCSCC(O)CO 62a_100011219619_100011215938 [0,1,1,0,0,0|2,0,0]=4 2898 B11R0.40 CCCOCCSC[C@@H](C)CO 62a_100000059175_100011215938 [0,1,1,0,0,0|2,0,0]=4 2899 B11R0.40 CCCOCCSC[C@@H](C)CO 62a_100011215938_100000059175 [0,1,1,0,0,0|2,0,0]=4 2900 B11R0.40 CCCOCCSC[C@@H](O)CF 62a_100011215938_100015614560 [0,1,1,0,0,0|2,0,0]=4 2901 B11R0.40 CCCOCCSC[C@@H](O)CF 62a_100015614560_100011215938 [0,1,1,0,0,0|2,0,0]=4 2902 B11R0.40 CCCOCCSC[C@@H](O)CO 62a_100009815848_100011215938 [0,1,1,0,0,0|2,0,0]=4 2903 B11R0.40 CCCOCCSC[C@@H](O)CO 62a_100011215938_100009815848 [0,1,1,0,0,0|2,0,0]=4 2904 B11R0.40 CCCSCCNCC(C)CC 2230a_100020603323_100000748023 [0,1,1,0,0,0|2,0,0]=4 2905 B11R0.40 CCCSCCNCC(C)CC 270004a_100020603323_100000243153 [0,1,1,0,0,0|2,0,0]=4 2906 B11R0.40 CCCSCCNCC(O)CC 2230a_100020603323_100011218378 [0,1,1,0,0,0|1,0,0]=3 2907 B11R0.40 CCCSCCNCC(O)CO 2230a_100020603323_100011219619 [0,1,1,0,0,0|1,0,0]=3 2908 B11R0.40 CCCSCCNC[C@@H](C)CC 2230a_100020603323_100009816398 [0,1,1,0,0,0|2,0,0]=4 2909 B11R0.40 CCCSCCNC[C@@H](C)CO 2230a_100020603323_100000059175 [0,1,1,0,0,0|1,0,0]=3 2910 B11R0.40 CCCSCCNC[C@@H](O)CF 2230a_100020603323_100015614560 [0,1,1,0,0,0|1,0,0]=3 2911 B11R0.40 CCCSCCNC[C@@H](O)CO 2230a_100020603323_100009815848 [0,1,1,0,0,0|1,0,0]=3 2912 B11R0.40 CCCSCCOCC(O)CC 34a_200000230433_100011218378 [0,1,1,0,0,0|2,0,0]=4 2913 B11R0.40 CCCSCCOCC(O)CC 7a_200000230433_100011218378 [0,1,1,0,0,0|2,0,0]=4 2914 B11R0.40 CCCSCCOCC(O)CO 34a_200000230433_100011219619 [0,1,1,0,0,0|2,0,0]=4 2915 B11R0.40 CCCSCCOCC(O)CO 7a_200000230433_100011219619 [0,1,1,0,0,0|2,0,0]=4 2916 B11R0.40 CCCSCCOC[C@@H](C)CO 34a_200000230433_100000059175 [0,1,1,0,0,0|2,0,0]=4 2917 B11R0.40 CCCSCCOC[C@@H](C)CO 7a_200000230433_100000059175 [0,1,1,0,0,0|2,0,0]=4 2918 B11R0.40 CCCSCCOC[C@@H](O)CF 34a_200000230433_100015614560 [0,1,1,0,0,0|2,0,0]=4 2919 B11R0.40 CCCSCCOC[C@@H](O)CF 7a_200000230433_100015614560 [0,1,1,0,0,0|2,0,0]=4 2920 B11R0.40 CCCSCCOC[C@@H](O)CO 34a_200000230433_100009815848 [0,1,1,0,0,0|2,0,0]=4 2921 B11R0.40 CCCSCCOC[C@@H](O)CO 7a_200000230433_100009815848 [0,1,1,0,0,0|2,0,0]=4 2922 B11R0.40 CCOCCCNCC(C)CC 2230a_100000210961_100000748023 [0,1,1,0,0,0|2,0,0]=4 2923 B11R0.40 CCOCCCNCC(C)CC 2230a_100020588543_100012232248 [0,1,1,0,0,0|2,0,0]=4 2924 B11R0.40 CCOCCCNCC(C)CC 270004a_100000210961_100000243153 [0,1,1,0,0,0|2,0,0]=4 2925 B11R0.40 CCOCCCNCC(C)CC 34a_100000210961_100000748023 [0,1,1,0,0,0|2,0,0]=4 2926 B11R0.40 CCOCCCNCC(C)CO 34a_100000744482_100012232248 [0,1,1,0,0,0|1,0,0]=3 2927 B11R0.40 CCOCCCNCC(O)CC 2230a_100000210961_100011218378 [0,1,1,0,0,0|1,0,0]=3 2928 B11R0.40 CCOCCCNCC(O)CC 2230a_100011218483_100012232248 [0,1,1,0,0,0|1,0,0]=3 2929 B11R0.40 CCOCCCNCC(O)CC 34a_100000210961_100011218378 [0,1,1,0,0,0|1,0,0]=3 2930 B11R0.40 CCOCCCNCC(O)CO 2230a_100000210961_100011219619 [0,1,1,0,0,0|1,0,0]=3 2931 B11R0.40 CCOCCCNCC(O)CO 34a_100000210961_100011219619 [0,1,1,0,0,0|1,0,0]=3 2932 B11R0.40 CCOCCCNC[C@@H](C)CC 2230a_100000210961_100009816398 [0,1,1,0,0,0|2,0,0]=4 2933 B11R0.40 CCOCCCNC[C@@H](C)CC 34a_100000210961_100009816398 [0,1,1,0,0,0|2,0,0]=4 2934 B11R0.40 CCOCCCNC[C@@H](C)CO 2230a_100000210961_100000059175 [0,1,1,0,0,0|1,0,0]=3 2935 B11R0.40 CCOCCCNC[C@@H](C)CO 34a_100000210961_100000059175 [0,1,1,0,0,0|1,0,0]=3 2936 B11R0.40 CCOCCCNC[C@@H](C)OC 2230a_100020591295_100012232248 [0,1,1,0,0,0|1,0,0]=3 2937 B11R0.40 CCOCCCNC[C@@H](F)CO 34a_100015665980_100012232248 [0,1,1,0,0,0|2,0,0]=4 2938 B11R0.40 CCOCCCNC[C@@H](O)CF 2230a_100000210961_100015614560 [0,1,1,0,0,0|1,0,0]=3 2939 B11R0.40 CCOCCCNC[C@@H](O)CF 34a_100000210961_100015614560 [0,1,1,0,0,0|1,0,0]=3 2940 B11R0.40 CCOCCCNC[C@@H](O)CO 2230a_100000210961_100009815848 [0,1,1,0,0,0|1,0,0]=3 2941 B11R0.40 CCOCCCNC[C@@H](O)CO 34a_100000210961_100009815848 [0,1,1,0,0,0|1,0,0]=3 2942 B11R0.40 CCOCCCNC[C@H](O)CO 2230a_100020644852_100012232248 [0,1,1,0,0,0|1,0,0]=3 2943 B11R0.40 CCOCCCOCC(C)OC 34a_100000690652_100012232248 [0,1,1,0,0,0|2,0,0]=4 2944 B11R0.40 CCOCCCOCC(O)CC 34a_100000757476_100011218378 [0,1,1,0,0,0|2,0,0]=4 2945 B11R0.40 CCOCCCOCC(O)CC 7a_100000757476_100011218378 [0,1,1,0,0,0|2,0,0]=4 2946 B11R0.40 CCOCCCOCC(O)CO 34a_100000757476_100011219619 [0,1,1,0,0,0|2,0,0]=4 2947 B11R0.40 CCOCCCOCC(O)CO 7a_100000757476_100011219619 [0,1,1,0,0,0|2,0,0]=4 2948 B11R0.40 CCOCCCOC[C@@H](C)CO 34a_100000757476_100000059175 [0,1,1,0,0,0|2,0,0]=4 2949 B11R0.40 CCOCCCOC[C@@H](C)CO 7a_100000757476_100000059175 [0,1,1,0,0,0|2,0,0]=4 2950 B11R0.40 CCOCCCOC[C@@H](O)CF 34a_100000757476_100015614560 [0,1,1,0,0,0|2,0,0]=4 2951 B11R0.40 CCOCCCOC[C@@H](O)CF 7a_100000757476_100015614560 [0,1,1,0,0,0|2,0,0]=4 2952 B11R0.40 CCOCCCOC[C@@H](O)CO 34a_100000757476_100009815848 [0,1,1,0,0,0|2,0,0]=4 2953 B11R0.40 CCOCCCOC[C@@H](O)CO 7a_100000757476_100009815848 [0,1,1,0,0,0|2,0,0]=4 2954 B11R0.40 CCOCCCSCC(O)CC 62a_100011218378_100012232248 [0,1,1,0,0,0|2,0,0]=4 2955 B11R0.40 CCOCCCSCC(O)CC 62a_100012232248_100011218378 [0,1,1,0,0,0|2,0,0]=4 2956 B11R0.40 CCOCCCSCC(O)CO 62a_100011219619_100012232248 [0,1,1,0,0,0|2,0,0]=4 2957 B11R0.40 CCOCCCSCC(O)CO 62a_100012232248_100011219619 [0,1,1,0,0,0|2,0,0]=4 2958 B11R0.40 CCOCCCSC[C@@H](C)CO 62a_100000059175_100012232248 [0,1,1,0,0,0|2,0,0]=4 2959 B11R0.40 CCOCCCSC[C@@H](C)CO 62a_100012232248_100000059175 [0,1,1,0,0,0|2,0,0]=4 2960 B11R0.40 CCOCCCSC[C@@H](O)CF 62a_100012232248_100015614560 [0,1,1,0,0,0|2,0,0]=4 2961 B11R0.40 CCOCCCSC[C@@H](O)CF 62a_100015614560_100012232248 [0,1,1,0,0,0|2,0,0]=4 2962 B11R0.40 CCOCCCSC[C@@H](O)CO 62a_100009815848_100012232248 [0,1,1,0,0,0|2,0,0]=4 2963 B11R0.40 CCOCCCSC[C@@H](O)CO 62a_100012232248_100009815848 [0,1,1,0,0,0|2,0,0]=4 2964 B11R0.40 CCSCCCOCC(O)CC 34a_100011216438_100011218378 [0,1,1,0,0,0|2,0,0]=4 2965 B11R0.40 CCSCCCOCC(O)CC 7a_100011216438_100011218378 [0,1,1,0,0,0|2,0,0]=4 2966 B11R0.40 CCSCCCOCC(O)CO 34a_100011216438_100011219619 [0,1,1,0,0,0|2,0,0]=4 2967 B11R0.40 CCSCCCOCC(O)CO 7a_100011216438_100011219619 [0,1,1,0,0,0|2,0,0]=4 2968 B11R0.40 CCSCCCOC[C@@H](C)CO 34a_100011216438_100000059175 [0,1,1,0,0,0|2,0,0]=4 2969 B11R0.40 CCSCCCOC[C@@H](C)CO 7a_100011216438_100000059175 [0,1,1,0,0,0|2,0,0]=4 2970 B11R0.40 CCSCCCOC[C@@H](O)CF 34a_100011216438_100015614560 [0,1,1,0,0,0|2,0,0]=4 2971 B11R0.40 CCSCCCOC[C@@H](O)CF 7a_100011216438_100015614560 [0,1,1,0,0,0|2,0,0]=4 2972 B11R0.40 CCSCCCOC[C@@H](O)CO 34a_100011216438_100009815848 [0,1,1,0,0,0|2,0,0]=4 2973 B11R0.40 CCSCCCOC[C@@H](O)CO 7a_100011216438_100009815848 [0,1,1,0,0,0|2,0,0]=4 2974 B11R0.40 CC[C@H](C)CNCCCCCO 2230a_100000762737_100009816398 [0,1,1,0,0,0|2,0,0]=4 2975 B11R0.40 CC[C@H](C)CNCCCCCO 34a_100000762737_100009816398 [0,1,1,0,0,0|2,0,0]=4 2976 B11R0.40 COC(C)COCCCCCF 34a_100000690652_100000729378 [0,1,1,0,0,0|2,0,0]=4 2977 B11R0.40 COC(C)COCCCCCO 34a_100000690652_100000746330 [0,1,1,0,0,0|2,0,0]=4 2978 B11R0.40 COCCCCNCC(C)CO 34a_100000744482_100000755781 [0,1,1,0,0,0|1,0,0]=3 2979 B11R0.40 COCCCCNC[C@@H](C)OC 2230a_100020591295_100000730899 [0,1,1,0,0,0|1,0,0]=3 2980 B11R0.40 COCCCCNC[C@@H](F)CO 34a_100015665980_100000755781 [0,1,1,0,0,0|2,0,0]=4 2981 B11R0.40 COCCCCNC[C@H](O)CO 2230a_100020644852_100000730899 [0,1,1,0,0,0|1,0,0]=3 2982 B11R0.40 COCCCCOCC(C)OC 34a_100000690652_100000755781 [0,1,1,0,0,0|2,0,0]=4 2983 B11R0.40 COCCCCOCC(O)CO 34a_100000740925_100011219619 [0,1,1,0,0,0|2,0,0]=4 2984 B11R0.40 COCCCCOC[C@@H](C)CO 34a_100000740925_100000059175 [0,1,1,0,0,0|2,0,0]=4 2985 B11R0.40 COCCCCOC[C@@H](O)CF 34a_100000740925_100015614560 [0,1,1,0,0,0|2,0,0]=4 2986 B11R0.40 COCCCCOC[C@@H](O)CO 34a_100000740925_100009815848 [0,1,1,0,0,0|2,0,0]=4 2987 B11R0.40 COCCCCSCC(O)CO 62a_100000730899_100011219619 [0,1,1,0,0,0|2,0,0]=4 2988 B11R0.40 COCCCCSCC(O)CO 62a_100011219619_100000730899 [0,1,1,0,0,0|2,0,0]=4 2989 B11R0.40 COCCCCSC[C@@H](C)CO 62a_100000059175_100000730899 [0,1,1,0,0,0|2,0,0]=4 2990 B11R0.40 COCCCCSC[C@@H](C)CO 62a_100000730899_100000059175 [0,1,1,0,0,0|2,0,0]=4 2991 B11R0.40 COCCCCSC[C@@H](O)CF 62a_100000730899_100015614560 [0,1,1,0,0,0|2,0,0]=4 2992 B11R0.40 COCCCCSC[C@@H](O)CF 62a_100015614560_100000730899 [0,1,1,0,0,0|2,0,0]=4 2993 B11R0.40 COCCCCSC[C@@H](O)CO 62a_100000730899_100009815848 [0,1,1,0,0,0|2,0,0]=4 2994 B11R0.40 COCCCCSC[C@@H](O)CO 62a_100009815848_100000730899 [0,1,1,0,0,0|2,0,0]=4 2995 B11R0.40 COCCOCNC[C@@H](C)OC 2230a_100020591295_100000231047 [0,1,1,0,0,0|2,0,0]=4 2996 B11R0.40 COCCOCNC[C@H](O)CO 2230a_100020644852_100000231047 [0,1,1,0,0,0|2,0,0]=4 2997 B11R0.40 CO[C@H](C)CNCCCCC#N 2230a_100020591295_100000211819 [0,1,1,0,0,0|1,0,1]=4 2998 B11R0.40 CO[C@H](C)CNCCCCC=O 2230a_100020591295_100000139335 [0,1,1,0,0,0|1,0,1]=4 2999 B11R0.40 CO[C@H](C)CNCCCCCF 2230a_100020591295_100000729378 [0,1,1,0,0,0|1,0,0]=3 3000 B11R0.40 CO[C@H](C)CNCCCCCO 2230a_100020591295_100000746330 [0,1,1,0,0,0|1,0,0]=3 3001 B11R0.40 CO[C@H](C)CNCCOCCO 2230a_100020591295_100011215305 [0,1,1,0,0,0|2,0,0]=4 3002 B11R0.40 CSCCCCOCC(O)CO 34a_100011217163_100011219619 [0,1,1,0,0,0|2,0,0]=4 3003 B11R0.40 CSCCCCOCC(O)CO 7a_100011217163_100011219619 [0,1,1,0,0,0|2,0,0]=4 3004 B11R0.40 CSCCCCOC[C@@H](C)CO 34a_100011217163_100000059175 [0,1,1,0,0,0|2,0,0]=4 3005 B11R0.40 CSCCCCOC[C@@H](C)CO 7a_100011217163_100000059175 [0,1,1,0,0,0|2,0,0]=4 3006 B11R0.40 CSCCCCOC[C@@H](O)CF 34a_100011217163_100015614560 [0,1,1,0,0,0|2,0,0]=4 3007 B11R0.40 CSCCCCOC[C@@H](O)CF 7a_100011217163_100015614560 [0,1,1,0,0,0|2,0,0]=4 3008 B11R0.40 CSCCCCOC[C@@H](O)CO 34a_100011217163_100009815848 [0,1,1,0,0,0|2,0,0]=4 3009 B11R0.40 CSCCCCOC[C@@H](O)CO 7a_100011217163_100009815848 [0,1,1,0,0,0|2,0,0]=4 3010 B11R0.40 C[C@@H](CO)CNCCCCCO 2230a_100000762737_100000059175 [0,1,1,0,0,0|1,0,0]=3 3011 B11R0.40 C[C@@H](CO)CNCCCCCO 34a_100000762737_100000059175 [0,1,1,0,0,0|1,0,0]=3 3012 B11R0.40 C[C@@H](CO)CNCCOCCO 2230a_100000211614_100000059175 [0,1,1,0,0,0|2,0,0]=4 3013 B11R0.40 C[C@@H](CO)CNCCOCCO 34a_100000211614_100000059175 [0,1,1,0,0,0|2,0,0]=4 3014 B11R0.40 C[C@@H](CO)CNCCSCCO 2230a_100011219999_100000059175 [0,1,1,0,0,0|2,0,0]=4 3015 B11R0.40 C[C@@H](CO)COCCCCCBr 34a_100000746331_100000059175 [0,1,1,0,0,0|2,0,0]=4 3016 B11R0.40 C[C@@H](CO)COCCCCCBr 7a_100000746331_100000059175 [0,1,1,0,0,0|2,0,0]=4 3017 B11R0.40 C[C@@H](CO)COCCCCCCl 34a_100000746330_100000059175 [0,1,1,0,0,0|2,0,0]=4 3018 B11R0.40 C[C@@H](CO)COCCCCCCl 7a_100000746330_100000059175 [0,1,1,0,0,0|2,0,0]=4 3019 B11R0.40 C[C@@H](CO)COCCCCCI 34a_200012148887_100000059175 [0,1,1,0,0,0|2,0,0]=4 3020 B11R0.40 C[C@@H](CO)COCCCCCI 7a_200012148887_100000059175 [0,1,1,0,0,0|2,0,0]=4 3021 B11R0.40 C[C@@H](CO)COCCCCCN 34a_100000762737_100000059175 [0,1,1,0,0,0|2,0,0]=4 3022 B11R0.40 C[C@@H](CO)CSCCCCCF 62a_100000059175_100000729378 [0,1,1,0,0,0|2,0,0]=4 3023 B11R0.40 C[C@@H](CO)CSCCCCCF 62a_100000729378_100000059175 [0,1,1,0,0,0|2,0,0]=4 3024 B11R0.40 C[C@@H](CO)CSCCCCCO 62a_100000059175_100000746330 [0,1,1,0,0,0|2,0,0]=4 3025 B11R0.40 C[C@@H](CO)CSCCCCCO 62a_100000746330_100000059175 [0,1,1,0,0,0|2,0,0]=4 3026 B11R0.40 N#CCCCCNC[C@H](O)CO 2230a_100020644852_100000211819 [0,1,1,0,0,0|1,0,1]=4 3027 B11R0.40 NCCCCCOCC(O)CO 34a_100000762737_100011219619 [0,1,1,0,0,0|2,0,0]=4 3028 B11R0.40 NCCCCCOC[C@@H](O)CF 34a_100000762737_100015614560 [0,1,1,0,0,0|2,0,0]=4 3029 B11R0.40 NCCCCCOC[C@@H](O)CO 34a_100000762737_100009815848 [0,1,1,0,0,0|2,0,0]=4 3030 B11R0.40 O=CCCCCNC[C@H](O)CO 2230a_100020644852_100000139335 [0,1,1,0,0,0|1,0,1]=4 3031 B11R0.40 OCC(O)COCCCCCBr 34a_100000746331_100011219619 [0,1,1,0,0,0|2,0,0]=4 3032 B11R0.40 OCC(O)COCCCCCBr 7a_100000746331_100011219619 [0,1,1,0,0,0|2,0,0]=4 3033 B11R0.40 OCC(O)COCCCCCCl 34a_100000746330_100011219619 [0,1,1,0,0,0|2,0,0]=4 3034 B11R0.40 OCC(O)COCCCCCCl 7a_100000746330_100011219619 [0,1,1,0,0,0|2,0,0]=4 3035 B11R0.40 OCC(O)COCCCCCI 34a_200012148887_100011219619 [0,1,1,0,0,0|2,0,0]=4 3036 B11R0.40 OCC(O)COCCCCCI 7a_200012148887_100011219619 [0,1,1,0,0,0|2,0,0]=4 3037 B11R0.40 OCC(O)CSCCCCCF 62a_100000729378_100011219619 [0,1,1,0,0,0|2,0,0]=4 3038 B11R0.40 OCC(O)CSCCCCCF 62a_100011219619_100000729378 [0,1,1,0,0,0|2,0,0]=4 3039 B11R0.40 OCCCCCNCC(O)CO 2230a_100000762737_100011219619 [0,1,1,0,0,0|1,0,0]=3 3040 B11R0.40 OCCCCCNCC(O)CO 34a_100000762737_100011219619 [0,1,1,0,0,0|1,0,0]=3 3041 B11R0.40 OCCCCCNC[C@@H](F)CO 34a_100015665980_100000746330 [0,1,1,0,0,0|2,0,0]=4 3042 B11R0.40 OCCCCCNC[C@@H](O)CF 2230a_100000762737_100015614560 [0,1,1,0,0,0|1,0,0]=3 3043 B11R0.40 OCCCCCNC[C@@H](O)CF 34a_100000762737_100015614560 [0,1,1,0,0,0|1,0,0]=3 3044 B11R0.40 OCCCCCNC[C@@H](O)CO 2230a_100000762737_100009815848 [0,1,1,0,0,0|1,0,0]=3 3045 B11R0.40 OCCCCCNC[C@@H](O)CO 34a_100000762737_100009815848 [0,1,1,0,0,0|1,0,0]=3 3046 B11R0.40 OCCCCCNC[C@H](O)CO 2230a_100020644852_100000746330 [0,1,1,0,0,0|1,0,0]=3 3047 B11R0.40 OCCCCCSCC(O)CO 62a_100000746330_100011219619 [0,1,1,0,0,0|2,0,0]=4 3048 B11R0.40 OCCCCCSCC(O)CO 62a_100011219619_100000746330 [0,1,1,0,0,0|2,0,0]=4 3049 B11R0.40 OCCCCCSC[C@@H](O)CF 62a_100000746330_100015614560 [0,1,1,0,0,0|2,0,0]=4 3050 B11R0.40 OCCCCCSC[C@@H](O)CF 62a_100015614560_100000746330 [0,1,1,0,0,0|2,0,0]=4 3051 B11R0.40 OCCCCCSC[C@@H](O)CO 62a_100000746330_100009815848 [0,1,1,0,0,0|2,0,0]=4 3052 B11R0.40 OCCCCCSC[C@@H](O)CO 62a_100009815848_100000746330 [0,1,1,0,0,0|2,0,0]=4 3053 B11R0.40 OCCOCCNCC(O)CO 2230a_100000211614_100011219619 [0,1,1,0,0,0|2,0,0]=4 3054 B11R0.40 OCCOCCNCC(O)CO 34a_100000211614_100011219619 [0,1,1,0,0,0|2,0,0]=4 3055 B11R0.40 OCCOCCNC[C@@H](O)CF 2230a_100000211614_100015614560 [0,1,1,0,0,0|2,0,0]=4 3056 B11R0.40 OCCOCCNC[C@@H](O)CF 34a_100000211614_100015614560 [0,1,1,0,0,0|2,0,0]=4 3057 B11R0.40 OCCOCCNC[C@@H](O)CO 2230a_100000211614_100009815848 [0,1,1,0,0,0|2,0,0]=4 3058 B11R0.40 OCCOCCNC[C@@H](O)CO 34a_100000211614_100009815848 [0,1,1,0,0,0|2,0,0]=4 3059 B11R0.40 OCCOCCNC[C@H](O)CO 2230a_100020644852_100011215305 [0,1,1,0,0,0|2,0,0]=4 3060 B11R0.40 OCCSCCNCC(O)CO 2230a_100011219999_100011219619 [0,1,1,0,0,0|2,0,0]=4 3061 B11R0.40 OCCSCCNC[C@@H](O)CF 2230a_100011219999_100015614560 [0,1,1,0,0,0|2,0,0]=4 3062 B11R0.40 OCCSCCNC[C@@H](O)CO 2230a_100011219999_100009815848 [0,1,1,0,0,0|2,0,0]=4 3063 B11R0.40 OC[C@@H](O)CNCCCCCF 2230a_100020644852_100000729378 [0,1,1,0,0,0|1,0,0]=3 3064 B11R0.40 OC[C@H](F)CNCCCCCF 34a_100015665980_100000729378 [0,1,1,0,0,0|2,0,0]=4 3065 B11R0.40 OC[C@H](O)COCCCCCBr 34a_100000746331_100009815848 [0,1,1,0,0,0|2,0,0]=4 3066 B11R0.40 OC[C@H](O)COCCCCCBr 7a_100000746331_100009815848 [0,1,1,0,0,0|2,0,0]=4 3067 B11R0.40 OC[C@H](O)COCCCCCCl 34a_100000746330_100009815848 [0,1,1,0,0,0|2,0,0]=4 3068 B11R0.40 OC[C@H](O)COCCCCCCl 7a_100000746330_100009815848 [0,1,1,0,0,0|2,0,0]=4 3069 B11R0.40 OC[C@H](O)COCCCCCI 34a_200012148887_100009815848 [0,1,1,0,0,0|2,0,0]=4 3070 B11R0.40 OC[C@H](O)COCCCCCI 7a_200012148887_100009815848 [0,1,1,0,0,0|2,0,0]=4 3071 B11R0.40 OC[C@H](O)CSCCCCCF 62a_100000729378_100009815848 [0,1,1,0,0,0|2,0,0]=4 3072 B11R0.40 OC[C@H](O)CSCCCCCF 62a_100009815848_100000729378 [0,1,1,0,0,0|2,0,0]=4 3073 B11R0.40 O[C@@H](CF)COCCCCCBr 34a_100000746331_100015614560 [0,1,1,0,0,0|2,0,0]=4 3074 B11R0.40 O[C@@H](CF)COCCCCCBr 7a_100000746331_100015614560 [0,1,1,0,0,0|2,0,0]=4 3075 B11R0.40 O[C@@H](CF)COCCCCCCl 34a_100000746330_100015614560 [0,1,1,0,0,0|2,0,0]=4 3076 B11R0.40 O[C@@H](CF)COCCCCCCl 7a_100000746330_100015614560 [0,1,1,0,0,0|2,0,0]=4 3077 B11R0.40 O[C@@H](CF)COCCCCCI 34a_200012148887_100015614560 [0,1,1,0,0,0|2,0,0]=4 3078 B11R0.40 O[C@@H](CF)COCCCCCI 7a_200012148887_100015614560 [0,1,1,0,0,0|2,0,0]=4 3079 B11R0.40 O[C@@H](CF)CSCCCCCF 62a_100000729378_100015614560 [0,1,1,0,0,0|2,0,0]=4 3080 B11R0.40 O[C@@H](CF)CSCCCCCF 62a_100015614560_100000729378 [0,1,1,0,0,0|2,0,0]=4 3081 B11R0.42 C=C(C)C(C)NCCCCCC 269862a_100000210581_100011216138 [0,1,1,0,0,0|1,0,1]=4 3082 B11R0.42 CC(C)C(C)NCCCCCF 2230a_100000211541_100000729378 [0,1,1,0,0,0|2,0,0]=4 3083 B11R0.42 CC(C)C(C)NCCCCCO 2230a_100000211541_100000746330 [0,1,1,0,0,0|2,0,0]=4 3084 B11R0.42 CCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210614 [0,1,1,0,0,0|1,0,1]=4 3085 B11R0.42 CCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210614 [0,1,1,0,0,0|1,0,1]=4 3086 B11R0.42 CCCCCCNC(=O)C(C)C 11a_100000210581_100000210198 [0,1,1,0,0,0|1,0,1]=4 3087 B11R0.42 CCCCCCNC(=O)C(C)C 1626a_100000210581_100000210198 [0,1,1,0,0,0|1,0,1]=4 3088 B11R0.42 CCCCCCNC(=O)C(C)C 240690a_100000210581_100000210198 [0,1,1,0,0,0|1,0,1]=4 3089 B11R0.42 CCCCCCNC(=O)C(C)C 527a_100000210581_100000210198 [0,1,1,0,0,0|1,0,1]=4 3090 B11R0.42 CCCCCCNC(=O)C(C)F 11a_100000210581_100000062450 [0,1,1,0,0,0|1,0,1]=4 3091 B11R0.42 CCCCCCNC(=O)C(C)F 1626a_100000210581_100000062450 [0,1,1,0,0,0|1,0,1]=4 3092 B11R0.42 CCCCCCNC(=O)C(C)F 240690a_100000210581_100000062450 [0,1,1,0,0,0|1,0,1]=4 3093 B11R0.42 CCCCCCNC(=O)C(C)F 527a_100000210581_100000062450 [0,1,1,0,0,0|1,0,1]=4 3094 B11R0.42 CCCCCCNC(=O)C(O)O 240690a_100000210581_100000233687 [0,1,1,0,0,0|1,0,1]=4 3095 B11R0.42 CCCCCCNC(=O)[C@@H](C)O 240690a_100000210581_100000717761 [0,1,1,0,0,0|0,0,1]=3 3096 B11R0.42 CCCCCCNC(=O)[C@H](C)O 1626a_100000210581_217856618621 [0,1,1,0,0,0|0,0,1]=3 3097 B11R0.42 CCCCCCNC(=O)[C@H](C)O 240690a_100000210581_217856618621 [0,1,1,0,0,0|0,0,1]=3 3098 B11R0.42 CCCCCCNC(C)C(=O)C 2230a_100000210581_100009814033 [0,1,1,0,0,0|0,0,2]=4 3099 B11R0.42 CCCCCCNC(C)C(C)C 2230a_100000211541_100000210314 [0,1,1,0,0,0|1,0,0]=3 3100 B11R0.42 CCCCCCN[C@@H](C)C(=O)O 269956a_100000743915_100000210757 [0,1,1,0,0,0|1,0,1]=4 3101 B11R0.42 CCCCCCOC(C)C(C)C 7a_100000748068_100000210314 [0,1,1,0,0,0|2,0,0]=4 3102 B11R0.42 CCCCCNNC(=O)[C@@H](C)O 22a_100000694160_100000717761 [0,1,1,0,0,0|1,0,1]=4 3103 B11R0.42 CCCCCNNC(=O)[C@H](C)O 22a_100000694160_217856618621 [0,1,1,0,0,0|1,0,1]=4 3104 B11R0.42 CCCCOCNC(C)C(C)C 2230a_100000211541_100011995733 [0,1,1,0,0,0|2,0,0]=4 3105 B11R0.42 CCCOCCNC(=O)[C@@H](C)O 240690a_100161115042_100000717761 [0,1,1,0,0,0|1,0,1]=4 3106 B11R0.42 CCCOCCNC(=O)[C@H](C)O 1626a_100161115042_217856618621 [0,1,1,0,0,0|1,0,1]=4 3107 B11R0.42 CCCOCCNC(=O)[C@H](C)O 240690a_100161115042_217856618621 [0,1,1,0,0,0|1,0,1]=4 3108 B11R0.42 CCCOCCNC(C)C(C)C 2230a_100000211541_100011215938 [0,1,1,0,0,0|2,0,0]=4 3109 B11R0.42 CCCSCCNC(=O)[C@@H](C)O 240690a_100020603323_100000717761 [0,1,1,0,0,0|1,0,1]=4 3110 B11R0.42 CCCSCCNC(=O)[C@H](C)O 240690a_100020603323_217856618621 [0,1,1,0,0,0|1,0,1]=4 3111 B11R0.42 CCOCCCNC(=O)[C@@H](C)O 240690a_100000210961_100000717761 [0,1,1,0,0,0|1,0,1]=4 3112 B11R0.42 CCOCCCNC(=O)[C@H](C)O 1626a_100000210961_217856618621 [0,1,1,0,0,0|1,0,1]=4 3113 B11R0.42 CCOCCCNC(=O)[C@H](C)O 240690a_100000210961_217856618621 [0,1,1,0,0,0|1,0,1]=4 3114 B11R0.42 CCOCCCNC(C)C(C)C 2230a_100000211541_100012232248 [0,1,1,0,0,0|2,0,0]=4 3115 B11R0.42 COCCCCNC(C)C(C)C 2230a_100000211541_100000730899 [0,1,1,0,0,0|2,0,0]=4 3116 B11R0.42 C[C@@H](O)C(=O)NCCCCCO 240690a_100000762737_100000717761 [0,1,1,0,0,0|1,0,1]=4 3117 B11R0.42 C[C@H](O)C(=O)NCCCCCO 240690a_100000762737_217856618621 [0,1,1,0,0,0|1,0,1]=4 3118 B11R0.46 C=C(C)CNC(C)CCCCC 2230a_100000211957_100000748629 [0,1,1,0,0,0|1,0,1]=4 3119 B11R0.46 CC(O)CNC(C)CCCC#N 270004a_100000210904_200000032708 [0,1,1,0,0,0|1,0,1]=4 3120 B11R0.46 CCCCCC(=O)CCC(C)O 1458a_100000212188_100012276601 [0,1,1,0,0,0|1,0,1]=4 3121 B11R0.46 CCCCCC(=O)NCC(C)C 11a_100000210953_100000212188 [0,1,1,0,0,0|1,0,1]=4 3122 B11R0.46 CCCCCC(=O)NCC(C)C 1626a_100000210953_100000212188 [0,1,1,0,0,0|1,0,1]=4 3123 B11R0.46 CCCCCC(=O)NCC(C)C 240690a_100000210953_100000212188 [0,1,1,0,0,0|1,0,1]=4 3124 B11R0.46 CCCCCC(=O)NCC(C)C 527a_100000210953_100000212188 [0,1,1,0,0,0|1,0,1]=4 3125 B11R0.46 CCCCCC(=O)NCC(C)O 11a_100000210904_100000212188 [0,1,1,0,0,0|0,0,1]=3 3126 B11R0.46 CCCCCC(=O)NCC(C)O 240690a_100000210904_100000212188 [0,1,1,0,0,0|0,0,1]=3 3127 B11R0.46 CCCCCC(=O)NCC(C)O 527a_100000210904_100000212188 [0,1,1,0,0,0|0,0,1]=3 3128 B11R0.46 CCCCCC(C)NCC(=O)O 269956a_100016091260_200011218191 [0,1,1,0,0,0|1,0,1]=4 3129 B11R0.46 CCCCCC(C)NCC(C)C 2230a_100000210953_200011218191 [0,1,1,0,0,0|1,0,0]=3 3130 B11R0.46 CCCCCC(C)NCC(C)C 2230a_100000211957_100000210760 [0,1,1,0,0,0|1,0,0]=3 3131 B11R0.46 CCCCCC(C)NCC(C)C 270004a_100000210953_100000211708 [0,1,1,0,0,0|1,0,0]=3 3132 B11R0.46 CCCCCC(C)NCC(C)C 270004a_100000211957_100000210432 [0,1,1,0,0,0|1,0,0]=3 3133 B11R0.46 CCCCCC(C)NCC(C)C 34a_100000210953_200011218191 [0,1,1,0,0,0|1,0,0]=3 3134 B11R0.46 CCCCCC(C)NCC(C)O 2230a_100000210904_200011218191 [0,1,1,0,0,0|0,0,0]=2 3135 B11R0.46 CCCCCC(C)NCC(C)O 2230a_100000211957_100011218427 [0,1,1,0,0,0|0,0,0]=2 3136 B11R0.46 CCCCCC(C)NCC(C)O 270004a_100000210904_100000211708 [0,1,1,0,0,0|0,0,0]=2 3137 B11R0.46 CCCCCC(C)NCC(C)O 34a_100000210904_200011218191 [0,1,1,0,0,0|0,0,0]=2 3138 B11R0.46 CCCCCC(C)NCC(F)F 2230a_100000211957_100011934356 [0,1,1,0,0,0|2,0,0]=4 3139 B11R0.46 CCCCCC(C)NCC(F)F 270004a_100000765723_100000211708 [0,1,1,0,0,0|2,0,0]=4 3140 B11R0.46 CCCCCC(C)NCC(F)F 34a_100000765723_200011218191 [0,1,1,0,0,0|2,0,0]=4 3141 B11R0.46 CCCCCC(C)NC[C@@H](C)O 2230a_100000211957_100009817552 [0,1,1,0,0,0|0,0,0]=2 3142 B11R0.46 CCCCCC(C)OCC(C)Br 34a_100012180447_200011218191 [0,1,1,0,0,0|2,0,0]=4 3143 B11R0.46 CCCCCC(C)OCC(C)C 34a_100000210257_200011218191 [0,1,1,0,0,0|2,0,0]=4 3144 B11R0.46 CCCCCC(C)OCC(C)C 34a_100011215632_100000210624 [0,1,1,0,0,0|2,0,0]=4 3145 B11R0.46 CCCCCC(C)OCC(C)C 7a_100011215632_100000210760 [0,1,1,0,0,0|2,0,0]=4 3146 B11R0.46 CCCCCC(C)OCC(C)F 34a_100015925927_200011218191 [0,1,1,0,0,0|2,0,0]=4 3147 B11R0.46 CCCCCC(C)OCC(C)O 34a_100011215632_100011218427 [0,1,1,0,0,0|1,0,0]=3 3148 B11R0.46 CCCCCC(C)OCC(C)O 7a_100011215632_100011218427 [0,1,1,0,0,0|1,0,0]=3 3149 B11R0.46 CCCCCC(C)OC[C@@H](C)Cl 34a_100016084084_200011218191 [0,1,1,0,0,0|2,0,0]=4 3150 B11R0.46 CCCCCC(C)OC[C@@H](C)N 34a_100000737577_200011218191 [0,1,1,0,0,0|2,0,0]=4 3151 B11R0.46 CCCCCC(C)OC[C@@H](C)O 34a_100011215632_100009817552 [0,1,1,0,0,0|1,0,0]=3 3152 B11R0.46 CCCCCC(C)OC[C@@H](C)O 7a_100011215632_100009817552 [0,1,1,0,0,0|1,0,0]=3 3153 B11R0.46 CCCCCC(C)SCC(C)C 62a_100000210624_200011218191 [0,1,1,0,0,0|2,0,0]=4 3154 B11R0.46 CCCCCC(C)SCC(C)C 62a_200011218191_100000210760 [0,1,1,0,0,0|2,0,0]=4 3155 B11R0.46 CCCCCC(C)SCC(C)O 62a_100011218427_200011218191 [0,1,1,0,0,0|1,0,0]=3 3156 B11R0.46 CCCCCC(C)SCC(C)O 62a_200011218191_100011218427 [0,1,1,0,0,0|1,0,0]=3 3157 B11R0.46 CCCCCC(C)SC[C@@H](C)O 62a_100009817552_200011218191 [0,1,1,0,0,0|1,0,0]=3 3158 B11R0.46 CCCCCC(C)SC[C@@H](C)O 62a_200011218191_100009817552 [0,1,1,0,0,0|1,0,0]=3 3159 B11R0.46 CCCCCN(C)CCC(C)O 2230a_100000223495_100012276601 [0,1,1,0,0,0|2,0,0]=4 3160 B11R0.46 CCCCCN(C)CCC(C)O 269982a_100000223495_100012276601 [0,1,1,0,0,0|2,0,0]=4 3161 B11R0.46 CCCCNC(=O)NCC(C)O 2708a_100000102301_100000210904 [0,1,1,0,0,0|1,0,1]=4 3162 B11R0.46 CCCCNC(=O)NCC(C)O 273464a_100000102301_100000210904 [0,1,1,0,0,0|1,0,1]=4 3163 B11R0.46 CCCCNC(=O)NCC(C)O 273464a_100000210904_100000102301 [0,1,1,0,0,0|1,0,1]=4 3164 B11R0.46 CCCCNC(=O)NCC(C)O 512a_100000102301_100000210904 [0,1,1,0,0,0|1,0,1]=4 3165 B11R0.46 CCCCNC(=O)NCC(C)O 512a_100000210904_100000102301 [0,1,1,0,0,0|1,0,1]=4 3166 B11R0.46 CCCOCC(=O)NCC(C)O 11a_100000210904_100000745993 [0,1,1,0,0,0|1,0,1]=4 3167 B11R0.46 CCCOCC(=O)NCC(C)O 240690a_100000210904_100000745993 [0,1,1,0,0,0|1,0,1]=4 3168 B11R0.46 CCCOCC(=O)NCC(C)O 527a_100000210904_100000745993 [0,1,1,0,0,0|1,0,1]=4 3169 B11R0.46 CCCSCC(=O)NCC(C)O 11a_100000210904_100000217233 [0,1,1,0,0,0|1,0,1]=4 3170 B11R0.46 CCCSCC(=O)NCC(C)O 240690a_100000210904_100000217233 [0,1,1,0,0,0|1,0,1]=4 3171 B11R0.46 CCCSCC(=O)NCC(C)O 527a_100000210904_100000217233 [0,1,1,0,0,0|1,0,1]=4 3172 B11R0.46 CCCSCC(C)NCC(C)C 270004a_100000210953_100011343953 [0,1,1,0,0,0|2,0,0]=4 3173 B11R0.46 CCCSCC(C)NCC(C)O 270004a_100000210904_100011343953 [0,1,1,0,0,0|1,0,0]=3 3174 B11R0.46 CCOCCC(=O)NCC(C)O 11a_100000210904_100000749530 [0,1,1,0,0,0|1,0,1]=4 3175 B11R0.46 CCOCCC(=O)NCC(C)O 240690a_100000210904_100000749530 [0,1,1,0,0,0|1,0,1]=4 3176 B11R0.46 CCOCCC(=O)NCC(C)O 527a_100000210904_100000749530 [0,1,1,0,0,0|1,0,1]=4 3177 B11R0.46 CCOCCC(C)NCC(C)C 270004a_100000210953_200011216536 [0,1,1,0,0,0|2,0,0]=4 3178 B11R0.46 CCOCCC(C)NCC(C)O 270004a_100000210904_200011216536 [0,1,1,0,0,0|1,0,0]=3 3179 B11R0.46 CCSCCC(=O)NCC(C)O 11a_100000210904_100000230768 [0,1,1,0,0,0|1,0,1]=4 3180 B11R0.46 CCSCCC(=O)NCC(C)O 240690a_100000210904_100000230768 [0,1,1,0,0,0|1,0,1]=4 3181 B11R0.46 CCSCCC(=O)NCC(C)O 527a_100000210904_100000230768 [0,1,1,0,0,0|1,0,1]=4 3182 B11R0.46 COCCCC(=O)NCC(C)O 11a_100000210904_100000741012 [0,1,1,0,0,0|1,0,1]=4 3183 B11R0.46 COCCCC(=O)NCC(C)O 240690a_100000210904_100000741012 [0,1,1,0,0,0|1,0,1]=4 3184 B11R0.46 COCCCC(=O)NCC(C)O 527a_100000210904_100000741012 [0,1,1,0,0,0|1,0,1]=4 3185 B11R0.46 COCCCC(C)OCC(C)O 34a_200011539412_100011218427 [0,1,1,0,0,0|2,0,0]=4 3186 B11R0.46 COCCCC(C)OCC(C)O 7a_200011539412_100011218427 [0,1,1,0,0,0|2,0,0]=4 3187 B11R0.46 COCCCC(C)OC[C@@H](C)O 34a_200011539412_100009817552 [0,1,1,0,0,0|2,0,0]=4 3188 B11R0.46 COCCCC(C)OC[C@@H](C)O 7a_200011539412_100009817552 [0,1,1,0,0,0|2,0,0]=4 3189 B11R0.46 CSCCCC(=O)NCC(C)O 11a_100000210904_100000173376 [0,1,1,0,0,0|1,0,1]=4 3190 B11R0.46 CSCCCC(=O)NCC(C)O 240690a_100000210904_100000173376 [0,1,1,0,0,0|1,0,1]=4 3191 B11R0.46 CSCCCC(=O)NCC(C)O 527a_100000210904_100000173376 [0,1,1,0,0,0|1,0,1]=4 3192 B11R0.46 CSCCCC(C)NCC(C)C 270004a_100000210953_100011399439 [0,1,1,0,0,0|2,0,0]=4 3193 B11R0.46 CSCCCC(C)NCC(C)O 270004a_100000210904_100011399439 [0,1,1,0,0,0|1,0,0]=3 3194 B11R0.111 CC(O)COCCC[C@@H](C)CN 34a_100160569302_100011218427 [0,1,1,0,0,0|2,0,0]=4 3195 B11R0.111 CCC(=O)NCCNCC(C)O 34a_100132302217_100011218427 [0,1,1,0,0,0|1,0,1]=4 3196 B11R0.111 CCC(=O)NCCNC[C@@H](C)O 34a_100132302217_100009817552 [0,1,1,0,0,0|1,0,1]=4 3197 B11R0.111 CCC(C)CCCOCC(C)C 7a_100011216074_100000210760 [0,1,1,0,0,0|2,0,0]=4 3198 B11R0.111 CCC(C)CCCOCC(C)O 7a_100011216074_100011218427 [0,1,1,0,0,0|1,0,0]=3 3199 B11R0.111 CCC(C)CCCOC[C@@H](C)O 7a_100011216074_100009817552 [0,1,1,0,0,0|1,0,0]=3 3200 B11R0.111 CCC(C)CCNCCC(C)O 2230a_100020591266_100012276601 [0,1,1,0,0,0|2,0,0]=4 3201 B11R0.111 CCC(C)CCOCCC(C)O 7a_100011215188_100012276601 [0,1,1,0,0,0|2,0,0]=4 3202 B11R0.111 CCC(C)CNCCCC(C)O 2230a_100020588543_200000718107 [0,1,1,0,0,0|2,0,0]=4 3203 B11R0.111 CCC(C)CSCCCC(C)O 62a_100000748023_200000718107 [0,1,1,0,0,0|2,0,0]=4 3204 B11R0.111 CCC(C)CSCCCC(C)O 62a_200000718107_100000748023 [0,1,1,0,0,0|2,0,0]=4 3205 B11R0.111 CCC(C)OCCNCC(C)C 34a_100015185251_100011215416 [0,1,1,0,0,0|2,0,0]=4 3206 B11R0.111 CCC(O)CNCCCC(C)O 2230a_100011218483_200000718107 [0,1,1,0,0,0|2,0,0]=4 3207 B11R0.111 CCC(O)CSCCCC(C)O 62a_100011218378_200000718107 [0,1,1,0,0,0|2,0,0]=4 3208 B11R0.111 CCC(O)CSCCCC(C)O 62a_200000718107_100011218378 [0,1,1,0,0,0|2,0,0]=4 3209 B11R0.111 CCN(C)CCCNCC(C)C 2230a_100000210953_100015186262 [0,1,1,0,0,0|2,0,0]=4 3210 B11R0.111 CCN(C)CCCNCC(C)O 2230a_100000210904_100015186262 [0,1,1,0,0,0|1,0,0]=3 3211 B11R0.111 CCN(C)CCCSCC(C)O 62a_100011218427_100015186262 [0,1,1,0,0,0|2,0,0]=4 3212 B11R0.111 CCN(C)CCCSC[C@@H](C)O 62a_100009817552_100015186262 [0,1,1,0,0,0|2,0,0]=4 3213 B11R0.111 CC[C@H](C)COCCCC(C)O 7a_100009816381_200000718107 [0,1,1,0,0,0|2,0,0]=4 3214 B11R0.111 CC[C@H](C)CSCCCC(C)O 62a_100009816398_200000718107 [0,1,1,0,0,0|2,0,0]=4 3215 B11R0.111 CC[C@H](C)CSCCCC(C)O 62a_200000718107_100009816398 [0,1,1,0,0,0|2,0,0]=4 3216 B11R0.111 CNC(=O)CCCNCC(C)O 2230a_100000210904_100000741757 [0,1,1,0,0,0|1,0,1]=4 3217 B11R0.111 CNC(=O)CCCNCC(C)O 2230a_100000740002_100011218427 [0,1,1,0,0,0|1,0,1]=4 3218 B11R0.111 CNC(=O)CCCNCC(C)O 34a_100000210904_100000741757 [0,1,1,0,0,0|1,0,1]=4 3219 B11R0.111 CNC(=O)CCCNCC(C)O 34a_100000740002_100011218427 [0,1,1,0,0,0|1,0,1]=4 3220 B11R0.111 CNC(=O)CCCNC[C@@H](C)O 2230a_100000740002_100009817552 [0,1,1,0,0,0|1,0,1]=4 3221 B11R0.111 CNC(=O)CCCNC[C@@H](C)O 34a_100000740002_100009817552 [0,1,1,0,0,0|1,0,1]=4 3222 B11R0.111 COC(=O)CCCNCC(C)O 2230a_100000210904_100011218270 [0,1,1,0,0,0|1,0,1]=4 3223 B11R0.111 COC(=O)CCCNCC(C)O 34a_100000210904_100000742333 [0,1,1,0,0,0|1,0,1]=4 3224 B11R0.111 C[C@@H](CN)CCCOC[C@@H](C)O 34a_100160569302_100009817552 [0,1,1,0,0,0|2,0,0]=4 3225 B11R0.147 CC(C)CNC[C@H](C)CCCO 2230a_100160569302_100000210760 [0,1,1,0,0,0|2,0,0]=4 3226 B11R0.147 CC(C)CNC[C@H](C)CCCO 270004a_100160569302_100000210432 [0,1,1,0,0,0|2,0,0]=4 3227 B11R0.147 CC(C)CNC[C@H](C)CCCO 34a_100160569302_100000210624 [0,1,1,0,0,0|2,0,0]=4 3228 B11R0.147 CC(O)CNC[C@H](C)CCCO 2230a_100160569302_100011218427 [0,1,1,0,0,0|1,0,0]=3 3229 B11R0.147 CC(O)CNC[C@H](C)CCCO 34a_100160569302_100011218427 [0,1,1,0,0,0|1,0,0]=3 3230 B11R0.147 CCCCC(=NNCC(C)O)C 4a_200000730056_100000210087 [0,1,1,0,0,0|1,0,1]=4 3231 B11R0.147 CCCCC(=O)CCCC(C)O 1458a_100000210183_200000718107 [0,1,1,0,0,0|1,0,1]=4 3232 B11R0.147 CCCCC(=O)NNCC(C)O 22a_200000730056_100000210183 [0,1,1,0,0,0|1,0,1]=4 3233 B11R0.147 CCCCC(C)COCC(C)C 34a_100011995851_100000210624 [0,1,1,0,0,0|2,0,0]=4 3234 B11R0.147 CCCCC(C)COCC(C)C 7a_100011995851_100000210760 [0,1,1,0,0,0|2,0,0]=4 3235 B11R0.147 CCCCC(C)COCC(C)O 34a_100011995851_100011218427 [0,1,1,0,0,0|1,0,0]=3 3236 B11R0.147 CCCCC(C)COCC(C)O 7a_100011995851_100011218427 [0,1,1,0,0,0|1,0,0]=3 3237 B11R0.147 CCCCC(C)COC[C@@H](C)O 34a_100011995851_100009817552 [0,1,1,0,0,0|1,0,0]=3 3238 B11R0.147 CCCCC(C)COC[C@@H](C)O 7a_100011995851_100009817552 [0,1,1,0,0,0|1,0,0]=3 3239 B11R0.147 CCCCC(C)NCCC(C)O 2230a_100000126638_100012276601 [0,1,1,0,0,0|2,0,0]=4 3240 B11R0.147 CCCCC(C)NCCC(C)O 2230a_200000755665_200011215066 [0,1,1,0,0,0|2,0,0]=4 3241 B11R0.147 CCCCC(C)NCCC(C)O 270004a_200000755665_100000210087 [0,1,1,0,0,0|2,0,0]=4 3242 B11R0.147 CCCCC(C)OCCC(C)O 34a_100000687866_100012276601 [0,1,1,0,0,0|2,0,0]=4 3243 B11R0.147 CCCCC(C)OCCC(C)O 7a_100000687866_100012276601 [0,1,1,0,0,0|2,0,0]=4 3244 B11R0.147 CCCCC(C)SCCC(C)O 62a_100012276601_200011215066 [0,1,1,0,0,0|2,0,0]=4 3245 B11R0.147 CCCCC(C)SCCC(C)O 62a_200011215066_100012276601 [0,1,1,0,0,0|2,0,0]=4 3246 B11R0.147 CCCCN(C)CCCC(C)O 2230a_100000207549_200000718107 [0,1,1,0,0,0|2,0,0]=4 3247 B11R0.147 CCCCN(C)CCCC(C)O 269982a_100000207549_200000718107 [0,1,1,0,0,0|2,0,0]=4 3248 B11R0.147 CCCC[C@H](N)COCC(C)C 34a_100011934283_100000210624 [0,1,1,0,0,0|2,0,0]=4 3249 B11R0.147 CCCC[C@H](N)COCC(C)O 34a_100011934283_100011218427 [0,1,1,0,0,0|1,0,0]=3 3250 B11R0.147 CCCC[C@H](N)COC[C@@H](C)O 34a_100011934283_100009817552 [0,1,1,0,0,0|1,0,0]=3 3251 B11R0.147 CCCNC(=O)CNCC(C)O 2230a_100000174927_100011218427 [0,1,1,0,0,0|1,0,1]=4 3252 B11R0.147 CCCNC(=O)CNCC(C)O 2230a_100000210904_100000183358 [0,1,1,0,0,0|1,0,1]=4 3253 B11R0.147 CCCNC(=O)CNCC(C)O 34a_100000210904_100000183358 [0,1,1,0,0,0|1,0,1]=4 3254 B11R0.147 CCCNC(=O)CNC[C@@H](C)O 2230a_100000174927_100009817552 [0,1,1,0,0,0|1,0,1]=4 3255 B11R0.147 CCCOC(=O)CNCC(C)O 2230a_100000210904_200011215008 [0,1,1,0,0,0|1,0,1]=4 3256 B11R0.147 CCCOC(=O)CNCC(C)O 34a_100000210904_200011215008 [0,1,1,0,0,0|1,0,1]=4 3257 B11R0.147 CCCOC(C)CNCC(C)C 2230a_100015185124_100000210760 [0,1,1,0,0,0|2,0,0]=4 3258 B11R0.147 CCCOC(C)CNCC(C)C 270004a_100015185124_100000210432 [0,1,1,0,0,0|2,0,0]=4 3259 B11R0.147 CCCOC(C)CNCC(C)C 34a_100015185124_100000210624 [0,1,1,0,0,0|2,0,0]=4 3260 B11R0.147 CCCOC(C)CNCC(C)O 2230a_100015185124_100011218427 [0,1,1,0,0,0|1,0,0]=3 3261 B11R0.147 CCCOC(C)CNCC(C)O 34a_100015185124_100011218427 [0,1,1,0,0,0|1,0,0]=3 3262 B11R0.147 CCCOC(C)CNC[C@@H](C)O 2230a_100015185124_100009817552 [0,1,1,0,0,0|1,0,0]=3 3263 B11R0.147 CCCOC(C)CNC[C@@H](C)O 34a_100015185124_100009817552 [0,1,1,0,0,0|1,0,0]=3 3264 B11R0.147 CCOCC(O)CNCC(C)C 2230a_102515437182_100000210760 [0,1,1,0,0,0|2,0,0]=4 3265 B11R0.147 CCOCC(O)CNCC(C)C 270004a_102515437182_100000210432 [0,1,1,0,0,0|2,0,0]=4 3266 B11R0.147 CCOCC(O)CNCC(C)C 34a_102515437182_100000210624 [0,1,1,0,0,0|2,0,0]=4 3267 B11R0.147 CCOCC(O)CNCC(C)O 2230a_102515437182_100011218427 [0,1,1,0,0,0|1,0,0]=3 3268 B11R0.147 CCOCC(O)CNCC(C)O 34a_102515437182_100011218427 [0,1,1,0,0,0|1,0,0]=3 3269 B11R0.147 CCOCC(O)CNC[C@@H](C)O 2230a_102515437182_100009817552 [0,1,1,0,0,0|1,0,0]=3 3270 B11R0.147 CCOCC(O)CNC[C@@H](C)O 34a_102515437182_100009817552 [0,1,1,0,0,0|1,0,0]=3 3271 B11R0.147 CSCC[C@H](N)COCC(C)O 34a_100011827619_100011218427 [0,1,1,0,0,0|2,0,0]=4 3272 B11R0.147 CSCC[C@H](N)COC[C@@H](C)O 34a_100011827619_100009817552 [0,1,1,0,0,0|2,0,0]=4 3273 B11R0.147 C[C@H](CCCO)CNC[C@@H](C)O 2230a_100160569302_100009817552 [0,1,1,0,0,0|1,0,0]=3 3274 B11R0.147 C[C@H](CCCO)CNC[C@@H](C)O 34a_100160569302_100009817552 [0,1,1,0,0,0|1,0,0]=3 3275 B11R0.148 C#CCCCCCNCC(C)C 2230a_100000210953_100012094781 [0,1,1,0,0,0|1,0,1]=4 3276 B11R0.148 C#CCCCCCNCC(C)C 34a_100000210953_100012094781 [0,1,1,0,0,0|1,0,1]=4 3277 B11R0.148 C#CCCCCCNCC(C)O 2230a_100000210904_100012094781 [0,1,1,0,0,0|0,0,1]=3 3278 B11R0.148 C#CCCCCCNCC(C)O 34a_100000210904_100012094781 [0,1,1,0,0,0|0,0,1]=3 3279 B11R0.148 C#CCCCCCOCC(C)O 34a_100000766912_100011218427 [0,1,1,0,0,0|1,0,1]=4 3280 B11R0.148 C#CCCCCCOCC(C)O 7a_100000766912_100011218427 [0,1,1,0,0,0|1,0,1]=4 3281 B11R0.148 C#CCCCCCOC[C@@H](C)O 34a_100000766912_100009817552 [0,1,1,0,0,0|1,0,1]=4 3282 B11R0.148 C#CCCCCCOC[C@@H](C)O 7a_100000766912_100009817552 [0,1,1,0,0,0|1,0,1]=4 3283 B11R0.148 C#CCCCCCSCC(C)O 62a_100011218427_100012094781 [0,1,1,0,0,0|1,0,1]=4 3284 B11R0.148 C#CCCCCCSCC(C)O 62a_100012094781_100011218427 [0,1,1,0,0,0|1,0,1]=4 3285 B11R0.148 C#CCCCCCSC[C@@H](C)O 62a_100009817552_100012094781 [0,1,1,0,0,0|1,0,1]=4 3286 B11R0.148 C#CCCCCCSC[C@@H](C)O 62a_100012094781_100009817552 [0,1,1,0,0,0|1,0,1]=4 3287 B11R0.148 C#CCCCCNCCC(C)O 2230a_100000706060_100012276601 [0,1,1,0,0,0|0,0,2]=4 3288 B11R0.148 C#CCCCCNCCC(C)O 2230a_200000755665_100010269958 [0,1,1,0,0,0|0,0,2]=4 3289 B11R0.148 C#CCCCCNCCC(C)O 34a_100000706060_100012276601 [0,1,1,0,0,0|0,0,2]=4 3290 B11R0.148 C=C(C)CCNCCCCCC 2230a_100000210581_100000730704 [0,1,1,0,0,0|1,0,1]=4 3291 B11R0.148 C=C(C)CNCCCCCCC 2230a_100000229938_100000748629 [0,1,1,0,0,0|1,0,1]=4 3292 B11R0.148 C=C(C)CNCCCCCCO 2230a_100000686447_100000748629 [0,1,1,0,0,0|1,0,1]=4 3293 B11R0.148 C=C(C)CNCCCCCCO 34a_100000686447_100000748629 [0,1,1,0,0,0|1,0,1]=4 3294 B11R0.148 C=C(C)CNCCCCCOC 2230a_100000747528_100000748629 [0,1,1,0,0,0|1,0,1]=4 3295 B11R0.148 C=C(C)CNCCCCCOC 34a_100000747528_100000748629 [0,1,1,0,0,0|1,0,1]=4 3296 B11R0.148 C=C(C)CNCCCOCCC 2230a_100011217757_100000748629 [0,1,1,0,0,0|1,0,1]=4 3297 B11R0.148 C=C(C)CNCCCOCCC 34a_100011217757_100000748629 [0,1,1,0,0,0|1,0,1]=4 3298 B11R0.148 C=C(C)CNCCSCCCC 2230a_100025743550_100000748629 [0,1,1,0,0,0|1,0,1]=4 3299 B11R0.148 C=CCCCCCNCC(C)C 2230a_100000210953_100000700193 [0,1,1,0,0,0|1,0,1]=4 3300 B11R0.148 C=CCCCCCNCC(C)C 34a_100000210953_100000700193 [0,1,1,0,0,0|1,0,1]=4 3301 B11R0.148 C=CCCCCCNCC(C)O 2230a_100000210904_100000700193 [0,1,1,0,0,0|0,0,1]=3 3302 B11R0.148 C=CCCCCCNCC(C)O 34a_100000210904_100000700193 [0,1,1,0,0,0|0,0,1]=3 3303 B11R0.148 C=CCCCCCOCC(C)O 34a_100011216702_100011218427 [0,1,1,0,0,0|1,0,1]=4 3304 B11R0.148 C=CCCCCCOCC(C)O 7a_100011216702_100011218427 [0,1,1,0,0,0|1,0,1]=4 3305 B11R0.148 C=CCCCCCOC[C@@H](C)O 34a_100011216702_100009817552 [0,1,1,0,0,0|1,0,1]=4 3306 B11R0.148 C=CCCCCCOC[C@@H](C)O 7a_100011216702_100009817552 [0,1,1,0,0,0|1,0,1]=4 3307 B11R0.148 C=CCCCCCSCC(C)O 62a_100000700193_100011218427 [0,1,1,0,0,0|1,0,1]=4 3308 B11R0.148 C=CCCCCCSCC(C)O 62a_100011218427_100000700193 [0,1,1,0,0,0|1,0,1]=4 3309 B11R0.148 C=CCCCCCSC[C@@H](C)O 62a_100000700193_100009817552 [0,1,1,0,0,0|1,0,1]=4 3310 B11R0.148 C=CCCCCCSC[C@@H](C)O 62a_100009817552_100000700193 [0,1,1,0,0,0|1,0,1]=4 3311 B11R0.148 C=CCCCCNCCC(C)O 2230a_100000703577_100012276601 [0,1,1,0,0,0|0,0,2]=4 3312 B11R0.148 C=CCCCCNCCC(C)O 2230a_200000755665_100011215482 [0,1,1,0,0,0|0,0,2]=4 3313 B11R0.148 C=CCCCCNCCC(C)O 34a_100000703577_100012276601 [0,1,1,0,0,0|0,0,2]=4 3314 B11R0.148 CC(Br)COCCCCCCF 34a_100012180447_100015922095 [0,1,1,0,0,0|2,0,0]=4 3315 B11R0.148 CC(Br)COCCCCCCO 34a_100012180447_100000766143 [0,1,1,0,0,0|2,0,0]=4 3316 B11R0.148 CC(C)CCCCCCCO[13CH3] 34a_200000210741_200025704644 [0,1,1,0,0,0|2,0,0]=4 3317 B11R0.148 CC(C)CCCCCCCO[13CH3] 7a_200000210741_200025704644 [0,1,1,0,0,0|2,0,0]=4 3318 B11R0.148 CC(C)CCNCCCCCO 2230a_100000762737_100000210312 [0,1,1,0,0,0|2,0,0]=4 3319 B11R0.148 CC(C)CCNCCCCCO 269862a_100000762737_100000185833 [0,1,1,0,0,0|2,0,0]=4 3320 B11R0.148 CC(C)CCNCCCCCO 34a_100000762737_100000210312 [0,1,1,0,0,0|2,0,0]=4 3321 B11R0.148 CC(C)CNCCCCCC#N 2230a_100000210953_100009813376 [0,1,1,0,0,0|1,0,1]=4 3322 B11R0.148 CC(C)CNCCCCCC#N 270004a_100000061152_100000210432 [0,1,1,0,0,0|1,0,1]=4 3323 B11R0.148 CC(C)CNCCCCCC=O 2230a_100000210953_100000139337 [0,1,1,0,0,0|1,0,1]=4 3324 B11R0.148 CC(C)CNCCCCCCF 2230a_100000210953_100015922095 [0,1,1,0,0,0|1,0,0]=3 3325 B11R0.148 CC(C)CNCCCCCCF 34a_100000210953_100015922095 [0,1,1,0,0,0|1,0,0]=3 3326 B11R0.148 CC(C)CNCCCCCCO 2230a_100000210953_100000766143 [0,1,1,0,0,0|1,0,0]=3 3327 B11R0.148 CC(C)CNCCCCCCO 2230a_100000686447_100000210760 [0,1,1,0,0,0|1,0,0]=3 3328 B11R0.148 CC(C)CNCCCCCCO 270004a_100000686447_100000210432 [0,1,1,0,0,0|1,0,0]=3 3329 B11R0.148 CC(C)CNCCCCCCO 34a_100000210953_100000766143 [0,1,1,0,0,0|1,0,0]=3 3330 B11R0.148 CC(C)CNCCCCCCO 34a_100000686447_100000210624 [0,1,1,0,0,0|1,0,0]=3 3331 B11R0.148 CC(C)CNCCOCCCF 34a_100015185251_100011934791 [0,1,1,0,0,0|2,0,0]=4 3332 B11R0.148 CC(C)CNCCOCCCO 34a_100015185251_100000230001 [0,1,1,0,0,0|2,0,0]=4 3333 B11R0.148 CC(C)COCCCCCCBr 34a_100011215345_100000210624 [0,1,1,0,0,0|2,0,0]=4 3334 B11R0.148 CC(C)COCCCCCCBr 7a_100011215345_100000210760 [0,1,1,0,0,0|2,0,0]=4 3335 B11R0.148 CC(C)COCCCCCCCl 34a_100000766143_100000210624 [0,1,1,0,0,0|2,0,0]=4 3336 B11R0.148 CC(C)COCCCCCCCl 7a_100000766143_100000210760 [0,1,1,0,0,0|2,0,0]=4 3337 B11R0.148 CC(C)COCCCCCCF 34a_100000210257_100015922095 [0,1,1,0,0,0|2,0,0]=4 3338 B11R0.148 CC(C)COCCCCCCF 34a_100000732779_100000210624 [0,1,1,0,0,0|2,0,0]=4 3339 B11R0.148 CC(C)COCCCCCCF 7a_100000732779_100000210760 [0,1,1,0,0,0|2,0,0]=4 3340 B11R0.148 CC(C)COCCCCCCN 34a_100000686447_100000210624 [0,1,1,0,0,0|2,0,0]=4 3341 B11R0.148 CC(C)COCCCCCCO 34a_100000210257_100000766143 [0,1,1,0,0,0|2,0,0]=4 3342 B11R0.148 CC(C)CSCCCCCCF 62a_100000210624_100015922095 [0,1,1,0,0,0|2,0,0]=4 3343 B11R0.148 CC(C)CSCCCCCCF 62a_100015922095_100000210760 [0,1,1,0,0,0|2,0,0]=4 3344 B11R0.148 CC(C)CSCCCCCCO 62a_100000210624_100000766143 [0,1,1,0,0,0|2,0,0]=4 3345 B11R0.148 CC(C)CSCCCCCCO 62a_100000766143_100000210760 [0,1,1,0,0,0|2,0,0]=4 3346 B11R0.148 CC(C)OCNCCCCCO 2230a_100000762737_100000709892 [0,1,1,0,0,0|2,0,0]=4 3347 B11R0.148 CC(C)OCNCCCCCO 34a_100000762737_100000709892 [0,1,1,0,0,0|2,0,0]=4 3348 B11R0.148 CC(F)COCCCCCCF 34a_100015925927_100015922095 [0,1,1,0,0,0|2,0,0]=4 3349 B11R0.148 CC(F)COCCCCCCO 34a_100015925927_100000766143 [0,1,1,0,0,0|2,0,0]=4 3350 B11R0.148 CC(O)CCCNCCCCO 2230a_100000750430_200000718107 [0,1,1,0,0,0|2,0,0]=4 3351 B11R0.148 CC(O)CCCNCCCCO 34a_100000750430_200000718107 [0,1,1,0,0,0|2,0,0]=4 3352 B11R0.148 CC(O)CCCOCCCCBr 34a_100011216708_200000718107 [0,1,1,0,0,0|2,0,0]=4 3353 B11R0.148 CC(O)CCCOCCCCCl 34a_100000210776_200000718107 [0,1,1,0,0,0|2,0,0]=4 3354 B11R0.148 CC(O)CCCOCCCCCl 7a_100000210776_200000718107 [0,1,1,0,0,0|2,0,0]=4 3355 B11R0.148 CC(O)CCCOCCCCF 34a_100011995726_200000718107 [0,1,1,0,0,0|2,0,0]=4 3356 B11R0.148 CC(O)CCCOCCCCF 7a_100011995726_200000718107 [0,1,1,0,0,0|2,0,0]=4 3357 B11R0.148 CC(O)CCCOCCCCI 34a_200012148704_200000718107 [0,1,1,0,0,0|2,0,0]=4 3358 B11R0.148 CC(O)CCCOCCCCN 34a_100000750430_200000718107 [0,1,1,0,0,0|2,0,0]=4 3359 B11R0.148 CC(O)CCCSCCCCF 62a_100000729493_200000718107 [0,1,1,0,0,0|2,0,0]=4 3360 B11R0.148 CC(O)CCCSCCCCF 62a_200000718107_100000729493 [0,1,1,0,0,0|2,0,0]=4 3361 B11R0.148 CC(O)CCCSCCCCO 62a_100000210776_200000718107 [0,1,1,0,0,0|2,0,0]=4 3362 B11R0.148 CC(O)CCCSCCCCO 62a_200000718107_100000210776 [0,1,1,0,0,0|2,0,0]=4 3363 B11R0.148 CC(O)CCNCCCCC#N 2230a_200000755665_100000211819 [0,1,1,0,0,0|1,0,1]=4 3364 B11R0.148 CC(O)CCNCCCCC=O 2230a_200000755665_100000139335 [0,1,1,0,0,0|1,0,1]=4 3365 B11R0.148 CC(O)CCNCCCCCF 2230a_200000755665_100000729378 [0,1,1,0,0,0|1,0,0]=3 3366 B11R0.148 CC(O)CCNCCCCCO 2230a_100000762737_100012276601 [0,1,1,0,0,0|1,0,0]=3 3367 B11R0.148 CC(O)CCNCCCCCO 2230a_200000755665_100000746330 [0,1,1,0,0,0|1,0,0]=3 3368 B11R0.148 CC(O)CCNCCCCCO 34a_100000762737_100012276601 [0,1,1,0,0,0|1,0,0]=3 3369 B11R0.148 CC(O)CCNCCOCCO 2230a_100000211614_100012276601 [0,1,1,0,0,0|2,0,0]=4 3370 B11R0.148 CC(O)CCNCCOCCO 2230a_200000755665_100011215305 [0,1,1,0,0,0|2,0,0]=4 3371 B11R0.148 CC(O)CCNCCOCCO 34a_100000211614_100012276601 [0,1,1,0,0,0|2,0,0]=4 3372 B11R0.148 CC(O)CCNCCSCCO 2230a_100011219999_100012276601 [0,1,1,0,0,0|2,0,0]=4 3373 B11R0.148 CC(O)CCOCCCCCBr 34a_100000746331_100012276601 [0,1,1,0,0,0|2,0,0]=4 3374 B11R0.148 CC(O)CCOCCCCCBr 7a_100000746331_100012276601 [0,1,1,0,0,0|2,0,0]=4 3375 B11R0.148 CC(O)CCOCCCCCCl 34a_100000746330_100012276601 [0,1,1,0,0,0|2,0,0]=4 3376 B11R0.148 CC(O)CCOCCCCCCl 7a_100000746330_100012276601 [0,1,1,0,0,0|2,0,0]=4 3377 B11R0.148 CC(O)CCOCCCCCI 34a_200012148887_100012276601 [0,1,1,0,0,0|2,0,0]=4 3378 B11R0.148 CC(O)CCOCCCCCI 7a_200012148887_100012276601 [0,1,1,0,0,0|2,0,0]=4 3379 B11R0.148 CC(O)CCOCCCCCN 34a_100000762737_100012276601 [0,1,1,0,0,0|2,0,0]=4 3380 B11R0.148 CC(O)CCSCCCCCF 62a_100000729378_100012276601 [0,1,1,0,0,0|2,0,0]=4 3381 B11R0.148 CC(O)CCSCCCCCF 62a_100012276601_100000729378 [0,1,1,0,0,0|2,0,0]=4 3382 B11R0.148 CC(O)CCSCCCCCO 62a_100000746330_100012276601 [0,1,1,0,0,0|2,0,0]=4 3383 B11R0.148 CC(O)CCSCCCCCO 62a_100012276601_100000746330 [0,1,1,0,0,0|2,0,0]=4 3384 B11R0.148 CC(O)CNCCCCCC#N 2230a_100000210904_100009813376 [0,1,1,0,0,0|0,0,1]=3 3385 B11R0.148 CC(O)CNCCCCCC=O 2230a_100000210904_100000139337 [0,1,1,0,0,0|0,0,1]=3 3386 B11R0.148 CC(O)CNCCCCCCF 2230a_100000210904_100015922095 [0,1,1,0,0,0|0,0,0]=2 3387 B11R0.148 CC(O)CNCCCCCCF 34a_100000210904_100015922095 [0,1,1,0,0,0|0,0,0]=2 3388 B11R0.148 CC(O)CNCCCCCCO 2230a_100000210904_100000766143 [0,1,1,0,0,0|0,0,0]=2 3389 B11R0.148 CC(O)CNCCCCCCO 2230a_100000686447_100011218427 [0,1,1,0,0,0|0,0,0]=2 3390 B11R0.148 CC(O)CNCCCCCCO 34a_100000210904_100000766143 [0,1,1,0,0,0|0,0,0]=2 3391 B11R0.148 CC(O)CNCCCCCCO 34a_100000686447_100011218427 [0,1,1,0,0,0|0,0,0]=2 3392 B11R0.148 CC(O)CNCCCCN=[N+]=[N-] 2230a_100000101370_100011218427 [0,1,1,0,0,0|2,0,0]=4 3393 B11R0.148 CC(O)CNN=CCCCCO 4a_200000730056_100000031955 [0,1,1,0,0,0|1,0,1]=4 3394 B11R0.148 CC(O)COCCCCCCBr 34a_100011215345_100011218427 [0,1,1,0,0,0|1,0,0]=3 3395 B11R0.148 CC(O)COCCCCCCBr 7a_100011215345_100011218427 [0,1,1,0,0,0|1,0,0]=3 3396 B11R0.148 CC(O)COCCCCCCCl 34a_100000766143_100011218427 [0,1,1,0,0,0|1,0,0]=3 3397 B11R0.148 CC(O)COCCCCCCCl 7a_100000766143_100011218427 [0,1,1,0,0,0|1,0,0]=3 3398 B11R0.148 CC(O)COCCCCCCF 34a_100000732779_100011218427 [0,1,1,0,0,0|1,0,0]=3 3399 B11R0.148 CC(O)COCCCCCCF 7a_100000732779_100011218427 [0,1,1,0,0,0|1,0,0]=3 3400 B11R0.148 CC(O)COCCCCCCN 34a_100000686447_100011218427 [0,1,1,0,0,0|1,0,0]=3 3401 B11R0.148 CC(O)CSCCCCCC#N 62a_100009813376_100011218427 [0,1,1,0,0,0|1,0,1]=4 3402 B11R0.148 CC(O)CSCCCCCC#N 62a_100011218427_100009813376 [0,1,1,0,0,0|1,0,1]=4 3403 B11R0.148 CC(O)CSCCCCCC=O 62a_100000139337_100011218427 [0,1,1,0,0,0|1,0,1]=4 3404 B11R0.148 CC(O)CSCCCCCC=O 62a_100011218427_100000139337 [0,1,1,0,0,0|1,0,1]=4 3405 B11R0.148 CC(O)CSCCCCCCF 62a_100011218427_100015922095 [0,1,1,0,0,0|1,0,0]=3 3406 B11R0.148 CC(O)CSCCCCCCF 62a_100015922095_100011218427 [0,1,1,0,0,0|1,0,0]=3 3407 B11R0.148 CC(O)CSCCCCCCO 62a_100000766143_100011218427 [0,1,1,0,0,0|1,0,0]=3 3408 B11R0.148 CC(O)CSCCCCCCO 62a_100011218427_100000766143 [0,1,1,0,0,0|1,0,0]=3 3409 B11R0.148 CC/C=C/CCCOCC(C)O 34a_100016287902_100011218427 [0,1,1,0,0,0|1,0,1]=4 3410 B11R0.148 CC/C=C/CCCOCC(C)O 7a_100016287902_100011218427 [0,1,1,0,0,0|1,0,1]=4 3411 B11R0.148 CC/C=C/CCCOC[C@@H](C)O 34a_100016287902_100009817552 [0,1,1,0,0,0|1,0,1]=4 3412 B11R0.148 CC/C=C/CCCOC[C@@H](C)O 7a_100016287902_100009817552 [0,1,1,0,0,0|1,0,1]=4 3413 B11R0.148 CC/C=C\CCNCCC(C)O 2230a_200000755665_100015370543 [0,1,1,0,0,0|0,0,2]=4 3414 B11R0.148 CCCC#CCCOCC(C)O 34a_100000042726_100011218427 [0,1,1,0,0,0|1,0,1]=4 3415 B11R0.148 CCCC#CCCOCC(C)O 7a_100000042726_100011218427 [0,1,1,0,0,0|1,0,1]=4 3416 B11R0.148 CCCC#CCCOC[C@@H](C)O 34a_100000042726_100009817552 [0,1,1,0,0,0|1,0,1]=4 3417 B11R0.148 CCCC#CCCOC[C@@H](C)O 7a_100000042726_100009817552 [0,1,1,0,0,0|1,0,1]=4 3418 B11R0.148 CCCC/C=C/COCC(C)O 34a_200016272032_100011218427 [0,1,1,0,0,0|1,0,1]=4 3419 B11R0.148 CCCC/C=C/COCC(C)O 7a_200016272032_100011218427 [0,1,1,0,0,0|1,0,1]=4 3420 B11R0.148 CCCC/C=C/COC[C@@H](C)O 34a_200016272032_100009817552 [0,1,1,0,0,0|1,0,1]=4 3421 B11R0.148 CCCC/C=C/COC[C@@H](C)O 7a_200016272032_100009817552 [0,1,1,0,0,0|1,0,1]=4 3422 B11R0.148 CCCCC#CCOCC(C)O 34a_200000034558_100011218427 [0,1,1,0,0,0|1,0,1]=4 3423 B11R0.148 CCCCC#CCOCC(C)O 7a_200000034558_100011218427 [0,1,1,0,0,0|1,0,1]=4 3424 B11R0.148 CCCCC#CCOC[C@@H](C)O 34a_200000034558_100009817552 [0,1,1,0,0,0|1,0,1]=4 3425 B11R0.148 CCCCC#CCOC[C@@H](C)O 7a_200000034558_100009817552 [0,1,1,0,0,0|1,0,1]=4 3426 B11R0.148 CCCCCC=NNCC(C)O 4a_200000730056_100000737632 [0,1,1,0,0,0|0,0,1]=3 3427 B11R0.148 CCCCCCCCNC(C)C 2230a_100000229939_100000210206 [0,1,1,0,0,0|2,0,0]=4 3428 B11R0.148 CCCCCCCCNC(C)C 2230a_100138425928_100000210759 [0,1,1,0,0,0|2,0,0]=4 3429 B11R0.148 CCCCCCCCNC(C)C 34a_100000229939_100000210206 [0,1,1,0,0,0|2,0,0]=4 3430 B11R0.148 CCCCCCCCNC(C)C 34a_100138425928_100000210759 [0,1,1,0,0,0|2,0,0]=4 3431 B11R0.148 CCCCCCCCOC(C)C 34a_100000210232_100000210206 [0,1,1,0,0,0|2,0,0]=4 3432 B11R0.148 CCCCCCCCOC(C)C 34a_100000212225_100000210759 [0,1,1,0,0,0|2,0,0]=4 3433 B11R0.148 CCCCCCCCOC(C)C 7a_100000210232_100000210206 [0,1,1,0,0,0|2,0,0]=4 3434 B11R0.148 CCCCCCCCSC(C)C 62a_100000210206_100000210317 [0,1,1,0,0,0|2,0,0]=4 3435 B11R0.148 CCCCCCCCSC(C)C 62a_100000210759_100000210206 [0,1,1,0,0,0|2,0,0]=4 3436 B11R0.148 CCCCCCCNCC(=O)O 269956a_100016091260_100000210614 [0,1,1,0,0,0|1,0,1]=4 3437 B11R0.148 CCCCCCCNCC(C)C 2230a_100000210953_100000210681 [0,1,1,0,0,0|1,0,0]=3 3438 B11R0.148 CCCCCCCNCC(C)C 2230a_100000229938_100000210760 [0,1,1,0,0,0|1,0,0]=3 3439 B11R0.148 CCCCCCCNCC(C)C 270004a_100000229938_100000210432 [0,1,1,0,0,0|1,0,0]=3 3440 B11R0.148 CCCCCCCNCC(C)C 34a_100000210953_100000210614 [0,1,1,0,0,0|1,0,0]=3 3441 B11R0.148 CCCCCCCNCC(C)O 2230a_100000210904_100000210681 [0,1,1,0,0,0|0,0,0]=2 3442 B11R0.148 CCCCCCCNCC(C)O 2230a_100000229938_100011218427 [0,1,1,0,0,0|0,0,0]=2 3443 B11R0.148 CCCCCCCNCC(C)O 34a_100000210904_100000210614 [0,1,1,0,0,0|0,0,0]=2 3444 B11R0.148 CCCCCCCNCC(F)F 2230a_100000229938_100011934356 [0,1,1,0,0,0|2,0,0]=4 3445 B11R0.148 CCCCCCCNCC(F)F 34a_100000765723_100000210614 [0,1,1,0,0,0|2,0,0]=4 3446 B11R0.148 CCCCCCCNC[C@@H](C)O 2230a_100000229938_100009817552 [0,1,1,0,0,0|0,0,0]=2 3447 B11R0.148 CCCCCCCOCC(C)Br 34a_100012180447_100000210614 [0,1,1,0,0,0|2,0,0]=4 3448 B11R0.148 CCCCCCCOCC(C)C 34a_100000210257_100000210614 [0,1,1,0,0,0|2,0,0]=4 3449 B11R0.148 CCCCCCCOCC(C)C 34a_100000210272_100000210624 [0,1,1,0,0,0|2,0,0]=4 3450 B11R0.148 CCCCCCCOCC(C)C 7a_100000210272_100000210760 [0,1,1,0,0,0|2,0,0]=4 3451 B11R0.148 CCCCCCCOCC(C)F 34a_100015925927_100000210614 [0,1,1,0,0,0|2,0,0]=4 3452 B11R0.148 CCCCCCCOCC(C)O 34a_100000210272_100011218427 [0,1,1,0,0,0|1,0,0]=3 3453 B11R0.148 CCCCCCCOCC(C)O 7a_100000210272_100011218427 [0,1,1,0,0,0|1,0,0]=3 3454 B11R0.148 CCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210614 [0,1,1,0,0,0|2,0,0]=4 3455 B11R0.148 CCCCCCCOC[C@@H](C)N 34a_100000737577_100000210614 [0,1,1,0,0,0|2,0,0]=4 3456 B11R0.148 CCCCCCCOC[C@@H](C)O 34a_100000210272_100009817552 [0,1,1,0,0,0|1,0,0]=3 3457 B11R0.148 CCCCCCCOC[C@@H](C)O 7a_100000210272_100009817552 [0,1,1,0,0,0|1,0,0]=3 3458 B11R0.148 CCCCCCCSCC(C)C 62a_100000210614_100000210760 [0,1,1,0,0,0|2,0,0]=4 3459 B11R0.148 CCCCCCCSCC(C)C 62a_100000210624_100000210316 [0,1,1,0,0,0|2,0,0]=4 3460 B11R0.148 CCCCCCCSCC(C)O 62a_100000210614_100011218427 [0,1,1,0,0,0|1,0,0]=3 3461 B11R0.148 CCCCCCCSCC(C)O 62a_100011218427_100000210316 [0,1,1,0,0,0|1,0,0]=3 3462 B11R0.148 CCCCCCCSC[C@@H](C)O 62a_100000210614_100009817552 [0,1,1,0,0,0|1,0,0]=3 3463 B11R0.148 CCCCCCCSC[C@@H](C)O 62a_100009817552_100000210316 [0,1,1,0,0,0|1,0,0]=3 3464 B11R0.148 CCCCCCNCC=C(C)C 2230a_100000210581_100000761012 [0,1,1,0,0,0|1,0,1]=4 3465 B11R0.148 CCCCCCNCC=C(C)C 34a_100000718196_100000210314 [0,1,1,0,0,0|1,0,1]=4 3466 B11R0.148 CCCCCCNCCC(C)C 2230a_100000210581_100000210312 [0,1,1,0,0,0|1,0,0]=3 3467 B11R0.148 CCCCCCNCCC(C)C 269862a_100000210581_100000185833 [0,1,1,0,0,0|1,0,0]=3 3468 B11R0.148 CCCCCCNCCC(C)O 2230a_100000210581_100012276601 [0,1,1,0,0,0|0,0,0]=2 3469 B11R0.148 CCCCCCNCCC(C)O 2230a_200000755665_100000210314 [0,1,1,0,0,0|0,0,0]=2 3470 B11R0.148 CCCCCCNCOC(C)C 2230a_100000210581_100000709892 [0,1,1,0,0,0|1,0,0]=3 3471 B11R0.148 CCCCCCNOCC(=O)O 269956a_100000106656_100000210757 [0,1,1,0,0,0|1,0,1]=4 3472 B11R0.148 CCCCCCOCCC(C)Br 34a_100009893172_100000210314 [0,1,1,0,0,0|2,0,0]=4 3473 B11R0.148 CCCCCCOCCC(C)C 34a_100000210254_100000210314 [0,1,1,0,0,0|2,0,0]=4 3474 B11R0.148 CCCCCCOCCC(C)C 34a_100000210259_100000210312 [0,1,1,0,0,0|2,0,0]=4 3475 B11R0.148 CCCCCCOCCC(C)C 7a_100000210254_100000210314 [0,1,1,0,0,0|2,0,0]=4 3476 B11R0.148 CCCCCCOCCC(C)C 7a_100000210259_100000210626 [0,1,1,0,0,0|2,0,0]=4 3477 B11R0.148 CCCCCCOCCC(C)O 34a_100000210259_100012276601 [0,1,1,0,0,0|1,0,0]=3 3478 B11R0.148 CCCCCCOCCC(C)O 7a_100000210259_100012276601 [0,1,1,0,0,0|1,0,0]=3 3479 B11R0.148 CCCCCCOCC[C@@H](C)N 34a_100000706166_100000210314 [0,1,1,0,0,0|2,0,0]=4 3480 B11R0.148 CCCCCCOCOC(C)C 34a_100000210259_100000709892 [0,1,1,0,0,0|2,0,0]=4 3481 B11R0.148 CCCCCCSCCC(C)C 62a_100000210312_100000210757 [0,1,1,0,0,0|2,0,0]=4 3482 B11R0.148 CCCCCCSCCC(C)C 62a_100000210314_100000210312 [0,1,1,0,0,0|2,0,0]=4 3483 B11R0.148 CCCCCCSCCC(C)O 62a_100000210314_100012276601 [0,1,1,0,0,0|1,0,0]=3 3484 B11R0.148 CCCCCCSCCC(C)O 62a_100012276601_100000210757 [0,1,1,0,0,0|1,0,0]=3 3485 B11R0.148 CCCCCCSCOC(C)C 62a_100000210314_100000709892 [0,1,1,0,0,0|2,0,0]=4 3486 B11R0.148 CCCCCCSCOC(C)C 62a_100000709892_100000210757 [0,1,1,0,0,0|2,0,0]=4 3487 B11R0.148 CCCCCNCCCC(C)C 2230a_100000209983_100011214892 [0,1,1,0,0,0|2,0,0]=4 3488 B11R0.148 CCCCCNCCCC(C)C 2230a_200000737386_100000210326 [0,1,1,0,0,0|2,0,0]=4 3489 B11R0.148 CCCCCNCCCC(C)C 34a_200000737386_100000718602 [0,1,1,0,0,0|2,0,0]=4 3490 B11R0.148 CCCCCNCCCC(C)O 2230a_100000209983_200000718107 [0,1,1,0,0,0|1,0,0]=3 3491 B11R0.148 CCCCCOCCCC(C)C 34a_100000210253_100011214892 [0,1,1,0,0,0|2,0,0]=4 3492 B11R0.148 CCCCCOCCCC(C)C 34a_100000210774_100000718602 [0,1,1,0,0,0|2,0,0]=4 3493 B11R0.148 CCCCCOCCCC(C)C 7a_100000210253_100011214892 [0,1,1,0,0,0|2,0,0]=4 3494 B11R0.148 CCCCCOCCCC(C)C 7a_100000210774_100000210326 [0,1,1,0,0,0|2,0,0]=4 3495 B11R0.148 CCCCCOCCCC(C)O 34a_100000210253_200000718107 [0,1,1,0,0,0|1,0,0]=3 3496 B11R0.148 CCCCCOCCCC(C)O 7a_100000210253_200000718107 [0,1,1,0,0,0|1,0,0]=3 3497 B11R0.148 CCCCCSCCCC(C)C 62a_100000210326_100011214892 [0,1,1,0,0,0|2,0,0]=4 3498 B11R0.148 CCCCCSCCCC(C)C 62a_100011214892_100000210326 [0,1,1,0,0,0|2,0,0]=4 3499 B11R0.148 CCCCCSCCCC(C)O 62a_100000210326_200000718107 [0,1,1,0,0,0|1,0,0]=3 3500 B11R0.148 CCCCCSCCCC(C)O 62a_200000718107_100000210326 [0,1,1,0,0,0|1,0,0]=3 3501 B11R0.148 CCCCNCCCCC(C)C 2230a_100000102301_100011216152 [0,1,1,0,0,0|2,0,0]=4 3502 B11R0.148 CCCCNCCCCC(C)C 7a_106832991798_100011216152 [0,1,1,0,0,0|2,0,0]=4 3503 B11R0.148 CCCCOCCCCC(C)C 34a_100000210227_100011216152 [0,1,1,0,0,0|2,0,0]=4 3504 B11R0.148 CCCCOCCCCC(C)C 34a_100011214890_100000210210 [0,1,1,0,0,0|2,0,0]=4 3505 B11R0.148 CCCCOCCCCC(C)C 7a_100000210227_100011216152 [0,1,1,0,0,0|2,0,0]=4 3506 B11R0.148 CCCCOCCCCC(C)C 7a_100011214890_100000210211 [0,1,1,0,0,0|2,0,0]=4 3507 B11R0.148 CCCCOCCNCC(=O)O 269956a_100016091260_100000743108 [0,1,1,0,0,0|1,0,1]=4 3508 B11R0.148 CCCCOCCNCC(C)C 2230a_100000210953_100000743108 [0,1,1,0,0,0|1,0,0]=3 3509 B11R0.148 CCCCOCCNCC(C)C 34a_100000210953_100000743108 [0,1,1,0,0,0|1,0,0]=3 3510 B11R0.148 CCCCOCCNCC(C)C 34a_100015185251_100000210210 [0,1,1,0,0,0|1,0,0]=3 3511 B11R0.148 CCCCOCCNCC(C)O 2230a_100000210904_100000743108 [0,1,1,0,0,0|0,0,0]=2 3512 B11R0.148 CCCCOCCNCC(C)O 34a_100000210904_100000743108 [0,1,1,0,0,0|0,0,0]=2 3513 B11R0.148 CCCCOCCNCC(F)F 34a_100000765723_100000743108 [0,1,1,0,0,0|2,0,0]=4 3514 B11R0.148 CCCCOCCOCC(C)Br 34a_100012180447_100000743108 [0,1,1,0,0,0|2,0,0]=4 3515 B11R0.148 CCCCOCCOCC(C)C 34a_100000210238_100000210624 [0,1,1,0,0,0|2,0,0]=4 3516 B11R0.148 CCCCOCCOCC(C)C 34a_100000210257_100000743108 [0,1,1,0,0,0|2,0,0]=4 3517 B11R0.148 CCCCOCCOCC(C)C 34a_100000703358_100000210210 [0,1,1,0,0,0|2,0,0]=4 3518 B11R0.148 CCCCOCCOCC(C)C 7a_100000210238_100000210760 [0,1,1,0,0,0|2,0,0]=4 3519 B11R0.148 CCCCOCCOCC(C)C 7a_100000703358_100000210211 [0,1,1,0,0,0|2,0,0]=4 3520 B11R0.148 CCCCOCCOCC(C)F 34a_100015925927_100000743108 [0,1,1,0,0,0|2,0,0]=4 3521 B11R0.148 CCCCOCCOCC(C)O 34a_100000210238_100011218427 [0,1,1,0,0,0|1,0,0]=3 3522 B11R0.148 CCCCOCCOCC(C)O 7a_100000210238_100011218427 [0,1,1,0,0,0|1,0,0]=3 3523 B11R0.148 CCCCOCCOC[C@@H](C)Cl 34a_100016084084_100000743108 [0,1,1,0,0,0|2,0,0]=4 3524 B11R0.148 CCCCOCCOC[C@@H](C)N 34a_100000737577_100000743108 [0,1,1,0,0,0|2,0,0]=4 3525 B11R0.148 CCCCOCCOC[C@@H](C)O 34a_100000210238_100009817552 [0,1,1,0,0,0|1,0,0]=3 3526 B11R0.148 CCCCOCCOC[C@@H](C)O 7a_100000210238_100009817552 [0,1,1,0,0,0|1,0,0]=3 3527 B11R0.148 CCCCOCCSCC(C)C 34a_200000230437_100000210210 [0,1,1,0,0,0|2,0,0]=4 3528 B11R0.148 CCCCOCCSCC(C)C 62a_100000210624_100000743108 [0,1,1,0,0,0|2,0,0]=4 3529 B11R0.148 CCCCOCCSCC(C)C 62a_100000743108_100000210760 [0,1,1,0,0,0|2,0,0]=4 3530 B11R0.148 CCCCOCCSCC(C)C 7a_200000230437_100000210211 [0,1,1,0,0,0|2,0,0]=4 3531 B11R0.148 CCCCOCCSCC(C)O 62a_100000743108_100011218427 [0,1,1,0,0,0|1,0,0]=3 3532 B11R0.148 CCCCOCCSCC(C)O 62a_100011218427_100000743108 [0,1,1,0,0,0|1,0,0]=3 3533 B11R0.148 CCCCOCCSC[C@@H](C)O 62a_100000743108_100009817552 [0,1,1,0,0,0|1,0,0]=3 3534 B11R0.148 CCCCOCCSC[C@@H](C)O 62a_100009817552_100000743108 [0,1,1,0,0,0|1,0,0]=3 3535 B11R0.148 CCCCOCNCCC(C)O 2230a_200000755665_100011995733 [0,1,1,0,0,0|1,0,0]=3 3536 B11R0.148 CCCCOCSCCC(C)O 62a_100011995733_100012276601 [0,1,1,0,0,0|2,0,0]=4 3537 B11R0.148 CCCCOCSCCC(C)O 62a_100012276601_100011995733 [0,1,1,0,0,0|2,0,0]=4 3538 B11R0.148 CCCCSCCCCC(C)C 62a_100000210211_100011216152 [0,1,1,0,0,0|2,0,0]=4 3539 B11R0.148 CCCCSCCCCC(C)C 62a_100011216152_100000210210 [0,1,1,0,0,0|2,0,0]=4 3540 B11R0.148 CCCCSCCNCC(C)C 2230a_100025743550_100000210760 [0,1,1,0,0,0|1,0,0]=3 3541 B11R0.148 CCCCSCCNCC(C)C 270004a_100025743550_100000210432 [0,1,1,0,0,0|1,0,0]=3 3542 B11R0.148 CCCCSCCNCC(C)O 2230a_100025743550_100011218427 [0,1,1,0,0,0|0,0,0]=2 3543 B11R0.148 CCCCSCCNCC(F)F 2230a_100025743550_100011934356 [0,1,1,0,0,0|2,0,0]=4 3544 B11R0.148 CCCCSCCNC[C@@H](C)O 2230a_100025743550_100009817552 [0,1,1,0,0,0|0,0,0]=2 3545 B11R0.148 CCCCSCCOCC(C)C 34a_200000230436_100000210624 [0,1,1,0,0,0|2,0,0]=4 3546 B11R0.148 CCCCSCCOCC(C)C 7a_200000230436_100000210760 [0,1,1,0,0,0|2,0,0]=4 3547 B11R0.148 CCCCSCCOCC(C)O 34a_200000230436_100011218427 [0,1,1,0,0,0|1,0,0]=3 3548 B11R0.148 CCCCSCCOCC(C)O 7a_200000230436_100011218427 [0,1,1,0,0,0|1,0,0]=3 3549 B11R0.148 CCCCSCCOC[C@@H](C)O 34a_200000230436_100009817552 [0,1,1,0,0,0|1,0,0]=3 3550 B11R0.148 CCCCSCCOC[C@@H](C)O 7a_200000230436_100009817552 [0,1,1,0,0,0|1,0,0]=3 3551 B11R0.148 CCCNCCCCCC(C)C 2230a_100011290863_100000210303 [0,1,1,0,0,0|2,0,0]=4 3552 B11R0.148 CCCNCCCCCC(C)C 34a_100011290863_100000210303 [0,1,1,0,0,0|2,0,0]=4 3553 B11R0.148 CCCNCCCOCC(C)C 2230a_100000205972_100000210303 [0,1,1,0,0,0|2,0,0]=4 3554 B11R0.148 CCCNCCCOCC(C)C 34a_100000205972_100000210303 [0,1,1,0,0,0|2,0,0]=4 3555 B11R0.148 CCCOCCCCCC(C)C 34a_100000210258_100000210682 [0,1,1,0,0,0|2,0,0]=4 3556 B11R0.148 CCCOCCCCCC(C)C 34a_100011995859_100000210303 [0,1,1,0,0,0|2,0,0]=4 3557 B11R0.148 CCCOCCCCCC(C)C 7a_100011995859_100000210303 [0,1,1,0,0,0|2,0,0]=4 3558 B11R0.148 CCCOCCCNCC(C)C 2230a_100011217757_100000210760 [0,1,1,0,0,0|1,0,0]=3 3559 B11R0.148 CCCOCCCNCC(C)C 270004a_100011217757_100000210432 [0,1,1,0,0,0|1,0,0]=3 3560 B11R0.148 CCCOCCCNCC(C)C 34a_100011217757_100000210624 [0,1,1,0,0,0|1,0,0]=3 3561 B11R0.148 CCCOCCCNCC(C)O 2230a_100011217757_100011218427 [0,1,1,0,0,0|0,0,0]=2 3562 B11R0.148 CCCOCCCNCC(C)O 34a_100011217757_100011218427 [0,1,1,0,0,0|0,0,0]=2 3563 B11R0.148 CCCOCCCNCC(F)F 2230a_100011217757_100011934356 [0,1,1,0,0,0|2,0,0]=4 3564 B11R0.148 CCCOCCCNCC(F)F 34a_100011217757_100011934356 [0,1,1,0,0,0|2,0,0]=4 3565 B11R0.148 CCCOCCCNC[C@@H](C)O 2230a_100011217757_100009817552 [0,1,1,0,0,0|0,0,0]=2 3566 B11R0.148 CCCOCCCNC[C@@H](C)O 34a_100011217757_100009817552 [0,1,1,0,0,0|0,0,0]=2 3567 B11R0.148 CCCOCCNCCC(C)C 2230a_100161115042_100000210312 [0,1,1,0,0,0|2,0,0]=4 3568 B11R0.148 CCCOCCNCCC(C)C 269862a_100161115042_100000185833 [0,1,1,0,0,0|2,0,0]=4 3569 B11R0.148 CCCOCCNCCC(C)C 34a_100161115042_100000210312 [0,1,1,0,0,0|2,0,0]=4 3570 B11R0.148 CCCOCCNCCC(C)O 2230a_100161115042_100012276601 [0,1,1,0,0,0|1,0,0]=3 3571 B11R0.148 CCCOCCNCCC(C)O 2230a_200000755665_100011215938 [0,1,1,0,0,0|1,0,0]=3 3572 B11R0.148 CCCOCCNCCC(C)O 34a_100161115042_100012276601 [0,1,1,0,0,0|1,0,0]=3 3573 B11R0.148 CCCOCCNCOC(C)C 2230a_100161115042_100000709892 [0,1,1,0,0,0|2,0,0]=4 3574 B11R0.148 CCCOCCNCOC(C)C 34a_100161115042_100000709892 [0,1,1,0,0,0|2,0,0]=4 3575 B11R0.148 CCCOCCOCCC(C)O 34a_100000752267_100012276601 [0,1,1,0,0,0|2,0,0]=4 3576 B11R0.148 CCCOCCOCCC(C)O 7a_100000752267_100012276601 [0,1,1,0,0,0|2,0,0]=4 3577 B11R0.148 CCCOCCSCCC(C)O 62a_100011215938_100012276601 [0,1,1,0,0,0|2,0,0]=4 3578 B11R0.148 CCCOCCSCCC(C)O 62a_100012276601_100011215938 [0,1,1,0,0,0|2,0,0]=4 3579 B11R0.148 CCCSCCCCCC(C)C 62a_100000210303_100000210682 [0,1,1,0,0,0|2,0,0]=4 3580 B11R0.148 CCCSCCCCCC(C)C 62a_100000210682_100000210303 [0,1,1,0,0,0|2,0,0]=4 3581 B11R0.148 CCCSCCNCCC(C)C 2230a_100020603323_100000210312 [0,1,1,0,0,0|2,0,0]=4 3582 B11R0.148 CCCSCCNCCC(C)C 269862a_100020603323_100000185833 [0,1,1,0,0,0|2,0,0]=4 3583 B11R0.148 CCCSCCNCCC(C)O 2230a_100020603323_100012276601 [0,1,1,0,0,0|1,0,0]=3 3584 B11R0.148 CCCSCCNCOC(C)C 2230a_100020603323_100000709892 [0,1,1,0,0,0|2,0,0]=4 3585 B11R0.148 CCCSCCOCCC(C)O 34a_200000230433_100012276601 [0,1,1,0,0,0|2,0,0]=4 3586 B11R0.148 CCCSCCOCCC(C)O 7a_200000230433_100012276601 [0,1,1,0,0,0|2,0,0]=4 3587 B11R0.148 CCNCCCCCCC(C)C 2230a_100000211014_100000210202 [0,1,1,0,0,0|2,0,0]=4 3588 B11R0.148 CCNCCCCCCC(C)C 34a_100000211014_100000210202 [0,1,1,0,0,0|2,0,0]=4 3589 B11R0.148 CCOCCCNCCC(C)C 2230a_100000210961_100000210312 [0,1,1,0,0,0|2,0,0]=4 3590 B11R0.148 CCOCCCNCCC(C)C 269862a_100000210961_100000185833 [0,1,1,0,0,0|2,0,0]=4 3591 B11R0.148 CCOCCCNCCC(C)C 34a_100000210961_100000210312 [0,1,1,0,0,0|2,0,0]=4 3592 B11R0.148 CCOCCCNCCC(C)O 2230a_100000210961_100012276601 [0,1,1,0,0,0|1,0,0]=3 3593 B11R0.148 CCOCCCNCCC(C)O 2230a_200000755665_100012232248 [0,1,1,0,0,0|1,0,0]=3 3594 B11R0.148 CCOCCCNCCC(C)O 34a_100000210961_100012276601 [0,1,1,0,0,0|1,0,0]=3 3595 B11R0.148 CCOCCCNCOC(C)C 2230a_100000210961_100000709892 [0,1,1,0,0,0|2,0,0]=4 3596 B11R0.148 CCOCCCNCOC(C)C 34a_100000210961_100000709892 [0,1,1,0,0,0|2,0,0]=4 3597 B11R0.148 CCOCCCOCCC(C)O 34a_100000757476_100012276601 [0,1,1,0,0,0|2,0,0]=4 3598 B11R0.148 CCOCCCOCCC(C)O 7a_100000757476_100012276601 [0,1,1,0,0,0|2,0,0]=4 3599 B11R0.148 CCOCCCSCCC(C)O 62a_100012232248_100012276601 [0,1,1,0,0,0|2,0,0]=4 3600 B11R0.148 CCOCCCSCCC(C)O 62a_100012276601_100012232248 [0,1,1,0,0,0|2,0,0]=4 3601 B11R0.148 CCOCCNCCCC(C)O 2230a_102516460346_200000718107 [0,1,1,0,0,0|2,0,0]=4 3602 B11R0.148 CCOCCNCCCC(C)O 34a_102516460346_200000718107 [0,1,1,0,0,0|2,0,0]=4 3603 B11R0.148 CCOCCOCCCC(C)O 34a_100000210136_200000718107 [0,1,1,0,0,0|2,0,0]=4 3604 B11R0.148 CCOCCOCCCC(C)O 7a_100000210136_200000718107 [0,1,1,0,0,0|2,0,0]=4 3605 B11R0.148 CCOCCSCCCC(C)O 62a_100000210147_200000718107 [0,1,1,0,0,0|2,0,0]=4 3606 B11R0.148 CCOCCSCCCC(C)O 62a_200000718107_100011215890 [0,1,1,0,0,0|2,0,0]=4 3607 B11R0.148 CCSCCCOCCC(C)O 34a_100011216438_100012276601 [0,1,1,0,0,0|2,0,0]=4 3608 B11R0.148 CCSCCCOCCC(C)O 7a_100011216438_100012276601 [0,1,1,0,0,0|2,0,0]=4 3609 B11R0.148 CCSCCNCCCC(C)O 2230a_100000106463_200000718107 [0,1,1,0,0,0|2,0,0]=4 3610 B11R0.148 CCSCCOCCCC(C)O 34a_100000212035_200000718107 [0,1,1,0,0,0|2,0,0]=4 3611 B11R0.148 CCSCCOCCCC(C)O 7a_100000212035_200000718107 [0,1,1,0,0,0|2,0,0]=4 3612 B11R0.148 CCSCCSCCCC(C)O 62a_100000757381_200000718107 [0,1,1,0,0,0|2,0,0]=4 3613 B11R0.148 CCSCCSCCCC(C)O 62a_200000718107_100000757381 [0,1,1,0,0,0|2,0,0]=4 3614 B11R0.148 CNCCCCCOCC(C)C 34a_100000722520_100000210624 [0,1,1,0,0,0|2,0,0]=4 3615 B11R0.148 CNCCCCCOCC(C)O 34a_100000722520_100011218427 [0,1,1,0,0,0|1,0,0]=3 3616 B11R0.148 CNCCCCCOC[C@@H](C)O 34a_100000722520_100009817552 [0,1,1,0,0,0|1,0,0]=3 3617 B11R0.148 CNCCCOCCCC(C)O 34a_100000213112_200000718107 [0,1,1,0,0,0|2,0,0]=4 3618 B11R0.148 CNCCOCCOCC(C)O 34a_100000228057_100011218427 [0,1,1,0,0,0|2,0,0]=4 3619 B11R0.148 CNCCOCCOC[C@@H](C)O 34a_100000228057_100009817552 [0,1,1,0,0,0|2,0,0]=4 3620 B11R0.148 COCCCCCCCC(C)C 34a_200000210741_200000210301 [0,1,1,0,0,0|2,0,0]=4 3621 B11R0.148 COCCCCCCCC(C)C 7a_200000210741_200000210301 [0,1,1,0,0,0|2,0,0]=4 3622 B11R0.148 COCCCCCNCC(C)C 2230a_100000747528_100000210760 [0,1,1,0,0,0|1,0,0]=3 3623 B11R0.148 COCCCCCNCC(C)C 270004a_100000747528_100000210432 [0,1,1,0,0,0|1,0,0]=3 3624 B11R0.148 COCCCCCNCC(C)C 34a_100000747528_100000210624 [0,1,1,0,0,0|1,0,0]=3 3625 B11R0.148 COCCCCCNCC(C)O 2230a_100000747528_100011218427 [0,1,1,0,0,0|0,0,0]=2 3626 B11R0.148 COCCCCCNCC(C)O 34a_100000747528_100011218427 [0,1,1,0,0,0|0,0,0]=2 3627 B11R0.148 COCCCCCNCC(F)F 2230a_100000747528_100011934356 [0,1,1,0,0,0|2,0,0]=4 3628 B11R0.148 COCCCCCNCC(F)F 34a_100000747528_100011934356 [0,1,1,0,0,0|2,0,0]=4 3629 B11R0.148 COCCCCCNC[C@@H](C)O 2230a_100000747528_100009817552 [0,1,1,0,0,0|0,0,0]=2 3630 B11R0.148 COCCCCCNC[C@@H](C)O 34a_100000747528_100009817552 [0,1,1,0,0,0|0,0,0]=2 3631 B11R0.148 COCCCCNCCC(C)O 2230a_200000755665_100000730899 [0,1,1,0,0,0|1,0,0]=3 3632 B11R0.148 COCCCCOCCC(C)O 34a_100000740925_100012276601 [0,1,1,0,0,0|2,0,0]=4 3633 B11R0.148 COCCCCSCCC(C)O 62a_100000730899_100012276601 [0,1,1,0,0,0|2,0,0]=4 3634 B11R0.148 COCCCCSCCC(C)O 62a_100012276601_100000730899 [0,1,1,0,0,0|2,0,0]=4 3635 B11R0.148 COCCCNCCCC(C)O 34a_100150723488_200000718107 [0,1,1,0,0,0|2,0,0]=4 3636 B11R0.148 COCCCOCCCC(C)O 34a_100000740835_200000718107 [0,1,1,0,0,0|2,0,0]=4 3637 B11R0.148 COCCCSCCCC(C)O 62a_100000709357_200000718107 [0,1,1,0,0,0|2,0,0]=4 3638 B11R0.148 COCCCSCCCC(C)O 62a_200000718107_100000709357 [0,1,1,0,0,0|2,0,0]=4 3639 B11R0.148 COCCOCCNCC(C)C 2230a_100000210953_100000695917 [0,1,1,0,0,0|2,0,0]=4 3640 B11R0.148 COCCOCCNCC(C)C 2230a_100000745349_100000210760 [0,1,1,0,0,0|2,0,0]=4 3641 B11R0.148 COCCOCCNCC(C)C 270004a_100000745349_100000210432 [0,1,1,0,0,0|2,0,0]=4 3642 B11R0.148 COCCOCCNCC(C)C 34a_100000210953_100000695917 [0,1,1,0,0,0|2,0,0]=4 3643 B11R0.148 COCCOCCNCC(C)C 34a_100000745349_100000210624 [0,1,1,0,0,0|2,0,0]=4 3644 B11R0.148 COCCOCCNCC(C)C 34a_100015185251_100011201679 [0,1,1,0,0,0|2,0,0]=4 3645 B11R0.148 COCCOCCNCC(C)O 2230a_100000210904_100000695917 [0,1,1,0,0,0|1,0,0]=3 3646 B11R0.148 COCCOCCNCC(C)O 2230a_100000745349_100011218427 [0,1,1,0,0,0|1,0,0]=3 3647 B11R0.148 COCCOCCNCC(C)O 34a_100000210904_100000695917 [0,1,1,0,0,0|1,0,0]=3 3648 B11R0.148 COCCOCCNCC(C)O 34a_100000745349_100011218427 [0,1,1,0,0,0|1,0,0]=3 3649 B11R0.148 COCCOCCNC[C@@H](C)O 2230a_100000745349_100009817552 [0,1,1,0,0,0|1,0,0]=3 3650 B11R0.148 COCCOCCNC[C@@H](C)O 34a_100000745349_100009817552 [0,1,1,0,0,0|1,0,0]=3 3651 B11R0.148 COCCOCCOCC(C)O 34a_100011215163_100011218427 [0,1,1,0,0,0|2,0,0]=4 3652 B11R0.148 COCCOCCOCC(C)O 7a_100011215163_100011218427 [0,1,1,0,0,0|2,0,0]=4 3653 B11R0.148 COCCOCCOC[C@@H](C)O 34a_100011215163_100009817552 [0,1,1,0,0,0|2,0,0]=4 3654 B11R0.148 COCCOCCOC[C@@H](C)O 7a_100011215163_100009817552 [0,1,1,0,0,0|2,0,0]=4 3655 B11R0.148 COCCOCCSCC(C)O 62a_100000695917_100011218427 [0,1,1,0,0,0|2,0,0]=4 3656 B11R0.148 COCCOCCSCC(C)O 62a_100011218427_100000695917 [0,1,1,0,0,0|2,0,0]=4 3657 B11R0.148 COCCOCCSC[C@@H](C)O 62a_100000695917_100009817552 [0,1,1,0,0,0|2,0,0]=4 3658 B11R0.148 COCCOCCSC[C@@H](C)O 62a_100009817552_100000695917 [0,1,1,0,0,0|2,0,0]=4 3659 B11R0.148 COCCOCNCCC(C)O 2230a_200000755665_100000231047 [0,1,1,0,0,0|2,0,0]=4 3660 B11R0.148 CSCCCCOCCC(C)O 34a_100011217163_100012276601 [0,1,1,0,0,0|2,0,0]=4 3661 B11R0.148 CSCCCCOCCC(C)O 7a_100011217163_100012276601 [0,1,1,0,0,0|2,0,0]=4 3662 B11R0.148 CSCCCNCCCC(C)O 2230a_100000749238_200000718107 [0,1,1,0,0,0|2,0,0]=4 3663 B11R0.148 CSCCCOCCCC(C)O 34a_100000690336_200000718107 [0,1,1,0,0,0|2,0,0]=4 3664 B11R0.148 CSCCCOCCCC(C)O 7a_100000690336_200000718107 [0,1,1,0,0,0|2,0,0]=4 3665 B11R0.148 CSCCOCCNCC(C)C 34a_100015185251_100000212216 [0,1,1,0,0,0|2,0,0]=4 3666 B11R0.148 C[C@@H](Cl)COCCCCCCF 34a_100016084084_100015922095 [0,1,1,0,0,0|2,0,0]=4 3667 B11R0.148 C[C@@H](Cl)COCCCCCCO 34a_100016084084_100000766143 [0,1,1,0,0,0|2,0,0]=4 3668 B11R0.148 C[C@@H](N)COCCCCCCF 34a_100000737577_100015922095 [0,1,1,0,0,0|2,0,0]=4 3669 B11R0.148 C[C@@H](N)COCCCCCCO 34a_100000737577_100000766143 [0,1,1,0,0,0|2,0,0]=4 3670 B11R0.148 C[C@@H](O)CNCCCCCCO 2230a_100000686447_100009817552 [0,1,1,0,0,0|0,0,0]=2 3671 B11R0.148 C[C@@H](O)CNCCCCCCO 34a_100000686447_100009817552 [0,1,1,0,0,0|0,0,0]=2 3672 B11R0.148 C[C@@H](O)CNCCCCN=[N+]=[N-] 2230a_100000101370_100009817552 [0,1,1,0,0,0|2,0,0]=4 3673 B11R0.148 C[C@@H](O)COCCCCCCBr 34a_100011215345_100009817552 [0,1,1,0,0,0|1,0,0]=3 3674 B11R0.148 C[C@@H](O)COCCCCCCBr 7a_100011215345_100009817552 [0,1,1,0,0,0|1,0,0]=3 3675 B11R0.148 C[C@@H](O)COCCCCCCCl 34a_100000766143_100009817552 [0,1,1,0,0,0|1,0,0]=3 3676 B11R0.148 C[C@@H](O)COCCCCCCCl 7a_100000766143_100009817552 [0,1,1,0,0,0|1,0,0]=3 3677 B11R0.148 C[C@@H](O)COCCCCCCF 34a_100000732779_100009817552 [0,1,1,0,0,0|1,0,0]=3 3678 B11R0.148 C[C@@H](O)COCCCCCCF 7a_100000732779_100009817552 [0,1,1,0,0,0|1,0,0]=3 3679 B11R0.148 C[C@@H](O)COCCCCCCN 34a_100000686447_100009817552 [0,1,1,0,0,0|1,0,0]=3 3680 B11R0.148 C[C@@H](O)CSCCCCCC#N 62a_100009813376_100009817552 [0,1,1,0,0,0|1,0,1]=4 3681 B11R0.148 C[C@@H](O)CSCCCCCC#N 62a_100009817552_100009813376 [0,1,1,0,0,0|1,0,1]=4 3682 B11R0.148 C[C@@H](O)CSCCCCCC=O 62a_100000139337_100009817552 [0,1,1,0,0,0|1,0,1]=4 3683 B11R0.148 C[C@@H](O)CSCCCCCC=O 62a_100009817552_100000139337 [0,1,1,0,0,0|1,0,1]=4 3684 B11R0.148 C[C@@H](O)CSCCCCCCF 62a_100009817552_100015922095 [0,1,1,0,0,0|1,0,0]=3 3685 B11R0.148 C[C@@H](O)CSCCCCCCF 62a_100015922095_100009817552 [0,1,1,0,0,0|1,0,0]=3 3686 B11R0.148 C[C@@H](O)CSCCCCCCO 62a_100000766143_100009817552 [0,1,1,0,0,0|1,0,0]=3 3687 B11R0.148 C[C@@H](O)CSCCCCCCO 62a_100009817552_100000766143 [0,1,1,0,0,0|1,0,0]=3 3688 B11R0.148 FCCCCCCNCC(F)F 34a_100000765723_100015922095 [0,1,1,0,0,0|2,0,0]=4 3689 B11R0.148 O=C(O)CNCCCCCCF 269956a_100016091260_100015922095 [0,1,1,0,0,0|1,0,1]=4 3690 B11R0.148 O=C(O)CNCCCCCCO 269956a_100016091260_100000766143 [0,1,1,0,0,0|1,0,1]=4 3691 B11R0.148 OCCCCCCNCC(F)F 2230a_100000686447_100011934356 [0,1,1,0,0,0|2,0,0]=4 3692 B11R0.148 OCCCCCCNCC(F)F 34a_100000686447_100011934356 [0,1,1,0,0,0|2,0,0]=4 3693 B11R0.148 OCCCCCCNCC(F)F 34a_100000765723_100000766143 [0,1,1,0,0,0|2,0,0]=4 3694 B11R0.159 C#CCCCCNCC(C)(C)O 2230a_100000751335_100010269958 [0,1,1,0,0,0|0,0,2]=4 3695 B11R0.159 C#CCCCCNCC(C)(C)O 34a_100000706060_100000764493 [0,1,1,0,0,0|0,0,2]=4 3696 B11R0.159 C=CCCCCNCC(C)(C)O 2230a_100000751335_100011215482 [0,1,1,0,0,0|0,0,2]=4 3697 B11R0.159 C=CCCCCNCC(C)(C)O 34a_100000703577_100000764493 [0,1,1,0,0,0|0,0,2]=4 3698 B11R0.159 CC(C)(C)CNCCCCCF 2230a_100000743828_100000729378 [0,1,1,0,0,0|2,0,0]=4 3699 B11R0.159 CC(C)(C)CNCCCCCO 2230a_100000743828_100000746330 [0,1,1,0,0,0|2,0,0]=4 3700 B11R0.159 CC(C)(C)CNCCCCCO 270004a_100000762737_100011204126 [0,1,1,0,0,0|2,0,0]=4 3701 B11R0.159 CC(C)(C)CNCCCCCO 34a_100000762737_100011219605 [0,1,1,0,0,0|2,0,0]=4 3702 B11R0.159 CC(C)(F)CNCCCCCF 2230a_100020643315_100000729378 [0,1,1,0,0,0|2,0,0]=4 3703 B11R0.159 CC(C)(F)CNCCCCCO 2230a_100020643315_100000746330 [0,1,1,0,0,0|2,0,0]=4 3704 B11R0.159 CC(C)(F)CNCCCCCO 34a_100000762737_100011997219 [0,1,1,0,0,0|2,0,0]=4 3705 B11R0.159 CC(C)(O)CNCCCCC#N 2230a_100000751335_100000211819 [0,1,1,0,0,0|1,0,1]=4 3706 B11R0.159 CC(C)(O)CNCCCCC=O 2230a_100000751335_100000139335 [0,1,1,0,0,0|1,0,1]=4 3707 B11R0.159 CC(C)(O)CNCCCCCF 2230a_100000751335_100000729378 [0,1,1,0,0,0|1,0,0]=3 3708 B11R0.159 CC(C)(O)CNCCCCCO 2230a_100000751335_100000746330 [0,1,1,0,0,0|1,0,0]=3 3709 B11R0.159 CC(C)(O)CNCCCCCO 34a_100000762737_100000764493 [0,1,1,0,0,0|1,0,0]=3 3710 B11R0.159 CC(C)(O)CNCCOCCO 2230a_100000751335_100011215305 [0,1,1,0,0,0|2,0,0]=4 3711 B11R0.159 CC(C)(O)CNCCOCCO 34a_100000211614_100000764493 [0,1,1,0,0,0|2,0,0]=4 3712 B11R0.159 CC(C)(O)COCCCCCBr 34a_100000746331_100000764493 [0,1,1,0,0,0|2,0,0]=4 3713 B11R0.159 CC(C)(O)COCCCCCBr 7a_100000746331_100000764493 [0,1,1,0,0,0|2,0,0]=4 3714 B11R0.159 CC(C)(O)COCCCCCCl 34a_100000746330_100000764493 [0,1,1,0,0,0|2,0,0]=4 3715 B11R0.159 CC(C)(O)COCCCCCCl 7a_100000746330_100000764493 [0,1,1,0,0,0|2,0,0]=4 3716 B11R0.159 CC(C)(O)COCCCCCI 34a_200012148887_100000764493 [0,1,1,0,0,0|2,0,0]=4 3717 B11R0.159 CC(C)(O)COCCCCCI 7a_200012148887_100000764493 [0,1,1,0,0,0|2,0,0]=4 3718 B11R0.159 CC(C)(O)COCCCCCN 34a_100000762737_100000764493 [0,1,1,0,0,0|2,0,0]=4 3719 B11R0.159 CC(C)(O)CSCCCCCF 62a_100000729378_100000764493 [0,1,1,0,0,0|2,0,0]=4 3720 B11R0.159 CC(C)(O)CSCCCCCF 62a_100000764493_100000729378 [0,1,1,0,0,0|2,0,0]=4 3721 B11R0.159 CC(C)(O)CSCCCCCO 62a_100000746330_100000764493 [0,1,1,0,0,0|2,0,0]=4 3722 B11R0.159 CC(C)(O)CSCCCCCO 62a_100000764493_100000746330 [0,1,1,0,0,0|2,0,0]=4 3723 B11R0.159 CC/C=C\CCNCC(C)(C)O 2230a_100000751335_100015370543 [0,1,1,0,0,0|0,0,2]=4 3724 B11R0.159 CCCCCCNCC(C)(C)C 2230a_100000743828_100000210314 [0,1,1,0,0,0|1,0,0]=3 3725 B11R0.159 CCCCCCNCC(C)(C)C 270004a_100000210581_100011204126 [0,1,1,0,0,0|1,0,0]=3 3726 B11R0.159 CCCCCCNCC(C)(C)F 2230a_100020643315_100000210314 [0,1,1,0,0,0|1,0,0]=3 3727 B11R0.159 CCCCCCNCC(C)(C)O 2230a_100000751335_100000210314 [0,1,1,0,0,0|0,0,0]=2 3728 B11R0.159 CCCCCCNCC(F)(F)F 2230a_100000210581_100000763148 [0,1,1,0,0,0|2,0,0]=4 3729 B11R0.159 CCCCCCNCC(F)(F)F 34a_100000717047_100000210314 [0,1,1,0,0,0|2,0,0]=4 3730 B11R0.159 CCCCCCNC[Si](C)(C)C 2230a_100000210581_100000037933 [0,1,1,0,0,0|1,1,0]=4 3731 B11R0.159 CCCCCCOCC(C)(C)C 34a_100000210259_100011219605 [0,1,1,0,0,0|2,0,0]=4 3732 B11R0.159 CCCCCCOCC(C)(C)F 34a_100000210259_100011997219 [0,1,1,0,0,0|2,0,0]=4 3733 B11R0.159 CCCCCCOCC(C)(C)F 34a_100000716592_100000210314 [0,1,1,0,0,0|2,0,0]=4 3734 B11R0.159 CCCCCCOCC(C)(C)O 34a_100000210259_100000764493 [0,1,1,0,0,0|1,0,0]=3 3735 B11R0.159 CCCCCCOCC(C)(C)O 7a_100000210259_100000764493 [0,1,1,0,0,0|1,0,0]=3 3736 B11R0.159 CCCCCCOCC(C)(F)F 34a_100000068830_100000210314 [0,1,1,0,0,0|2,0,0]=4 3737 B11R0.159 CCCCCCSCC(C)(C)C 62a_100000210314_100011219605 [0,1,1,0,0,0|2,0,0]=4 3738 B11R0.159 CCCCCCSCC(C)(C)C 62a_100011219605_100000210757 [0,1,1,0,0,0|2,0,0]=4 3739 B11R0.159 CCCCCCSCC(C)(C)F 62a_100000210314_100011997219 [0,1,1,0,0,0|2,0,0]=4 3740 B11R0.159 CCCCCCSCC(C)(C)F 62a_100011997219_100000210757 [0,1,1,0,0,0|2,0,0]=4 3741 B11R0.159 CCCCCCSCC(C)(C)O 62a_100000210314_100000764493 [0,1,1,0,0,0|1,0,0]=3 3742 B11R0.159 CCCCCCSCC(C)(C)O 62a_100000764493_100000210757 [0,1,1,0,0,0|1,0,0]=3 3743 B11R0.159 CCCCCNCCC(C)(C)O 2230a_100000209983_100000702414 [0,1,1,0,0,0|2,0,0]=4 3744 B11R0.159 CCCCCOCCC(C)(C)O 34a_100000210253_100000702414 [0,1,1,0,0,0|2,0,0]=4 3745 B11R0.159 CCCCCOCCC(C)(C)O 7a_100000210253_100000702414 [0,1,1,0,0,0|2,0,0]=4 3746 B11R0.159 CCCCCSCCC(C)(C)O 62a_100000210326_100000702414 [0,1,1,0,0,0|2,0,0]=4 3747 B11R0.159 CCCCCSCCC(C)(C)O 62a_100000702414_100000210326 [0,1,1,0,0,0|2,0,0]=4 3748 B11R0.159 CCCCNCCCC(C)(C)O 2230a_100000102301_100009888830 [0,1,1,0,0,0|2,0,0]=4 3749 B11R0.159 CCCCNCCCC(C)(C)O 7a_106832991798_100009888830 [0,1,1,0,0,0|2,0,0]=4 3750 B11R0.159 CCCCOCCCC(C)(C)O 34a_100000210227_100009888830 [0,1,1,0,0,0|2,0,0]=4 3751 B11R0.159 CCCCOCCCC(C)(C)O 7a_100000210227_100009888830 [0,1,1,0,0,0|2,0,0]=4 3752 B11R0.159 CCCCOCNCC(C)(C)C 2230a_100000743828_100011995733 [0,1,1,0,0,0|2,0,0]=4 3753 B11R0.159 CCCCOCNCC(C)(C)F 2230a_100020643315_100011995733 [0,1,1,0,0,0|2,0,0]=4 3754 B11R0.159 CCCCOCNCC(C)(C)O 2230a_100000751335_100011995733 [0,1,1,0,0,0|1,0,0]=3 3755 B11R0.159 CCCCOCSCC(C)(C)O 62a_100000764493_100011995733 [0,1,1,0,0,0|2,0,0]=4 3756 B11R0.159 CCCCOCSCC(C)(C)O 62a_100011995733_100000764493 [0,1,1,0,0,0|2,0,0]=4 3757 B11R0.159 CCCCSCCCC(C)(C)O 62a_100000210211_100009888830 [0,1,1,0,0,0|2,0,0]=4 3758 B11R0.159 CCCCSCCCC(C)(C)O 62a_100009888830_100000210210 [0,1,1,0,0,0|2,0,0]=4 3759 B11R0.159 CCCOCCNCC(C)(C)C 2230a_100000743828_100011215938 [0,1,1,0,0,0|2,0,0]=4 3760 B11R0.159 CCCOCCNCC(C)(C)C 270004a_100161115042_100011204126 [0,1,1,0,0,0|2,0,0]=4 3761 B11R0.159 CCCOCCNCC(C)(C)C 34a_100161115042_100011219605 [0,1,1,0,0,0|2,0,0]=4 3762 B11R0.159 CCCOCCNCC(C)(C)F 2230a_100020643315_100011215938 [0,1,1,0,0,0|2,0,0]=4 3763 B11R0.159 CCCOCCNCC(C)(C)F 34a_100161115042_100011997219 [0,1,1,0,0,0|2,0,0]=4 3764 B11R0.159 CCCOCCNCC(C)(C)O 2230a_100000751335_100011215938 [0,1,1,0,0,0|1,0,0]=3 3765 B11R0.159 CCCOCCNCC(C)(C)O 34a_100161115042_100000764493 [0,1,1,0,0,0|1,0,0]=3 3766 B11R0.159 CCCOCCOCC(C)(C)O 34a_100000752267_100000764493 [0,1,1,0,0,0|2,0,0]=4 3767 B11R0.159 CCCOCCOCC(C)(C)O 7a_100000752267_100000764493 [0,1,1,0,0,0|2,0,0]=4 3768 B11R0.159 CCCOCCSCC(C)(C)O 62a_100000764493_100011215938 [0,1,1,0,0,0|2,0,0]=4 3769 B11R0.159 CCCOCCSCC(C)(C)O 62a_100011215938_100000764493 [0,1,1,0,0,0|2,0,0]=4 3770 B11R0.159 CCCSCCNCC(C)(C)C 270004a_100020603323_100011204126 [0,1,1,0,0,0|2,0,0]=4 3771 B11R0.159 CCCSCCOCC(C)(C)O 34a_200000230433_100000764493 [0,1,1,0,0,0|2,0,0]=4 3772 B11R0.159 CCCSCCOCC(C)(C)O 7a_200000230433_100000764493 [0,1,1,0,0,0|2,0,0]=4 3773 B11R0.159 CCNCCCCCC(C)(C)O 2230a_100015525214_100010402123 [0,1,1,0,0,0|2,0,0]=4 3774 B11R0.159 CCOCCCCCC(C)(C)O 34a_100121572206_100010402123 [0,1,1,0,0,0|2,0,0]=4 3775 B11R0.159 CCOCCCNCC(C)(C)C 2230a_100000743828_100012232248 [0,1,1,0,0,0|2,0,0]=4 3776 B11R0.159 CCOCCCNCC(C)(C)C 270004a_100000210961_100011204126 [0,1,1,0,0,0|2,0,0]=4 3777 B11R0.159 CCOCCCNCC(C)(C)C 34a_100000210961_100011219605 [0,1,1,0,0,0|2,0,0]=4 3778 B11R0.159 CCOCCCNCC(C)(C)F 2230a_100020643315_100012232248 [0,1,1,0,0,0|2,0,0]=4 3779 B11R0.159 CCOCCCNCC(C)(C)F 34a_100000210961_100011997219 [0,1,1,0,0,0|2,0,0]=4 3780 B11R0.159 CCOCCCNCC(C)(C)O 2230a_100000751335_100012232248 [0,1,1,0,0,0|1,0,0]=3 3781 B11R0.159 CCOCCCNCC(C)(C)O 34a_100000210961_100000764493 [0,1,1,0,0,0|1,0,0]=3 3782 B11R0.159 CCOCCCOCC(C)(C)O 34a_100000757476_100000764493 [0,1,1,0,0,0|2,0,0]=4 3783 B11R0.159 CCOCCCOCC(C)(C)O 7a_100000757476_100000764493 [0,1,1,0,0,0|2,0,0]=4 3784 B11R0.159 CCOCCCSCC(C)(C)O 62a_100000764493_100012232248 [0,1,1,0,0,0|2,0,0]=4 3785 B11R0.159 CCOCCCSCC(C)(C)O 62a_100012232248_100000764493 [0,1,1,0,0,0|2,0,0]=4 3786 B11R0.159 CCSCCCCCC(C)(C)O 62a_100000210202_100010402123 [0,1,1,0,0,0|2,0,0]=4 3787 B11R0.159 CCSCCCCCC(C)(C)O 62a_100010402123_100000210202 [0,1,1,0,0,0|2,0,0]=4 3788 B11R0.159 CCSCCCOCC(C)(C)O 34a_100011216438_100000764493 [0,1,1,0,0,0|2,0,0]=4 3789 B11R0.159 CCSCCCOCC(C)(C)O 7a_100011216438_100000764493 [0,1,1,0,0,0|2,0,0]=4 3790 B11R0.159 COCCCCNCC(C)(C)C 2230a_100000743828_100000730899 [0,1,1,0,0,0|2,0,0]=4 3791 B11R0.159 COCCCCNCC(C)(C)F 2230a_100020643315_100000730899 [0,1,1,0,0,0|2,0,0]=4 3792 B11R0.159 COCCCCNCC(C)(C)O 2230a_100000751335_100000730899 [0,1,1,0,0,0|1,0,0]=3 3793 B11R0.159 COCCCCOCC(C)(C)O 34a_100000740925_100000764493 [0,1,1,0,0,0|2,0,0]=4 3794 B11R0.159 COCCCCSCC(C)(C)O 62a_100000730899_100000764493 [0,1,1,0,0,0|2,0,0]=4 3795 B11R0.159 COCCCCSCC(C)(C)O 62a_100000764493_100000730899 [0,1,1,0,0,0|2,0,0]=4 3796 B11R0.159 COCCOCNCC(C)(C)O 2230a_100000751335_100000231047 [0,1,1,0,0,0|2,0,0]=4 3797 B11R0.159 CSCCCCOCC(C)(C)O 34a_100011217163_100000764493 [0,1,1,0,0,0|2,0,0]=4 3798 B11R0.159 CSCCCCOCC(C)(C)O 7a_100011217163_100000764493 [0,1,1,0,0,0|2,0,0]=4 3799 B11R0.176 CCCC(=O)OCNCC(C)O 2230a_100000210904_100000034017 [0,1,1,0,0,0|1,0,1]=4 3800 B11R0.176 CCCC(=O)OCNCC(C)O 34a_100000210904_100000034017 [0,1,1,0,0,0|1,0,1]=4 3801 B11R0.176 CCCC(C)C=NNCC(C)O 4a_200000730056_100000243154 [0,1,1,0,0,0|1,0,1]=4 3802 B11R0.176 CCCC(C)CCOCC(C)C 34a_100011217855_100000210624 [0,1,1,0,0,0|2,0,0]=4 3803 B11R0.176 CCCC(C)CCOCC(C)C 7a_100011217855_100000210760 [0,1,1,0,0,0|2,0,0]=4 3804 B11R0.176 CCCC(C)CCOCC(C)O 34a_100011217855_100011218427 [0,1,1,0,0,0|1,0,0]=3 3805 B11R0.176 CCCC(C)CCOCC(C)O 7a_100011217855_100011218427 [0,1,1,0,0,0|1,0,0]=3 3806 B11R0.176 CCCC(C)CCOC[C@@H](C)O 34a_100011217855_100009817552 [0,1,1,0,0,0|1,0,0]=3 3807 B11R0.176 CCCC(C)CCOC[C@@H](C)O 7a_100011217855_100009817552 [0,1,1,0,0,0|1,0,0]=3 3808 B11R0.176 CCCC(C)CNCCC(C)O 2230a_200000755665_100011216630 [0,1,1,0,0,0|2,0,0]=4 3809 B11R0.176 CCCC(C)CNCCC(C)O 270004a_200000755665_100000243154 [0,1,1,0,0,0|2,0,0]=4 3810 B11R0.176 CCCC(C)COCCC(C)O 34a_100000688023_100012276601 [0,1,1,0,0,0|2,0,0]=4 3811 B11R0.176 CCCC(C)COCCC(C)O 7a_100000688023_100012276601 [0,1,1,0,0,0|2,0,0]=4 3812 B11R0.176 CCCC(C)CSCCC(C)O 62a_100011216630_100012276601 [0,1,1,0,0,0|2,0,0]=4 3813 B11R0.176 CCCC(C)CSCCC(C)O 62a_100012276601_100011216630 [0,1,1,0,0,0|2,0,0]=4 3814 B11R0.176 CCCC(C)NCCCC(C)O 2230a_100000741246_200000718107 [0,1,1,0,0,0|2,0,0]=4 3815 B11R0.176 CCCC(C)OCCCC(C)O 34a_100000764384_200000718107 [0,1,1,0,0,0|2,0,0]=4 3816 B11R0.176 CCCC(C)OCCCC(C)O 7a_100000764384_200000718107 [0,1,1,0,0,0|2,0,0]=4 3817 B11R0.176 CCCC(C)SCCCC(C)O 62a_100000766640_200000718107 [0,1,1,0,0,0|2,0,0]=4 3818 B11R0.176 CCCC(C)SCCCC(C)O 62a_200000718107_100000766640 [0,1,1,0,0,0|2,0,0]=4 3819 B11R0.176 CCC[C@H](N)CCOCC(C)C 34a_100015193777_100000210624 [0,1,1,0,0,0|2,0,0]=4 3820 B11R0.176 CCC[C@H](N)CCOCC(C)O 34a_100015193777_100011218427 [0,1,1,0,0,0|1,0,0]=3 3821 B11R0.176 CCC[C@H](N)CCOC[C@@H](C)O 34a_100015193777_100009817552 [0,1,1,0,0,0|1,0,0]=3 3822 B11R0.176 CCC[C@H](N)COCCC(C)O 34a_100000732646_100012276601 [0,1,1,0,0,0|2,0,0]=4 3823 B11R0.176 CCNC(=O)CCNCC(C)O 2230a_100000210904_100000737597 [0,1,1,0,0,0|1,0,1]=4 3824 B11R0.176 CCNC(=O)CCNCC(C)O 34a_100025743525_100011218427 [0,1,1,0,0,0|1,0,1]=4 3825 B11R0.176 CCNC(=O)CCNC[C@@H](C)O 34a_100025743525_100009817552 [0,1,1,0,0,0|1,0,1]=4 3826 B11R0.176 CCOC(=O)CCNCC(C)O 2230a_100000210904_100011206558 [0,1,1,0,0,0|1,0,1]=4 3827 B11R0.176 CCOC(=O)CCNCC(C)O 34a_100000210904_100000765890 [0,1,1,0,0,0|1,0,1]=4 3828 B11R0.1 C=C(C)CN(C)CC(C)CCC 2230a_100000225649_100011216630 [0,1,1,0,0,0|1,0,1]=4 3829 B11R0.1 C=C(C)CN(C)CC(C)CCC 269982a_100000225649_100011216630 [0,1,1,0,0,0|1,0,1]=4 3830 B11R0.1 C=C(C)CN(C)CC(C)CCC 270004a_100000225649_100000243154 [0,1,1,0,0,0|1,0,1]=4 3831 B11R0.1 CC(O)CN(C)C[C@@H](O)CC#N 2230a_100000227577_100000001066 [0,1,1,0,0,0|1,0,1]=4 3832 B11R0.1 CCCC(=O)CN(C)CC(C)C 2230a_100000747067_100000747444 [0,1,1,0,0,0|1,0,1]=4 3833 B11R0.1 CCCC(=O)CN(C)CC(C)C 269982a_100000747067_100000747444 [0,1,1,0,0,0|1,0,1]=4 3834 B11R0.1 CCCC(=O)CN(C)CC(C)O 2230a_100000227577_100000747444 [0,1,1,0,0,0|0,0,1]=3 3835 B11R0.1 CCCC(=O)CN(C)CC(C)O 269982a_100000227577_100000747444 [0,1,1,0,0,0|0,0,1]=3 3836 B11R0.1 CCCC(C)CC(=O)CC(C)O 1458a_100000748435_100011218427 [0,1,1,0,0,0|2,0,0]=4 3837 B11R0.1 CCCC(C)CC(=O)C[C@@H](C)O 1458a_100011933948_100011216630 [0,1,1,0,0,0|2,0,0]=4 3838 B11R0.1 CCCC(C)CN(C)CC(=O)O 269956a_100000746989_100011216630 [0,1,1,0,0,0|1,0,1]=4 3839 B11R0.1 CCCC(C)CN(C)CC(C)C 2230a_100000747067_100011216630 [0,1,1,0,0,0|1,0,0]=3 3840 B11R0.1 CCCC(C)CN(C)CC(C)C 269982a_100000747067_100011216630 [0,1,1,0,0,0|1,0,0]=3 3841 B11R0.1 CCCC(C)CN(C)CC(C)C 270004a_100000747067_100000243154 [0,1,1,0,0,0|1,0,0]=3 3842 B11R0.1 CCCC(C)CN(C)CC(C)O 2230a_100000227577_100011216630 [0,1,1,0,0,0|0,0,0]=2 3843 B11R0.1 CCCC(C)CN(C)CC(C)O 269982a_100000227577_100011216630 [0,1,1,0,0,0|0,0,0]=2 3844 B11R0.1 CCCC(C)CN(C)CC(C)O 270004a_100000227577_100000243154 [0,1,1,0,0,0|0,0,0]=2 3845 B11R0.1 CCNC(=O)CN(C)CC(C)O 2230a_100000227577_100000183381 [0,1,1,0,0,0|1,0,1]=4 3846 B11R0.1 CCNC(=O)CN(C)CC(C)O 2230a_100000741943_100011218427 [0,1,1,0,0,0|1,0,1]=4 3847 B11R0.1 CCNC(=O)CN(C)CC(C)O 269982a_100000227577_100000183381 [0,1,1,0,0,0|1,0,1]=4 3848 B11R0.1 CCNC(=O)CN(C)CC(C)O 269982a_100000741943_100011218427 [0,1,1,0,0,0|1,0,1]=4 3849 B11R0.1 CCNC(=O)CN(C)C[C@@H](C)O 2230a_100000741943_100009817552 [0,1,1,0,0,0|1,0,1]=4 3850 B11R0.1 CCNC(=O)CN(C)C[C@@H](C)O 269982a_100000741943_100009817552 [0,1,1,0,0,0|1,0,1]=4 3851 B11R0.1 CCOC(=O)CN(C)CC(C)O 2230a_100000220588_100011218427 [0,1,1,0,0,0|1,0,1]=4 3852 B11R0.1 CCOC(=O)CN(C)CC(C)O 2230a_100000227577_100000188475 [0,1,1,0,0,0|1,0,1]=4 3853 B11R0.1 CCOC(=O)CN(C)CC(C)O 269982a_100000227577_100000188475 [0,1,1,0,0,0|1,0,1]=4 3854 B11R0.1 CCOC(=O)CN(C)C[C@@H](C)O 2230a_100000220588_100009817552 [0,1,1,0,0,0|1,0,1]=4 3855 B11R0.1 COCC(O)CN(C)CC(C)C 2230a_100000739405_100000210760 [0,1,1,0,0,0|2,0,0]=4 3856 B11R0.1 COCC(O)CN(C)CC(C)C 269982a_100000739405_100000210624 [0,1,1,0,0,0|2,0,0]=4 3857 B11R0.1 COCC(O)CN(C)CC(C)C 270004a_100000739405_100000210432 [0,1,1,0,0,0|2,0,0]=4 3858 B11R0.1 COCC(O)CN(C)CC(C)O 2230a_100000739405_100011218427 [0,1,1,0,0,0|1,0,0]=3 3859 B11R0.1 COCC(O)CN(C)CC(C)O 269982a_100000739405_100011218427 [0,1,1,0,0,0|1,0,0]=3 3860 B11R0.1 COCC(O)CN(C)C[C@@H](C)O 2230a_100000739405_100009817552 [0,1,1,0,0,0|1,0,0]=3 3861 B11R0.1 COCC(O)CN(C)C[C@@H](C)O 269982a_100000739405_100009817552 [0,1,1,0,0,0|1,0,0]=3 3862 B11R0.6 C=C(C)CN(C)CCCC(C)C 2230a_100000225649_100011214892 [0,1,1,0,0,0|1,0,1]=4 3863 B11R0.6 C=C(C)CN(C)CCCC(C)C 269982a_100000225649_100011214892 [0,1,1,0,0,0|1,0,1]=4 3864 B11R0.6 C=C(C)CN(C)CCCC(C)O 2230a_100000225649_200000718107 [0,1,1,0,0,0|1,0,1]=4 3865 B11R0.6 C=C(C)CN(C)CCCC(C)O 269982a_100000225649_200000718107 [0,1,1,0,0,0|1,0,1]=4 3866 B11R0.6 CC(=CCCN(C)CC(C)O)C 2230a_100000227577_100011217483 [0,1,1,0,0,0|0,0,2]=4 3867 B11R0.6 CC(=CCCN(C)CC(C)O)C 269982a_100000227577_100011217483 [0,1,1,0,0,0|0,0,2]=4 3868 B11R0.6 CC(=O)CCCN(C)CC(C)C 269982a_100000747067_100011215641 [0,1,1,0,0,0|1,0,1]=4 3869 B11R0.6 CC(=O)CCCN(C)CC(C)O 269982a_100000227577_100011215641 [0,1,1,0,0,0|0,0,1]=3 3870 B11R0.6 CC(=O)NCCN(C)CC(C)O 2230a_100000227577_100000189650 [0,1,1,0,0,0|1,0,1]=4 3871 B11R0.6 CC(=O)NCCN(C)CC(C)O 269982a_100000227577_100000189650 [0,1,1,0,0,0|1,0,1]=4 3872 B11R0.6 CC(=O)OCCN(C)CC(C)O 269982a_100000227577_100009814007 [0,1,1,0,0,0|1,0,1]=4 3873 B11R0.6 CC(C)CCCC(=O)CC(C)O 1458a_100011216857_100011218427 [0,1,1,0,0,0|2,0,0]=4 3874 B11R0.6 CC(C)CCCC(=O)C[C@@H](C)O 1458a_100011933948_100011214892 [0,1,1,0,0,0|2,0,0]=4 3875 B11R0.6 CC(C)CCCN(C)CC(=O)O 269956a_100000746989_100011214892 [0,1,1,0,0,0|1,0,1]=4 3876 B11R0.6 CC(C)CCCN(C)CC(C)C 2230a_100000747067_100011214892 [0,1,1,0,0,0|1,0,0]=3 3877 B11R0.6 CC(C)CCCN(C)CC(C)C 269982a_100000747067_100011214892 [0,1,1,0,0,0|1,0,0]=3 3878 B11R0.6 CC(C)CCCN(C)CC(C)O 2230a_100000227577_100011214892 [0,1,1,0,0,0|0,0,0]=2 3879 B11R0.6 CC(C)CCCN(C)CC(C)O 269982a_100000227577_100011214892 [0,1,1,0,0,0|0,0,0]=2 3880 B11R0.6 CC(C)CN(C)CCCC(C)O 2230a_100000747067_200000718107 [0,1,1,0,0,0|1,0,0]=3 3881 B11R0.6 CC(C)CN(C)CCCC(C)O 269982a_100000747067_200000718107 [0,1,1,0,0,0|1,0,0]=3 3882 B11R0.6 CC(C)CN(C)CCCN(C)C 269982a_100000225831_100000210624 [0,1,1,0,0,0|2,0,0]=4 3883 B11R0.6 CC(C)CN(C)CCCN(C)C 269982a_100000747067_100000757444 [0,1,1,0,0,0|2,0,0]=4 3884 B11R0.6 CC(C)CN(C)CCCN(C)C 270004a_100000225831_100000210432 [0,1,1,0,0,0|2,0,0]=4 3885 B11R0.6 CC(C)CN(C)CCOC(C)C 2230a_100000747067_100000211751 [0,1,1,0,0,0|2,0,0]=4 3886 B11R0.6 CC(C)CN(C)CCOC(C)C 269982a_100000747067_100000211751 [0,1,1,0,0,0|2,0,0]=4 3887 B11R0.6 CC(C)CN(C)CCSC(C)C 2230a_100000747067_100000730970 [0,1,1,0,0,0|2,0,0]=4 3888 B11R0.6 CC(C)CN(C)CCSC(C)C 269982a_100000747067_100000730970 [0,1,1,0,0,0|2,0,0]=4 3889 B11R0.6 CC(O)CCCC(=O)C[C@@H](C)O 1458a_100011933948_200000718107 [0,1,1,0,0,0|2,0,0]=4 3890 B11R0.6 CC(O)CCCN(C)CC(=O)O 269956a_100000746989_200000718107 [0,1,1,0,0,0|1,0,1]=4 3891 B11R0.6 CC(O)CCCN(C)CC(C)O 2230a_100000227577_200000718107 [0,1,1,0,0,0|0,0,0]=2 3892 B11R0.6 CC(O)CCCN(C)CC(C)O 269982a_100000227577_200000718107 [0,1,1,0,0,0|0,0,0]=2 3893 B11R0.6 CC(O)CN(C)CCCC(=O)N 269982a_100000227577_100102525003 [0,1,1,0,0,0|1,0,1]=4 3894 B11R0.6 CC(O)CN(C)CCCC(=O)O 269956a_100000719178_100011218427 [0,1,1,0,0,0|1,0,1]=4 3895 B11R0.6 CC(O)CN(C)CCCN(C)C 269982a_100000225831_100011218427 [0,1,1,0,0,0|1,0,0]=3 3896 B11R0.6 CC(O)CN(C)CCCN(C)C 269982a_100000227577_100000757444 [0,1,1,0,0,0|1,0,0]=3 3897 B11R0.6 CC(O)CN(C)CCOC(C)C 2230a_100000227577_100000211751 [0,1,1,0,0,0|1,0,0]=3 3898 B11R0.6 CC(O)CN(C)CCOC(C)C 269982a_100000227577_100000211751 [0,1,1,0,0,0|1,0,0]=3 3899 B11R0.6 CC(O)CN(C)CCSC(C)C 2230a_100000227577_100000730970 [0,1,1,0,0,0|1,0,0]=3 3900 B11R0.6 CC(O)CN(C)CCSC(C)C 269982a_100000227577_100000730970 [0,1,1,0,0,0|1,0,0]=3 3901 B11R0.6 C[C@@H](O)CN(C)CCCC(=O)O 269956a_100000719178_100009817552 [0,1,1,0,0,0|1,0,1]=4 3902 B11R0.6 C[C@@H](O)CN(C)CCCN(C)C 269982a_100000225831_100009817552 [0,1,1,0,0,0|1,0,0]=3 3903 B11R0.68 C=C(C)CN(C)C(C)CCCC 2230a_100000225649_200011215066 [0,1,1,0,0,0|1,0,1]=4 3904 B11R0.68 C=C(C)CN(C)C(C)CCCC 269982a_100000225649_200011215066 [0,1,1,0,0,0|1,0,1]=4 3905 B11R0.68 C=C(C)CN(C)C(C)CCCC 270004a_100000225649_100000210087 [0,1,1,0,0,0|1,0,1]=4 3906 B11R0.68 C=CCCC(C)N(C)CC(C)O 270004a_100000227577_100000762624 [0,1,1,0,0,0|0,0,2]=4 3907 B11R0.68 CCCCC(=O)N(C)CC(C)C 11a_100000747067_100000210183 [0,1,1,0,0,0|1,0,1]=4 3908 B11R0.68 CCCCC(=O)N(C)CC(C)C 1626a_100000747067_100000210183 [0,1,1,0,0,0|1,0,1]=4 3909 B11R0.68 CCCCC(=O)N(C)CC(C)C 240690a_100000747067_100000210183 [0,1,1,0,0,0|1,0,1]=4 3910 B11R0.68 CCCCC(=O)N(C)CC(C)C 527a_100000747067_100000210183 [0,1,1,0,0,0|1,0,1]=4 3911 B11R0.68 CCCCC(=O)N(C)CC(C)O 240690a_100000227577_100000210183 [0,1,1,0,0,0|0,0,1]=3 3912 B11R0.68 CCCCC(=O)N(C)CC(C)O 527a_100000227577_100000210183 [0,1,1,0,0,0|0,0,1]=3 3913 B11R0.68 CCCCC(C)C(=O)CC(C)O 1458a_100000725509_100011218427 [0,1,1,0,0,0|2,0,0]=4 3914 B11R0.68 CCCCC(C)C(=O)C[C@@H](C)O 1458a_100011933948_200011215066 [0,1,1,0,0,0|2,0,0]=4 3915 B11R0.68 CCCCC(C)N(C)CC(=O)O 269956a_100000746989_200011215066 [0,1,1,0,0,0|1,0,1]=4 3916 B11R0.68 CCCCC(C)N(C)CC(C)C 2230a_100000747067_200011215066 [0,1,1,0,0,0|1,0,0]=3 3917 B11R0.68 CCCCC(C)N(C)CC(C)C 269982a_100000747067_200011215066 [0,1,1,0,0,0|1,0,0]=3 3918 B11R0.68 CCCCC(C)N(C)CC(C)C 270004a_100000747067_100000210087 [0,1,1,0,0,0|1,0,0]=3 3919 B11R0.68 CCCCC(C)N(C)CC(C)O 2230a_100000227577_200011215066 [0,1,1,0,0,0|0,0,0]=2 3920 B11R0.68 CCCCC(C)N(C)CC(C)O 269982a_100000227577_200011215066 [0,1,1,0,0,0|0,0,0]=2 3921 B11R0.68 CCCCC(C)N(C)CC(C)O 270004a_100000227577_100000210087 [0,1,1,0,0,0|0,0,0]=2 3922 B11R0.68 CCCCC(O)C(=O)CC(C)O 1458a_100000720857_100011218427 [0,1,1,0,0,0|2,0,0]=4 3923 B11R0.68 CCCNC(=O)N(C)CC(C)O 2708a_100020643023_100000227577 [0,1,1,0,0,0|1,0,1]=4 3924 B11R0.68 CCOCC(=O)N(C)CC(C)O 240690a_100000227577_100000211967 [0,1,1,0,0,0|1,0,1]=4 3925 B11R0.68 CCOCC(=O)N(C)CC(C)O 527a_100000227577_100000211967 [0,1,1,0,0,0|1,0,1]=4 3926 B11R0.68 CCSCC(=O)N(C)CC(C)O 240690a_100000227577_100000230394 [0,1,1,0,0,0|1,0,1]=4 3927 B11R0.68 CCSCC(=O)N(C)CC(C)O 527a_100000227577_100000230394 [0,1,1,0,0,0|1,0,1]=4 3928 B11R0.68 CCSCC(C)N(C)CC(C)C 270004a_100000747067_200011216171 [0,1,1,0,0,0|2,0,0]=4 3929 B11R0.68 CCSCC(C)N(C)CC(C)O 270004a_100000227577_200011216171 [0,1,1,0,0,0|1,0,0]=3 3930 B11R0.68 COCCC(=O)N(C)CC(C)O 240690a_100000227577_100000749529 [0,1,1,0,0,0|1,0,1]=4 3931 B11R0.68 COCCC(=O)N(C)CC(C)O 527a_100000227577_100000749529 [0,1,1,0,0,0|1,0,1]=4 3932 B11R0.68 COCCC(C)N(C)CC(C)C 270004a_100000747067_100000742357 [0,1,1,0,0,0|2,0,0]=4 3933 B11R0.68 COCCC(C)N(C)CC(C)O 270004a_100000227577_100000742357 [0,1,1,0,0,0|1,0,0]=3 3934 B11R0.68 CSCCC(=O)N(C)CC(C)O 240690a_100000227577_100000174002 [0,1,1,0,0,0|1,0,1]=4 3935 B11R0.68 CSCCC(=O)N(C)CC(C)O 527a_100000227577_100000174002 [0,1,1,0,0,0|1,0,1]=4 3936 B11R0.68 CSCCC(C)N(C)CC(C)C 270004a_100000747067_100011217047 [0,1,1,0,0,0|2,0,0]=4 3937 B11R0.68 CSCCC(C)N(C)CC(C)O 270004a_100000227577_100011217047 [0,1,1,0,0,0|1,0,0]=3 3938 B11R0.77 C#CCCCN(CC)C[C@H](C)O 2230a_100000729506_100000731252 [0,1,1,0,0,0|0,0,2]=4 3939 B11R0.77 C#CCCCN(CC)C[C@H](C)O 269982a_100000729506_100011215417 [0,1,1,0,0,0|0,0,2]=4 3940 B11R0.77 C=C(C)CN(CC)CCCCC 2230a_100000211296_100000210326 [0,1,1,0,0,0|1,0,1]=4 3941 B11R0.77 C=C(C)CN(CC)CCCCC 269982a_100000211296_100000210215 [0,1,1,0,0,0|1,0,1]=4 3942 B11R0.77 C=CCCCN(CC)C[C@H](C)O 2230a_100000729506_100011713584 [0,1,1,0,0,0|0,0,2]=4 3943 B11R0.77 C=CCCCN(CC)C[C@H](C)O 269982a_100000729506_100000757094 [0,1,1,0,0,0|0,0,2]=4 3944 B11R0.77 CC/C=C\CN(CC)C[C@H](C)O 2230a_100000729506_100103147603 [0,1,1,0,0,0|0,0,2]=4 3945 B11R0.77 CC/C=C\CN(CC)C[C@H](C)O 269982a_100000729506_100103147603 [0,1,1,0,0,0|0,0,2]=4 3946 B11R0.77 CCC#CCN(CC)C[C@H](C)O 2230a_100000729506_100009813939 [0,1,1,0,0,0|0,0,2]=4 3947 B11R0.77 CCCCCN(CC)CC(=O)O 269956a_100000746405_100000210326 [0,1,1,0,0,0|1,0,1]=4 3948 B11R0.77 CCCCCN(CC)CC(C)C 2230a_100000738554_100000210326 [0,1,1,0,0,0|1,0,0]=3 3949 B11R0.77 CCCCCN(CC)CC(C)C 269982a_100000738554_100000210215 [0,1,1,0,0,0|1,0,0]=3 3950 B11R0.77 CCCCCN(CC)C[C@H](C)O 2230a_100000729506_100000210326 [0,1,1,0,0,0|0,0,0]=2 3951 B11R0.77 CCCCCN(CC)C[C@H](C)O 269982a_100000729506_100000210215 [0,1,1,0,0,0|0,0,0]=2 3952 B11R0.77 CCN(CCCC#N)C[C@H](C)O 2230a_100000729506_100000687738 [0,1,1,0,0,0|1,0,1]=4 3953 B11R0.77 CCN(CCCC#N)C[C@H](C)O 269982a_100000729506_100000687738 [0,1,1,0,0,0|1,0,1]=4 3954 B11R0.77 CCN(CCCC=O)C[C@H](C)O 2230a_100000729506_200011292268 [0,1,1,0,0,0|1,0,1]=4 3955 B11R0.77 CCN(CCCC=O)C[C@H](C)O 269982a_100000729506_200011292268 [0,1,1,0,0,0|1,0,1]=4 3956 B11R0.77 CCN(CCCCF)CC(C)C 2230a_100000738554_100000729493 [0,1,1,0,0,0|2,0,0]=4 3957 B11R0.77 CCN(CCCCF)CC(C)C 269982a_100000738554_100000729493 [0,1,1,0,0,0|2,0,0]=4 3958 B11R0.77 CCN(CCCCF)C[C@H](C)O 2230a_100000729506_100000729493 [0,1,1,0,0,0|1,0,0]=3 3959 B11R0.77 CCN(CCCCF)C[C@H](C)O 269982a_100000729506_100000729493 [0,1,1,0,0,0|1,0,0]=3 3960 B11R0.77 CCN(CCCCO)CC(C)C 2230a_100000738554_100000210776 [0,1,1,0,0,0|2,0,0]=4 3961 B11R0.77 CCN(CCCCO)CC(C)C 2230a_100011217355_100000210760 [0,1,1,0,0,0|2,0,0]=4 3962 B11R0.77 CCN(CCCCO)CC(C)C 269982a_100000738554_100000210776 [0,1,1,0,0,0|2,0,0]=4 3963 B11R0.77 CCN(CCCCO)CC(C)C 269982a_100011217355_100000210624 [0,1,1,0,0,0|2,0,0]=4 3964 B11R0.77 CCN(CCCCO)CC(C)C 270004a_100011217355_100000210432 [0,1,1,0,0,0|2,0,0]=4 3965 B11R0.77 CCN(CCCCO)CC(C)O 2230a_100011217355_100011218427 [0,1,1,0,0,0|1,0,0]=3 3966 B11R0.77 CCN(CCCCO)CC(C)O 269982a_100011217355_100011218427 [0,1,1,0,0,0|1,0,0]=3 3967 B11R0.77 CCN(CCCCO)C[C@@H](C)O 2230a_100011217355_100009817552 [0,1,1,0,0,0|1,0,0]=3 3968 B11R0.77 CCN(CCCCO)C[C@@H](C)O 269982a_100011217355_100009817552 [0,1,1,0,0,0|1,0,0]=3 3969 B11R0.77 CCN(CCCCO)C[C@H](C)O 2230a_100000729506_100000210776 [0,1,1,0,0,0|1,0,0]=3 3970 B11R0.77 CCN(CCCCO)C[C@H](C)O 269982a_100000729506_100000210776 [0,1,1,0,0,0|1,0,0]=3 3971 B11R0.77 CCN(CCCOC)CC(C)C 2230a_100000738554_100000740836 [0,1,1,0,0,0|2,0,0]=4 3972 B11R0.77 CCN(CCCOC)CC(C)C 269982a_100000738554_100000740836 [0,1,1,0,0,0|2,0,0]=4 3973 B11R0.77 CCN(CCCOC)C[C@H](C)O 2230a_100000729506_100000740836 [0,1,1,0,0,0|1,0,0]=3 3974 B11R0.77 CCN(CCCOC)C[C@H](C)O 269982a_100000729506_100000740836 [0,1,1,0,0,0|1,0,0]=3 3975 B11R0.77 CCOCCN(CC)CC(C)C 2230a_100000738554_100011215890 [0,1,1,0,0,0|2,0,0]=4 3976 B11R0.77 CCOCCN(CC)CC(C)C 269982a_100000738554_100011215890 [0,1,1,0,0,0|2,0,0]=4 3977 B11R0.77 CCOCCN(CC)C[C@H](C)O 2230a_100000729506_100011215890 [0,1,1,0,0,0|1,0,0]=3 3978 B11R0.77 CCOCCN(CC)C[C@H](C)O 269982a_100000729506_100011215890 [0,1,1,0,0,0|1,0,0]=3 3979 B11R0.77 CCSCCN(CC)CC(C)C 2230a_100000738554_100000757381 [0,1,1,0,0,0|2,0,0]=4 3980 B11R0.77 CCSCCN(CC)CC(C)C 269982a_100000738554_100000757381 [0,1,1,0,0,0|2,0,0]=4 3981 B11R0.77 CCSCCN(CC)C[C@H](C)O 2230a_100000729506_100000757381 [0,1,1,0,0,0|1,0,0]=3 3982 B11R0.77 CCSCCN(CC)C[C@H](C)O 269982a_100000729506_100000757381 [0,1,1,0,0,0|1,0,0]=3 3983 B11R0.107 CCC(C)CCC(=O)CC(C)O 1458a_100000701222_100011218427 [0,1,1,0,0,0|2,0,0]=4 3984 B11R0.107 CNC(=O)CCN(C)CC(C)O 2230a_100000227577_100000737683 [0,1,1,0,0,0|1,0,1]=4 3985 B11R0.107 CNC(=O)CCN(C)CC(C)O 2230a_100000750875_100011218427 [0,1,1,0,0,0|1,0,1]=4 3986 B11R0.107 CNC(=O)CCN(C)CC(C)O 269982a_100000227577_100000737683 [0,1,1,0,0,0|1,0,1]=4 3987 B11R0.107 CNC(=O)CCN(C)CC(C)O 269982a_100000750875_100011218427 [0,1,1,0,0,0|1,0,1]=4 3988 B11R0.107 CNC(=O)CCN(C)C[C@@H](C)O 2230a_100000750875_100009817552 [0,1,1,0,0,0|1,0,1]=4 3989 B11R0.107 CNC(=O)CCN(C)C[C@@H](C)O 269982a_100000750875_100009817552 [0,1,1,0,0,0|1,0,1]=4 3990 B11R0.107 COC(=O)CCN(C)CC(C)O 2230a_100000227577_100000204255 [0,1,1,0,0,0|1,0,1]=4 3991 B11R0.107 COC(=O)CCN(C)CC(C)O 269982a_100000227577_100000204255 [0,1,1,0,0,0|1,0,1]=4 3992 B11R0.107 COC(=O)CCN(C)CC(C)O 269982a_100025711912_100011218427 [0,1,1,0,0,0|1,0,1]=4 3993 B11R0.107 COC(=O)CCN(C)C[C@@H](C)O 269982a_100025711912_100009817552 [0,1,1,0,0,0|1,0,1]=4 3994 B11R0.139 CC(C)C(C)N(C)CCCCF 2230a_100000228512_100000729493 [0,1,1,0,0,0|2,0,0]=4 3995 B11R0.139 CC(C)C(C)N(C)CCCCF 269982a_100000228512_100000729493 [0,1,1,0,0,0|2,0,0]=4 3996 B11R0.139 CC(C)C(C)N(C)CCCCO 2230a_100000228512_100000210776 [0,1,1,0,0,0|2,0,0]=4 3997 B11R0.139 CC(C)C(C)N(C)CCCCO 269982a_100000228512_100000210776 [0,1,1,0,0,0|2,0,0]=4 3998 B11R0.139 CCCCCC(C)C(=O)[C@@H](C)O 1458a_100000717761_200011218191 [0,1,1,0,0,0|1,0,1]=4 3999 B11R0.139 CCCCCC(C)C(=O)[C@H](C)O 1458a_217856618621_200011218191 [0,1,1,0,0,0|1,0,1]=4 4000 B11R0.139 CCCCCN(C)C(=O)C(C)C 11a_100000223495_100000210198 [0,1,1,0,0,0|1,0,1]=4 4001 B11R0.139 CCCCCN(C)C(=O)C(C)C 1626a_100000223495_100000210198 [0,1,1,0,0,0|1,0,1]=4 4002 B11R0.139 CCCCCN(C)C(=O)C(C)C 240690a_100000223495_100000210198 [0,1,1,0,0,0|1,0,1]=4 4003 B11R0.139 CCCCCN(C)C(=O)C(C)C 527a_100000223495_100000210198 [0,1,1,0,0,0|1,0,1]=4 4004 B11R0.139 CCCCCN(C)C(=O)C(C)F 11a_100000223495_100000062450 [0,1,1,0,0,0|1,0,1]=4 4005 B11R0.139 CCCCCN(C)C(=O)C(C)F 1626a_100000223495_100000062450 [0,1,1,0,0,0|1,0,1]=4 4006 B11R0.139 CCCCCN(C)C(=O)C(C)F 240690a_100000223495_100000062450 [0,1,1,0,0,0|1,0,1]=4 4007 B11R0.139 CCCCCN(C)C(=O)C(C)F 527a_100000223495_100000062450 [0,1,1,0,0,0|1,0,1]=4 4008 B11R0.139 CCCCCN(C)C(=O)C(O)O 240690a_100000223495_100000233687 [0,1,1,0,0,0|1,0,1]=4 4009 B11R0.139 CCCCCN(C)C(=O)[C@@H](C)O 240690a_100000223495_100000717761 [0,1,1,0,0,0|0,0,1]=3 4010 B11R0.139 CCCCCN(C)C(=O)[C@H](C)O 1626a_100000223495_217856618621 [0,1,1,0,0,0|0,0,1]=3 4011 B11R0.139 CCCCCN(C)C(=O)[C@H](C)O 240690a_100000223495_217856618621 [0,1,1,0,0,0|0,0,1]=3 4012 B11R0.139 CCCCCN(C)C(C)C(=O)C 2230a_100000223495_100009814033 [0,1,1,0,0,0|0,0,2]=4 4013 B11R0.139 CCCCCN(C)C(C)C(=O)C 269982a_100000223495_100009814033 [0,1,1,0,0,0|0,0,2]=4 4014 B11R0.139 CCCCCN(C)C(C)C(=O)O 269956a_100000749554_100000210326 [0,1,1,0,0,0|1,0,1]=4 4015 B11R0.139 CCCCCN(C)C(C)C(C)C 2230a_100000228512_100000210326 [0,1,1,0,0,0|1,0,0]=3 4016 B11R0.139 CCCCCN(C)C(C)C(C)C 269982a_100000228512_100000210215 [0,1,1,0,0,0|1,0,0]=3 4017 B11R0.139 CCOCCN(C)C(C)C(C)C 2230a_100000228512_100011215890 [0,1,1,0,0,0|2,0,0]=4 4018 B11R0.139 CCOCCN(C)C(C)C(C)C 269982a_100000228512_100011215890 [0,1,1,0,0,0|2,0,0]=4 4019 B11R0.139 CCSCCN(C)C(C)C(C)C 2230a_100000228512_100000757381 [0,1,1,0,0,0|2,0,0]=4 4020 B11R0.139 CCSCCN(C)C(C)C(C)C 269982a_100000228512_100000757381 [0,1,1,0,0,0|2,0,0]=4 4021 B11R0.139 COCCCN(C)C(=O)[C@@H](C)O 240690a_100000224831_100000717761 [0,1,1,0,0,0|1,0,1]=4 4022 B11R0.139 COCCCN(C)C(=O)[C@H](C)O 1626a_100000224831_217856618621 [0,1,1,0,0,0|1,0,1]=4 4023 B11R0.139 COCCCN(C)C(=O)[C@H](C)O 240690a_100000224831_217856618621 [0,1,1,0,0,0|1,0,1]=4 4024 B11R0.139 COCCCN(C)C(C)C(C)C 2230a_100000228512_100000740836 [0,1,1,0,0,0|2,0,0]=4 4025 B11R0.139 COCCCN(C)C(C)C(C)C 269982a_100000228512_100000740836 [0,1,1,0,0,0|2,0,0]=4 4026 B11R0.139 C[C@@H](O)C(=O)N(C)CCCCO 240690a_100000717598_100000717761 [0,1,1,0,0,0|1,0,1]=4 4027 B11R0.139 C[C@H](O)C(=O)N(C)CCCCO 240690a_100000717598_217856618621 [0,1,1,0,0,0|1,0,1]=4 4028 B11R0.154 C#CCCCN(C)CC(O)CO 2230a_100011216503_100000731252 [0,1,1,0,0,0|0,0,2]=4 4029 B11R0.154 C#CCCCN(C)CC(O)CO 269982a_100011216503_100011215417 [0,1,1,0,0,0|0,0,2]=4 4030 B11R0.154 C=CC(O)CN(C)CCCCC 2230a_100000223495_100000730141 [0,1,1,0,0,0|0,0,1]=3 4031 B11R0.154 C=CC(O)CN(C)CCCCO 2230a_100000717598_100000730141 [0,1,1,0,0,0|1,0,1]=4 4032 B11R0.154 C=CC(O)CN(C)CCCOC 2230a_100000224831_100000730141 [0,1,1,0,0,0|1,0,1]=4 4033 B11R0.154 C=CCCCN(C)CC(O)CO 2230a_100011216503_100011713584 [0,1,1,0,0,0|0,0,2]=4 4034 B11R0.154 C=CCCCN(C)CC(O)CO 269982a_100011216503_100000757094 [0,1,1,0,0,0|0,0,2]=4 4035 B11R0.154 CC/C=C\CN(C)CC(O)CO 2230a_100011216503_100103147603 [0,1,1,0,0,0|0,0,2]=4 4036 B11R0.154 CC/C=C\CN(C)CC(O)CO 269982a_100011216503_100103147603 [0,1,1,0,0,0|0,0,2]=4 4037 B11R0.154 CCC#CCN(C)CC(O)CO 2230a_100011216503_100009813939 [0,1,1,0,0,0|0,0,2]=4 4038 B11R0.154 CCC(C)CN(C)CCCCF 2230a_100000753921_100000729493 [0,1,1,0,0,0|2,0,0]=4 4039 B11R0.154 CCC(C)CN(C)CCCCF 269982a_100000753921_100000729493 [0,1,1,0,0,0|2,0,0]=4 4040 B11R0.154 CCC(C)CN(C)CCCCO 2230a_100000717598_100000748023 [0,1,1,0,0,0|2,0,0]=4 4041 B11R0.154 CCC(C)CN(C)CCCCO 2230a_100000753921_100000210776 [0,1,1,0,0,0|2,0,0]=4 4042 B11R0.154 CCC(C)CN(C)CCCCO 269982a_100000717598_100000748023 [0,1,1,0,0,0|2,0,0]=4 4043 B11R0.154 CCC(C)CN(C)CCCCO 269982a_100000753921_100000210776 [0,1,1,0,0,0|2,0,0]=4 4044 B11R0.154 CCC(C)CN(C)CCCCO 270004a_100000717598_100000243153 [0,1,1,0,0,0|2,0,0]=4 4045 B11R0.154 CCC(C)CN(C)CCCOC 2230a_100000224831_100000748023 [0,1,1,0,0,0|2,0,0]=4 4046 B11R0.154 CCC(C)CN(C)CCCOC 2230a_100000753921_100000740836 [0,1,1,0,0,0|2,0,0]=4 4047 B11R0.154 CCC(C)CN(C)CCCOC 269982a_100000224831_100000748023 [0,1,1,0,0,0|2,0,0]=4 4048 B11R0.154 CCC(C)CN(C)CCCOC 269982a_100000753921_100000740836 [0,1,1,0,0,0|2,0,0]=4 4049 B11R0.154 CCC(C)CN(C)CCCOC 270004a_100000224831_100000243153 [0,1,1,0,0,0|2,0,0]=4 4050 B11R0.154 CCC(O)CN(C)CCCCO 2230a_100000717598_100011218378 [0,1,1,0,0,0|1,0,0]=3 4051 B11R0.154 CCC(O)CN(C)CCCCO 269982a_100000717598_100011218378 [0,1,1,0,0,0|1,0,0]=3 4052 B11R0.154 CCC(O)CN(C)CCCOC 2230a_100000224831_100011218378 [0,1,1,0,0,0|1,0,0]=3 4053 B11R0.154 CCC(O)CN(C)CCCOC 269982a_100000224831_100011218378 [0,1,1,0,0,0|1,0,0]=3 4054 B11R0.154 CCCCCC(=O)CC(O)CC 1458a_100000212188_100011218378 [0,1,1,0,0,0|2,0,0]=4 4055 B11R0.154 CCCCCC(=O)CC(O)CC 1458a_100011667805_100000210326 [0,1,1,0,0,0|2,0,0]=4 4056 B11R0.154 CCCCCC(=O)C[C@@H](C)CO 1458a_100000212188_100000059175 [0,1,1,0,0,0|2,0,0]=4 4057 B11R0.154 CCCCCC(C)NC(C)CO 2230a_100000211957_100012180447 [0,1,1,0,0,0|2,0,0]=4 4058 B11R0.154 CCCCCC(C)N[C@H](C)CO 2230a_100000737577_200011218191 [0,1,1,0,0,0|2,0,0]=4 4059 B11R0.154 CCCCCC(C)N[C@H](C)CO 270004a_100000737577_100000211708 [0,1,1,0,0,0|2,0,0]=4 4060 B11R0.154 CCCCCC(C)OC(C)CO 34a_100011215632_100012180447 [0,1,1,0,0,0|2,0,0]=4 4061 B11R0.154 CCCCCC(C)OC(C)CO 7a_100011215632_100012180447 [0,1,1,0,0,0|2,0,0]=4 4062 B11R0.154 CCCCCC(C)SC(C)CO 62a_100012180447_200011218191 [0,1,1,0,0,0|2,0,0]=4 4063 B11R0.154 CCCCCC(C)SC(C)OC 62a_100009879195_200011218191 [0,1,1,0,0,0|2,0,0]=4 4064 B11R0.154 CCCCCC(C)SC(C)OC 62a_200011218191_100009879195 [0,1,1,0,0,0|2,0,0]=4 4065 B11R0.154 CCCCCC(C)S[C@H](C)CO 62a_100016084084_200011218191 [0,1,1,0,0,0|2,0,0]=4 4066 B11R0.154 CCCCCC(C)S[C@H](C)CO 62a_200011218191_100016084084 [0,1,1,0,0,0|2,0,0]=4 4067 B11R0.154 CCCCCN(C)CC(=O)CC 269982a_100000223495_100000747405 [0,1,1,0,0,0|0,0,2]=4 4068 B11R0.154 CCCCCN(C)CC(=O)NC 2230a_100000189611_100000210326 [0,1,1,0,0,0|0,0,2]=4 4069 B11R0.154 CCCCCN(C)CC(=O)NC 2230a_100000223495_100000183359 [0,1,1,0,0,0|0,0,2]=4 4070 B11R0.154 CCCCCN(C)CC(=O)NC 269982a_100000223495_100000183359 [0,1,1,0,0,0|0,0,2]=4 4071 B11R0.154 CCCCCN(C)CC(=O)OC 2230a_100000198492_100000210326 [0,1,1,0,0,0|0,0,2]=4 4072 B11R0.154 CCCCCN(C)CC(=O)OC 2230a_100000223495_100000747449 [0,1,1,0,0,0|0,0,2]=4 4073 B11R0.154 CCCCCN(C)CC(=O)OC 269982a_100000223495_100000747449 [0,1,1,0,0,0|0,0,2]=4 4074 B11R0.154 CCCCCN(C)CC(C)CC 2230a_100000223495_100000748023 [0,1,1,0,0,0|1,0,0]=3 4075 B11R0.154 CCCCCN(C)CC(C)CC 2230a_100000753921_100000210326 [0,1,1,0,0,0|1,0,0]=3 4076 B11R0.154 CCCCCN(C)CC(C)CC 269982a_100000223495_100000748023 [0,1,1,0,0,0|1,0,0]=3 4077 B11R0.154 CCCCCN(C)CC(C)CC 269982a_100000753921_100000210215 [0,1,1,0,0,0|1,0,0]=3 4078 B11R0.154 CCCCCN(C)CC(C)CC 270004a_100000223495_100000243153 [0,1,1,0,0,0|1,0,0]=3 4079 B11R0.154 CCCCCN(C)CC(O)CC 2230a_100000223495_100011218378 [0,1,1,0,0,0|0,0,0]=2 4080 B11R0.154 CCCCCN(C)CC(O)CC 269982a_100000223495_100011218378 [0,1,1,0,0,0|0,0,0]=2 4081 B11R0.154 CCCCCN(C)CC(O)CO 2230a_100000223495_100011219619 [0,1,1,0,0,0|0,0,0]=2 4082 B11R0.154 CCCCCN(C)CC(O)CO 2230a_100011216503_100000210326 [0,1,1,0,0,0|0,0,0]=2 4083 B11R0.154 CCCCCN(C)CC(O)CO 269982a_100011216503_100000210215 [0,1,1,0,0,0|0,0,0]=2 4084 B11R0.154 CCCCCN(C)C[C@@H](C)CC 2230a_100000223495_100009816398 [0,1,1,0,0,0|1,0,0]=3 4085 B11R0.154 CCCCCN(C)C[C@@H](C)CC 269982a_100000223495_100009816398 [0,1,1,0,0,0|1,0,0]=3 4086 B11R0.154 CCCCCN(C)C[C@@H](C)CO 2230a_100000223495_100000059175 [0,1,1,0,0,0|0,0,0]=2 4087 B11R0.154 CCCCCN(C)C[C@@H](C)CO 269982a_100000223495_100000059175 [0,1,1,0,0,0|0,0,0]=2 4088 B11R0.154 CCCCCN(C)C[C@@H](O)CF 2230a_100000223495_100015614560 [0,1,1,0,0,0|0,0,0]=2 4089 B11R0.154 CCCCCN(C)C[C@@H](O)CO 2230a_100000223495_100009815848 [0,1,1,0,0,0|0,0,0]=2 4090 B11R0.154 CCOCCN(C)CC(C)CC 2230a_100000753921_100011215890 [0,1,1,0,0,0|2,0,0]=4 4091 B11R0.154 CCOCCN(C)CC(C)CC 269982a_100000753921_100011215890 [0,1,1,0,0,0|2,0,0]=4 4092 B11R0.154 CCOCCN(C)CC(O)CO 2230a_100011216503_100011215890 [0,1,1,0,0,0|1,0,0]=3 4093 B11R0.154 CCOCCN(C)CC(O)CO 269982a_100011216503_100011215890 [0,1,1,0,0,0|1,0,0]=3 4094 B11R0.154 CCSCCN(C)CC(C)CC 2230a_100000753921_100000757381 [0,1,1,0,0,0|2,0,0]=4 4095 B11R0.154 CCSCCN(C)CC(C)CC 269982a_100000753921_100000757381 [0,1,1,0,0,0|2,0,0]=4 4096 B11R0.154 CCSCCN(C)CC(O)CO 2230a_100011216503_100000757381 [0,1,1,0,0,0|1,0,0]=3 4097 B11R0.154 CCSCCN(C)CC(O)CO 269982a_100011216503_100000757381 [0,1,1,0,0,0|1,0,0]=3 4098 B11R0.154 CC[C@H](C)CN(C)CCCCO 2230a_100000717598_100009816398 [0,1,1,0,0,0|2,0,0]=4 4099 B11R0.154 CC[C@H](C)CN(C)CCCCO 269982a_100000717598_100009816398 [0,1,1,0,0,0|2,0,0]=4 4100 B11R0.154 CC[C@H](C)CN(C)CCCOC 2230a_100000224831_100009816398 [0,1,1,0,0,0|2,0,0]=4 4101 B11R0.154 CC[C@H](C)CN(C)CCCOC 269982a_100000224831_100009816398 [0,1,1,0,0,0|2,0,0]=4 4102 B11R0.154 CN(CCCC#N)CC(O)CO 2230a_100011216503_100000687738 [0,1,1,0,0,0|1,0,1]=4 4103 B11R0.154 CN(CCCC#N)CC(O)CO 269982a_100011216503_100000687738 [0,1,1,0,0,0|1,0,1]=4 4104 B11R0.154 CN(CCCC=O)CC(O)CO 2230a_100011216503_200011292268 [0,1,1,0,0,0|1,0,1]=4 4105 B11R0.154 CN(CCCC=O)CC(O)CO 269982a_100011216503_200011292268 [0,1,1,0,0,0|1,0,1]=4 4106 B11R0.154 CN(CCCCF)CC(O)CO 2230a_100011216503_100000729493 [0,1,1,0,0,0|1,0,0]=3 4107 B11R0.154 CN(CCCCF)CC(O)CO 269982a_100011216503_100000729493 [0,1,1,0,0,0|1,0,0]=3 4108 B11R0.154 CN(CCCCO)CC(O)CO 2230a_100000717598_100011219619 [0,1,1,0,0,0|1,0,0]=3 4109 B11R0.154 CN(CCCCO)CC(O)CO 2230a_100011216503_100000210776 [0,1,1,0,0,0|1,0,0]=3 4110 B11R0.154 CN(CCCCO)CC(O)CO 269982a_100011216503_100000210776 [0,1,1,0,0,0|1,0,0]=3 4111 B11R0.154 CN(CCCCO)C[C@@H](O)CF 2230a_100000717598_100015614560 [0,1,1,0,0,0|1,0,0]=3 4112 B11R0.154 CN(CCCCO)C[C@@H](O)CO 2230a_100000717598_100009815848 [0,1,1,0,0,0|1,0,0]=3 4113 B11R0.154 COCCCN(C)CC(O)CO 2230a_100000224831_100011219619 [0,1,1,0,0,0|1,0,0]=3 4114 B11R0.154 COCCCN(C)CC(O)CO 2230a_100011216503_100000740836 [0,1,1,0,0,0|1,0,0]=3 4115 B11R0.154 COCCCN(C)CC(O)CO 269982a_100011216503_100000740836 [0,1,1,0,0,0|1,0,0]=3 4116 B11R0.154 COCCCN(C)C[C@@H](C)CO 2230a_100000224831_100000059175 [0,1,1,0,0,0|1,0,0]=3 4117 B11R0.154 COCCCN(C)C[C@@H](C)CO 269982a_100000224831_100000059175 [0,1,1,0,0,0|1,0,0]=3 4118 B11R0.154 COCCCN(C)C[C@@H](O)CF 2230a_100000224831_100015614560 [0,1,1,0,0,0|1,0,0]=3 4119 B11R0.154 COCCCN(C)C[C@@H](O)CO 2230a_100000224831_100009815848 [0,1,1,0,0,0|1,0,0]=3 4120 B11R0.154 C[C@@H](CO)CN(C)CCCCO 2230a_100000717598_100000059175 [0,1,1,0,0,0|1,0,0]=3 4121 B11R0.154 C[C@@H](CO)CN(C)CCCCO 269982a_100000717598_100000059175 [0,1,1,0,0,0|1,0,0]=3 4122 B11R0.165 C#CCCCN(C)CC(C)(C)O 2230a_100000755907_100000731252 [0,1,1,0,0,0|0,0,2]=4 4123 B11R0.165 C#CCCCN(C)CC(C)(C)O 269982a_100000755907_100011215417 [0,1,1,0,0,0|0,0,2]=4 4124 B11R0.165 C=CCCCN(C)CC(C)(C)O 2230a_100000755907_100011713584 [0,1,1,0,0,0|0,0,2]=4 4125 B11R0.165 C=CCCCN(C)CC(C)(C)O 269982a_100000755907_100000757094 [0,1,1,0,0,0|0,0,2]=4 4126 B11R0.165 CC/C=C\CN(C)CC(C)(C)O 2230a_100000755907_100103147603 [0,1,1,0,0,0|0,0,2]=4 4127 B11R0.165 CC/C=C\CN(C)CC(C)(C)O 269982a_100000755907_100103147603 [0,1,1,0,0,0|0,0,2]=4 4128 B11R0.165 CCC#CCN(C)CC(C)(C)O 2230a_100000755907_100009813939 [0,1,1,0,0,0|0,0,2]=4 4129 B11R0.165 CCCCCC(=O)CC(C)(C)O 1458a_100000693243_100000210326 [0,1,1,0,0,0|2,0,0]=4 4130 B11R0.165 CCCCCN(C)CC(C)(C)C 2230a_100000742839_100000210326 [0,1,1,0,0,0|1,0,0]=3 4131 B11R0.165 CCCCCN(C)CC(C)(C)C 269982a_100000742839_100000210215 [0,1,1,0,0,0|1,0,0]=3 4132 B11R0.165 CCCCCN(C)CC(C)(C)C 270004a_100000223495_100011204126 [0,1,1,0,0,0|1,0,0]=3 4133 B11R0.165 CCCCCN(C)CC(C)(C)O 2230a_100000755907_100000210326 [0,1,1,0,0,0|0,0,0]=2 4134 B11R0.165 CCCCCN(C)CC(C)(C)O 269982a_100000755907_100000210215 [0,1,1,0,0,0|0,0,0]=2 4135 B11R0.165 CCCCCN(C)CC(F)(F)F 2230a_100000223495_100000763148 [0,1,1,0,0,0|2,0,0]=4 4136 B11R0.165 CCCCCN(C)CC(F)(F)F 2230a_100000738877_100000210326 [0,1,1,0,0,0|2,0,0]=4 4137 B11R0.165 CCCCCN(C)C[N+](C)(C)C 269982a_100000223495_200000036245 [0,1,1,0,0,0|2,0,0]=4 4138 B11R0.165 CCCCCN(C)C[Si](C)(C)C 2230a_100000223495_100000037933 [0,1,1,0,0,0|1,1,0]=4 4139 B11R0.165 CCCCCN(C)C[Si](C)(C)C 269982a_200020589227_100000210215 [0,1,1,0,0,0|1,1,0]=4 4140 B11R0.165 CCOCCN(C)CC(C)(C)C 2230a_100000742839_100011215890 [0,1,1,0,0,0|2,0,0]=4 4141 B11R0.165 CCOCCN(C)CC(C)(C)C 269982a_100000742839_100011215890 [0,1,1,0,0,0|2,0,0]=4 4142 B11R0.165 CCOCCN(C)CC(C)(C)O 2230a_100000755907_100011215890 [0,1,1,0,0,0|1,0,0]=3 4143 B11R0.165 CCOCCN(C)CC(C)(C)O 269982a_100000755907_100011215890 [0,1,1,0,0,0|1,0,0]=3 4144 B11R0.165 CCSCCN(C)CC(C)(C)C 2230a_100000742839_100000757381 [0,1,1,0,0,0|2,0,0]=4 4145 B11R0.165 CCSCCN(C)CC(C)(C)C 269982a_100000742839_100000757381 [0,1,1,0,0,0|2,0,0]=4 4146 B11R0.165 CCSCCN(C)CC(C)(C)O 2230a_100000755907_100000757381 [0,1,1,0,0,0|1,0,0]=3 4147 B11R0.165 CCSCCN(C)CC(C)(C)O 269982a_100000755907_100000757381 [0,1,1,0,0,0|1,0,0]=3 4148 B11R0.165 CN(CCCC#N)CC(C)(C)O 2230a_100000755907_100000687738 [0,1,1,0,0,0|1,0,1]=4 4149 B11R0.165 CN(CCCC#N)CC(C)(C)O 269982a_100000755907_100000687738 [0,1,1,0,0,0|1,0,1]=4 4150 B11R0.165 CN(CCCC=O)CC(C)(C)O 2230a_100000755907_200011292268 [0,1,1,0,0,0|1,0,1]=4 4151 B11R0.165 CN(CCCC=O)CC(C)(C)O 269982a_100000755907_200011292268 [0,1,1,0,0,0|1,0,1]=4 4152 B11R0.165 CN(CCCCF)CC(C)(C)C 2230a_100000742839_100000729493 [0,1,1,0,0,0|2,0,0]=4 4153 B11R0.165 CN(CCCCF)CC(C)(C)C 269982a_100000742839_100000729493 [0,1,1,0,0,0|2,0,0]=4 4154 B11R0.165 CN(CCCCF)CC(C)(C)O 2230a_100000755907_100000729493 [0,1,1,0,0,0|1,0,0]=3 4155 B11R0.165 CN(CCCCF)CC(C)(C)O 269982a_100000755907_100000729493 [0,1,1,0,0,0|1,0,0]=3 4156 B11R0.165 CN(CCCCO)CC(C)(C)C 2230a_100000742839_100000210776 [0,1,1,0,0,0|2,0,0]=4 4157 B11R0.165 CN(CCCCO)CC(C)(C)C 269982a_100000742839_100000210776 [0,1,1,0,0,0|2,0,0]=4 4158 B11R0.165 CN(CCCCO)CC(C)(C)C 270004a_100000717598_100011204126 [0,1,1,0,0,0|2,0,0]=4 4159 B11R0.165 CN(CCCCO)CC(C)(C)O 2230a_100000755907_100000210776 [0,1,1,0,0,0|1,0,0]=3 4160 B11R0.165 CN(CCCCO)CC(C)(C)O 269982a_100000755907_100000210776 [0,1,1,0,0,0|1,0,0]=3 4161 B11R0.165 COCCCN(C)CC(C)(C)C 2230a_100000742839_100000740836 [0,1,1,0,0,0|2,0,0]=4 4162 B11R0.165 COCCCN(C)CC(C)(C)C 269982a_100000742839_100000740836 [0,1,1,0,0,0|2,0,0]=4 4163 B11R0.165 COCCCN(C)CC(C)(C)C 270004a_100000224831_100011204126 [0,1,1,0,0,0|2,0,0]=4 4164 B11R0.165 COCCCN(C)CC(C)(C)O 2230a_100000755907_100000740836 [0,1,1,0,0,0|1,0,0]=3 4165 B11R0.165 COCCCN(C)CC(C)(C)O 269982a_100000755907_100000740836 [0,1,1,0,0,0|1,0,0]=3 4166 B11R0.35 C#CCN(CC(C)O)CC(C)O 2230a_100011218400_100000038162 [0,1,1,0,0,0|0,0,2]=4 4167 B11R0.35 C=C(C)CN(CCO)CC(C)O 2230a_100000731851_100000748629 [0,1,1,0,0,0|1,0,1]=4 4168 B11R0.35 C=C(C)CN(CCO)CC(C)O 269982a_100000731851_100000748629 [0,1,1,0,0,0|1,0,1]=4 4169 B11R0.35 C=CCN(CC(C)O)CC(C)O 2230a_100011218400_100000210623 [0,1,1,0,0,0|0,0,2]=4 4170 B11R0.35 C=CCN(CC(C)O)CC(C)O 269982a_100011218400_100000210623 [0,1,1,0,0,0|0,0,2]=4 4171 B11R0.35 CC(C)CN(CCF)CC(C)C 2230a_100000201412_100011217306 [0,1,1,0,0,0|2,0,0]=4 4172 B11R0.35 CC(C)CN(CCF)CC(C)C 269982a_100000201412_100011217306 [0,1,1,0,0,0|2,0,0]=4 4173 B11R0.35 CC(C)CN(CCF)CC(C)C 34a_100000201412_100011217306 [0,1,1,0,0,0|2,0,0]=4 4174 B11R0.35 CC(C)CN(CCO)CC(C)C 2230a_100000201412_100000211926 [0,1,1,0,0,0|2,0,0]=4 4175 B11R0.35 CC(C)CN(CCO)CC(C)C 2230a_100015185251_100000210760 [0,1,1,0,0,0|2,0,0]=4 4176 B11R0.35 CC(C)CN(CCO)CC(C)C 269982a_100000201412_100000211926 [0,1,1,0,0,0|2,0,0]=4 4177 B11R0.35 CC(C)CN(CCO)CC(C)C 269982a_100015185251_100000210624 [0,1,1,0,0,0|2,0,0]=4 4178 B11R0.35 CC(C)CN(CCO)CC(C)C 270004a_100015185251_100000210432 [0,1,1,0,0,0|2,0,0]=4 4179 B11R0.35 CC(C)CN(CCO)CC(C)C 34a_100000201412_100000211926 [0,1,1,0,0,0|2,0,0]=4 4180 B11R0.35 CC(C)CN(CCO)CC(C)O 2230a_100000731851_100000210760 [0,1,1,0,0,0|1,0,0]=3 4181 B11R0.35 CC(C)CN(CCO)CC(C)O 2230a_100015185251_100011218427 [0,1,1,0,0,0|1,0,0]=3 4182 B11R0.35 CC(C)CN(CCO)CC(C)O 269982a_100000731851_100000210624 [0,1,1,0,0,0|1,0,0]=3 4183 B11R0.35 CC(C)CN(CCO)CC(C)O 269982a_100015185251_100011218427 [0,1,1,0,0,0|1,0,0]=3 4184 B11R0.35 CC(C)CN(CCO)C[C@@H](C)O 2230a_100015185251_100009817552 [0,1,1,0,0,0|1,0,0]=3 4185 B11R0.35 CC(C)CN(CCO)C[C@@H](C)O 269982a_100015185251_100009817552 [0,1,1,0,0,0|1,0,0]=3 4186 B11R0.35 CC(O)CN(CC#N)CC(C)O 2230a_100011218400_100011215382 [0,1,1,0,0,0|1,0,1]=4 4187 B11R0.35 CC(O)CN(CC#N)CC(C)O 269982a_100011218400_100011214920 [0,1,1,0,0,0|1,0,1]=4 4188 B11R0.35 CC(O)CN(CC=O)CC(C)O 2230a_100011218400_200015260668 [0,1,1,0,0,0|1,0,1]=4 4189 B11R0.35 CC(O)CN(CC=O)CC(C)O 269982a_100011218400_200015260668 [0,1,1,0,0,0|1,0,1]=4 4190 B11R0.35 CC(O)CN(CCF)CC(C)O 2230a_100011218400_100011217306 [0,1,1,0,0,0|1,0,0]=3 4191 B11R0.35 CC(O)CN(CCF)CC(C)O 269982a_100011218400_100011217306 [0,1,1,0,0,0|1,0,0]=3 4192 B11R0.35 CC(O)CN(CCO)CC(C)O 2230a_100000731851_100011218427 [0,1,1,0,0,0|1,0,0]=3 4193 B11R0.35 CC(O)CN(CCO)CC(C)O 2230a_100011218400_100000211926 [0,1,1,0,0,0|1,0,0]=3 4194 B11R0.35 CC(O)CN(CCO)CC(C)O 269982a_100000731851_100011218427 [0,1,1,0,0,0|1,0,0]=3 4195 B11R0.35 CC(O)CN(CCO)CC(C)O 269982a_100011218400_100000211926 [0,1,1,0,0,0|1,0,0]=3 4196 B11R0.35 CC(O)CN(CCO)CC(F)F 2230a_100000731851_100011934356 [0,1,1,0,0,0|2,0,0]=4 4197 B11R0.35 CC(O)CN(CCO)CC(F)F 269982a_100000731851_100011934356 [0,1,1,0,0,0|2,0,0]=4 4198 B11R0.35 CC(O)CN(CCO)C[C@@H](C)O 2230a_100000731851_100009817552 [0,1,1,0,0,0|1,0,0]=3 4199 B11R0.35 CC(O)CN(CCO)C[C@@H](C)O 269982a_100000731851_100009817552 [0,1,1,0,0,0|1,0,0]=3 4200 B11R0.35 CCCN(CC(C)C)CC(C)C 2230a_100000201412_100000210303 [0,1,1,0,0,0|1,0,0]=3 4201 B11R0.35 CCCN(CC(C)C)CC(C)C 269982a_100000201412_100000210303 [0,1,1,0,0,0|1,0,0]=3 4202 B11R0.35 CCCN(CC(C)C)CC(C)C 34a_100000201412_100000210303 [0,1,1,0,0,0|1,0,0]=3 4203 B11R0.35 CCCN(CC(C)O)CC(C)O 2230a_100011218400_100000210303 [0,1,1,0,0,0|0,0,0]=2 4204 B11R0.35 CCCN(CC(C)O)CC(C)O 269982a_100011218400_100000210303 [0,1,1,0,0,0|0,0,0]=2 4205 B11R0.35 COCN(CC(C)C)CC(C)C 2230a_100000201412_100000766300 [0,1,1,0,0,0|2,0,0]=4 4206 B11R0.35 COCN(CC(C)C)CC(C)C 269982a_100000201412_100000766300 [0,1,1,0,0,0|2,0,0]=4 4207 B11R0.35 COCN(CC(C)O)CC(C)O 2230a_100011218400_100000766300 [0,1,1,0,0,0|1,0,0]=3 4208 B11R0.35 COCN(CC(C)O)CC(C)O 269982a_100011218400_100000766300 [0,1,1,0,0,0|1,0,0]=3 4209 B11R0.35 CSCN(CC(C)C)CC(C)C 2230a_100000201412_100011218213 [0,1,1,0,0,0|2,0,0]=4 4210 B11R0.35 CSCN(CC(C)C)CC(C)C 269982a_100000201412_100011218213 [0,1,1,0,0,0|2,0,0]=4 4211 B11R0.35 CSCN(CC(C)C)CC(C)C 34a_100000201412_100011218213 [0,1,1,0,0,0|2,0,0]=4 4212 B11R0.35 CSCN(CC(C)O)CC(C)O 2230a_100011218400_100011218213 [0,1,1,0,0,0|1,0,0]=3 4213 B11R0.35 CSCN(CC(C)O)CC(C)O 269982a_100011218400_100011218213 [0,1,1,0,0,0|1,0,0]=3 4214 B11R0.39 C=C(C)CN(CCC)C(C)CC 2230a_200011216551_100000748629 [0,1,1,0,0,0|1,0,1]=4 4215 B11R0.39 C=C(C)CN(CCC)C(C)CC 269982a_200011216551_100000748629 [0,1,1,0,0,0|1,0,1]=4 4216 B11R0.39 CC(O)CN(CCO)C(C)CO 2230a_100000731851_100012180447 [0,1,1,0,0,0|2,0,0]=4 4217 B11R0.39 CC(O)CN(CCO)[C@H](C)CO 269982a_100000731851_100016084084 [0,1,1,0,0,0|2,0,0]=4 4218 B11R0.39 CCC(=O)N(CCO)CC(C)O 240690a_100000731851_100000210414 [0,1,1,0,0,0|1,0,1]=4 4219 B11R0.39 CCC(=O)N(CCO)CC(C)O 527a_100000731851_100000210414 [0,1,1,0,0,0|1,0,1]=4 4220 B11R0.39 CCC(C)N(CCO)CC(C)C 2230a_100015185251_100000758301 [0,1,1,0,0,0|2,0,0]=4 4221 B11R0.39 CCC(C)N(CCO)CC(C)C 269982a_100015185251_100000758301 [0,1,1,0,0,0|2,0,0]=4 4222 B11R0.39 CCC(C)N(CCO)CC(C)O 2230a_100000731851_100000758301 [0,1,1,0,0,0|1,0,0]=3 4223 B11R0.39 CCC(C)N(CCO)CC(C)O 269982a_100000731851_100000758301 [0,1,1,0,0,0|1,0,0]=3 4224 B11R0.39 CCCN(CC(C)C)C(C)CC 2230a_200011216551_100000210760 [0,1,1,0,0,0|1,0,0]=3 4225 B11R0.39 CCCN(CC(C)C)C(C)CC 269982a_200011216551_100000210624 [0,1,1,0,0,0|1,0,0]=3 4226 B11R0.39 CCCN(CC(C)C)C(C)CC 270004a_200011216551_100000210432 [0,1,1,0,0,0|1,0,0]=3 4227 B11R0.39 CCCN(CC(C)C)C(C)CO 2230a_100011303929_100000210760 [0,1,1,0,0,0|2,0,0]=4 4228 B11R0.39 CCCN(CC(C)C)C(C)CO 269982a_100011303929_100000210624 [0,1,1,0,0,0|2,0,0]=4 4229 B11R0.39 CCCN(CC(C)C)C(C)CO 270004a_100011303929_100000210432 [0,1,1,0,0,0|2,0,0]=4 4230 B11R0.39 CCCN(CC(C)O)C(C)CC 2230a_200011216551_100011218427 [0,1,1,0,0,0|0,0,0]=2 4231 B11R0.39 CCCN(CC(C)O)C(C)CC 269982a_200011216551_100011218427 [0,1,1,0,0,0|0,0,0]=2 4232 B11R0.39 CCCN(CC(C)O)C(C)CO 2230a_100011303929_100011218427 [0,1,1,0,0,0|1,0,0]=3 4233 B11R0.39 CCCN(CC(C)O)C(C)CO 269982a_100011303929_100011218427 [0,1,1,0,0,0|1,0,0]=3 4234 B11R0.39 CCCN(CC(F)F)C(C)CC 2230a_200011216551_100011934356 [0,1,1,0,0,0|2,0,0]=4 4235 B11R0.39 CCCN(CC(F)F)C(C)CC 269982a_200011216551_100011934356 [0,1,1,0,0,0|2,0,0]=4 4236 B11R0.39 CCCN(C[C@@H](C)O)C(C)CC 2230a_200011216551_100009817552 [0,1,1,0,0,0|0,0,0]=2 4237 B11R0.39 CCCN(C[C@@H](C)O)C(C)CC 269982a_200011216551_100009817552 [0,1,1,0,0,0|0,0,0]=2 4238 B11R0.39 CCCN(C[C@@H](C)O)C(C)CO 2230a_100011303929_100009817552 [0,1,1,0,0,0|1,0,0]=3 4239 B11R0.39 CCCN(C[C@@H](C)O)C(C)CO 269982a_100011303929_100009817552 [0,1,1,0,0,0|1,0,0]=3 4240 B11R0.39 COC(C)N(CCO)CC(C)O 269982a_100000731851_100009879195 [0,1,1,0,0,0|2,0,0]=4 4241 B11R0.47 C#CCCN(CCO)CC(C)O 2230a_100000731851_100000688953 [0,1,1,0,0,0|1,0,1]=4 4242 B11R0.47 C#CCCN(CCO)CC(C)O 269982a_100000731851_100000730999 [0,1,1,0,0,0|1,0,1]=4 4243 B11R0.47 C#CCN(CCOC)CC(C)O 2230a_100000223814_100011218427 [0,1,1,0,0,0|0,0,2]=4 4244 B11R0.47 C#CCN(CCOC)CC(C)O 34a_100000223814_100011218427 [0,1,1,0,0,0|0,0,2]=4 4245 B11R0.47 C#CCN(CCOC)C[C@@H](C)O 2230a_100000223814_100009817552 [0,1,1,0,0,0|0,0,2]=4 4246 B11R0.47 C#CCN(CCOC)C[C@@H](C)O 34a_100000223814_100009817552 [0,1,1,0,0,0|0,0,2]=4 4247 B11R0.47 C/C=C/CN(CCO)CC(C)O 269982a_100000731851_100102629194 [0,1,1,0,0,0|1,0,1]=4 4248 B11R0.47 C=C(C)CN(CCC)CCCC 2230a_200000207744_100000748629 [0,1,1,0,0,0|1,0,1]=4 4249 B11R0.47 C=C(C)CN(CCC)CCCC 269982a_200000207744_100000748629 [0,1,1,0,0,0|1,0,1]=4 4250 B11R0.47 C=C(C)CN(CCC)CCOC 2230a_200011192371_100000748629 [0,1,1,0,0,0|1,0,1]=4 4251 B11R0.47 C=C(C)CN(CCC)CCOC 269982a_200011192371_100000748629 [0,1,1,0,0,0|1,0,1]=4 4252 B11R0.47 C=CCCN(CCO)CC(C)O 2230a_100000731851_100000754431 [0,1,1,0,0,0|1,0,1]=4 4253 B11R0.47 C=CCCN(CCO)CC(C)O 269982a_100000731851_100000754431 [0,1,1,0,0,0|1,0,1]=4 4254 B11R0.47 CC#CCN(CCO)CC(C)O 2230a_100000731851_100000748600 [0,1,1,0,0,0|1,0,1]=4 4255 B11R0.47 CC(C)CN(CCO)CCCF 2230a_100015185251_100011934791 [0,1,1,0,0,0|2,0,0]=4 4256 B11R0.47 CC(C)CN(CCO)CCCF 269982a_100015185251_100011934791 [0,1,1,0,0,0|2,0,0]=4 4257 B11R0.47 CC(C)CN(CCO)CCCO 2230a_100015185251_100000230001 [0,1,1,0,0,0|2,0,0]=4 4258 B11R0.47 CC(C)CN(CCO)CCCO 2230a_200000212863_100000210760 [0,1,1,0,0,0|2,0,0]=4 4259 B11R0.47 CC(C)CN(CCO)CCCO 269982a_100015185251_100011215043 [0,1,1,0,0,0|2,0,0]=4 4260 B11R0.47 CC(C)CN(CCO)CCCO 269982a_200000212863_100000210624 [0,1,1,0,0,0|2,0,0]=4 4261 B11R0.47 CC(C)CN(CCO)CCCO 270004a_200000212863_100000210432 [0,1,1,0,0,0|2,0,0]=4 4262 B11R0.47 CC(O)CN(CCO)CCC#N 2230a_100000731851_100011215226 [0,1,1,0,0,0|1,0,1]=4 4263 B11R0.47 CC(O)CN(CCO)CCC#N 269982a_100000731851_100011215226 [0,1,1,0,0,0|1,0,1]=4 4264 B11R0.47 CC(O)CN(CCO)CCCF 2230a_100000731851_100011934791 [0,1,1,0,0,0|1,0,0]=3 4265 B11R0.47 CC(O)CN(CCO)CCCF 269982a_100000731851_100011934791 [0,1,1,0,0,0|1,0,0]=3 4266 B11R0.47 CC(O)CN(CCO)CCCO 2230a_100000731851_100000230001 [0,1,1,0,0,0|1,0,0]=3 4267 B11R0.47 CC(O)CN(CCO)CCCO 2230a_200000212863_100011218427 [0,1,1,0,0,0|1,0,0]=3 4268 B11R0.47 CC(O)CN(CCO)CCCO 269982a_100000731851_100011215043 [0,1,1,0,0,0|1,0,0]=3 4269 B11R0.47 CC(O)CN(CCO)CCCO 269982a_200000212863_100011218427 [0,1,1,0,0,0|1,0,0]=3 4270 B11R0.47 CC=CCN(CCO)CC(C)O 2230a_100000731851_100000070051 [0,1,1,0,0,0|1,0,1]=4 4271 B11R0.47 CCCCN(CC#N)CC(C)O 2230a_200011192266_100011218427 [0,1,1,0,0,0|1,0,1]=4 4272 B11R0.47 CCCCN(CC#N)C[C@@H](C)O 2230a_200011192266_100009817552 [0,1,1,0,0,0|1,0,1]=4 4273 B11R0.47 CCCCN(CCC)CC(C)C 2230a_200000207744_100000210760 [0,1,1,0,0,0|1,0,0]=3 4274 B11R0.47 CCCCN(CCC)CC(C)C 269982a_200000207744_100000210624 [0,1,1,0,0,0|1,0,0]=3 4275 B11R0.47 CCCCN(CCC)CC(C)C 270004a_200000207744_100000210432 [0,1,1,0,0,0|1,0,0]=3 4276 B11R0.47 CCCCN(CCC)CC(C)O 2230a_200000207744_100011218427 [0,1,1,0,0,0|0,0,0]=2 4277 B11R0.47 CCCCN(CCC)CC(C)O 269982a_200000207744_100011218427 [0,1,1,0,0,0|0,0,0]=2 4278 B11R0.47 CCCCN(CCC)CC(F)F 2230a_200000207744_100011934356 [0,1,1,0,0,0|2,0,0]=4 4279 B11R0.47 CCCCN(CCC)CC(F)F 269982a_200000207744_100011934356 [0,1,1,0,0,0|2,0,0]=4 4280 B11R0.47 CCCCN(CCC)C[C@@H](C)O 2230a_200000207744_100009817552 [0,1,1,0,0,0|0,0,0]=2 4281 B11R0.47 CCCCN(CCC)C[C@@H](C)O 269982a_200000207744_100009817552 [0,1,1,0,0,0|0,0,0]=2 4282 B11R0.47 CCCCN(CCO)CC(C)C 2230a_100000198060_100000210760 [0,1,1,0,0,0|2,0,0]=4 4283 B11R0.47 CCCCN(CCO)CC(C)C 2230a_100015185251_100000210211 [0,1,1,0,0,0|2,0,0]=4 4284 B11R0.47 CCCCN(CCO)CC(C)C 269982a_100000198060_100000210624 [0,1,1,0,0,0|2,0,0]=4 4285 B11R0.47 CCCCN(CCO)CC(C)C 269982a_100015185251_100000210211 [0,1,1,0,0,0|2,0,0]=4 4286 B11R0.47 CCCCN(CCO)CC(C)C 270004a_100000198060_100000210432 [0,1,1,0,0,0|2,0,0]=4 4287 B11R0.47 CCCCN(CCO)CC(C)O 2230a_100000198060_100011218427 [0,1,1,0,0,0|1,0,0]=3 4288 B11R0.47 CCCCN(CCO)CC(C)O 2230a_100000731851_100000210211 [0,1,1,0,0,0|1,0,0]=3 4289 B11R0.47 CCCCN(CCO)CC(C)O 269982a_100000198060_100011218427 [0,1,1,0,0,0|1,0,0]=3 4290 B11R0.47 CCCCN(CCO)CC(C)O 269982a_100000731851_100000210211 [0,1,1,0,0,0|1,0,0]=3 4291 B11R0.47 CCCCN(CCO)C[C@@H](C)O 2230a_100000198060_100009817552 [0,1,1,0,0,0|1,0,0]=3 4292 B11R0.47 CCCCN(CCO)C[C@@H](C)O 269982a_100000198060_100009817552 [0,1,1,0,0,0|1,0,0]=3 4293 B11R0.47 CCCN(CCC#N)CC(C)C 2230a_100000176855_100000210760 [0,1,1,0,0,0|1,0,1]=4 4294 B11R0.47 CCCN(CCC#N)CC(C)C 270004a_100000176855_100000210432 [0,1,1,0,0,0|1,0,1]=4 4295 B11R0.47 CCCN(CCC#N)CC(C)O 2230a_100000176855_100011218427 [0,1,1,0,0,0|0,0,1]=3 4296 B11R0.47 CCCN(CCC#N)C[C@@H](C)O 2230a_100000176855_100009817552 [0,1,1,0,0,0|0,0,1]=3 4297 B11R0.47 CCCN(CCOC)CC(C)C 2230a_200011192371_100000210760 [0,1,1,0,0,0|1,0,0]=3 4298 B11R0.47 CCCN(CCOC)CC(C)C 269982a_200011192371_100000210624 [0,1,1,0,0,0|1,0,0]=3 4299 B11R0.47 CCCN(CCOC)CC(C)C 270004a_200011192371_100000210432 [0,1,1,0,0,0|1,0,0]=3 4300 B11R0.47 CCCN(CCOC)CC(C)O 2230a_200011192371_100011218427 [0,1,1,0,0,0|0,0,0]=2 4301 B11R0.47 CCCN(CCOC)CC(C)O 269982a_200011192371_100011218427 [0,1,1,0,0,0|0,0,0]=2 4302 B11R0.47 CCCN(CCOC)CC(F)F 2230a_200011192371_100011934356 [0,1,1,0,0,0|2,0,0]=4 4303 B11R0.47 CCCN(CCOC)CC(F)F 269982a_200011192371_100011934356 [0,1,1,0,0,0|2,0,0]=4 4304 B11R0.47 CCCN(CCOC)C[C@@H](C)O 2230a_200011192371_100009817552 [0,1,1,0,0,0|0,0,0]=2 4305 B11R0.47 CCCN(CCOC)C[C@@H](C)O 269982a_200011192371_100009817552 [0,1,1,0,0,0|0,0,0]=2 4306 B11R0.47 CCCOC(CCC)CC(C)C 34a_100011351045_100000210303 [0,1,1,0,0,0|2,0,0]=4 4307 B11R0.47 CCCOC(CCC)CC(C)C 7a_100011351045_100000210303 [0,1,1,0,0,0|2,0,0]=4 4308 B11R0.47 CCOCN(CCO)CC(C)C 269982a_100015185251_100000739092 [0,1,1,0,0,0|2,0,0]=4 4309 B11R0.47 CCOCN(CCO)CC(C)O 269982a_100000731851_100000739092 [0,1,1,0,0,0|1,0,0]=3 4310 B11R0.47 COCCN(CC#N)CC(C)O 2230a_100011199603_100011218427 [0,1,1,0,0,0|1,0,1]=4 4311 B11R0.47 COCCN(CC#N)C[C@@H](C)O 2230a_100011199603_100009817552 [0,1,1,0,0,0|1,0,1]=4 4312 B11R0.47 COCCN(CCO)CC(C)C 2230a_100015185251_100011201679 [0,1,1,0,0,0|2,0,0]=4 4313 B11R0.47 COCCN(CCO)CC(C)C 269982a_100015185251_100000233755 [0,1,1,0,0,0|2,0,0]=4 4314 B11R0.47 COCCN(CCO)CC(C)O 2230a_100000731851_100011201679 [0,1,1,0,0,0|1,0,0]=3 4315 B11R0.47 COCCN(CCO)CC(C)O 269982a_100000731851_100000233755 [0,1,1,0,0,0|1,0,0]=3 4316 B11R0.47 CSCCN(CCO)CC(C)C 2230a_100015185251_100000751147 [0,1,1,0,0,0|2,0,0]=4 4317 B11R0.47 CSCCN(CCO)CC(C)C 269982a_100015185251_100000212216 [0,1,1,0,0,0|2,0,0]=4 4318 B11R0.47 CSCCN(CCO)CC(C)O 2230a_100000731851_100000751147 [0,1,1,0,0,0|1,0,0]=3 4319 B11R0.47 CSCCN(CCO)CC(C)O 269982a_100000731851_100000212216 [0,1,1,0,0,0|1,0,0]=3 4320 B11R0.47 C[C@@H](O)CN(CCO)CCCO 2230a_200000212863_100009817552 [0,1,1,0,0,0|1,0,0]=3 4321 B11R0.47 C[C@@H](O)CN(CCO)CCCO 269982a_200000212863_100009817552 [0,1,1,0,0,0|1,0,0]=3 4322 B11R0.95 CCCN(CCC)CC(C)(C)C 2230a_107254831479_100000210303 [0,1,1,0,0,0|1,0,0]=3 4323 B11R0.95 CCCN(CCC)CC(C)(C)C 269982a_107254831479_100000210303 [0,1,1,0,0,0|1,0,0]=3 4324 B11R0.95 CCCN(CCC)CC(C)(C)C 270004a_100000210455_100011204126 [0,1,1,0,0,0|1,0,0]=3 4325 B11R0.95 CCCN(CCC)CC(F)(F)F 2230a_100000210455_100000763148 [0,1,1,0,0,0|2,0,0]=4 4326 B11R0.95 CCCN(CCC)CC(F)(F)F 2230a_100000739208_100000210303 [0,1,1,0,0,0|2,0,0]=4 4327 B11R0.95 CCCN(CCC)C[N+](C)(C)C 269982a_100000210455_200000036245 [0,1,1,0,0,0|2,0,0]=4 4328 B11R0.95 CCCN(CCC)C[Si](C)(C)C 2230a_100000210455_100000037933 [0,1,1,0,0,0|1,1,0]=4 4329 B11R0.95 CCCN(CCF)CC(C)(C)C 2230a_107254831479_100011217306 [0,1,1,0,0,0|2,0,0]=4 4330 B11R0.95 CCCN(CCF)CC(C)(C)C 269982a_107254831479_100011217306 [0,1,1,0,0,0|2,0,0]=4 4331 B11R0.95 CCCN(CCO)CC(C)(C)C 2230a_100000752879_100000210303 [0,1,1,0,0,0|2,0,0]=4 4332 B11R0.95 CCCN(CCO)CC(C)(C)C 2230a_107254831479_100000211926 [0,1,1,0,0,0|2,0,0]=4 4333 B11R0.95 CCCN(CCO)CC(C)(C)C 269982a_100000752879_100000210303 [0,1,1,0,0,0|2,0,0]=4 4334 B11R0.95 CCCN(CCO)CC(C)(C)C 269982a_107254831479_100000211926 [0,1,1,0,0,0|2,0,0]=4 4335 B11R0.95 CCCN(CCO)CC(C)(C)C 270004a_100000211420_100011204126 [0,1,1,0,0,0|2,0,0]=4 4336 B11R0.95 CCCN(COC)CC(C)(C)C 2230a_107254831479_100000766300 [0,1,1,0,0,0|2,0,0]=4 4337 B11R0.95 CCCN(COC)CC(C)(C)C 269982a_107254831479_100000766300 [0,1,1,0,0,0|2,0,0]=4 4338 B11R0.95 CCCN(CSC)CC(C)(C)C 2230a_107254831479_100011218213 [0,1,1,0,0,0|2,0,0]=4 4339 B11R0.95 CCCN(CSC)CC(C)(C)C 269982a_107254831479_100011218213 [0,1,1,0,0,0|2,0,0]=4 4340 B11R0.98 CCCC(CCC)C(=O)[C@@H](C)O 1458a_100000717761_200011218217 [0,1,1,0,0,0|1,0,1]=4 4341 B11R0.98 CCCC(CCC)C(=O)[C@H](C)O 1458a_217856618621_200011218217 [0,1,1,0,0,0|1,0,1]=4 4342 B11R0.98 CCCN(CCC)C(=O)C(C)C 11a_100000210455_100000210198 [0,1,1,0,0,0|1,0,1]=4 4343 B11R0.98 CCCN(CCC)C(=O)C(C)C 1626a_100000210455_100000210198 [0,1,1,0,0,0|1,0,1]=4 4344 B11R0.98 CCCN(CCC)C(=O)C(C)C 240690a_100000210455_100000210198 [0,1,1,0,0,0|1,0,1]=4 4345 B11R0.98 CCCN(CCC)C(=O)C(C)C 527a_100000210455_100000210198 [0,1,1,0,0,0|1,0,1]=4 4346 B11R0.98 CCCN(CCC)C(=O)C(C)F 11a_100000210455_100000062450 [0,1,1,0,0,0|1,0,1]=4 4347 B11R0.98 CCCN(CCC)C(=O)C(C)F 1626a_100000210455_100000062450 [0,1,1,0,0,0|1,0,1]=4 4348 B11R0.98 CCCN(CCC)C(=O)C(C)F 240690a_100000210455_100000062450 [0,1,1,0,0,0|1,0,1]=4 4349 B11R0.98 CCCN(CCC)C(=O)C(C)F 527a_100000210455_100000062450 [0,1,1,0,0,0|1,0,1]=4 4350 B11R0.98 CCCN(CCC)C(=O)C(O)O 240690a_100000210455_100000233687 [0,1,1,0,0,0|1,0,1]=4 4351 B11R0.98 CCCN(CCC)C(=O)[C@@H](C)O 240690a_100000210455_100000717761 [0,1,1,0,0,0|0,0,1]=3 4352 B11R0.98 CCCN(CCC)C(=O)[C@H](C)O 1626a_100000210455_217856618621 [0,1,1,0,0,0|0,0,1]=3 4353 B11R0.98 CCCN(CCC)C(=O)[C@H](C)O 240690a_100000210455_217856618621 [0,1,1,0,0,0|0,0,1]=3 4354 B11R0.98 CCCN(CCC)C(C)C(=O)C 2230a_100000210455_100009814033 [0,1,1,0,0,0|0,0,2]=4 4355 B11R0.98 CCCN(CCC)C(C)C(=O)C 269982a_100000210455_100009814033 [0,1,1,0,0,0|0,0,2]=4 4356 B11R0.98 CCCN(CCC)C(C)C(C)C 2230a_200015185082_100000210303 [0,1,1,0,0,0|1,0,0]=3 4357 B11R0.98 CCCN(CCC)C(C)C(C)C 269982a_200015185082_100000210303 [0,1,1,0,0,0|1,0,0]=3 4358 B11R0.98 CCCN(CCC)[C@@H](C)C(=O)C 1458a_200009815822_200000210301 [0,1,1,0,0,0|0,0,2]=4 4359 B11R0.98 CCCN(CCC)[C@@H](C)C(=O)[13CH3] 1458a_200009815822_200025704644 [0,1,1,0,0,0|0,0,2]=4 4360 B11R0.98 CCCN(CCF)C(C)C(C)C 2230a_200015185082_100011217306 [0,1,1,0,0,0|2,0,0]=4 4361 B11R0.98 CCCN(CCF)C(C)C(C)C 269982a_200015185082_100011217306 [0,1,1,0,0,0|2,0,0]=4 4362 B11R0.98 CCCN(CCO)C(=O)[C@@H](C)O 240690a_100000211420_100000717761 [0,1,1,0,0,0|1,0,1]=4 4363 B11R0.98 CCCN(CCO)C(=O)[C@H](C)O 240690a_100000211420_217856618621 [0,1,1,0,0,0|1,0,1]=4 4364 B11R0.98 CCCN(CCO)C(C)C(C)C 2230a_200015185082_100000211926 [0,1,1,0,0,0|2,0,0]=4 4365 B11R0.98 CCCN(CCO)C(C)C(C)C 269982a_200015185082_100000211926 [0,1,1,0,0,0|2,0,0]=4 4366 B11R0.98 CCCN(COC)C(C)C(C)C 2230a_200015185082_100000766300 [0,1,1,0,0,0|2,0,0]=4 4367 B11R0.98 CCCN(COC)C(C)C(C)C 269982a_200015185082_100000766300 [0,1,1,0,0,0|2,0,0]=4 4368 B11R0.98 CCCN(CSC)C(C)C(C)C 2230a_200015185082_100011218213 [0,1,1,0,0,0|2,0,0]=4 4369 B11R0.98 CCCN(CSC)C(C)C(C)C 269982a_200015185082_100011218213 [0,1,1,0,0,0|2,0,0]=4 4370 B11R0.279 C#CCN(CCC)CC(O)CO 2230a_200000156893_100000038162 [0,1,1,0,0,0|0,0,2]=4 4371 B11R0.279 C=CC(O)CN(CCC)CCC 2230a_100000210455_100000730141 [0,1,1,0,0,0|0,0,1]=3 4372 B11R0.279 C=CC(O)CN(CCC)CCO 2230a_100000211420_100000730141 [0,1,1,0,0,0|1,0,1]=4 4373 B11R0.279 C=CCN(CCC)CC(O)CO 2230a_200000156893_100000210623 [0,1,1,0,0,0|0,0,2]=4 4374 B11R0.279 C=CCN(CCC)CC(O)CO 269982a_200000156893_100000210623 [0,1,1,0,0,0|0,0,2]=4 4375 B11R0.279 CCC(O)CN(CCO)CCO 2230a_100000210587_100011218378 [0,1,1,0,0,0|2,0,0]=4 4376 B11R0.279 CCC(O)CN(CCO)CCO 269982a_100000210587_100011218378 [0,1,1,0,0,0|2,0,0]=4 4377 B11R0.279 CCCC(CCC)NC(C)CO 2230a_100011207992_100012180447 [0,1,1,0,0,0|2,0,0]=4 4378 B11R0.279 CCCC(CCC)NC(C)CO 34a_100011207992_100012180447 [0,1,1,0,0,0|2,0,0]=4 4379 B11R0.279 CCCC(CCC)N[C@H](C)CO 270004a_100000737577_100000210088 [0,1,1,0,0,0|2,0,0]=4 4380 B11R0.279 CCCC(CCC)OC(C)CO 34a_200011218534_100012180447 [0,1,1,0,0,0|2,0,0]=4 4381 B11R0.279 CCCC(CCC)OC(C)CO 7a_200011218534_100012180447 [0,1,1,0,0,0|2,0,0]=4 4382 B11R0.279 CCCC(CCC)SC(C)CO 62a_100012180447_200011218217 [0,1,1,0,0,0|2,0,0]=4 4383 B11R0.279 CCCC(CCC)SC(C)OC 62a_100009879195_200011218217 [0,1,1,0,0,0|2,0,0]=4 4384 B11R0.279 CCCC(CCC)SC(C)OC 62a_200011218217_100009879195 [0,1,1,0,0,0|2,0,0]=4 4385 B11R0.279 CCCC(CCC)S[C@H](C)CO 62a_100016084084_200011218217 [0,1,1,0,0,0|2,0,0]=4 4386 B11R0.279 CCCC(CCC)S[C@H](C)CO 62a_200011218217_100016084084 [0,1,1,0,0,0|2,0,0]=4 4387 B11R0.279 CCCN(CC#N)CC(O)CO 2230a_200000156893_100011215382 [0,1,1,0,0,0|1,0,1]=4 4388 B11R0.279 CCCN(CC#N)CC(O)CO 269982a_200000156893_100011214920 [0,1,1,0,0,0|1,0,1]=4 4389 B11R0.279 CCCN(CC=O)CC(O)CO 2230a_200000156893_200015260668 [0,1,1,0,0,0|1,0,1]=4 4390 B11R0.279 CCCN(CC=O)CC(O)CO 269982a_200000156893_200015260668 [0,1,1,0,0,0|1,0,1]=4 4391 B11R0.279 CCCN(CCC)CC(=O)CC 1458a_200011243382_100000210202 [0,1,1,0,0,0|0,0,2]=4 4392 B11R0.279 CCCN(CCC)CC(=O)CC 269982a_100000210455_100000747405 [0,1,1,0,0,0|0,0,2]=4 4393 B11R0.279 CCCN(CCC)CC(=O)CF 1458a_200011243382_100015361967 [0,1,1,0,0,0|0,0,2]=4 4394 B11R0.279 CCCN(CCC)CC(=O)NC 11a_106832991635_200011243382 [0,1,1,0,0,0|0,0,2]=4 4395 B11R0.279 CCCN(CCC)CC(=O)NC 1626a_100102657272_200011243382 [0,1,1,0,0,0|0,0,2]=4 4396 B11R0.279 CCCN(CCC)CC(=O)NC 2230a_100000210455_100000183359 [0,1,1,0,0,0|0,0,2]=4 4397 B11R0.279 CCCN(CCC)CC(=O)NC 240690a_100102657272_200011243382 [0,1,1,0,0,0|0,0,2]=4 4398 B11R0.279 CCCN(CCC)CC(=O)NC 269982a_100000210455_100000183359 [0,1,1,0,0,0|0,0,2]=4 4399 B11R0.279 CCCN(CCC)CC(=O)NC 527a_100102657272_200011243382 [0,1,1,0,0,0|0,0,2]=4 4400 B11R0.279 CCCN(CCC)CC(=O)OC 2230a_100000210455_100000747449 [0,1,1,0,0,0|0,0,2]=4 4401 B11R0.279 CCCN(CCC)CC(=O)OC 269982a_100000210455_100000747449 [0,1,1,0,0,0|0,0,2]=4 4402 B11R0.279 CCCN(CCC)CC(C)CC 2230a_100000210455_100000748023 [0,1,1,0,0,0|1,0,0]=3 4403 B11R0.279 CCCN(CCC)CC(C)CC 269982a_100000210455_100000748023 [0,1,1,0,0,0|1,0,0]=3 4404 B11R0.279 CCCN(CCC)CC(C)CC 270004a_100000210455_100000243153 [0,1,1,0,0,0|1,0,0]=3 4405 B11R0.279 CCCN(CCC)CC(O)CC 2230a_100000210455_100011218378 [0,1,1,0,0,0|0,0,0]=2 4406 B11R0.279 CCCN(CCC)CC(O)CC 269982a_100000210455_100011218378 [0,1,1,0,0,0|0,0,0]=2 4407 B11R0.279 CCCN(CCC)CC(O)CO 2230a_100000210455_100011219619 [0,1,1,0,0,0|0,0,0]=2 4408 B11R0.279 CCCN(CCC)CC(O)CO 2230a_200000156893_100000210303 [0,1,1,0,0,0|0,0,0]=2 4409 B11R0.279 CCCN(CCC)CC(O)CO 269982a_200000156893_100000210303 [0,1,1,0,0,0|0,0,0]=2 4410 B11R0.279 CCCN(CCC)C[C@@H](C)CC 2230a_100000210455_100009816398 [0,1,1,0,0,0|1,0,0]=3 4411 B11R0.279 CCCN(CCC)C[C@@H](C)CC 269982a_100000210455_100009816398 [0,1,1,0,0,0|1,0,0]=3 4412 B11R0.279 CCCN(CCC)C[C@@H](C)CO 2230a_100000210455_100000059175 [0,1,1,0,0,0|0,0,0]=2 4413 B11R0.279 CCCN(CCC)C[C@@H](C)CO 269982a_100000210455_100000059175 [0,1,1,0,0,0|0,0,0]=2 4414 B11R0.279 CCCN(CCC)C[C@@H](O)CF 2230a_100000210455_100015614560 [0,1,1,0,0,0|0,0,0]=2 4415 B11R0.279 CCCN(CCC)C[C@@H](O)CO 2230a_100000210455_100009815848 [0,1,1,0,0,0|0,0,0]=2 4416 B11R0.279 CCCN(CCF)CC(O)CO 2230a_200000156893_100011217306 [0,1,1,0,0,0|1,0,0]=3 4417 B11R0.279 CCCN(CCF)CC(O)CO 269982a_200000156893_100011217306 [0,1,1,0,0,0|1,0,0]=3 4418 B11R0.279 CCCN(CCO)CC(C)CC 2230a_100000211420_100000748023 [0,1,1,0,0,0|2,0,0]=4 4419 B11R0.279 CCCN(CCO)CC(C)CC 269982a_100000211420_100000748023 [0,1,1,0,0,0|2,0,0]=4 4420 B11R0.279 CCCN(CCO)CC(C)CC 270004a_100000211420_100000243153 [0,1,1,0,0,0|2,0,0]=4 4421 B11R0.279 CCCN(CCO)CC(O)CC 2230a_100000211420_100011218378 [0,1,1,0,0,0|1,0,0]=3 4422 B11R0.279 CCCN(CCO)CC(O)CC 269982a_100000211420_100011218378 [0,1,1,0,0,0|1,0,0]=3 4423 B11R0.279 CCCN(CCO)CC(O)CO 2230a_100000211420_100011219619 [0,1,1,0,0,0|1,0,0]=3 4424 B11R0.279 CCCN(CCO)CC(O)CO 2230a_200000156893_100000211926 [0,1,1,0,0,0|1,0,0]=3 4425 B11R0.279 CCCN(CCO)CC(O)CO 269982a_200000156893_100000211926 [0,1,1,0,0,0|1,0,0]=3 4426 B11R0.279 CCCN(CCO)C[C@@H](C)CC 2230a_100000211420_100009816398 [0,1,1,0,0,0|2,0,0]=4 4427 B11R0.279 CCCN(CCO)C[C@@H](C)CC 269982a_100000211420_100009816398 [0,1,1,0,0,0|2,0,0]=4 4428 B11R0.279 CCCN(CCO)C[C@@H](C)CO 2230a_100000211420_100000059175 [0,1,1,0,0,0|1,0,0]=3 4429 B11R0.279 CCCN(CCO)C[C@@H](C)CO 269982a_100000211420_100000059175 [0,1,1,0,0,0|1,0,0]=3 4430 B11R0.279 CCCN(CCO)C[C@@H](O)CF 2230a_100000211420_100015614560 [0,1,1,0,0,0|1,0,0]=3 4431 B11R0.279 CCCN(CCO)C[C@@H](O)CO 2230a_100000211420_100009815848 [0,1,1,0,0,0|1,0,0]=3 4432 B11R0.279 CCCN(COC)CC(O)CO 2230a_200000156893_100000766300 [0,1,1,0,0,0|1,0,0]=3 4433 B11R0.279 CCCN(COC)CC(O)CO 269982a_200000156893_100000766300 [0,1,1,0,0,0|1,0,0]=3 4434 B11R0.279 CCCN(CSC)CC(O)CO 2230a_200000156893_100011218213 [0,1,1,0,0,0|1,0,0]=3 4435 B11R0.279 CCCN(CSC)CC(O)CO 269982a_200000156893_100011218213 [0,1,1,0,0,0|1,0,0]=3 4436 B11R0.279 C[C@@H](CO)CN(CCO)CCO 2230a_100000210587_100000059175 [0,1,1,0,0,0|2,0,0]=4 4437 B11R0.279 C[C@@H](CO)CN(CCO)CCO 269982a_100000210587_100000059175 [0,1,1,0,0,0|2,0,0]=4 4438 B11R0.279 OCCN(CCO)CC(O)CO 2230a_100000210587_100011219619 [0,1,1,0,0,0|2,0,0]=4 4439 B11R0.279 OCCN(CCO)C[C@@H](O)CF 2230a_100000210587_100015614560 [0,1,1,0,0,0|2,0,0]=4 4440 B11R0.279 OCCN(CCO)C[C@@H](O)CO 2230a_100000210587_100009815848 [0,1,1,0,0,0|2,0,0]=4 4441 B11R0.56 C=C(C)CN(CC)C(C)CCC 2230a_100000211296_100000766640 [0,1,1,0,0,0|1,0,1]=4 4442 B11R0.56 C=C(C)CN(CC)C(C)CCC 269982a_100000211296_100000766640 [0,1,1,0,0,0|1,0,1]=4 4443 B11R0.56 C=C(C)CN(CC)C(C)CCC 270004a_100000211296_100000211909 [0,1,1,0,0,0|1,0,1]=4 4444 B11R0.56 CCCC(=O)N(CC)CC(C)C 11a_100000738554_100000211992 [0,1,1,0,0,0|1,0,1]=4 4445 B11R0.56 CCCC(=O)N(CC)CC(C)C 1626a_100000738554_100000211992 [0,1,1,0,0,0|1,0,1]=4 4446 B11R0.56 CCCC(=O)N(CC)CC(C)C 240690a_100000738554_100000211992 [0,1,1,0,0,0|1,0,1]=4 4447 B11R0.56 CCCC(=O)N(CC)CC(C)C 527a_100000738554_100000211992 [0,1,1,0,0,0|1,0,1]=4 4448 B11R0.56 CCCC(=O)N(CC)C[C@H](C)O 240690a_100000729506_100000211992 [0,1,1,0,0,0|0,0,1]=3 4449 B11R0.56 CCCC(=O)N(CC)C[C@H](C)O 527a_100000729506_100000211992 [0,1,1,0,0,0|0,0,1]=3 4450 B11R0.56 CCCC(C)N(CC)CC(=O)O 269956a_100000746405_100000766640 [0,1,1,0,0,0|1,0,1]=4 4451 B11R0.56 CCCC(C)N(CC)CC(C)C 2230a_100000738554_100000766640 [0,1,1,0,0,0|1,0,0]=3 4452 B11R0.56 CCCC(C)N(CC)CC(C)C 269982a_100000738554_100000766640 [0,1,1,0,0,0|1,0,0]=3 4453 B11R0.56 CCCC(C)N(CC)CC(C)C 270004a_100000738554_100000211909 [0,1,1,0,0,0|1,0,0]=3 4454 B11R0.56 CCCC(C)N(CC)C[C@H](C)O 2230a_100000729506_100000766640 [0,1,1,0,0,0|0,0,0]=2 4455 B11R0.56 CCCC(C)N(CC)C[C@H](C)O 269982a_100000729506_100000766640 [0,1,1,0,0,0|0,0,0]=2 4456 B11R0.56 CCCC(C)N(CC)C[C@H](C)O 270004a_100000729506_100000211909 [0,1,1,0,0,0|0,0,0]=2 4457 B11R0.56 CCN(CC(C)C)C(C)CCO 2230a_100000738554_100009893172 [0,1,1,0,0,0|2,0,0]=4 4458 B11R0.56 CCN(CC(C)C)C(C)CCO 2230a_100011935059_100000210760 [0,1,1,0,0,0|2,0,0]=4 4459 B11R0.56 CCN(CC(C)C)C(C)CCO 269982a_100000738554_100009893172 [0,1,1,0,0,0|2,0,0]=4 4460 B11R0.56 CCN(CC(C)C)C(C)CCO 269982a_100011935059_100000210624 [0,1,1,0,0,0|2,0,0]=4 4461 B11R0.56 CCN(CC(C)C)C(C)CCO 270004a_100011935059_100000210432 [0,1,1,0,0,0|2,0,0]=4 4462 B11R0.56 CCN(CC(C)C)C(C)COC 2230a_100000738554_100000765312 [0,1,1,0,0,0|2,0,0]=4 4463 B11R0.56 CCN(CC(C)C)C(C)COC 269982a_100000738554_100000765312 [0,1,1,0,0,0|2,0,0]=4 4464 B11R0.56 CCN(CC(C)C)C(C)COC 270004a_100000738554_100000749346 [0,1,1,0,0,0|2,0,0]=4 4465 B11R0.56 CCN(CC(C)C)C(C)CSC 270004a_100000738554_100011216314 [0,1,1,0,0,0|2,0,0]=4 4466 B11R0.56 CCN(CC(C)O)C(C)CCO 2230a_100011935059_100011218427 [0,1,1,0,0,0|1,0,0]=3 4467 B11R0.56 CCN(CC(C)O)C(C)CCO 269982a_100011935059_100011218427 [0,1,1,0,0,0|1,0,0]=3 4468 B11R0.56 CCN(C[C@@H](C)O)C(C)CCO 2230a_100011935059_100009817552 [0,1,1,0,0,0|1,0,0]=3 4469 B11R0.56 CCN(C[C@@H](C)O)C(C)CCO 269982a_100011935059_100009817552 [0,1,1,0,0,0|1,0,0]=3 4470 B11R0.56 CCN(C[C@H](C)O)C(=O)CCO 240690a_100000729506_100011216618 [0,1,1,0,0,0|1,0,1]=4 4471 B11R0.56 CCN(C[C@H](C)O)C(=O)COC 240690a_100000729506_100000210968 [0,1,1,0,0,0|1,0,1]=4 4472 B11R0.56 CCN(C[C@H](C)O)C(=O)COC 527a_100000729506_100000210968 [0,1,1,0,0,0|1,0,1]=4 4473 B11R0.56 CCN(C[C@H](C)O)C(=O)CSC 240690a_100000729506_100000184570 [0,1,1,0,0,0|1,0,1]=4 4474 B11R0.56 CCN(C[C@H](C)O)C(=O)CSC 527a_100000729506_100000184570 [0,1,1,0,0,0|1,0,1]=4 4475 B11R0.56 CCN(C[C@H](C)O)C(C)CC#N 2230a_100000729506_100009813641 [0,1,1,0,0,0|1,0,1]=4 4476 B11R0.56 CCN(C[C@H](C)O)C(C)CC#N 269982a_100000729506_100009813641 [0,1,1,0,0,0|1,0,1]=4 4477 B11R0.56 CCN(C[C@H](C)O)C(C)CCO 2230a_100000729506_100009893172 [0,1,1,0,0,0|1,0,0]=3 4478 B11R0.56 CCN(C[C@H](C)O)C(C)CCO 269982a_100000729506_100009893172 [0,1,1,0,0,0|1,0,0]=3 4479 B11R0.56 CCN(C[C@H](C)O)C(C)COC 2230a_100000729506_100000765312 [0,1,1,0,0,0|1,0,0]=3 4480 B11R0.56 CCN(C[C@H](C)O)C(C)COC 269982a_100000729506_100000765312 [0,1,1,0,0,0|1,0,0]=3 4481 B11R0.56 CCN(C[C@H](C)O)C(C)COC 270004a_100000729506_100000749346 [0,1,1,0,0,0|1,0,0]=3 4482 B11R0.56 CCN(C[C@H](C)O)C(C)CSC 270004a_100000729506_100011216314 [0,1,1,0,0,0|1,0,0]=3 4483 B11R0.56 CCNC(=O)N(CC)C[C@H](C)O 2708a_100015525214_100000729506 [0,1,1,0,0,0|1,0,1]=4 4484 B11R0.56 CCNC(=O)N(CC)C[C@H](C)O 273464a_100015525214_100000729506 [0,1,1,0,0,0|1,0,1]=4 4485 B11R0.91 C=C(C)CN(CC)CC(C)CC 2230a_100000211296_100000748023 [0,1,1,0,0,0|1,0,1]=4 4486 B11R0.91 C=C(C)CN(CC)CC(C)CC 269982a_100000211296_100000748023 [0,1,1,0,0,0|1,0,1]=4 4487 B11R0.91 C=C(C)CN(CC)CC(C)CC 270004a_100000211296_100000243153 [0,1,1,0,0,0|1,0,1]=4 4488 B11R0.91 C=C(C)CN(CC)CC(O)CC 2230a_100000211296_100011218378 [0,1,1,0,0,0|1,0,1]=4 4489 B11R0.91 C=C(C)CN(CC)CC(O)CC 2230a_100011365200_100000748629 [0,1,1,0,0,0|1,0,1]=4 4490 B11R0.91 C=C(C)CN(CC)CC(O)CC 269982a_100000211296_100011218378 [0,1,1,0,0,0|1,0,1]=4 4491 B11R0.91 C=C(C)CN(CC)CC(O)CC 269982a_100011365200_100000748629 [0,1,1,0,0,0|1,0,1]=4 4492 B11R0.91 C=C(C)CN(CC)C[C@@H](C)CC 2230a_100000211296_100009816398 [0,1,1,0,0,0|1,0,1]=4 4493 B11R0.91 C=C(C)CN(CC)C[C@@H](C)CC 269982a_100000211296_100009816398 [0,1,1,0,0,0|1,0,1]=4 4494 B11R0.91 C=CC(O)CN(CC)C[C@H](C)O 2230a_100000729506_100000730141 [0,1,1,0,0,0|0,0,2]=4 4495 B11R0.91 CCC(=O)CN(CC)CC(C)C 269982a_100000738554_100000747405 [0,1,1,0,0,0|1,0,1]=4 4496 B11R0.91 CCC(=O)CN(CC)C[C@H](C)O 269982a_100000729506_100000747405 [0,1,1,0,0,0|0,0,1]=3 4497 B11R0.91 CCC(C)CN(CC)CC(=O)O 269956a_100000746405_100000748023 [0,1,1,0,0,0|1,0,1]=4 4498 B11R0.91 CCC(C)CN(CC)CC(C)C 2230a_100000738554_100000748023 [0,1,1,0,0,0|1,0,0]=3 4499 B11R0.91 CCC(C)CN(CC)CC(C)C 269982a_100000738554_100000748023 [0,1,1,0,0,0|1,0,0]=3 4500 B11R0.91 CCC(C)CN(CC)CC(C)C 270004a_100000738554_100000243153 [0,1,1,0,0,0|1,0,0]=3 4501 B11R0.91 CCC(C)CN(CC)C[C@H](C)O 2230a_100000729506_100000748023 [0,1,1,0,0,0|0,0,0]=2 4502 B11R0.91 CCC(C)CN(CC)C[C@H](C)O 269982a_100000729506_100000748023 [0,1,1,0,0,0|0,0,0]=2 4503 B11R0.91 CCC(C)CN(CC)C[C@H](C)O 270004a_100000729506_100000243153 [0,1,1,0,0,0|0,0,0]=2 4504 B11R0.91 CCC(O)CN(CC)CC(=O)O 269956a_100000746405_100011218378 [0,1,1,0,0,0|1,0,1]=4 4505 B11R0.91 CCC(O)CN(CC)CC(C)C 2230a_100000738554_100011218378 [0,1,1,0,0,0|1,0,0]=3 4506 B11R0.91 CCC(O)CN(CC)CC(C)C 2230a_100011365200_100000210760 [0,1,1,0,0,0|1,0,0]=3 4507 B11R0.91 CCC(O)CN(CC)CC(C)C 269982a_100000738554_100011218378 [0,1,1,0,0,0|1,0,0]=3 4508 B11R0.91 CCC(O)CN(CC)CC(C)C 269982a_100011365200_100000210624 [0,1,1,0,0,0|1,0,0]=3 4509 B11R0.91 CCC(O)CN(CC)CC(C)C 270004a_100011365200_100000210432 [0,1,1,0,0,0|1,0,0]=3 4510 B11R0.91 CCC(O)CN(CC)CC(C)O 2230a_100011365200_100011218427 [0,1,1,0,0,0|0,0,0]=2 4511 B11R0.91 CCC(O)CN(CC)CC(C)O 269982a_100011365200_100011218427 [0,1,1,0,0,0|0,0,0]=2 4512 B11R0.91 CCC(O)CN(CC)CC(F)F 2230a_100011365200_100011934356 [0,1,1,0,0,0|2,0,0]=4 4513 B11R0.91 CCC(O)CN(CC)CC(F)F 269982a_100011365200_100011934356 [0,1,1,0,0,0|2,0,0]=4 4514 B11R0.91 CCC(O)CN(CC)C[C@@H](C)O 2230a_100011365200_100009817552 [0,1,1,0,0,0|0,0,0]=2 4515 B11R0.91 CCC(O)CN(CC)C[C@@H](C)O 269982a_100011365200_100009817552 [0,1,1,0,0,0|0,0,0]=2 4516 B11R0.91 CCC(O)CN(CC)C[C@H](C)O 2230a_100000729506_100011218378 [0,1,1,0,0,0|0,0,0]=2 4517 B11R0.91 CCC(O)CN(CC)C[C@H](C)O 269982a_100000729506_100011218378 [0,1,1,0,0,0|0,0,0]=2 4518 B11R0.91 CCN(CC(=O)NC)C[C@H](C)O 2230a_100000729506_100000183359 [0,1,1,0,0,0|1,0,1]=4 4519 B11R0.91 CCN(CC(=O)NC)C[C@H](C)O 269982a_100000729506_100000183359 [0,1,1,0,0,0|1,0,1]=4 4520 B11R0.91 CCN(CC(=O)OC)C[C@H](C)O 2230a_100000729506_100000747449 [0,1,1,0,0,0|1,0,1]=4 4521 B11R0.91 CCN(CC(=O)OC)C[C@H](C)O 269982a_100000729506_100000747449 [0,1,1,0,0,0|1,0,1]=4 4522 B11R0.91 CCN(CC(C)C)CC(O)CO 2230a_100000738554_100011219619 [0,1,1,0,0,0|2,0,0]=4 4523 B11R0.91 CCN(CC(C)C)C[C@@H](C)CO 2230a_100000738554_100000059175 [0,1,1,0,0,0|2,0,0]=4 4524 B11R0.91 CCN(CC(C)C)C[C@@H](C)CO 269982a_100000738554_100000059175 [0,1,1,0,0,0|2,0,0]=4 4525 B11R0.91 CCN(CC(C)C)C[C@@H](O)CF 2230a_100000738554_100015614560 [0,1,1,0,0,0|2,0,0]=4 4526 B11R0.91 CCN(CC(C)C)C[C@@H](O)CO 2230a_100000738554_100009815848 [0,1,1,0,0,0|2,0,0]=4 4527 B11R0.91 CCN(CC(O)CO)C[C@H](C)O 2230a_100000729506_100011219619 [0,1,1,0,0,0|1,0,0]=3 4528 B11R0.91 CCN(C[C@@H](C)CO)C[C@H](C)O 2230a_100000729506_100000059175 [0,1,1,0,0,0|1,0,0]=3 4529 B11R0.91 CCN(C[C@@H](C)CO)C[C@H](C)O 269982a_100000729506_100000059175 [0,1,1,0,0,0|1,0,0]=3 4530 B11R0.91 CCN(C[C@@H](O)CF)C[C@H](C)O 2230a_100000729506_100015614560 [0,1,1,0,0,0|1,0,0]=3 4531 B11R0.91 CCN(C[C@@H](O)CO)C[C@H](C)O 2230a_100000729506_100009815848 [0,1,1,0,0,0|1,0,0]=3 4532 B11R0.91 CC[C@H](C)CN(CC)CC(=O)O 269956a_100000746405_100009816398 [0,1,1,0,0,0|1,0,1]=4 4533 B11R0.91 CC[C@H](C)CN(CC)CC(C)C 2230a_100000738554_100009816398 [0,1,1,0,0,0|1,0,0]=3 4534 B11R0.91 CC[C@H](C)CN(CC)CC(C)C 269982a_100000738554_100009816398 [0,1,1,0,0,0|1,0,0]=3 4535 B11R0.91 CC[C@H](C)CN(CC)C[C@H](C)O 2230a_100000729506_100009816398 [0,1,1,0,0,0|0,0,0]=2 4536 B11R0.91 CC[C@H](C)CN(CC)C[C@H](C)O 269982a_100000729506_100009816398 [0,1,1,0,0,0|0,0,0]=2 4537 B11R0.143 C=C(C)CCN(CC)CC(C)C 2230a_100000738554_100000730704 [0,1,1,0,0,0|1,0,1]=4 4538 B11R0.143 C=C(C)CCN(CC)CC(C)C 269982a_100000738554_100000730704 [0,1,1,0,0,0|1,0,1]=4 4539 B11R0.143 C=C(C)CCN(CC)C[C@H](C)O 2230a_100000729506_100000730704 [0,1,1,0,0,0|0,0,1]=3 4540 B11R0.143 C=C(C)CCN(CC)C[C@H](C)O 269982a_100000729506_100000730704 [0,1,1,0,0,0|0,0,1]=3 4541 B11R0.143 C=C(C)CN(CC)CCC(C)C 2230a_100000207693_100000748629 [0,1,1,0,0,0|1,0,1]=4 4542 B11R0.143 C=C(C)CN(CC)CCC(C)C 2230a_100000211296_100000210312 [0,1,1,0,0,0|1,0,1]=4 4543 B11R0.143 C=C(C)CN(CC)CCC(C)C 269982a_100000207693_100000748629 [0,1,1,0,0,0|1,0,1]=4 4544 B11R0.143 C=C(C)CN(CC)CCC(C)C 269982a_100000211296_100000210312 [0,1,1,0,0,0|1,0,1]=4 4545 B11R0.143 C=C(C)CN(CC)CCC(C)O 2230a_100000211296_100012276601 [0,1,1,0,0,0|1,0,1]=4 4546 B11R0.143 C=C(C)CN(CC)CCC(C)O 269982a_100000211296_100012276601 [0,1,1,0,0,0|1,0,1]=4 4547 B11R0.143 CCN(CC=C(C)C)C[C@H](C)O 2230a_100000729506_100000761012 [0,1,1,0,0,0|0,0,2]=4 4548 B11R0.143 CCN(CC=C(C)C)C[C@H](C)O 269982a_100000729506_100000761012 [0,1,1,0,0,0|0,0,2]=4 4549 B11R0.143 CCN(CCC(=O)C)CC(C)C 269982a_100000738554_100000053229 [0,1,1,0,0,0|1,0,1]=4 4550 B11R0.143 CCN(CCC(=O)C)C[C@H](C)O 269982a_100000729506_100000053229 [0,1,1,0,0,0|0,0,1]=3 4551 B11R0.143 CCN(CCC(=O)N)CC(C)O 2230a_100020645749_100011218427 [0,1,1,0,0,0|1,0,1]=4 4552 B11R0.143 CCN(CCC(=O)N)C[C@@H](C)O 2230a_100020645749_100009817552 [0,1,1,0,0,0|1,0,1]=4 4553 B11R0.143 CCN(CCC(=O)N)C[C@H](C)O 2230a_100000729506_100000744528 [0,1,1,0,0,0|1,0,1]=4 4554 B11R0.143 CCN(CCC(=O)N)C[C@H](C)O 269982a_100000729506_100000744528 [0,1,1,0,0,0|1,0,1]=4 4555 B11R0.143 CCN(CCC(C)C)CC(=O)O 269956a_100000746405_100000210312 [0,1,1,0,0,0|1,0,1]=4 4556 B11R0.143 CCN(CCC(C)C)CC(C)C 2230a_100000207693_100000210760 [0,1,1,0,0,0|1,0,0]=3 4557 B11R0.143 CCN(CCC(C)C)CC(C)C 2230a_100000738554_100000210312 [0,1,1,0,0,0|1,0,0]=3 4558 B11R0.143 CCN(CCC(C)C)CC(C)C 269982a_100000207693_100000210624 [0,1,1,0,0,0|1,0,0]=3 4559 B11R0.143 CCN(CCC(C)C)CC(C)C 269982a_100000738554_100000210312 [0,1,1,0,0,0|1,0,0]=3 4560 B11R0.143 CCN(CCC(C)C)CC(C)C 270004a_100000207693_100000210432 [0,1,1,0,0,0|1,0,0]=3 4561 B11R0.143 CCN(CCC(C)C)CC(C)O 2230a_100000207693_100011218427 [0,1,1,0,0,0|0,0,0]=2 4562 B11R0.143 CCN(CCC(C)C)CC(C)O 269982a_100000207693_100011218427 [0,1,1,0,0,0|0,0,0]=2 4563 B11R0.143 CCN(CCC(C)C)CC(F)F 2230a_100000207693_100011934356 [0,1,1,0,0,0|2,0,0]=4 4564 B11R0.143 CCN(CCC(C)C)CC(F)F 269982a_100000207693_100011934356 [0,1,1,0,0,0|2,0,0]=4 4565 B11R0.143 CCN(CCC(C)C)C[C@@H](C)O 2230a_100000207693_100009817552 [0,1,1,0,0,0|0,0,0]=2 4566 B11R0.143 CCN(CCC(C)C)C[C@@H](C)O 269982a_100000207693_100009817552 [0,1,1,0,0,0|0,0,0]=2 4567 B11R0.143 CCN(CCC(C)C)C[C@H](C)O 2230a_100000729506_100000210312 [0,1,1,0,0,0|0,0,0]=2 4568 B11R0.143 CCN(CCC(C)C)C[C@H](C)O 269982a_100000729506_100000210312 [0,1,1,0,0,0|0,0,0]=2 4569 B11R0.143 CCN(CCC(C)O)CC(=O)O 269956a_100000746405_100012276601 [0,1,1,0,0,0|1,0,1]=4 4570 B11R0.143 CCN(CCC(C)O)CC(C)C 2230a_100000738554_100012276601 [0,1,1,0,0,0|1,0,0]=3 4571 B11R0.143 CCN(CCC(C)O)CC(C)C 269982a_100000738554_100012276601 [0,1,1,0,0,0|1,0,0]=3 4572 B11R0.143 CCN(CCC(C)O)C[C@H](C)O 2230a_100000729506_100012276601 [0,1,1,0,0,0|0,0,0]=2 4573 B11R0.143 CCN(CCC(C)O)C[C@H](C)O 269982a_100000729506_100012276601 [0,1,1,0,0,0|0,0,0]=2 4574 B11R0.143 CCN(CCN(C)C)CC(C)C 269982a_100000225870_100000210624 [0,1,1,0,0,0|2,0,0]=4 4575 B11R0.143 CCN(CCN(C)C)CC(C)C 269982a_100000738554_100000755713 [0,1,1,0,0,0|2,0,0]=4 4576 B11R0.143 CCN(CCN(C)C)CC(C)C 270004a_100000225870_100000210432 [0,1,1,0,0,0|2,0,0]=4 4577 B11R0.143 CCN(CCN(C)C)CC(C)O 269982a_100000225870_100011218427 [0,1,1,0,0,0|1,0,0]=3 4578 B11R0.143 CCN(CCN(C)C)C[C@@H](C)O 269982a_100000225870_100009817552 [0,1,1,0,0,0|1,0,0]=3 4579 B11R0.143 CCN(CCN(C)C)C[C@H](C)O 269982a_100000729506_100000755713 [0,1,1,0,0,0|1,0,0]=3 4580 B11R0.143 CCN(COC(=O)C)C[C@H](C)O 269982a_100000729506_100000076356 [0,1,1,0,0,0|1,0,1]=4 4581 B11R0.143 CCN(COC(C)C)CC(C)C 2230a_100000738554_100000709892 [0,1,1,0,0,0|2,0,0]=4 4582 B11R0.143 CCN(COC(C)C)CC(C)C 269982a_100000738554_100000709892 [0,1,1,0,0,0|2,0,0]=4 4583 B11R0.143 CCN(COC(C)C)C[C@H](C)O 2230a_100000729506_100000709892 [0,1,1,0,0,0|1,0,0]=3 4584 B11R0.143 CCN(COC(C)C)C[C@H](C)O 269982a_100000729506_100000709892 [0,1,1,0,0,0|1,0,0]=3 4585 B11R0.160 C=C(C)CN(CCCC)C(C)C 2230a_100000207398_100000748629 [0,1,1,0,0,0|1,0,1]=4 4586 B11R0.160 C=C(C)CN(CCCC)C(C)C 269982a_100000207398_100000748629 [0,1,1,0,0,0|1,0,1]=4 4587 B11R0.160 CC(C)CN(CCCF)C(C)C 2230a_100000737641_100011934791 [0,1,1,0,0,0|2,0,0]=4 4588 B11R0.160 CC(C)CN(CCCF)C(C)C 269982a_100000737641_100011934791 [0,1,1,0,0,0|2,0,0]=4 4589 B11R0.160 CC(C)CN(CCCO)C(C)C 2230a_100000182298_100000210760 [0,1,1,0,0,0|2,0,0]=4 4590 B11R0.160 CC(C)CN(CCCO)C(C)C 2230a_100000737641_100000230001 [0,1,1,0,0,0|2,0,0]=4 4591 B11R0.160 CC(C)CN(CCCO)C(C)C 269982a_100000182298_100000210624 [0,1,1,0,0,0|2,0,0]=4 4592 B11R0.160 CC(C)CN(CCCO)C(C)C 269982a_100000737641_100011215043 [0,1,1,0,0,0|2,0,0]=4 4593 B11R0.160 CC(C)CN(CCCO)C(C)C 270004a_100000182298_100000210432 [0,1,1,0,0,0|2,0,0]=4 4594 B11R0.160 CC(C)N(CCCO)C[C@@H](C)O 2230a_100000182298_100009817552 [0,1,1,0,0,0|1,0,0]=3 4595 B11R0.160 CC(C)N(CCCO)C[C@@H](C)O 269982a_100000182298_100009817552 [0,1,1,0,0,0|1,0,0]=3 4596 B11R0.160 CC(O)CN(CCCO)C(C)C 2230a_100000182298_100011218427 [0,1,1,0,0,0|1,0,0]=3 4597 B11R0.160 CC(O)CN(CCCO)C(C)C 269982a_100000182298_100011218427 [0,1,1,0,0,0|1,0,0]=3 4598 B11R0.160 CCCCN(CC(C)C)C(C)C 2230a_100000207398_100000210760 [0,1,1,0,0,0|1,0,0]=3 4599 B11R0.160 CCCCN(CC(C)C)C(C)C 2230a_100000737641_100000210211 [0,1,1,0,0,0|1,0,0]=3 4600 B11R0.160 CCCCN(CC(C)C)C(C)C 269982a_100000207398_100000210624 [0,1,1,0,0,0|1,0,0]=3 4601 B11R0.160 CCCCN(CC(C)C)C(C)C 269982a_100000737641_100000210211 [0,1,1,0,0,0|1,0,0]=3 4602 B11R0.160 CCCCN(CC(C)C)C(C)C 270004a_100000207398_100000210432 [0,1,1,0,0,0|1,0,0]=3 4603 B11R0.160 CCCCN(CC(C)O)C(C)C 2230a_100000207398_100011218427 [0,1,1,0,0,0|0,0,0]=2 4604 B11R0.160 CCCCN(CC(C)O)C(C)C 269982a_100000207398_100011218427 [0,1,1,0,0,0|0,0,0]=2 4605 B11R0.160 CCCCN(CC(F)F)C(C)C 2230a_100000207398_100011934356 [0,1,1,0,0,0|2,0,0]=4 4606 B11R0.160 CCCCN(CC(F)F)C(C)C 269982a_100000207398_100011934356 [0,1,1,0,0,0|2,0,0]=4 4607 B11R0.160 CCCCN(C[C@@H](C)O)C(C)C 2230a_100000207398_100009817552 [0,1,1,0,0,0|0,0,0]=2 4608 B11R0.160 CCCCN(C[C@@H](C)O)C(C)C 269982a_100000207398_100009817552 [0,1,1,0,0,0|0,0,0]=2 4609 B11R0.160 CCOCN(CC(C)C)C(C)C 269982a_100000737641_100000739092 [0,1,1,0,0,0|2,0,0]=4 4610 B11R0.160 COCCN(CC(C)C)C(C)C 2230a_100000737641_100011201679 [0,1,1,0,0,0|2,0,0]=4 4611 B11R0.160 COCCN(CC(C)C)C(C)C 2230a_200000223778_100000210760 [0,1,1,0,0,0|2,0,0]=4 4612 B11R0.160 COCCN(CC(C)C)C(C)C 269982a_100000737641_100000233755 [0,1,1,0,0,0|2,0,0]=4 4613 B11R0.160 COCCN(CC(C)C)C(C)C 269982a_200000223778_100000210624 [0,1,1,0,0,0|2,0,0]=4 4614 B11R0.160 COCCN(CC(C)C)C(C)C 270004a_200000223778_100000210432 [0,1,1,0,0,0|2,0,0]=4 4615 B11R0.160 COCCN(CC(C)O)C(C)C 2230a_200000223778_100011218427 [0,1,1,0,0,0|1,0,0]=3 4616 B11R0.160 COCCN(CC(C)O)C(C)C 269982a_200000223778_100011218427 [0,1,1,0,0,0|1,0,0]=3 4617 B11R0.160 COCCN(C[C@@H](C)O)C(C)C 2230a_200000223778_100009817552 [0,1,1,0,0,0|1,0,0]=3 4618 B11R0.160 COCCN(C[C@@H](C)O)C(C)C 269982a_200000223778_100009817552 [0,1,1,0,0,0|1,0,0]=3 4619 B11R0.160 CSCCN(CC(C)C)C(C)C 2230a_100000737641_100000751147 [0,1,1,0,0,0|2,0,0]=4 4620 B11R0.160 CSCCN(CC(C)C)C(C)C 269982a_100000737641_100000212216 [0,1,1,0,0,0|2,0,0]=4 4621 B11R0.162 CCCCC(CC)C(=O)[C@@H](C)O 1458a_100000717761_200011216223 [0,1,1,0,0,0|1,0,1]=4 4622 B11R0.162 CCCCC(CC)C(=O)[C@H](C)O 1458a_217856618621_200011216223 [0,1,1,0,0,0|1,0,1]=4 4623 B11R0.162 CCCCN(CC)C(=O)C(C)C 11a_100000207695_100000210198 [0,1,1,0,0,0|1,0,1]=4 4624 B11R0.162 CCCCN(CC)C(=O)C(C)C 1626a_100000207695_100000210198 [0,1,1,0,0,0|1,0,1]=4 4625 B11R0.162 CCCCN(CC)C(=O)C(C)C 240690a_100000207695_100000210198 [0,1,1,0,0,0|1,0,1]=4 4626 B11R0.162 CCCCN(CC)C(=O)C(C)C 527a_100000207695_100000210198 [0,1,1,0,0,0|1,0,1]=4 4627 B11R0.162 CCCCN(CC)C(=O)C(C)F 11a_100000207695_100000062450 [0,1,1,0,0,0|1,0,1]=4 4628 B11R0.162 CCCCN(CC)C(=O)C(C)F 1626a_100000207695_100000062450 [0,1,1,0,0,0|1,0,1]=4 4629 B11R0.162 CCCCN(CC)C(=O)C(C)F 240690a_100000207695_100000062450 [0,1,1,0,0,0|1,0,1]=4 4630 B11R0.162 CCCCN(CC)C(=O)C(C)F 527a_100000207695_100000062450 [0,1,1,0,0,0|1,0,1]=4 4631 B11R0.162 CCCCN(CC)C(=O)C(O)O 240690a_100000207695_100000233687 [0,1,1,0,0,0|1,0,1]=4 4632 B11R0.162 CCCCN(CC)C(=O)[C@@H](C)O 240690a_100000207695_100000717761 [0,1,1,0,0,0|0,0,1]=3 4633 B11R0.162 CCCCN(CC)C(=O)[C@H](C)O 1626a_100000207695_217856618621 [0,1,1,0,0,0|0,0,1]=3 4634 B11R0.162 CCCCN(CC)C(=O)[C@H](C)O 240690a_100000207695_217856618621 [0,1,1,0,0,0|0,0,1]=3 4635 B11R0.162 CCCCN(CC)C(C)C(=O)C 2230a_100000207695_100009814033 [0,1,1,0,0,0|0,0,2]=4 4636 B11R0.162 CCCCN(CC)C(C)C(=O)C 269982a_100000207695_100009814033 [0,1,1,0,0,0|0,0,2]=4 4637 B11R0.162 CCCCN(CC)C(C)C(C)C 2230a_100000746363_100000210211 [0,1,1,0,0,0|1,0,0]=3 4638 B11R0.162 CCCCN(CC)C(C)C(C)C 269982a_100000746363_100000210211 [0,1,1,0,0,0|1,0,0]=3 4639 B11R0.162 CCN(CCCF)C(C)C(C)C 2230a_100000746363_100011934791 [0,1,1,0,0,0|2,0,0]=4 4640 B11R0.162 CCN(CCCF)C(C)C(C)C 269982a_100000746363_100011934791 [0,1,1,0,0,0|2,0,0]=4 4641 B11R0.162 CCN(CCCO)C(C)C(C)C 2230a_100000746363_100000230001 [0,1,1,0,0,0|2,0,0]=4 4642 B11R0.162 CCN(CCCO)C(C)C(C)C 269982a_100000746363_100011215043 [0,1,1,0,0,0|2,0,0]=4 4643 B11R0.162 CCN(CCOC)C(=O)[C@@H](C)O 240690a_100000731262_100000717761 [0,1,1,0,0,0|1,0,1]=4 4644 B11R0.162 CCN(CCOC)C(=O)[C@H](C)O 1626a_100000731262_217856618621 [0,1,1,0,0,0|1,0,1]=4 4645 B11R0.162 CCN(CCOC)C(=O)[C@H](C)O 240690a_100000731262_217856618621 [0,1,1,0,0,0|1,0,1]=4 4646 B11R0.162 CCN(CCOC)C(C)C(C)C 2230a_100000746363_100011201679 [0,1,1,0,0,0|2,0,0]=4 4647 B11R0.162 CCN(CCOC)C(C)C(C)C 269982a_100000746363_100000233755 [0,1,1,0,0,0|2,0,0]=4 4648 B11R0.162 CCN(CCSC)C(C)C(C)C 2230a_100000746363_100000751147 [0,1,1,0,0,0|2,0,0]=4 4649 B11R0.162 CCN(CCSC)C(C)C(C)C 269982a_100000746363_100000212216 [0,1,1,0,0,0|2,0,0]=4 4650 B11R0.162 CCOCN(CC)C(C)C(C)C 269982a_100000746363_100000739092 [0,1,1,0,0,0|2,0,0]=4 4651 B11R0.166 C#CCCN(CC)CC(O)CC 2230a_100011365200_100000688953 [0,1,1,0,0,0|0,0,2]=4 4652 B11R0.166 C#CCCN(CC)CC(O)CC 269982a_100011365200_100000730999 [0,1,1,0,0,0|0,0,2]=4 4653 B11R0.166 C/C=C/CN(CC)CC(O)CC 269982a_100011365200_100102629194 [0,1,1,0,0,0|0,0,2]=4 4654 B11R0.166 C=CC(O)CN(CC)CCCC 2230a_100000207695_100000730141 [0,1,1,0,0,0|0,0,1]=3 4655 B11R0.166 C=CC(O)CN(CC)CCOC 2230a_100000731262_100000730141 [0,1,1,0,0,0|1,0,1]=4 4656 B11R0.166 C=CCCN(CC)CC(O)CC 2230a_100011365200_100000754431 [0,1,1,0,0,0|0,0,2]=4 4657 B11R0.166 C=CCCN(CC)CC(O)CC 269982a_100011365200_100000754431 [0,1,1,0,0,0|0,0,2]=4 4658 B11R0.166 CC#CCN(CC)CC(O)CC 2230a_100011365200_100000748600 [0,1,1,0,0,0|0,0,2]=4 4659 B11R0.166 CC=CCN(CC)CC(O)CC 2230a_100011365200_100000070051 [0,1,1,0,0,0|0,0,2]=4 4660 B11R0.166 CCC(C)CN(CC)CCOC 2230a_100000731262_100000748023 [0,1,1,0,0,0|2,0,0]=4 4661 B11R0.166 CCC(C)CN(CC)CCOC 269982a_100000731262_100000748023 [0,1,1,0,0,0|2,0,0]=4 4662 B11R0.166 CCC(C)CN(CC)CCOC 270004a_100000731262_100000243153 [0,1,1,0,0,0|2,0,0]=4 4663 B11R0.166 CCC(O)CN(CC)CCC#N 2230a_100000226048_100011218378 [0,1,1,0,0,0|1,0,1]=4 4664 B11R0.166 CCC(O)CN(CC)CCC#N 2230a_100011365200_100011215226 [0,1,1,0,0,0|1,0,1]=4 4665 B11R0.166 CCC(O)CN(CC)CCC#N 269982a_100011365200_100011215226 [0,1,1,0,0,0|1,0,1]=4 4666 B11R0.166 CCC(O)CN(CC)CCCF 2230a_100011365200_100011934791 [0,1,1,0,0,0|1,0,0]=3 4667 B11R0.166 CCC(O)CN(CC)CCCF 269982a_100011365200_100011934791 [0,1,1,0,0,0|1,0,0]=3 4668 B11R0.166 CCC(O)CN(CC)CCCO 2230a_100011365200_100000230001 [0,1,1,0,0,0|1,0,0]=3 4669 B11R0.166 CCC(O)CN(CC)CCCO 269982a_100011365200_100011215043 [0,1,1,0,0,0|1,0,0]=3 4670 B11R0.166 CCC(O)CN(CC)CCOC 2230a_100000731262_100011218378 [0,1,1,0,0,0|1,0,0]=3 4671 B11R0.166 CCC(O)CN(CC)CCOC 2230a_100011365200_100011201679 [0,1,1,0,0,0|1,0,0]=3 4672 B11R0.166 CCC(O)CN(CC)CCOC 269982a_100000731262_100011218378 [0,1,1,0,0,0|1,0,0]=3 4673 B11R0.166 CCC(O)CN(CC)CCOC 269982a_100011365200_100000233755 [0,1,1,0,0,0|1,0,0]=3 4674 B11R0.166 CCC(O)CN(CC)CCSC 2230a_100011365200_100000751147 [0,1,1,0,0,0|1,0,0]=3 4675 B11R0.166 CCC(O)CN(CC)CCSC 269982a_100011365200_100000212216 [0,1,1,0,0,0|1,0,0]=3 4676 B11R0.166 CCCCC(CC)CC(C)OC 7a_200011290772_200000210301 [0,1,1,0,0,0|1,0,0]=3 4677 B11R0.166 CCCCC(CC)CC(C)O[13CH3] 7a_200011290772_200025704644 [0,1,1,0,0,0|1,0,0]=3 4678 B11R0.166 CCCCC(CC)N[C@H](C)CO 270004a_100000737577_100000753412 [0,1,1,0,0,0|2,0,0]=4 4679 B11R0.166 CCCCC(CC)OC(C)CO 34a_100011215227_100012180447 [0,1,1,0,0,0|2,0,0]=4 4680 B11R0.166 CCCCC(CC)OC(C)CO 7a_100011215227_100012180447 [0,1,1,0,0,0|2,0,0]=4 4681 B11R0.166 CCCCC(CC)SC(C)CO 62a_100012180447_200011216223 [0,1,1,0,0,0|2,0,0]=4 4682 B11R0.166 CCCCC(CC)SC(C)OC 62a_100009879195_200011216223 [0,1,1,0,0,0|2,0,0]=4 4683 B11R0.166 CCCCC(CC)SC(C)OC 62a_200011216223_100009879195 [0,1,1,0,0,0|2,0,0]=4 4684 B11R0.166 CCCCC(CC)S[C@H](C)CO 62a_100016084084_200011216223 [0,1,1,0,0,0|2,0,0]=4 4685 B11R0.166 CCCCC(CC)S[C@H](C)CO 62a_200011216223_100016084084 [0,1,1,0,0,0|2,0,0]=4 4686 B11R0.166 CCCCN(CC)CC(=O)CC 269982a_100000207695_100000747405 [0,1,1,0,0,0|0,0,2]=4 4687 B11R0.166 CCCCN(CC)CC(=O)NC 2230a_100000207695_100000183359 [0,1,1,0,0,0|0,0,2]=4 4688 B11R0.166 CCCCN(CC)CC(=O)NC 269982a_100000207695_100000183359 [0,1,1,0,0,0|0,0,2]=4 4689 B11R0.166 CCCCN(CC)CC(=O)OC 2230a_100000207695_100000747449 [0,1,1,0,0,0|0,0,2]=4 4690 B11R0.166 CCCCN(CC)CC(=O)OC 269982a_100000207695_100000747449 [0,1,1,0,0,0|0,0,2]=4 4691 B11R0.166 CCCCN(CC)CC(C)CC 2230a_100000207695_100000748023 [0,1,1,0,0,0|1,0,0]=3 4692 B11R0.166 CCCCN(CC)CC(C)CC 269982a_100000207695_100000748023 [0,1,1,0,0,0|1,0,0]=3 4693 B11R0.166 CCCCN(CC)CC(C)CC 270004a_100000207695_100000243153 [0,1,1,0,0,0|1,0,0]=3 4694 B11R0.166 CCCCN(CC)CC(O)CC 2230a_100000207695_100011218378 [0,1,1,0,0,0|0,0,0]=2 4695 B11R0.166 CCCCN(CC)CC(O)CC 2230a_100011365200_100000210211 [0,1,1,0,0,0|0,0,0]=2 4696 B11R0.166 CCCCN(CC)CC(O)CC 269982a_100000207695_100011218378 [0,1,1,0,0,0|0,0,0]=2 4697 B11R0.166 CCCCN(CC)CC(O)CC 269982a_100011365200_100000210211 [0,1,1,0,0,0|0,0,0]=2 4698 B11R0.166 CCCCN(CC)CC(O)CO 2230a_100000207695_100011219619 [0,1,1,0,0,0|0,0,0]=2 4699 B11R0.166 CCCCN(CC)C[C@@H](C)CC 2230a_100000207695_100009816398 [0,1,1,0,0,0|1,0,0]=3 4700 B11R0.166 CCCCN(CC)C[C@@H](C)CC 269982a_100000207695_100009816398 [0,1,1,0,0,0|1,0,0]=3 4701 B11R0.166 CCCCN(CC)C[C@@H](C)CO 2230a_100000207695_100000059175 [0,1,1,0,0,0|0,0,0]=2 4702 B11R0.166 CCCCN(CC)C[C@@H](C)CO 269982a_100000207695_100000059175 [0,1,1,0,0,0|0,0,0]=2 4703 B11R0.166 CCCCN(CC)C[C@@H](O)CF 2230a_100000207695_100015614560 [0,1,1,0,0,0|0,0,0]=2 4704 B11R0.166 CCCCN(CC)C[C@@H](O)CO 2230a_100000207695_100009815848 [0,1,1,0,0,0|0,0,0]=2 4705 B11R0.166 CCN(CCC#N)CC(O)CO 2230a_100000226048_100011219619 [0,1,1,0,0,0|1,0,1]=4 4706 B11R0.166 CCN(CCC#N)C[C@@H](C)CO 2230a_100000226048_100000059175 [0,1,1,0,0,0|1,0,1]=4 4707 B11R0.166 CCN(CCC#N)C[C@@H](O)CF 2230a_100000226048_100015614560 [0,1,1,0,0,0|1,0,1]=4 4708 B11R0.166 CCN(CCC#N)C[C@@H](O)CO 2230a_100000226048_100009815848 [0,1,1,0,0,0|1,0,1]=4 4709 B11R0.166 CCN(CCOC)CC(O)CO 2230a_100000731262_100011219619 [0,1,1,0,0,0|1,0,0]=3 4710 B11R0.166 CCN(CCOC)C[C@@H](C)CO 2230a_100000731262_100000059175 [0,1,1,0,0,0|1,0,0]=3 4711 B11R0.166 CCN(CCOC)C[C@@H](C)CO 269982a_100000731262_100000059175 [0,1,1,0,0,0|1,0,0]=3 4712 B11R0.166 CCN(CCOC)C[C@@H](O)CF 2230a_100000731262_100015614560 [0,1,1,0,0,0|1,0,0]=3 4713 B11R0.166 CCN(CCOC)C[C@@H](O)CO 2230a_100000731262_100009815848 [0,1,1,0,0,0|1,0,0]=3 4714 B11R0.166 CCOCN(CC)CC(O)CC 269982a_100011365200_100000739092 [0,1,1,0,0,0|1,0,0]=3 4715 B11R0.166 CC[C@H](C)CN(CC)CCOC 2230a_100000731262_100009816398 [0,1,1,0,0,0|2,0,0]=4 4716 B11R0.166 CC[C@H](C)CN(CC)CCOC 269982a_100000731262_100009816398 [0,1,1,0,0,0|2,0,0]=4 4717 B11R0.190 C#CCCN(CC)CC(C)(C)O 2230a_100000755687_100000688953 [0,1,1,0,0,0|0,0,2]=4 4718 B11R0.190 C#CCCN(CC)CC(C)(C)O 269982a_100000755687_100000730999 [0,1,1,0,0,0|0,0,2]=4 4719 B11R0.190 C/C=C/CN(CC)CC(C)(C)O 269982a_100000755687_100102629194 [0,1,1,0,0,0|0,0,2]=4 4720 B11R0.190 C=CCCN(CC)CC(C)(C)O 2230a_100000755687_100000754431 [0,1,1,0,0,0|0,0,2]=4 4721 B11R0.190 C=CCCN(CC)CC(C)(C)O 269982a_100000755687_100000754431 [0,1,1,0,0,0|0,0,2]=4 4722 B11R0.190 CC#CCN(CC)CC(C)(C)O 2230a_100000755687_100000748600 [0,1,1,0,0,0|0,0,2]=4 4723 B11R0.190 CC=CCN(CC)CC(C)(C)O 2230a_100000755687_100000070051 [0,1,1,0,0,0|0,0,2]=4 4724 B11R0.190 CCCCN(CC)CC(C)(C)C 2230a_100000732750_100000210211 [0,1,1,0,0,0|1,0,0]=3 4725 B11R0.190 CCCCN(CC)CC(C)(C)C 269982a_100000732750_100000210211 [0,1,1,0,0,0|1,0,0]=3 4726 B11R0.190 CCCCN(CC)CC(C)(C)C 270004a_100000207695_100011204126 [0,1,1,0,0,0|1,0,0]=3 4727 B11R0.190 CCCCN(CC)CC(C)(C)O 2230a_100000755687_100000210211 [0,1,1,0,0,0|0,0,0]=2 4728 B11R0.190 CCCCN(CC)CC(C)(C)O 269982a_100000755687_100000210211 [0,1,1,0,0,0|0,0,0]=2 4729 B11R0.190 CCCCN(CC)CC(F)(F)F 2230a_100000207695_100000763148 [0,1,1,0,0,0|2,0,0]=4 4730 B11R0.190 CCCCN(CC)CC(F)(F)F 2230a_100000739184_100000210202 [0,1,1,0,0,0|2,0,0]=4 4731 B11R0.190 CCCCN(CC)C[N+](C)(C)C 269982a_100000207695_200000036245 [0,1,1,0,0,0|2,0,0]=4 4732 B11R0.190 CCCCN(CC)C[Si](C)(C)C 2230a_100000207695_100000037933 [0,1,1,0,0,0|1,1,0]=4 4733 B11R0.190 CCN(CCC#N)CC(C)(C)O 2230a_100000755687_100011215226 [0,1,1,0,0,0|1,0,1]=4 4734 B11R0.190 CCN(CCC#N)CC(C)(C)O 269982a_100000755687_100011215226 [0,1,1,0,0,0|1,0,1]=4 4735 B11R0.190 CCN(CCCF)CC(C)(C)C 2230a_100000732750_100011934791 [0,1,1,0,0,0|2,0,0]=4 4736 B11R0.190 CCN(CCCF)CC(C)(C)C 269982a_100000732750_100011934791 [0,1,1,0,0,0|2,0,0]=4 4737 B11R0.190 CCN(CCCF)CC(C)(C)O 2230a_100000755687_100011934791 [0,1,1,0,0,0|1,0,0]=3 4738 B11R0.190 CCN(CCCF)CC(C)(C)O 269982a_100000755687_100011934791 [0,1,1,0,0,0|1,0,0]=3 4739 B11R0.190 CCN(CCCO)CC(C)(C)C 2230a_100000732750_100000230001 [0,1,1,0,0,0|2,0,0]=4 4740 B11R0.190 CCN(CCCO)CC(C)(C)C 2230a_100000752882_100000210202 [0,1,1,0,0,0|2,0,0]=4 4741 B11R0.190 CCN(CCCO)CC(C)(C)C 269982a_100000732750_100011215043 [0,1,1,0,0,0|2,0,0]=4 4742 B11R0.190 CCN(CCCO)CC(C)(C)C 269982a_100000752882_100000204670 [0,1,1,0,0,0|2,0,0]=4 4743 B11R0.190 CCN(CCCO)CC(C)(C)O 2230a_100000755687_100000230001 [0,1,1,0,0,0|1,0,0]=3 4744 B11R0.190 CCN(CCCO)CC(C)(C)O 269982a_100000755687_100011215043 [0,1,1,0,0,0|1,0,0]=3 4745 B11R0.190 CCN(CCOC)CC(C)(C)C 2230a_100000732750_100011201679 [0,1,1,0,0,0|2,0,0]=4 4746 B11R0.190 CCN(CCOC)CC(C)(C)C 269982a_100000732750_100000233755 [0,1,1,0,0,0|2,0,0]=4 4747 B11R0.190 CCN(CCOC)CC(C)(C)C 270004a_100000731262_100011204126 [0,1,1,0,0,0|2,0,0]=4 4748 B11R0.190 CCN(CCOC)CC(C)(C)O 2230a_100000755687_100011201679 [0,1,1,0,0,0|1,0,0]=3 4749 B11R0.190 CCN(CCOC)CC(C)(C)O 269982a_100000755687_100000233755 [0,1,1,0,0,0|1,0,0]=3 4750 B11R0.190 CCN(CCSC)CC(C)(C)C 2230a_100000732750_100000751147 [0,1,1,0,0,0|2,0,0]=4 4751 B11R0.190 CCN(CCSC)CC(C)(C)C 269982a_100000732750_100000212216 [0,1,1,0,0,0|2,0,0]=4 4752 B11R0.190 CCN(CCSC)CC(C)(C)O 2230a_100000755687_100000751147 [0,1,1,0,0,0|1,0,0]=3 4753 B11R0.190 CCN(CCSC)CC(C)(C)O 269982a_100000755687_100000212216 [0,1,1,0,0,0|1,0,0]=3 4754 B11R0.190 CCOCN(CC)CC(C)(C)C 269982a_100000732750_100000739092 [0,1,1,0,0,0|2,0,0]=4 4755 B11R0.190 CCOCN(CC)CC(C)(C)O 269982a_100000755687_100000739092 [0,1,1,0,0,0|1,0,0]=3 4756 B11R1.110 C#CCN1CCCCC(C1)O 2230a_100025706797_100000038162 [1,1,0,0,0,0|0,0,2]=4 4757 B11R1.110 C=CCN1CCCCC(C1)O 2230a_100025706797_100000210623 [1,1,0,0,0,0|0,0,2]=4 4758 B11R1.110 C=CCN1CCCCC(C1)O 269982a_100025706797_100000210623 [1,1,0,0,0,0|0,0,2]=4 4759 B11R1.110 CCCN1CCCCC(C1)O 2230a_100025706797_100000210303 [1,1,0,0,0,0|0,0,0]=2 4760 B11R1.110 CCCN1CCCCC(C1)O 269982a_100025706797_100000210303 [1,1,0,0,0,0|0,0,0]=2 4761 B11R1.110 CCCN1CCCNC(=O)C1 2230a_100015190381_100000210303 [1,1,0,0,0,0|1,0,1]=4 4762 B11R1.110 CCCN1CCOC[C@@H](C1)O 2230a_100016073750_100000210303 [1,1,0,0,0,0|1,0,0]=3 4763 B11R1.110 CCCN1CCOC[C@@H](C1)O 269982a_100016073750_100000210303 [1,1,0,0,0,0|1,0,0]=3 4764 B11R1.110 COCN1CCCCC(C1)O 2230a_100025706797_100000766300 [1,1,0,0,0,0|1,0,0]=3 4765 B11R1.110 COCN1CCCCC(C1)O 269982a_100025706797_100000766300 [1,1,0,0,0,0|1,0,0]=3 4766 B11R1.110 COCN1CCOC[C@@H](C1)O 2230a_100016073750_100000766300 [1,1,0,0,0,0|2,0,0]=4 4767 B11R1.110 COCN1CCOC[C@@H](C1)O 269982a_100016073750_100000766300 [1,1,0,0,0,0|2,0,0]=4 4768 B11R1.110 CSCN1CCCCC(C1)O 2230a_100025706797_100011218213 [1,1,0,0,0,0|1,0,0]=3 4769 B11R1.110 CSCN1CCCCC(C1)O 269982a_100025706797_100011218213 [1,1,0,0,0,0|1,0,0]=3 4770 B11R1.110 CSCN1CCOC[C@@H](C1)O 2230a_100016073750_100011218213 [1,1,0,0,0,0|2,0,0]=4 4771 B11R1.110 CSCN1CCOC[C@@H](C1)O 269982a_100016073750_100011218213 [1,1,0,0,0,0|2,0,0]=4 4772 B11R1.110 N#CCN1CCCCC(C1)O 2230a_100025706797_100011215382 [1,1,0,0,0,0|1,0,1]=4 4773 B11R1.110 N#CCN1CCCCC(C1)O 269982a_100025706797_100011214920 [1,1,0,0,0,0|1,0,1]=4 4774 B11R1.110 O=C1CN(CCCN1)CCO 2230a_100015190381_100000211926 [1,1,0,0,0,0|1,0,1]=4 4775 B11R1.110 O=CCN1CCCCC(C1)O 2230a_100025706797_200015260668 [1,1,0,0,0,0|0,0,2]=4 4776 B11R1.110 O=CCN1CCCCC(C1)O 269982a_100025706797_200015260668 [1,1,0,0,0,0|0,0,2]=4 4777 B11R1.110 OC1CCCCN(C1)CCF 2230a_100025706797_100011217306 [1,1,0,0,0,0|1,0,0]=3 4778 B11R1.110 OC1CCCCN(C1)CCF 269982a_100025706797_100011217306 [1,1,0,0,0,0|1,0,0]=3 4779 B11R1.110 OCCN1CCCCC(C1)O 2230a_100025706797_100000211926 [1,1,0,0,0,0|0,0,0]=2 4780 B11R1.110 OCCN1CCCCC(C1)O 269982a_100025706797_100000211926 [1,1,0,0,0,0|0,0,0]=2 4781 B11R1.110 OCCN1CCOC[C@@H](C1)O 2230a_100016073750_100000211926 [1,1,0,0,0,0|1,0,0]=3 4782 B11R1.110 OCCN1CCOC[C@@H](C1)O 269982a_100016073750_100000211926 [1,1,0,0,0,0|1,0,0]=3 4783 B11R1.110 O[C@H]1COCCN(C1)CCF 2230a_100016073750_100011217306 [1,1,0,0,0,0|2,0,0]=4 4784 B11R1.110 O[C@H]1COCCN(C1)CCF 269982a_100016073750_100011217306 [1,1,0,0,0,0|2,0,0]=4 4785 B11R1.135 C#CCN1CCCC(CC1)C 2230a_100025706717_100000038162 [1,1,0,0,0,0|0,0,2]=4 4786 B11R1.135 C#CCN1CCCC(CC1)C 34a_100025706717_100000184674 [1,1,0,0,0,0|0,0,2]=4 4787 B11R1.135 C#CCN1CCCC(CC1)O 2230a_100015186869_100000038162 [1,1,0,0,0,0|0,0,2]=4 4788 B11R1.135 C=CCN1CCCC(CC1)C 2230a_100025706717_100000210623 [1,1,0,0,0,0|0,0,2]=4 4789 B11R1.135 C=CCN1CCCC(CC1)C 269982a_100025706717_100000210623 [1,1,0,0,0,0|0,0,2]=4 4790 B11R1.135 C=CCN1CCCC(CC1)C 34a_100025706717_100015514636 [1,1,0,0,0,0|0,0,2]=4 4791 B11R1.135 C=CCN1CCCC(CC1)O 2230a_100015186869_100000210623 [1,1,0,0,0,0|0,0,2]=4 4792 B11R1.135 C=CCN1CCCC(CC1)O 269982a_100015186869_100000210623 [1,1,0,0,0,0|0,0,2]=4 4793 B11R1.135 CC1CCCN(CC1)CC#N 2230a_100025706717_100011215382 [1,1,0,0,0,0|1,0,1]=4 4794 B11R1.135 CC1CCCN(CC1)CC#N 269982a_100025706717_100011214920 [1,1,0,0,0,0|1,0,1]=4 4795 B11R1.135 CC1CCCN(CC1)CC=O 2230a_100025706717_200015260668 [1,1,0,0,0,0|0,0,2]=4 4796 B11R1.135 CC1CCCN(CC1)CC=O 269982a_100025706717_200015260668 [1,1,0,0,0,0|0,0,2]=4 4797 B11R1.135 CC1CCCN(CC1)CC=O 34a_100025706717_200009817547 [1,1,0,0,0,0|0,0,2]=4 4798 B11R1.135 CC1CCCN(CC1)CCF 2230a_100025706717_100011217306 [1,1,0,0,0,0|1,0,0]=3 4799 B11R1.135 CC1CCCN(CC1)CCF 269982a_100025706717_100011217306 [1,1,0,0,0,0|1,0,0]=3 4800 B11R1.135 CC1CCCN(CC1)CCF 34a_100025706717_100011217306 [1,1,0,0,0,0|1,0,0]=3 4801 B11R1.135 CC1CCCN(CC1)CCO 2230a_100025706717_100000211926 [1,1,0,0,0,0|0,0,0]=2 4802 B11R1.135 CC1CCCN(CC1)CCO 269982a_100025706717_100000211926 [1,1,0,0,0,0|0,0,0]=2 4803 B11R1.135 CC1CCCN(CC1)CCO 34a_100025706717_100000211926 [1,1,0,0,0,0|0,0,0]=2 4804 B11R1.135 CCCN1CCCC(CC1)C 2230a_100025706717_100000210303 [1,1,0,0,0,0|0,0,0]=2 4805 B11R1.135 CCCN1CCCC(CC1)C 269982a_100025706717_100000210303 [1,1,0,0,0,0|0,0,0]=2 4806 B11R1.135 CCCN1CCCC(CC1)C 34a_100025706717_100000210303 [1,1,0,0,0,0|0,0,0]=2 4807 B11R1.135 CCCN1CCCC(CC1)O 2230a_100015186869_100000210303 [1,1,0,0,0,0|0,0,0]=2 4808 B11R1.135 CCCN1CCCC(CC1)O 269982a_100015186869_100000210303 [1,1,0,0,0,0|0,0,0]=2 4809 B11R1.135 CCCN1CCCN(CC1)C 2230a_100000211313_100000210303 [1,1,0,0,0,0|1,0,0]=3 4810 B11R1.135 CCCN1CCCN(CC1)C 2230a_100000748530_200000210301 [1,1,0,0,0,0|1,0,0]=3 4811 B11R1.135 CCCN1CCCN(CC1)C 269982a_100000211313_100000210303 [1,1,0,0,0,0|1,0,0]=3 4812 B11R1.135 CCCN1CCCN(CC1)C 269982a_100000748530_200000210301 [1,1,0,0,0,0|1,0,0]=3 4813 B11R1.135 CCCN1CCCN(CC1)[13CH3] 2230a_100000748530_200025704644 [1,1,0,0,0,0|1,0,0]=3 4814 B11R1.135 CCCN1CCCN(CC1)[13CH3] 269982a_100000748530_200025704644 [1,1,0,0,0,0|1,0,0]=3 4815 B11R1.135 CCCN1CCNC(=O)CC1 2230a_100000698595_100000210303 [1,1,0,0,0,0|1,0,1]=4 4816 B11R1.135 CCCN1CCNC(=O)CC1 269982a_100000698595_100000210303 [1,1,0,0,0,0|1,0,1]=4 4817 B11R1.135 CN1CCCN(CC1)CCF 2230a_100000211313_100011217306 [1,1,0,0,0,0|2,0,0]=4 4818 B11R1.135 CN1CCCN(CC1)CCF 269982a_100000211313_100011217306 [1,1,0,0,0,0|2,0,0]=4 4819 B11R1.135 CN1CCCN(CC1)CCO 2230a_100000211313_100000211926 [1,1,0,0,0,0|1,0,0]=3 4820 B11R1.135 CN1CCCN(CC1)CCO 269982a_100000211313_100000211926 [1,1,0,0,0,0|1,0,0]=3 4821 B11R1.135 CN1CCCN(CC1)CCO 269982a_100000752306_200000210301 [1,1,0,0,0,0|1,0,0]=3 4822 B11R1.135 COCN1CCCC(CC1)C 2230a_100025706717_100000766300 [1,1,0,0,0,0|1,0,0]=3 4823 B11R1.135 COCN1CCCC(CC1)C 269982a_100025706717_100000766300 [1,1,0,0,0,0|1,0,0]=3 4824 B11R1.135 COCN1CCCC(CC1)O 2230a_100015186869_100000766300 [1,1,0,0,0,0|1,0,0]=3 4825 B11R1.135 COCN1CCCC(CC1)O 269982a_100015186869_100000766300 [1,1,0,0,0,0|1,0,0]=3 4826 B11R1.135 COCN1CCCN(CC1)C 2230a_100000211313_100000766300 [1,1,0,0,0,0|2,0,0]=4 4827 B11R1.135 COCN1CCCN(CC1)C 269982a_100000211313_100000766300 [1,1,0,0,0,0|2,0,0]=4 4828 B11R1.135 CSCN1CCCC(CC1)C 2230a_100025706717_100011218213 [1,1,0,0,0,0|1,0,0]=3 4829 B11R1.135 CSCN1CCCC(CC1)C 269982a_100025706717_100011218213 [1,1,0,0,0,0|1,0,0]=3 4830 B11R1.135 CSCN1CCCC(CC1)C 34a_100025706717_100011218213 [1,1,0,0,0,0|1,0,0]=3 4831 B11R1.135 CSCN1CCCC(CC1)O 2230a_100015186869_100011218213 [1,1,0,0,0,0|1,0,0]=3 4832 B11R1.135 CSCN1CCCC(CC1)O 269982a_100015186869_100011218213 [1,1,0,0,0,0|1,0,0]=3 4833 B11R1.135 CSCN1CCCN(CC1)C 2230a_100000211313_100011218213 [1,1,0,0,0,0|2,0,0]=4 4834 B11R1.135 CSCN1CCCN(CC1)C 269982a_100000211313_100011218213 [1,1,0,0,0,0|2,0,0]=4 4835 B11R1.135 N#CCN1CCCC(CC1)O 2230a_100015186869_100011215382 [1,1,0,0,0,0|1,0,1]=4 4836 B11R1.135 N#CCN1CCCC(CC1)O 269982a_100015186869_100011214920 [1,1,0,0,0,0|1,0,1]=4 4837 B11R1.135 O=C1CCN(CCN1)CCO 2230a_100000698595_100000211926 [1,1,0,0,0,0|1,0,1]=4 4838 B11R1.135 O=C1CCN(CCN1)CCO 269982a_100000698595_100000211926 [1,1,0,0,0,0|1,0,1]=4 4839 B11R1.135 O=CCN1CCCC(CC1)O 2230a_100015186869_200015260668 [1,1,0,0,0,0|0,0,2]=4 4840 B11R1.135 O=CCN1CCCC(CC1)O 269982a_100015186869_200015260668 [1,1,0,0,0,0|0,0,2]=4 4841 B11R1.135 OC1CCCN(CC1)CCF 2230a_100015186869_100011217306 [1,1,0,0,0,0|1,0,0]=3 4842 B11R1.135 OC1CCCN(CC1)CCF 269982a_100015186869_100011217306 [1,1,0,0,0,0|1,0,0]=3 4843 B11R1.135 OCCN1CCCC(CC1)O 2230a_100015186869_100000211926 [1,1,0,0,0,0|0,0,0]=2 4844 B11R1.135 OCCN1CCCC(CC1)O 269982a_100015186869_100000211926 [1,1,0,0,0,0|0,0,0]=2 4845 B11R1.135 [13CH3]N1CCCN(CC1)CCO 269982a_100000752306_200025704644 [1,1,0,0,0,0|1,0,0]=3 4846 B11R1.203 BrCCOC1CCCCCC1 34a_100000211926_100011217769 [1,1,0,0,0,0|2,0,0]=4 4847 B11R1.203 C#CCCN1CCCCCC1 2230a_100000185865_100000688953 [1,1,0,0,0,0|0,0,1]=3 4848 B11R1.203 C#CCCN1CCCCCC1 269982a_100000185865_100000730999 [1,1,0,0,0,0|0,0,1]=3 4849 B11R1.203 C#CCCN1CCCCCC1 34a_100000185865_100000688953 [1,1,0,0,0,0|0,0,1]=3 4850 B11R1.203 C#CCCN1CCCOCC1 2230a_100000685342_100000688953 [1,1,0,0,0,0|1,0,1]=4 4851 B11R1.203 C#CCCN1CCCOCC1 269982a_100000685342_100000730999 [1,1,0,0,0,0|1,0,1]=4 4852 B11R1.203 C#CCCN1CCCOCC1 34a_100000685342_100000688953 [1,1,0,0,0,0|1,0,1]=4 4853 B11R1.203 C/C=C/CN1CCCCCC1 269982a_100000185865_100102629194 [1,1,0,0,0,0|0,0,1]=3 4854 B11R1.203 C/C=C/CN1CCCCCC1 34a_100000185865_100102629194 [1,1,0,0,0,0|0,0,1]=3 4855 B11R1.203 C/C=C/CN1CCCOCC1 269982a_100000685342_100102629194 [1,1,0,0,0,0|1,0,1]=4 4856 B11R1.203 C/C=C/CN1CCCOCC1 34a_100000685342_100102629194 [1,1,0,0,0,0|1,0,1]=4 4857 B11R1.203 C=CCCN1CCCCCC1 2230a_100000185865_100000754431 [1,1,0,0,0,0|0,0,1]=3 4858 B11R1.203 C=CCCN1CCCCCC1 269982a_100000185865_100000754431 [1,1,0,0,0,0|0,0,1]=3 4859 B11R1.203 C=CCCN1CCCCCC1 34a_100000185865_100000754431 [1,1,0,0,0,0|0,0,1]=3 4860 B11R1.203 C=CCCN1CCCOCC1 2230a_100000685342_100000754431 [1,1,0,0,0,0|1,0,1]=4 4861 B11R1.203 C=CCCN1CCCOCC1 269982a_100000685342_100000754431 [1,1,0,0,0,0|1,0,1]=4 4862 B11R1.203 C=CCCN1CCCOCC1 34a_100000685342_100000754431 [1,1,0,0,0,0|1,0,1]=4 4863 B11R1.203 CC#CCN1CCCCCC1 2230a_100000185865_100000748600 [1,1,0,0,0,0|0,0,1]=3 4864 B11R1.203 CC#CCN1CCCCCC1 34a_100000185865_100000748600 [1,1,0,0,0,0|0,0,1]=3 4865 B11R1.203 CC#CCN1CCCOCC1 2230a_100000685342_100000748600 [1,1,0,0,0,0|1,0,1]=4 4866 B11R1.203 CC#CCN1CCCOCC1 34a_100000685342_100000748600 [1,1,0,0,0,0|1,0,1]=4 4867 B11R1.203 CC=CCN1CCCCCC1 2230a_100000185865_100000070051 [1,1,0,0,0,0|0,0,1]=3 4868 B11R1.203 CC=CCN1CCCCCC1 34a_100000185865_100000070051 [1,1,0,0,0,0|0,0,1]=3 4869 B11R1.203 CC=CCN1CCCOCC1 2230a_100000685342_100000070051 [1,1,0,0,0,0|1,0,1]=4 4870 B11R1.203 CC=CCN1CCCOCC1 34a_100000685342_100000070051 [1,1,0,0,0,0|1,0,1]=4 4871 B11R1.203 CCCCN1CCCCCC1 2230a_100000185865_100000210211 [1,1,0,0,0,0|0,0,0]=2 4872 B11R1.203 CCCCN1CCCCCC1 269982a_100000185865_100000210211 [1,1,0,0,0,0|0,0,0]=2 4873 B11R1.203 CCCCN1CCCCCC1 34a_100000185865_100000210210 [1,1,0,0,0,0|0,0,0]=2 4874 B11R1.203 CCCCN1CCCOCC1 2230a_100000685342_100000210211 [1,1,0,0,0,0|1,0,0]=3 4875 B11R1.203 CCCCN1CCCOCC1 269982a_100000685342_100000210211 [1,1,0,0,0,0|1,0,0]=3 4876 B11R1.203 CCCCN1CCCOCC1 34a_100000685342_100000210210 [1,1,0,0,0,0|1,0,0]=3 4877 B11R1.203 CCCNC1CCCCCC1 2230a_100000210984_100000210303 [1,1,0,0,0,0|1,0,0]=3 4878 B11R1.203 CCCNC1CCCCCC1 270004a_100020643023_100000210131 [1,1,0,0,0,0|1,0,0]=3 4879 B11R1.203 CCCNC1CCCCCC1 34a_100000210984_100000210303 [1,1,0,0,0,0|1,0,0]=3 4880 B11R1.203 CCCNC1CCCNCC1 270004a_100020643023_100015187895 [1,1,0,0,0,0|2,0,0]=4 4881 B11R1.203 CCCOC1CCCCCC1 34a_100000210258_100011217769 [1,1,0,0,0,0|1,0,0]=3 4882 B11R1.203 CCCOC1CCCCCC1 34a_100000210887_100000210303 [1,1,0,0,0,0|1,0,0]=3 4883 B11R1.203 CCCOC1CCCCCC1 7a_100000210887_100000210303 [1,1,0,0,0,0|1,0,0]=3 4884 B11R1.203 CCCSC1CCCCCC1 62a_100000210303_100011217769 [1,1,0,0,0,0|1,0,0]=3 4885 B11R1.203 CCCSC1CCCCCC1 62a_100011217769_100000210303 [1,1,0,0,0,0|1,0,0]=3 4886 B11R1.203 CCNCC1CCCCCC1 2230a_100015204231_100000210202 [1,1,0,0,0,0|1,0,0]=3 4887 B11R1.203 CCNCC1CCCCCC1 2230a_100015525214_200000696569 [1,1,0,0,0,0|1,0,0]=3 4888 B11R1.203 CCNCC1CCCCCC1 269862a_100015525214_200000763224 [1,1,0,0,0,0|1,0,0]=3 4889 B11R1.203 CCNCC1CCCCCC1 34a_100015204231_100000210202 [1,1,0,0,0,0|1,0,0]=3 4890 B11R1.203 CCNN=C1CCCCCC1 4a_100000756455_100000210131 [1,1,0,0,0,0|2,0,0]=4 4891 B11R1.203 CCOCC1CCCCCC1 34a_100000699130_100000210202 [1,1,0,0,0,0|1,0,0]=3 4892 B11R1.203 CCOCC1CCCCCC1 34a_100121572206_200000696569 [1,1,0,0,0,0|1,0,0]=3 4893 B11R1.203 CCOCC1CCCCCC1 7a_100000699130_100000210202 [1,1,0,0,0,0|1,0,0]=3 4894 B11R1.203 CCOCN1CCCCCC1 269982a_100000185865_100000739092 [1,1,0,0,0,0|0,0,0]=2 4895 B11R1.203 CCOCN1CCCOCC1 269982a_100000685342_100000739092 [1,1,0,0,0,0|1,0,0]=3 4896 B11R1.203 CCSCC1CCCCCC1 62a_100000210202_200000696569 [1,1,0,0,0,0|1,0,0]=3 4897 B11R1.203 CCSCC1CCCCCC1 62a_200000696569_100000210202 [1,1,0,0,0,0|1,0,0]=3 4898 B11R1.203 CNCCC1CCCCCC1 2230a_100011532351_200000210301 [1,1,0,0,0,0|1,0,0]=3 4899 B11R1.203 CNCCC1CCCCCC1 34a_100011532351_200000210301 [1,1,0,0,0,0|1,0,0]=3 4900 B11R1.203 CNCCN1CCCCCC1 7a_106832991635_100000722644 [1,1,0,0,0,0|0,0,0]=2 4901 B11R1.203 COCCN1CCCCCC1 2230a_100000185865_100011201679 [1,1,0,0,0,0|0,0,0]=2 4902 B11R1.203 COCCN1CCCCCC1 269982a_100000185865_100000233755 [1,1,0,0,0,0|0,0,0]=2 4903 B11R1.203 COCCN1CCCCCC1 34a_100000185865_100011201679 [1,1,0,0,0,0|0,0,0]=2 4904 B11R1.203 COCCN1CCCCCC1 34a_100000238007_200000210301 [1,1,0,0,0,0|0,0,0]=2 4905 B11R1.203 COCCN1CCCOCC1 2230a_100000685342_100011201679 [1,1,0,0,0,0|1,0,0]=3 4906 B11R1.203 COCCN1CCCOCC1 269982a_100000685342_100000233755 [1,1,0,0,0,0|1,0,0]=3 4907 B11R1.203 COCCN1CCCOCC1 34a_100000685342_100011201679 [1,1,0,0,0,0|1,0,0]=3 4908 B11R1.203 COCNC1CCCCCC1 2230a_100000210984_100000766300 [1,1,0,0,0,0|2,0,0]=4 4909 B11R1.203 COCSC1CCCCCC1 62a_100000766300_100011217769 [1,1,0,0,0,0|2,0,0]=4 4910 B11R1.203 COCSC1CCCCCC1 62a_100011217769_100000766300 [1,1,0,0,0,0|2,0,0]=4 4911 B11R1.203 CSCCN1CCCCCC1 2230a_100000185865_100000751147 [1,1,0,0,0,0|0,0,0]=2 4912 B11R1.203 CSCCN1CCCCCC1 269982a_100000185865_100000212216 [1,1,0,0,0,0|0,0,0]=2 4913 B11R1.203 CSCCN1CCCCCC1 34a_100000185865_100000212216 [1,1,0,0,0,0|0,0,0]=2 4914 B11R1.203 CSCCN1CCCCCC1 62a_100000722644_200000210301 [1,1,0,0,0,0|0,0,0]=2 4915 B11R1.203 CSCCN1CCCCCC1 62a_200000210301_100000722644 [1,1,0,0,0,0|0,0,0]=2 4916 B11R1.203 CSCCN1CCCOCC1 2230a_100000685342_100000751147 [1,1,0,0,0,0|1,0,0]=3 4917 B11R1.203 CSCCN1CCCOCC1 269982a_100000685342_100000212216 [1,1,0,0,0,0|1,0,0]=3 4918 B11R1.203 CSCCN1CCCOCC1 34a_100000685342_100000212216 [1,1,0,0,0,0|1,0,0]=3 4919 B11R1.203 CSCNC1CCCCCC1 2230a_100000210984_100011218213 [1,1,0,0,0,0|2,0,0]=4 4920 B11R1.203 CSCNC1CCCCCC1 34a_100000210984_100011218213 [1,1,0,0,0,0|2,0,0]=4 4921 B11R1.203 CSCOC1CCCCCC1 34a_100000210887_100011218213 [1,1,0,0,0,0|2,0,0]=4 4922 B11R1.203 CSCSC1CCCCCC1 62a_100011217769_100011218213 [1,1,0,0,0,0|2,0,0]=4 4923 B11R1.203 CSCSC1CCCCCC1 62a_100011218213_100011217769 [1,1,0,0,0,0|2,0,0]=4 4924 B11R1.203 FCCCN1CCCCCC1 2230a_100000185865_100011934791 [1,1,0,0,0,0|0,0,0]=2 4925 B11R1.203 FCCCN1CCCCCC1 269982a_100000185865_100011934791 [1,1,0,0,0,0|0,0,0]=2 4926 B11R1.203 FCCCN1CCCCCC1 34a_100000185865_100011934791 [1,1,0,0,0,0|0,0,0]=2 4927 B11R1.203 FCCCN1CCCOCC1 2230a_100000685342_100011934791 [1,1,0,0,0,0|1,0,0]=3 4928 B11R1.203 FCCCN1CCCOCC1 269982a_100000685342_100011934791 [1,1,0,0,0,0|1,0,0]=3 4929 B11R1.203 FCCCN1CCCOCC1 34a_100000685342_100011934791 [1,1,0,0,0,0|1,0,0]=3 4930 B11R1.203 FCCNC1CCCCCC1 2230a_100000210984_100011217306 [1,1,0,0,0,0|2,0,0]=4 4931 B11R1.203 FCCNC1CCCCCC1 34a_100000210984_100011217306 [1,1,0,0,0,0|2,0,0]=4 4932 B11R1.203 FCCNC1CCCCCC1 34a_100000724931_100011217769 [1,1,0,0,0,0|2,0,0]=4 4933 B11R1.203 FCCOC1CCCCCC1 34a_100000210887_100011217306 [1,1,0,0,0,0|2,0,0]=4 4934 B11R1.203 FCCOC1CCCCCC1 7a_100000210887_100011217306 [1,1,0,0,0,0|2,0,0]=4 4935 B11R1.203 FCCSC1CCCCCC1 62a_100011217306_100011217769 [1,1,0,0,0,0|2,0,0]=4 4936 B11R1.203 FCCSC1CCCCCC1 62a_100011217769_100011217306 [1,1,0,0,0,0|2,0,0]=4 4937 B11R1.203 FCNCC1CCCCCC1 34a_100015204231_100015361967 [1,1,0,0,0,0|2,0,0]=4 4938 B11R1.203 FCOCC1CCCCCC1 34a_100000699130_100015361967 [1,1,0,0,0,0|2,0,0]=4 4939 B11R1.203 FCOCC1CCCCCC1 7a_100000699130_100015361967 [1,1,0,0,0,0|2,0,0]=4 4940 B11R1.203 FCSCC1CCCCCC1 62a_100015361967_200000696569 [1,1,0,0,0,0|2,0,0]=4 4941 B11R1.203 FCSCC1CCCCCC1 62a_200000696569_100015361967 [1,1,0,0,0,0|2,0,0]=4 4942 B11R1.203 N#CCCN1CCCCCC1 2230a_100000185865_100011215226 [1,1,0,0,0,0|0,0,1]=3 4943 B11R1.203 N#CCCN1CCCCCC1 269982a_100000185865_100011215226 [1,1,0,0,0,0|0,0,1]=3 4944 B11R1.203 N#CCCN1CCCOCC1 2230a_100000685342_100011215226 [1,1,0,0,0,0|1,0,1]=4 4945 B11R1.203 N#CCCN1CCCOCC1 269982a_100000685342_100011215226 [1,1,0,0,0,0|1,0,1]=4 4946 B11R1.203 N#CSCN1CCCCCC1 269982a_100000185865_100000211825 [1,1,0,0,0,0|1,0,1]=4 4947 B11R1.203 NCCOC1CCCCCC1 34a_100000210304_100011217769 [1,1,0,0,0,0|2,0,0]=4 4948 B11R1.203 OCCCN1CCCCCC1 2230a_100000185865_100000230001 [1,1,0,0,0,0|0,0,0]=2 4949 B11R1.203 OCCCN1CCCCCC1 269982a_100000185865_100011215043 [1,1,0,0,0,0|0,0,0]=2 4950 B11R1.203 OCCCN1CCCCCC1 34a_100000185865_100000230001 [1,1,0,0,0,0|0,0,0]=2 4951 B11R1.203 OCCCN1CCCOCC1 2230a_100000685342_100000230001 [1,1,0,0,0,0|1,0,0]=3 4952 B11R1.203 OCCCN1CCCOCC1 269982a_100000685342_100011215043 [1,1,0,0,0,0|1,0,0]=3 4953 B11R1.203 OCCCN1CCCOCC1 34a_100000685342_100000230001 [1,1,0,0,0,0|1,0,0]=3 4954 B11R1.203 OCCNC1CCCCCC1 2230a_100000210984_100000211926 [1,1,0,0,0,0|1,0,0]=3 4955 B11R1.203 OCCNC1CCCCCC1 270004a_100000210304_100000210131 [1,1,0,0,0,0|1,0,0]=3 4956 B11R1.203 OCCNC1CCCCCC1 34a_100000210984_100000211926 [1,1,0,0,0,0|1,0,0]=3 4957 B11R1.203 OCCNC1CCCCCC1 34a_100016990907_100011217769 [1,1,0,0,0,0|1,0,0]=3 4958 B11R1.203 OCCNC1CCCNCC1 270004a_100000210304_100015187895 [1,1,0,0,0,0|2,0,0]=4 4959 B11R1.203 OCCOC1CCCCCC1 34a_100000210887_100000211926 [1,1,0,0,0,0|1,0,0]=3 4960 B11R1.203 OCCOC1CCCCCC1 7a_100000210887_100000211926 [1,1,0,0,0,0|1,0,0]=3 4961 B11R1.203 OCCSC1CCCCCC1 62a_100000211926_100011217769 [1,1,0,0,0,0|1,0,0]=3 4962 B11R1.203 OCCSC1CCCCCC1 62a_100011217769_100000211926 [1,1,0,0,0,0|1,0,0]=3 4963 B11R1.203 [13CH3]NCCC1CCCCCC1 2230a_100011532351_200025704644 [1,1,0,0,0,0|1,0,0]=3 4964 B11R1.203 [13CH3]NCCC1CCCCCC1 34a_100011532351_200025704644 [1,1,0,0,0,0|1,0,0]=3 4965 B11R1.203 [13CH3]OCCN1CCCCCC1 34a_100000238007_200025704644 [1,1,0,0,0,0|0,0,0]=2 4966 B11R1.203 [13CH3]SCCN1CCCCCC1 62a_100000722644_200025704644 [1,1,0,0,0,0|0,0,0]=2 4967 B11R1.203 [13CH3]SCCN1CCCCCC1 62a_200025704644_100000722644 [1,1,0,0,0,0|0,0,0]=2 4968 B11R1.779 CCNC1(CCCCCC1)C 2230a_100000704638_100000210202 [1,1,0,0,0,0|2,0,0]=4 4969 B11R1.779 CCNC1(CCCCCC1)C 34a_100000704638_100000210202 [1,1,0,0,0,0|2,0,0]=4 4970 B11R1.779 CCOC1(CCCCCC1)C 34a_100000708895_100000210202 [1,1,0,0,0,0|2,0,0]=4 4971 B11R1.779 CCOC1(CCCCCC1)C 7a_100000708895_100000210202 [1,1,0,0,0,0|2,0,0]=4 4972 B11R1.852 C#CC(C)N1CCCCCC1 34a_100000185865_200000035995 [1,1,0,0,0,0|0,0,2]=4 4973 B11R1.852 C=CC(C)N1CCCCCC1 269982a_100000185865_100011215867 [1,1,0,0,0,0|0,0,2]=4 4974 B11R1.852 CC(C#N)N1CCCCCC1 2230a_100000185865_100000184139 [1,1,0,0,0,0|1,0,1]=4 4975 B11R1.852 CC(C#N)N1CCCCCC1 269982a_100000185865_100000703298 [1,1,0,0,0,0|1,0,1]=4 4976 B11R1.852 CC(CO)N1CCCCCC1 2230a_100000185865_100012180447 [1,1,0,0,0,0|0,0,0]=2 4977 B11R1.852 CC(CO)N1CCCCCC1 34a_100000185865_100012180447 [1,1,0,0,0,0|0,0,0]=2 4978 B11R1.852 CC(CO)N1CCCOCC1 2230a_100000685342_100012180447 [1,1,0,0,0,0|1,0,0]=3 4979 B11R1.852 CC(CO)N1CCCOCC1 34a_100000685342_100012180447 [1,1,0,0,0,0|1,0,0]=3 4980 B11R1.852 CCC(=O)C1CCCCCC1 1458a_100000210414_100011217769 [1,1,0,0,0,0|1,0,1]=4 4981 B11R1.852 CCC(=O)C1CCCCCC1 1458a_100000749507_100000210202 [1,1,0,0,0,0|1,0,1]=4 4982 B11R1.852 CCC(=O)N1CCCCCC1 11a_100000185865_100000210414 [1,1,0,0,0,0|0,0,1]=3 4983 B11R1.852 CCC(=O)N1CCCCCC1 1626a_100000185865_100000210414 [1,1,0,0,0,0|0,0,1]=3 4984 B11R1.852 CCC(=O)N1CCCCCC1 240690a_100000185865_100000210414 [1,1,0,0,0,0|0,0,1]=3 4985 B11R1.852 CCC(=O)N1CCCCCC1 527a_100000185865_100000210414 [1,1,0,0,0,0|0,0,1]=3 4986 B11R1.852 CCC(=O)N1CCCOCC1 11a_100000685342_100000210414 [1,1,0,0,0,0|1,0,1]=4 4987 B11R1.852 CCC(=O)N1CCCOCC1 1626a_100000685342_100000210414 [1,1,0,0,0,0|1,0,1]=4 4988 B11R1.852 CCC(=O)N1CCCOCC1 240690a_100000685342_100000210414 [1,1,0,0,0,0|1,0,1]=4 4989 B11R1.852 CCC(=O)N1CCCOCC1 527a_100000685342_100000210414 [1,1,0,0,0,0|1,0,1]=4 4990 B11R1.852 CCC(C)N1CCCCCC1 2230a_100000185865_100000758301 [1,1,0,0,0,0|0,0,0]=2 4991 B11R1.852 CCC(C)N1CCCCCC1 269982a_100000185865_100000758301 [1,1,0,0,0,0|0,0,0]=2 4992 B11R1.852 CCC(C)N1CCCCCC1 34a_100000185865_100011215416 [1,1,0,0,0,0|0,0,0]=2 4993 B11R1.852 CCC(C)N1CCCOCC1 2230a_100000685342_100000758301 [1,1,0,0,0,0|1,0,0]=3 4994 B11R1.852 CCC(C)N1CCCOCC1 269982a_100000685342_100000758301 [1,1,0,0,0,0|1,0,0]=3 4995 B11R1.852 CCC(C)N1CCCOCC1 34a_100000685342_100011215416 [1,1,0,0,0,0|1,0,0]=3 4996 B11R1.852 CCN(C)C1CCCCCC1 2230a_100015185097_100000210202 [1,1,0,0,0,0|2,0,0]=4 4997 B11R1.852 CCN(C)C1CCCCCC1 2230a_114901603759_200000210301 [1,1,0,0,0,0|2,0,0]=4 4998 B11R1.852 CCN(C)C1CCCCCC1 269982a_100000225621_100011217769 [1,1,0,0,0,0|2,0,0]=4 4999 B11R1.852 CCN(C)C1CCCCCC1 269982a_100015185097_100000204670 [1,1,0,0,0,0|2,0,0]=4 5000 B11R1.852 CCN(C)C1CCCCCC1 269982a_114901603759_200000210301 [1,1,0,0,0,0|2,0,0]=4 5001 B11R1.852 CCN(C)C1CCCCCC1 34a_100015185097_100000210202 [1,1,0,0,0,0|2,0,0]=4 5002 B11R1.852 CCN(C)C1CCCCCC1 34a_114901603759_200000210301 [1,1,0,0,0,0|2,0,0]=4 5003 B11R1.852 CCN([13CH3])C1CCCCCC1 2230a_114901603759_200025704644 [1,1,0,0,0,0|2,0,0]=4 5004 B11R1.852 CCN([13CH3])C1CCCCCC1 269982a_114901603759_200025704644 [1,1,0,0,0,0|2,0,0]=4 5005 B11R1.852 CCN([13CH3])C1CCCCCC1 34a_114901603759_200025704644 [1,1,0,0,0,0|2,0,0]=4 5006 B11R1.852 CNC(=O)N1CCCCCC1 2708a_100102657272_100000185865 [1,1,0,0,0,0|1,0,1]=4 5007 B11R1.852 CNC(=O)N1CCCCCC1 273464a_100102657272_100000185865 [1,1,0,0,0,0|1,0,1]=4 5008 B11R1.852 COC(C)N1CCCCCC1 269982a_100000185865_100009879195 [1,1,0,0,0,0|1,0,0]=3 5009 B11R1.852 COC(C)N1CCCOCC1 269982a_100000685342_100009879195 [1,1,0,0,0,0|2,0,0]=4 5010 B11R1.852 C[C@H](CO)N1CCCCCC1 269982a_100000185865_100016084084 [1,1,0,0,0,0|0,0,0]=2 5011 B11R1.852 C[C@H](CO)N1CCCOCC1 269982a_100000685342_100016084084 [1,1,0,0,0,0|1,0,0]=3 5012 B11R1.852 O=C(CO)C1CCCCCC1 1458a_100000210174_100011217769 [1,1,0,0,0,0|1,0,1]=4 5013 B11R1.852 O=C(CO)N1CCCCCC1 240690a_100000185865_100000210174 [1,1,0,0,0,0|0,0,1]=3 5014 B11R1.852 O=C(CO)N1CCCCCC1 527a_100000185865_100000210174 [1,1,0,0,0,0|0,0,1]=3 5015 B11R1.852 O=C(CO)N1CCCOCC1 240690a_100000685342_100000210174 [1,1,0,0,0,0|1,0,1]=4 5016 B11R1.852 O=C(CO)N1CCCOCC1 527a_100000685342_100000210174 [1,1,0,0,0,0|1,0,1]=4 5017 B11R1.20 C=C(C)CN1CCC(CC1)C 2230a_100000188429_100000748629 [0,1,0,0,1,0|1,0,1]=4 5018 B11R1.20 C=C(C)CN1CCC(CC1)C 269982a_100000188429_100000748629 [0,1,0,0,1,0|1,0,1]=4 5019 B11R1.20 C=C(C)CN1CCC(CC1)C 34a_100000188429_100000748629 [0,1,0,0,1,0|1,0,1]=4 5020 B11R1.20 C=C(C)CN1CCC(CC1)F 2230a_100015193889_100000748629 [0,1,0,0,1,0|1,0,1]=4 5021 B11R1.20 C=C(C)CN1CCC(CC1)F 269982a_100015193889_100000748629 [0,1,0,0,1,0|1,0,1]=4 5022 B11R1.20 C=C(C)CN1CCC(CC1)F 34a_100015193889_100000748629 [0,1,0,0,1,0|1,0,1]=4 5023 B11R1.20 C=C(C)CN1CCC(CC1)O 2230a_100025773856_100000748629 [0,1,0,0,1,0|1,0,1]=4 5024 B11R1.20 C=C(C)CN1CCC(CC1)O 269982a_100025773856_100000748629 [0,1,0,0,1,0|1,0,1]=4 5025 B11R1.20 C=C1CCN(CC1)CC(C)C 2230a_100000752442_100000210760 [0,1,0,0,1,0|1,0,1]=4 5026 B11R1.20 C=C1CCN(CC1)CC(C)C 269982a_100000752442_100000210624 [0,1,0,0,1,0|1,0,1]=4 5027 B11R1.20 C=C1CCN(CC1)CC(C)C 270004a_100000752442_100000210432 [0,1,0,0,1,0|1,0,1]=4 5028 B11R1.20 C=C1CCN(CC1)CC(C)C 34a_100000752442_100000210624 [0,1,0,0,1,0|1,0,1]=4 5029 B11R1.20 C=C1CCN(CC1)CC(C)O 2230a_100000752442_100011218427 [0,1,0,0,1,0|0,0,1]=3 5030 B11R1.20 C=C1CCN(CC1)CC(C)O 269982a_100000752442_100011218427 [0,1,0,0,1,0|0,0,1]=3 5031 B11R1.20 C=C1CCN(CC1)CC(C)O 34a_100000752442_100011218427 [0,1,0,0,1,0|0,0,1]=3 5032 B11R1.20 C=C1CCN(CC1)C[C@@H](C)O 2230a_100000752442_100009817552 [0,1,0,0,1,0|0,0,1]=3 5033 B11R1.20 C=C1CCN(CC1)C[C@@H](C)O 269982a_100000752442_100009817552 [0,1,0,0,1,0|0,0,1]=3 5034 B11R1.20 C=C1CCN(CC1)C[C@@H](C)O 34a_100000752442_100009817552 [0,1,0,0,1,0|0,0,1]=3 5035 B11R1.20 CC(=O)CN1CCC(CC1)C 1458a_100000238061_200000210301 [0,1,0,0,1,0|0,0,2]=4 5036 B11R1.20 CC(C)CN1CCC(CC1)C 2230a_100000188429_100000210760 [0,1,0,0,1,0|1,0,0]=3 5037 B11R1.20 CC(C)CN1CCC(CC1)C 269982a_100000188429_100000210624 [0,1,0,0,1,0|1,0,0]=3 5038 B11R1.20 CC(C)CN1CCC(CC1)C 270004a_100000188429_100000210432 [0,1,0,0,1,0|1,0,0]=3 5039 B11R1.20 CC(C)CN1CCC(CC1)C 34a_100000188429_100000210624 [0,1,0,0,1,0|1,0,0]=3 5040 B11R1.20 CC(C)CN1CCC(CC1)F 2230a_100015193889_100000210760 [0,1,0,0,1,0|1,0,0]=3 5041 B11R1.20 CC(C)CN1CCC(CC1)F 269982a_100015193889_100000210624 [0,1,0,0,1,0|1,0,0]=3 5042 B11R1.20 CC(C)CN1CCC(CC1)F 270004a_100015193889_100000210432 [0,1,0,0,1,0|1,0,0]=3 5043 B11R1.20 CC(C)CN1CCC(CC1)F 34a_100015193889_100000210624 [0,1,0,0,1,0|1,0,0]=3 5044 B11R1.20 CC(C)CN1CCC(CC1)O 2230a_100025773856_100000210760 [0,1,0,0,1,0|1,0,0]=3 5045 B11R1.20 CC(C)CN1CCC(CC1)O 269982a_100025773856_100000210624 [0,1,0,0,1,0|1,0,0]=3 5046 B11R1.20 CC(C)CN1CCC(CC1)O 270004a_100025773856_100000210432 [0,1,0,0,1,0|1,0,0]=3 5047 B11R1.20 CC(C)CN1CCN(CC1)C 2230a_100000188432_100000210760 [0,1,0,0,1,0|2,0,0]=4 5048 B11R1.20 CC(C)CN1CCN(CC1)C 2230a_100000203725_200000210301 [0,1,0,0,1,0|2,0,0]=4 5049 B11R1.20 CC(C)CN1CCN(CC1)C 269982a_100000188432_100000210624 [0,1,0,0,1,0|2,0,0]=4 5050 B11R1.20 CC(C)CN1CCN(CC1)C 269982a_100000203725_200000210301 [0,1,0,0,1,0|2,0,0]=4 5051 B11R1.20 CC(C)CN1CCN(CC1)C 270004a_100000188432_100000210432 [0,1,0,0,1,0|2,0,0]=4 5052 B11R1.20 CC(C)CN1CCN(CC1)[13CH3] 2230a_100000203725_200025704644 [0,1,0,0,1,0|2,0,0]=4 5053 B11R1.20 CC(C)CN1CCN(CC1)[13CH3] 269982a_100000203725_200025704644 [0,1,0,0,1,0|2,0,0]=4 5054 B11R1.20 CC(C)CN1CCS(=O)CC1 2230a_100000752083_100000210760 [0,1,0,0,1,0|2,0,0]=4 5055 B11R1.20 CC(C)CN1CCS(=O)CC1 269982a_100000752083_100000210624 [0,1,0,0,1,0|2,0,0]=4 5056 B11R1.20 CC(C)CN1CCS(=O)CC1 270004a_100000752083_100000210432 [0,1,0,0,1,0|2,0,0]=4 5057 B11R1.20 CC(O)CN1CCC(CC1)C 2230a_100000188429_100011218427 [0,1,0,0,1,0|0,0,0]=2 5058 B11R1.20 CC(O)CN1CCC(CC1)C 269982a_100000188429_100011218427 [0,1,0,0,1,0|0,0,0]=2 5059 B11R1.20 CC(O)CN1CCC(CC1)C 34a_100000188429_100011218427 [0,1,0,0,1,0|0,0,0]=2 5060 B11R1.20 CC(O)CN1CCC(CC1)F 2230a_100015193889_100011218427 [0,1,0,0,1,0|0,0,0]=2 5061 B11R1.20 CC(O)CN1CCC(CC1)F 269982a_100015193889_100011218427 [0,1,0,0,1,0|0,0,0]=2 5062 B11R1.20 CC(O)CN1CCC(CC1)F 34a_100015193889_100011218427 [0,1,0,0,1,0|0,0,0]=2 5063 B11R1.20 CC(O)CN1CCC(CC1)O 2230a_100025773856_100011218427 [0,1,0,0,1,0|0,0,0]=2 5064 B11R1.20 CC(O)CN1CCC(CC1)O 269982a_100025773856_100011218427 [0,1,0,0,1,0|0,0,0]=2 5065 B11R1.20 CC(O)CN1CCN(CC1)C 2230a_100000188432_100011218427 [0,1,0,0,1,0|1,0,0]=3 5066 B11R1.20 CC(O)CN1CCN(CC1)C 2230a_100000751509_200000210301 [0,1,0,0,1,0|1,0,0]=3 5067 B11R1.20 CC(O)CN1CCN(CC1)C 269982a_100000188432_100011218427 [0,1,0,0,1,0|1,0,0]=3 5068 B11R1.20 CC(O)CN1CCN(CC1)C 269982a_100000751509_200000210301 [0,1,0,0,1,0|1,0,0]=3 5069 B11R1.20 CC(O)CN1CCN(CC1)[13CH3] 2230a_100000751509_200025704644 [0,1,0,0,1,0|1,0,0]=3 5070 B11R1.20 CC(O)CN1CCN(CC1)[13CH3] 269982a_100000751509_200025704644 [0,1,0,0,1,0|1,0,0]=3 5071 B11R1.20 CC(O)CN1CCS(=O)CC1 2230a_100000752083_100011218427 [0,1,0,0,1,0|1,0,0]=3 5072 B11R1.20 CC(O)CN1CCS(=O)CC1 269982a_100000752083_100011218427 [0,1,0,0,1,0|1,0,0]=3 5073 B11R1.20 CC1=CCN(CC1)CC(C)O 2230a_100000693516_100011218427 [0,1,0,0,1,0|0,0,2]=4 5074 B11R1.20 CC1=CCN(CC1)CC(C)O 269982a_100000693516_100011218427 [0,1,0,0,1,0|0,0,2]=4 5075 B11R1.20 CC1=CCN(CC1)CC(C)O 34a_100000693516_100011218427 [0,1,0,0,1,0|0,0,2]=4 5076 B11R1.20 CC1=CCN(CC1)C[C@@H](C)O 2230a_100000693516_100009817552 [0,1,0,0,1,0|0,0,2]=4 5077 B11R1.20 CC1=CCN(CC1)C[C@@H](C)O 269982a_100000693516_100009817552 [0,1,0,0,1,0|0,0,2]=4 5078 B11R1.20 CC1=CCN(CC1)C[C@@H](C)O 34a_100000693516_100009817552 [0,1,0,0,1,0|0,0,2]=4 5079 B11R1.20 CC1CCN(CC1)CC(=O)[13CH3] 1458a_100000238061_200025704644 [0,1,0,0,1,0|0,0,2]=4 5080 B11R1.20 CC1CCN(CC1)CC(F)F 2230a_100000188429_100011934356 [0,1,0,0,1,0|2,0,0]=4 5081 B11R1.20 CC1CCN(CC1)CC(F)F 269982a_100000188429_100011934356 [0,1,0,0,1,0|2,0,0]=4 5082 B11R1.20 CC1CCN(CC1)CC(F)F 34a_100000188429_100011934356 [0,1,0,0,1,0|2,0,0]=4 5083 B11R1.20 CC1CCN(CC1)C[C@@H](C)O 2230a_100000188429_100009817552 [0,1,0,0,1,0|0,0,0]=2 5084 B11R1.20 CC1CCN(CC1)C[C@@H](C)O 269982a_100000188429_100009817552 [0,1,0,0,1,0|0,0,0]=2 5085 B11R1.20 CC1CCN(CC1)C[C@@H](C)O 34a_100000188429_100009817552 [0,1,0,0,1,0|0,0,0]=2 5086 B11R1.20 C[C@@H](O)CN1CCC(CC1)F 2230a_100015193889_100009817552 [0,1,0,0,1,0|0,0,0]=2 5087 B11R1.20 C[C@@H](O)CN1CCC(CC1)F 269982a_100015193889_100009817552 [0,1,0,0,1,0|0,0,0]=2 5088 B11R1.20 C[C@@H](O)CN1CCC(CC1)F 34a_100015193889_100009817552 [0,1,0,0,1,0|0,0,0]=2 5089 B11R1.20 C[C@@H](O)CN1CCC(CC1)O 2230a_100025773856_100009817552 [0,1,0,0,1,0|0,0,0]=2 5090 B11R1.20 C[C@@H](O)CN1CCC(CC1)O 269982a_100025773856_100009817552 [0,1,0,0,1,0|0,0,0]=2 5091 B11R1.20 C[C@@H](O)CN1CCN(CC1)C 2230a_100000188432_100009817552 [0,1,0,0,1,0|1,0,0]=3 5092 B11R1.20 C[C@@H](O)CN1CCN(CC1)C 269982a_100000188432_100009817552 [0,1,0,0,1,0|1,0,0]=3 5093 B11R1.20 C[C@@H](O)CN1CCS(=O)CC1 2230a_100000752083_100009817552 [0,1,0,0,1,0|1,0,0]=3 5094 B11R1.20 C[C@@H](O)CN1CCS(=O)CC1 269982a_100000752083_100009817552 [0,1,0,0,1,0|1,0,0]=3 5095 B11R1.20 FC(F)CN1CCC(CC1)F 2230a_100015193889_100011934356 [0,1,0,0,1,0|2,0,0]=4 5096 B11R1.20 FC(F)CN1CCC(CC1)F 269982a_100015193889_100011934356 [0,1,0,0,1,0|2,0,0]=4 5097 B11R1.20 FC(F)CN1CCC(CC1)F 34a_100015193889_100011934356 [0,1,0,0,1,0|2,0,0]=4 5098 B11R1.20 OC1CCN(CC1)CC(F)F 2230a_100025773856_100011934356 [0,1,0,0,1,0|2,0,0]=4 5099 B11R1.20 OC1CCN(CC1)CC(F)F 269982a_100025773856_100011934356 [0,1,0,0,1,0|2,0,0]=4 5100 B11R1.36 C[C@@H](O)C(=O)C1CCCCC1 1458a_100000717761_100000210327 [0,1,0,0,1,0|1,0,1]=4 5101 B11R1.36 C[C@@H](O)C(=O)N1CCCOC1 240690a_100000131196_100000717761 [0,1,0,0,1,0|1,0,1]=4 5102 B11R1.36 C[C@@H](O)C(=O)N1CCOCC1 240690a_100015191051_100000717761 [0,1,0,0,1,0|1,0,1]=4 5103 B11R1.36 C[C@@H](O)C(=O)N1CCSCC1 240690a_100000737611_100000717761 [0,1,0,0,1,0|1,0,1]=4 5104 B11R1.36 C[C@H](O)C(=O)C1CCCCC1 1458a_217856618621_100000210327 [0,1,0,0,1,0|1,0,1]=4 5105 B11R1.36 C[C@H](O)C(=O)N1CCCOC1 240690a_100000131196_217856618621 [0,1,0,0,1,0|1,0,1]=4 5106 B11R1.36 C[C@H](O)C(=O)N1CCOCC1 1626a_100015191051_217856618621 [0,1,0,0,1,0|1,0,1]=4 5107 B11R1.36 C[C@H](O)C(=O)N1CCOCC1 240690a_100015191051_217856618621 [0,1,0,0,1,0|1,0,1]=4 5108 B11R1.36 C[C@H](O)C(=O)N1CCSCC1 240690a_100000737611_217856618621 [0,1,0,0,1,0|1,0,1]=4 5109 B11R1.40 C=CC(O)CN1CCCOC1 2230a_100000131196_100000730141 [0,1,0,0,1,0|1,0,1]=4 5110 B11R1.40 C=CC(O)CN1CCCOC1 34a_100000131196_100000730141 [0,1,0,0,1,0|1,0,1]=4 5111 B11R1.40 C=CC(O)CN1CCOCC1 2230a_100015191051_100000730141 [0,1,0,0,1,0|1,0,1]=4 5112 B11R1.40 C=CC(O)CN1CCOCC1 34a_100015191051_100000730141 [0,1,0,0,1,0|1,0,1]=4 5113 B11R1.40 C=CC(O)CN1CCSCC1 2230a_100000737611_100000730141 [0,1,0,0,1,0|1,0,1]=4 5114 B11R1.40 CC(CN1CCCCC1)N[13CH3] 2230a_100000738326_200025704644 [0,1,0,0,1,0|1,0,0]=3 5115 B11R1.40 CC(CN1CCCCC1)S[13CH3] 62a_100009831500_200025704644 [0,1,0,0,1,0|0,1,0]=3 5116 B11R1.40 CC(CN1CCCCC1)S[13CH3] 62a_200025704644_100009831500 [0,1,0,0,1,0|0,1,0]=3 5117 B11R1.40 CC(CN1CCOCC1)N[13CH3] 2230a_100000739823_200025704644 [0,1,0,0,1,0|2,0,0]=4 5118 B11R1.40 CC(CO)NC1CCCCC1 2230a_100000182618_100012180447 [0,1,0,0,1,0|2,0,0]=4 5119 B11R1.40 CC(CO)NC1CCCCC1 34a_100000182618_100012180447 [0,1,0,0,1,0|2,0,0]=4 5120 B11R1.40 CC(CO)OC1CCCCC1 34a_100000210231_100012180447 [0,1,0,0,1,0|2,0,0]=4 5121 B11R1.40 CC(CO)OC1CCCCC1 7a_100000210231_100012180447 [0,1,0,0,1,0|2,0,0]=4 5122 B11R1.40 CC(CO)SC1CCCCC1 62a_100012180447_100000210327 [0,1,0,0,1,0|2,0,0]=4 5123 B11R1.40 CCC(=O)CN1CCCCC1 1458a_100000740322_100000210202 [0,1,0,0,1,0|0,0,2]=4 5124 B11R1.40 CCC(C)CN1CCCOC1 2230a_100000131196_100000748023 [0,1,0,0,1,0|2,0,0]=4 5125 B11R1.40 CCC(C)CN1CCCOC1 269982a_100000131196_100000748023 [0,1,0,0,1,0|2,0,0]=4 5126 B11R1.40 CCC(C)CN1CCCOC1 270004a_100000131196_100000243153 [0,1,0,0,1,0|2,0,0]=4 5127 B11R1.40 CCC(C)CN1CCCOC1 34a_100000131196_100000748023 [0,1,0,0,1,0|2,0,0]=4 5128 B11R1.40 CCC(C)CN1CCOCC1 2230a_100015191051_100000748023 [0,1,0,0,1,0|2,0,0]=4 5129 B11R1.40 CCC(C)CN1CCOCC1 269982a_100015191051_100000748023 [0,1,0,0,1,0|2,0,0]=4 5130 B11R1.40 CCC(C)CN1CCOCC1 270004a_100015191051_100000243153 [0,1,0,0,1,0|2,0,0]=4 5131 B11R1.40 CCC(C)CN1CCOCC1 34a_100015191051_100000748023 [0,1,0,0,1,0|2,0,0]=4 5132 B11R1.40 CCC(C)CN1CCSCC1 2230a_100000737611_100000748023 [0,1,0,0,1,0|2,0,0]=4 5133 B11R1.40 CCC(C)CN1CCSCC1 269982a_100000737611_100000748023 [0,1,0,0,1,0|2,0,0]=4 5134 B11R1.40 CCC(C)CN1CCSCC1 270004a_100000737611_100000243153 [0,1,0,0,1,0|2,0,0]=4 5135 B11R1.40 CCC(O)CN1CC=CCC1 2230a_100000698166_100011218378 [0,1,0,0,1,0|0,0,2]=4 5136 B11R1.40 CCC(O)CN1CC=CCC1 269982a_100000698166_100011218378 [0,1,0,0,1,0|0,0,2]=4 5137 B11R1.40 CCC(O)CN1CC=CCC1 34a_100000698166_100011218378 [0,1,0,0,1,0|0,0,2]=4 5138 B11R1.40 CCC(O)CN1CCCOC1 2230a_100000131196_100011218378 [0,1,0,0,1,0|1,0,0]=3 5139 B11R1.40 CCC(O)CN1CCCOC1 269982a_100000131196_100011218378 [0,1,0,0,1,0|1,0,0]=3 5140 B11R1.40 CCC(O)CN1CCCOC1 34a_100000131196_100011218378 [0,1,0,0,1,0|1,0,0]=3 5141 B11R1.40 CCC(O)CN1CCOCC1 2230a_100015191051_100011218378 [0,1,0,0,1,0|1,0,0]=3 5142 B11R1.40 CCC(O)CN1CCOCC1 269982a_100015191051_100011218378 [0,1,0,0,1,0|1,0,0]=3 5143 B11R1.40 CCC(O)CN1CCOCC1 34a_100015191051_100011218378 [0,1,0,0,1,0|1,0,0]=3 5144 B11R1.40 CCC(O)CN1CCSCC1 2230a_100000737611_100011218378 [0,1,0,0,1,0|1,0,0]=3 5145 B11R1.40 CCC(O)CN1CCSCC1 269982a_100000737611_100011218378 [0,1,0,0,1,0|1,0,0]=3 5146 B11R1.40 CC[C@H](C)CN1CCCOC1 2230a_100000131196_100009816398 [0,1,0,0,1,0|2,0,0]=4 5147 B11R1.40 CC[C@H](C)CN1CCCOC1 269982a_100000131196_100009816398 [0,1,0,0,1,0|2,0,0]=4 5148 B11R1.40 CC[C@H](C)CN1CCCOC1 34a_100000131196_100009816398 [0,1,0,0,1,0|2,0,0]=4 5149 B11R1.40 CC[C@H](C)CN1CCOCC1 2230a_100015191051_100009816398 [0,1,0,0,1,0|2,0,0]=4 5150 B11R1.40 CC[C@H](C)CN1CCOCC1 269982a_100015191051_100009816398 [0,1,0,0,1,0|2,0,0]=4 5151 B11R1.40 CC[C@H](C)CN1CCOCC1 34a_100015191051_100009816398 [0,1,0,0,1,0|2,0,0]=4 5152 B11R1.40 CC[C@H](C)CN1CCSCC1 2230a_100000737611_100009816398 [0,1,0,0,1,0|2,0,0]=4 5153 B11R1.40 CC[C@H](C)CN1CCSCC1 269982a_100000737611_100009816398 [0,1,0,0,1,0|2,0,0]=4 5154 B11R1.40 CNC(=O)CN1CCCCC1 11a_106832991635_100000740322 [0,1,0,0,1,0|0,0,2]=4 5155 B11R1.40 CNC(=O)CN1CCCCC1 240690a_100102657272_100000740322 [0,1,0,0,1,0|0,0,2]=4 5156 B11R1.40 CNC(=O)CN1CCCCC1 527a_100102657272_100000740322 [0,1,0,0,1,0|0,0,2]=4 5157 B11R1.40 CNC(C)CC1CCCCC1 270004a_106832991635_100011215996 [0,1,0,0,1,0|2,0,0]=4 5158 B11R1.40 CNC(C)CN1CCCCC1 2230a_100000738326_200000210301 [0,1,0,0,1,0|1,0,0]=3 5159 B11R1.40 CNC(C)CN1CCOCC1 2230a_100000739823_200000210301 [0,1,0,0,1,0|2,0,0]=4 5160 B11R1.40 COC(C)SC1CCCCC1 62a_100000210327_100009879195 [0,1,0,0,1,0|2,0,0]=4 5161 B11R1.40 COC(C)SC1CCCCC1 62a_100009879195_100000210327 [0,1,0,0,1,0|2,0,0]=4 5162 B11R1.40 CSC(C)CN1CCCCC1 62a_100009831500_200000210301 [0,1,0,0,1,0|0,1,0]=3 5163 B11R1.40 CSC(C)CN1CCCCC1 62a_200000210301_100009831500 [0,1,0,0,1,0|0,1,0]=3 5164 B11R1.40 C[C@@H](CO)CN1CC=CCC1 2230a_100000698166_100000059175 [0,1,0,0,1,0|0,0,2]=4 5165 B11R1.40 C[C@@H](CO)CN1CC=CCC1 269982a_100000698166_100000059175 [0,1,0,0,1,0|0,0,2]=4 5166 B11R1.40 C[C@@H](CO)CN1CC=CCC1 34a_100000698166_100000059175 [0,1,0,0,1,0|0,0,2]=4 5167 B11R1.40 C[C@@H](CO)CN1CCCOC1 2230a_100000131196_100000059175 [0,1,0,0,1,0|1,0,0]=3 5168 B11R1.40 C[C@@H](CO)CN1CCCOC1 269982a_100000131196_100000059175 [0,1,0,0,1,0|1,0,0]=3 5169 B11R1.40 C[C@@H](CO)CN1CCCOC1 34a_100000131196_100000059175 [0,1,0,0,1,0|1,0,0]=3 5170 B11R1.40 C[C@@H](CO)CN1CCOCC1 2230a_100015191051_100000059175 [0,1,0,0,1,0|1,0,0]=3 5171 B11R1.40 C[C@@H](CO)CN1CCOCC1 269982a_100015191051_100000059175 [0,1,0,0,1,0|1,0,0]=3 5172 B11R1.40 C[C@@H](CO)CN1CCOCC1 34a_100015191051_100000059175 [0,1,0,0,1,0|1,0,0]=3 5173 B11R1.40 C[C@@H](CO)CN1CCSCC1 2230a_100000737611_100000059175 [0,1,0,0,1,0|1,0,0]=3 5174 B11R1.40 C[C@@H](CO)CN1CCSCC1 269982a_100000737611_100000059175 [0,1,0,0,1,0|1,0,0]=3 5175 B11R1.40 C[C@H](CO)NC1CCCCC1 270004a_100000737577_100000210434 [0,1,0,0,1,0|2,0,0]=4 5176 B11R1.40 C[C@H](CO)SC1CCCCC1 62a_100000210327_100016084084 [0,1,0,0,1,0|2,0,0]=4 5177 B11R1.40 C[C@H](CO)SC1CCCCC1 62a_100016084084_100000210327 [0,1,0,0,1,0|2,0,0]=4 5178 B11R1.40 O=C(CF)CN1CCCCC1 1458a_100000740322_100015361967 [0,1,0,0,1,0|0,0,2]=4 5179 B11R1.40 OCC(O)CN1CC=CCC1 2230a_100000698166_100011219619 [0,1,0,0,1,0|0,0,2]=4 5180 B11R1.40 OCC(O)CN1CC=CCC1 34a_100000698166_100011219619 [0,1,0,0,1,0|0,0,2]=4 5181 B11R1.40 OCC(O)CN1CCCOC1 2230a_100000131196_100011219619 [0,1,0,0,1,0|1,0,0]=3 5182 B11R1.40 OCC(O)CN1CCCOC1 34a_100000131196_100011219619 [0,1,0,0,1,0|1,0,0]=3 5183 B11R1.40 OCC(O)CN1CCOCC1 2230a_100015191051_100011219619 [0,1,0,0,1,0|1,0,0]=3 5184 B11R1.40 OCC(O)CN1CCOCC1 34a_100015191051_100011219619 [0,1,0,0,1,0|1,0,0]=3 5185 B11R1.40 OCC(O)CN1CCSCC1 2230a_100000737611_100011219619 [0,1,0,0,1,0|1,0,0]=3 5186 B11R1.40 OC[C@H](O)CN1CC=CCC1 2230a_100000698166_100009815848 [0,1,0,0,1,0|0,0,2]=4 5187 B11R1.40 OC[C@H](O)CN1CC=CCC1 34a_100000698166_100009815848 [0,1,0,0,1,0|0,0,2]=4 5188 B11R1.40 OC[C@H](O)CN1CCCOC1 2230a_100000131196_100009815848 [0,1,0,0,1,0|1,0,0]=3 5189 B11R1.40 OC[C@H](O)CN1CCCOC1 34a_100000131196_100009815848 [0,1,0,0,1,0|1,0,0]=3 5190 B11R1.40 OC[C@H](O)CN1CCOCC1 2230a_100015191051_100009815848 [0,1,0,0,1,0|1,0,0]=3 5191 B11R1.40 OC[C@H](O)CN1CCOCC1 34a_100015191051_100009815848 [0,1,0,0,1,0|1,0,0]=3 5192 B11R1.40 OC[C@H](O)CN1CCSCC1 2230a_100000737611_100009815848 [0,1,0,0,1,0|1,0,0]=3 5193 B11R1.40 O[C@@H](CF)CN1CC=CCC1 2230a_100000698166_100015614560 [0,1,0,0,1,0|0,0,2]=4 5194 B11R1.40 O[C@@H](CF)CN1CC=CCC1 34a_100000698166_100015614560 [0,1,0,0,1,0|0,0,2]=4 5195 B11R1.40 O[C@@H](CF)CN1CCCOC1 2230a_100000131196_100015614560 [0,1,0,0,1,0|1,0,0]=3 5196 B11R1.40 O[C@@H](CF)CN1CCCOC1 34a_100000131196_100015614560 [0,1,0,0,1,0|1,0,0]=3 5197 B11R1.40 O[C@@H](CF)CN1CCOCC1 2230a_100015191051_100015614560 [0,1,0,0,1,0|1,0,0]=3 5198 B11R1.40 O[C@@H](CF)CN1CCOCC1 34a_100015191051_100015614560 [0,1,0,0,1,0|1,0,0]=3 5199 B11R1.40 O[C@@H](CF)CN1CCSCC1 2230a_100000737611_100015614560 [0,1,0,0,1,0|1,0,0]=3 5200 B11R1.86 C=C(C)CN1CCCCC1C 2230a_100000211376_100000748629 [0,1,0,0,1,0|1,0,1]=4 5201 B11R1.86 C=C(C)CN1CCCCC1C 269982a_100000211376_100000748629 [0,1,0,0,1,0|1,0,1]=4 5202 B11R1.86 C=C(C)CN1CCCCC1C 34a_100000211376_100000748629 [0,1,0,0,1,0|1,0,1]=4 5203 B11R1.86 CC(C)CN1CCCCC1C 2230a_100000211376_100000210760 [0,1,0,0,1,0|1,0,0]=3 5204 B11R1.86 CC(C)CN1CCCCC1C 269982a_100000211376_100000210624 [0,1,0,0,1,0|1,0,0]=3 5205 B11R1.86 CC(C)CN1CCCCC1C 270004a_100000211376_100000210432 [0,1,0,0,1,0|1,0,0]=3 5206 B11R1.86 CC(C)CN1CCCCC1C 34a_100000211376_100000210624 [0,1,0,0,1,0|1,0,0]=3 5207 B11R1.86 CC(C)CN1CCOC[C@@H]1C 2230a_100009815349_100000210760 [0,1,0,0,1,0|2,0,0]=4 5208 B11R1.86 CC(C)CN1CCOC[C@@H]1C 269982a_100009815349_100000210624 [0,1,0,0,1,0|2,0,0]=4 5209 B11R1.86 CC(C)CN1CCOC[C@@H]1C 270004a_100009815349_100000210432 [0,1,0,0,1,0|2,0,0]=4 5210 B11R1.86 CC(C)CN1CCOC[C@@H]1C 34a_100009815349_100000210624 [0,1,0,0,1,0|2,0,0]=4 5211 B11R1.86 CC(O)CN1CCCCC1C 2230a_100000211376_100011218427 [0,1,0,0,1,0|0,0,0]=2 5212 B11R1.86 CC(O)CN1CCCCC1C 269982a_100000211376_100011218427 [0,1,0,0,1,0|0,0,0]=2 5213 B11R1.86 CC(O)CN1CCCCC1C 34a_100000211376_100011218427 [0,1,0,0,1,0|0,0,0]=2 5214 B11R1.86 CC(O)CN1CCOC[C@@H]1C 2230a_100009815349_100011218427 [0,1,0,0,1,0|1,0,0]=3 5215 B11R1.86 CC(O)CN1CCOC[C@@H]1C 269982a_100009815349_100011218427 [0,1,0,0,1,0|1,0,0]=3 5216 B11R1.86 CC(O)CN1CCOC[C@@H]1C 34a_100009815349_100011218427 [0,1,0,0,1,0|1,0,0]=3 5217 B11R1.86 CC1CCCCN1CC(F)F 2230a_100000211376_100011934356 [0,1,0,0,1,0|2,0,0]=4 5218 B11R1.86 CC1CCCCN1CC(F)F 269982a_100000211376_100011934356 [0,1,0,0,1,0|2,0,0]=4 5219 B11R1.86 CC1CCCCN1CC(F)F 34a_100000211376_100011934356 [0,1,0,0,1,0|2,0,0]=4 5220 B11R1.86 CC1CCCCN1C[C@@H](C)O 2230a_100000211376_100009817552 [0,1,0,0,1,0|0,0,0]=2 5221 B11R1.86 CC1CCCCN1C[C@@H](C)O 269982a_100000211376_100009817552 [0,1,0,0,1,0|0,0,0]=2 5222 B11R1.86 CC1CCCCN1C[C@@H](C)O 34a_100000211376_100009817552 [0,1,0,0,1,0|0,0,0]=2 5223 B11R1.86 C[C@@H](O)CN1CCOC[C@@H]1C 2230a_100009815349_100009817552 [0,1,0,0,1,0|1,0,0]=3 5224 B11R1.86 C[C@@H](O)CN1CCOC[C@@H]1C 269982a_100009815349_100009817552 [0,1,0,0,1,0|1,0,0]=3 5225 B11R1.86 C[C@@H](O)CN1CCOC[C@@H]1C 34a_100009815349_100009817552 [0,1,0,0,1,0|1,0,0]=3 5226 B11R1.157 C=C(C)CN1CCCC(C1)F 2230a_100000697950_100000748629 [0,1,0,0,1,0|1,0,1]=4 5227 B11R1.157 C=C(C)CN1CCCC(C1)F 269982a_100000697950_100000748629 [0,1,0,0,1,0|1,0,1]=4 5228 B11R1.157 C=C(C)CN1CCCC(C1)F 34a_100000697950_100000748629 [0,1,0,0,1,0|1,0,1]=4 5229 B11R1.157 C=C(C)CN1CCCC(C1)O 2230a_100000211013_100000748629 [0,1,0,0,1,0|1,0,1]=4 5230 B11R1.157 C=C(C)CN1CCCC(C1)O 269982a_100000211013_100000748629 [0,1,0,0,1,0|1,0,1]=4 5231 B11R1.157 C=C(C)CN1CCC[C@@H](C1)C 2230a_100000717927_100000748629 [0,1,0,0,1,0|1,0,1]=4 5232 B11R1.157 C=C(C)CN1CCC[C@@H](C1)C 269982a_100000717927_100000748629 [0,1,0,0,1,0|1,0,1]=4 5233 B11R1.157 C=C(C)CN1CCC[C@@H](C1)C 34a_100000717927_100000748629 [0,1,0,0,1,0|1,0,1]=4 5234 B11R1.157 CC(C)CN1CCCC(C1)F 2230a_100000697950_100000210760 [0,1,0,0,1,0|1,0,0]=3 5235 B11R1.157 CC(C)CN1CCCC(C1)F 269982a_100000697950_100000210624 [0,1,0,0,1,0|1,0,0]=3 5236 B11R1.157 CC(C)CN1CCCC(C1)F 270004a_100000697950_100000210432 [0,1,0,0,1,0|1,0,0]=3 5237 B11R1.157 CC(C)CN1CCCC(C1)F 34a_100000697950_100000210624 [0,1,0,0,1,0|1,0,0]=3 5238 B11R1.157 CC(C)CN1CCCC(C1)O 2230a_100000211013_100000210760 [0,1,0,0,1,0|1,0,0]=3 5239 B11R1.157 CC(C)CN1CCCC(C1)O 269982a_100000211013_100000210624 [0,1,0,0,1,0|1,0,0]=3 5240 B11R1.157 CC(C)CN1CCCC(C1)O 270004a_100000211013_100000210432 [0,1,0,0,1,0|1,0,0]=3 5241 B11R1.157 CC(C)CN1CCC[C@@H](C1)C 2230a_100000717927_100000210760 [0,1,0,0,1,0|1,0,0]=3 5242 B11R1.157 CC(C)CN1CCC[C@@H](C1)C 269982a_100000717927_100000210624 [0,1,0,0,1,0|1,0,0]=3 5243 B11R1.157 CC(C)CN1CCC[C@@H](C1)C 270004a_100000717927_100000210432 [0,1,0,0,1,0|1,0,0]=3 5244 B11R1.157 CC(C)CN1CCC[C@@H](C1)C 34a_100000717927_100000210624 [0,1,0,0,1,0|1,0,0]=3 5245 B11R1.157 CC(C)CN1CCOC(C1)C 2230a_100000729577_100000210760 [0,1,0,0,1,0|2,0,0]=4 5246 B11R1.157 CC(C)CN1CCOC(C1)C 269982a_100000729577_100000210624 [0,1,0,0,1,0|2,0,0]=4 5247 B11R1.157 CC(C)CN1CCOC(C1)C 270004a_100000729577_100000210432 [0,1,0,0,1,0|2,0,0]=4 5248 B11R1.157 CC(C)CN1CCOC(C1)C 34a_100000729577_100000210624 [0,1,0,0,1,0|2,0,0]=4 5249 B11R1.157 CC(C)CN1CCOC(C1)O 2230a_100000688207_100000210760 [0,1,0,0,1,0|2,0,0]=4 5250 B11R1.157 CC(C)CN1CCOC(C1)O 269982a_100000688207_100000210624 [0,1,0,0,1,0|2,0,0]=4 5251 B11R1.157 CC(C)CN1CCOC(C1)O 270004a_100000688207_100000210432 [0,1,0,0,1,0|2,0,0]=4 5252 B11R1.157 CC(O)CN1CCCC(C1)F 2230a_100000697950_100011218427 [0,1,0,0,1,0|0,0,0]=2 5253 B11R1.157 CC(O)CN1CCCC(C1)F 269982a_100000697950_100011218427 [0,1,0,0,1,0|0,0,0]=2 5254 B11R1.157 CC(O)CN1CCCC(C1)F 34a_100000697950_100011218427 [0,1,0,0,1,0|0,0,0]=2 5255 B11R1.157 CC(O)CN1CCCC(C1)O 2230a_100000211013_100011218427 [0,1,0,0,1,0|0,0,0]=2 5256 B11R1.157 CC(O)CN1CCCC(C1)O 269982a_100000211013_100011218427 [0,1,0,0,1,0|0,0,0]=2 5257 B11R1.157 CC(O)CN1CCC[C@@H](C1)C 2230a_100000717927_100011218427 [0,1,0,0,1,0|0,0,0]=2 5258 B11R1.157 CC(O)CN1CCC[C@@H](C1)C 269982a_100000717927_100011218427 [0,1,0,0,1,0|0,0,0]=2 5259 B11R1.157 CC(O)CN1CCC[C@@H](C1)C 34a_100000717927_100011218427 [0,1,0,0,1,0|0,0,0]=2 5260 B11R1.157 CC(O)CN1CCNC(=O)C1 2230a_100000184651_100011218427 [0,1,0,0,1,0|1,0,1]=4 5261 B11R1.157 CC(O)CN1CCOC(=O)C1 2230a_100000131268_100011218427 [0,1,0,0,1,0|1,0,1]=4 5262 B11R1.157 CC(O)CN1CCOC(C1)C 2230a_100000729577_100011218427 [0,1,0,0,1,0|1,0,0]=3 5263 B11R1.157 CC(O)CN1CCOC(C1)C 269982a_100000729577_100011218427 [0,1,0,0,1,0|1,0,0]=3 5264 B11R1.157 CC(O)CN1CCOC(C1)C 34a_100000729577_100011218427 [0,1,0,0,1,0|1,0,0]=3 5265 B11R1.157 CC(O)CN1CCOC(C1)O 2230a_100000688207_100011218427 [0,1,0,0,1,0|1,0,0]=3 5266 B11R1.157 CC(O)CN1CCOC(C1)O 269982a_100000688207_100011218427 [0,1,0,0,1,0|1,0,0]=3 5267 B11R1.157 CC1=CCCN(C1)CC(C)O 2230a_100000725631_100011218427 [0,1,0,0,1,0|0,0,2]=4 5268 B11R1.157 CC1=CCCN(C1)CC(C)O 269982a_100000725631_100011218427 [0,1,0,0,1,0|0,0,2]=4 5269 B11R1.157 CC1=CCCN(C1)CC(C)O 34a_100000725631_100011218427 [0,1,0,0,1,0|0,0,2]=4 5270 B11R1.157 CC1=CCCN(C1)C[C@@H](C)O 2230a_100000725631_100009817552 [0,1,0,0,1,0|0,0,2]=4 5271 B11R1.157 CC1=CCCN(C1)C[C@@H](C)O 269982a_100000725631_100009817552 [0,1,0,0,1,0|0,0,2]=4 5272 B11R1.157 CC1=CCCN(C1)C[C@@H](C)O 34a_100000725631_100009817552 [0,1,0,0,1,0|0,0,2]=4 5273 B11R1.157 CC1CN(CCO1)C[C@@H](C)O 2230a_100000729577_100009817552 [0,1,0,0,1,0|1,0,0]=3 5274 B11R1.157 CC1CN(CCO1)C[C@@H](C)O 269982a_100000729577_100009817552 [0,1,0,0,1,0|1,0,0]=3 5275 B11R1.157 CC1CN(CCO1)C[C@@H](C)O 34a_100000729577_100009817552 [0,1,0,0,1,0|1,0,0]=3 5276 B11R1.157 C[C@@H](O)CN1CCCC(C1)F 2230a_100000697950_100009817552 [0,1,0,0,1,0|0,0,0]=2 5277 B11R1.157 C[C@@H](O)CN1CCCC(C1)F 269982a_100000697950_100009817552 [0,1,0,0,1,0|0,0,0]=2 5278 B11R1.157 C[C@@H](O)CN1CCCC(C1)F 34a_100000697950_100009817552 [0,1,0,0,1,0|0,0,0]=2 5279 B11R1.157 C[C@@H](O)CN1CCCC(C1)O 2230a_100000211013_100009817552 [0,1,0,0,1,0|0,0,0]=2 5280 B11R1.157 C[C@@H](O)CN1CCCC(C1)O 269982a_100000211013_100009817552 [0,1,0,0,1,0|0,0,0]=2 5281 B11R1.157 C[C@@H](O)CN1CCNC(=O)C1 2230a_100000184651_100009817552 [0,1,0,0,1,0|1,0,1]=4 5282 B11R1.157 C[C@@H](O)CN1CCOC(=O)C1 2230a_100000131268_100009817552 [0,1,0,0,1,0|1,0,1]=4 5283 B11R1.157 C[C@@H](O)CN1CCOC(C1)O 2230a_100000688207_100009817552 [0,1,0,0,1,0|1,0,0]=3 5284 B11R1.157 C[C@@H](O)CN1CCOC(C1)O 269982a_100000688207_100009817552 [0,1,0,0,1,0|1,0,0]=3 5285 B11R1.157 C[C@H]1CCCN(C1)CC(F)F 2230a_100000717927_100011934356 [0,1,0,0,1,0|2,0,0]=4 5286 B11R1.157 C[C@H]1CCCN(C1)CC(F)F 269982a_100000717927_100011934356 [0,1,0,0,1,0|2,0,0]=4 5287 B11R1.157 C[C@H]1CCCN(C1)CC(F)F 34a_100000717927_100011934356 [0,1,0,0,1,0|2,0,0]=4 5288 B11R1.157 C[C@H]1CCCN(C1)C[C@@H](C)O 2230a_100000717927_100009817552 [0,1,0,0,1,0|0,0,0]=2 5289 B11R1.157 C[C@H]1CCCN(C1)C[C@@H](C)O 269982a_100000717927_100009817552 [0,1,0,0,1,0|0,0,0]=2 5290 B11R1.157 C[C@H]1CCCN(C1)C[C@@H](C)O 34a_100000717927_100009817552 [0,1,0,0,1,0|0,0,0]=2 5291 B11R1.157 FC(F)CN1CCCC(C1)F 2230a_100000697950_100011934356 [0,1,0,0,1,0|2,0,0]=4 5292 B11R1.157 FC(F)CN1CCCC(C1)F 269982a_100000697950_100011934356 [0,1,0,0,1,0|2,0,0]=4 5293 B11R1.157 FC(F)CN1CCCC(C1)F 34a_100000697950_100011934356 [0,1,0,0,1,0|2,0,0]=4 5294 B11R1.157 OC1CCCN(C1)CC(F)F 2230a_100000211013_100011934356 [0,1,0,0,1,0|2,0,0]=4 5295 B11R1.157 OC1CCCN(C1)CC(F)F 269982a_100000211013_100011934356 [0,1,0,0,1,0|2,0,0]=4 5296 B11R1.509 CC(C)(C)CN1CCCOC1 270004a_100000131196_100011204126 [0,1,0,0,1,0|2,0,0]=4 5297 B11R1.509 CC(C)(C)CN1CCCOC1 34a_100000131196_100011219605 [0,1,0,0,1,0|2,0,0]=4 5298 B11R1.509 CC(C)(C)CN1CCOCC1 270004a_100015191051_100011204126 [0,1,0,0,1,0|2,0,0]=4 5299 B11R1.509 CC(C)(C)CN1CCOCC1 34a_100015191051_100011219605 [0,1,0,0,1,0|2,0,0]=4 5300 B11R1.509 CC(C)(C)CN1CCSCC1 270004a_100000737611_100011204126 [0,1,0,0,1,0|2,0,0]=4 5301 B11R1.509 CC(C)(F)CN1CCCOC1 34a_100000131196_100011997219 [0,1,0,0,1,0|2,0,0]=4 5302 B11R1.509 CC(C)(F)CN1CCOCC1 34a_100015191051_100011997219 [0,1,0,0,1,0|2,0,0]=4 5303 B11R1.509 CC(C)(O)CN1CC=CCC1 34a_100000698166_100000764493 [0,1,0,0,1,0|0,0,2]=4 5304 B11R1.509 CC(C)(O)CN1CCCOC1 34a_100000131196_100000764493 [0,1,0,0,1,0|1,0,0]=3 5305 B11R1.509 CC(C)(O)CN1CCOCC1 34a_100015191051_100000764493 [0,1,0,0,1,0|1,0,0]=3 5306 B11R1.497 CC(=O)N1CCCCC(C1)O 240690a_100025706797_100015343762 [0,1,0,0,1,0|0,0,2]=4 5307 B11R1.497 CC(C)N1CCCCC(C1)O 2230a_100025706797_100000210206 [0,1,0,0,1,0|1,0,0]=3 5308 B11R1.497 CC(C)N1CCCCC(C1)O 269982a_100025706797_100000210206 [0,1,0,0,1,0|1,0,0]=3 5309 B11R1.497 CC(C)N1CCOC[C@@H](C1)O 2230a_100016073750_100000210206 [0,1,0,0,1,0|2,0,0]=4 5310 B11R1.497 CC(C)N1CCOC[C@@H](C1)O 269982a_100016073750_100000210206 [0,1,0,0,1,0|2,0,0]=4 5311 B11R1.565 CC(=O)N1CCCC(CC1)C 11a_100025706717_100015343762 [0,1,0,0,1,0|0,0,2]=4 5312 B11R1.565 CC(=O)N1CCCC(CC1)C 1626a_100025706717_100015343762 [0,1,0,0,1,0|0,0,2]=4 5313 B11R1.565 CC(=O)N1CCCC(CC1)C 240690a_100025706717_100015343762 [0,1,0,0,1,0|0,0,2]=4 5314 B11R1.565 CC(=O)N1CCCC(CC1)C 527a_100025706717_100103153847 [0,1,0,0,1,0|0,0,2]=4 5315 B11R1.565 CC(=O)N1CCCC(CC1)O 240690a_100015186869_100015343762 [0,1,0,0,1,0|0,0,2]=4 5316 B11R1.565 CC(=O)N1CCCC(CC1)O 527a_100015186869_100103153847 [0,1,0,0,1,0|0,0,2]=4 5317 B11R1.565 CC(C)N1CCCC(CC1)O 2230a_100015186869_100000210206 [0,1,0,0,1,0|1,0,0]=3 5318 B11R1.565 CC(C)N1CCCC(CC1)O 269982a_100015186869_100000210206 [0,1,0,0,1,0|1,0,0]=3 5319 B11R1.565 CC(C)N1CCCN(CC1)C 2230a_100000211313_100000210206 [0,1,0,0,1,0|2,0,0]=4 5320 B11R1.565 CC(C)N1CCCN(CC1)C 269982a_100000211313_100000210206 [0,1,0,0,1,0|2,0,0]=4 5321 B11R1.565 CC1CCCN(CC1)C(C)C 2230a_100025706717_100000210206 [0,1,0,0,1,0|1,0,0]=3 5322 B11R1.565 CC1CCCN(CC1)C(C)C 269982a_100025706717_100000210206 [0,1,0,0,1,0|1,0,0]=3 5323 B11R1.565 CC1CCCN(CC1)C(C)C 34a_100025706717_100000210206 [0,1,0,0,1,0|1,0,0]=3 5324 B11R1.1121 CC(C)(C)N1CCCCCC1 269982a_100000185865_100000210625 [0,1,0,0,1,0|1,0,0]=3 5325 B11R1.1121 CC(C)(C)N1CCCCCC1 34a_100000185865_100000210625 [0,1,0,0,1,0|1,0,0]=3 5326 B11R1.1121 CC(C)(C)N1CCCOCC1 269982a_100000685342_100000210625 [0,1,0,0,1,0|2,0,0]=4 5327 B11R1.1121 CC(C)(C)N1CCCOCC1 34a_100000685342_100000210625 [0,1,0,0,1,0|2,0,0]=4 5328 B11R1.1121 CS(=O)(=O)N1CCCCCC1 40a_100000185865_100000738038 [0,1,0,0,1,0|1,0,1]=4 5329 B11R1.1121 FC(F)(F)N1CCCCCC1 269982a_100000185865_200000243211 [0,1,0,0,1,0|2,0,0]=4 5330 B11R1.1121 FC(F)(F)N1CCCCCC1 34a_100000185865_200103152311 [0,1,0,0,1,0|2,0,0]=4 5331 B13R1.280 CC(O)CSC1CCCCCC1=O 62a_100000243696_100011218427 [0,1,0,0,0,1|1,0,1]=4 5332 B13R1.280 CC(O)CSC1CCCCCC1=O 62a_100011218427_100000243696 [0,1,0,0,0,1|1,0,1]=4 5333 B13R1.280 C[C@@H](O)CSC1CCCCCC1=O 62a_100000243696_100009817552 [0,1,0,0,0,1|1,0,1]=4 5334 B13R1.280 C[C@@H](O)CSC1CCCCCC1=O 62a_100009817552_100000243696 [0,1,0,0,0,1|1,0,1]=4 5335 B13R1.1711 C#CC(C)NCC1CCCCCC1 2230a_100000707721_200000696569 [0,1,0,0,0,1|2,0,0]=4 5336 B13R1.1711 C#CC(C)NCC1CCCCCC1 34a_100000707721_200000696569 [0,1,0,0,0,1|2,0,0]=4 5337 B13R1.1711 C#CC(C)NCC1CCCCCC1 34a_100015204231_200000035995 [0,1,0,0,0,1|2,0,0]=4 5338 B13R1.1711 C#CC(C)OCC1CCCCCC1 34a_100000699130_200000035995 [0,1,0,0,0,1|2,0,0]=4 5339 B13R1.1711 C#CC(C)SCC1CCCCCC1 62a_200000035995_200000696569 [0,1,0,0,0,1|2,0,0]=4 5340 B13R1.1711 C#C[C@@H](C)OCC1CCCCCC1 34a_100009815206_200000696569 [0,1,0,0,0,1|2,0,0]=4 5341 B13R1.1711 C#C[C@@H](C)OCC1CCCCCC1 7a_100009815206_200000696569 [0,1,0,0,0,1|2,0,0]=4 5342 B13R1.1711 C=CC(C)COC1CCCCCC1 34a_100011215527_100011217769 [0,1,0,0,0,1|2,0,0]=4 5343 B13R1.1711 C=CC(C)OCC1CCCCCC1 34a_100000695699_200000696569 [0,1,0,0,0,1|2,0,0]=4 5344 B13R1.1711 C=CC(C)SCC1CCCCCC1 62a_100011215867_200000696569 [0,1,0,0,0,1|2,0,0]=4 5345 B13R1.1711 C=CC(O)CNC1CCCCCC1 2230a_100000210984_100000730141 [0,1,0,0,0,1|1,0,1]=4 5346 B13R1.1711 C=CC(O)CNC1CCCCCC1 34a_100000210984_100000730141 [0,1,0,0,0,1|1,0,1]=4 5347 B13R1.1711 C=CC(O)COC1CCCCCC1 34a_100000210887_100000730141 [0,1,0,0,0,1|1,0,1]=4 5348 B13R1.1711 C=CC(O)COC1CCCCCC1 7a_100000210887_100000730141 [0,1,0,0,0,1|1,0,1]=4 5349 B13R1.1711 C=CC(O)CSC1CCCCCC1 62a_100000730141_100011217769 [0,1,0,0,0,1|1,0,1]=4 5350 B13R1.1711 C=CC(O)CSC1CCCCCC1 62a_100011217769_100000730141 [0,1,0,0,0,1|1,0,1]=4 5351 B13R1.1711 CC(C#N)NCC1CCCCCC1 2230a_100000737613_200000696569 [0,1,0,0,0,1|2,0,0]=4 5352 B13R1.1711 CC(C#N)NCC1CCCCCC1 2230a_100015204231_100000184139 [0,1,0,0,0,1|2,0,0]=4 5353 B13R1.1711 CC(C#N)OCC1CCCCCC1 34a_100011218135_200000696569 [0,1,0,0,0,1|2,0,0]=4 5354 B13R1.1711 CC(C#N)OCC1CCCCCC1 7a_100000699130_100000703298 [0,1,0,0,0,1|2,0,0]=4 5355 B13R1.1711 CC(C#N)SCC1CCCCCC1 62a_100000703298_200000696569 [0,1,0,0,0,1|2,0,0]=4 5356 B13R1.1711 CC(C#N)SCC1CCCCCC1 62a_200000696569_100000703298 [0,1,0,0,0,1|2,0,0]=4 5357 B13R1.1711 CC(CF)OCC1CCCCCC1 34a_100016041109_200000696569 [0,1,0,0,0,1|2,0,0]=4 5358 B13R1.1711 CC(CF)OCC1CCCCCC1 7a_100016041109_200000696569 [0,1,0,0,0,1|2,0,0]=4 5359 B13R1.1711 CC(CN)COC1CCCCCC1 34a_100000744482_100011217769 [0,1,0,0,0,1|2,0,0]=4 5360 B13R1.1711 CC(CN)OCC1CCCCCC1 34a_100000210904_200000696569 [0,1,0,0,0,1|2,0,0]=4 5361 B13R1.1711 CC(CO)CNC1CCCCCC1 34a_100000744482_100011217769 [0,1,0,0,0,1|1,0,0]=3 5362 B13R1.1711 CC(CO)NCC1CCCCCC1 2230a_100015204231_100012180447 [0,1,0,0,0,1|1,0,0]=3 5363 B13R1.1711 CC(CO)NCC1CCCCCC1 34a_100015204231_100012180447 [0,1,0,0,0,1|1,0,0]=3 5364 B13R1.1711 CC(CO)OCC1CCCCCC1 34a_100000699130_100012180447 [0,1,0,0,0,1|1,0,0]=3 5365 B13R1.1711 CC(CO)OCC1CCCCCC1 7a_100000699130_100012180447 [0,1,0,0,0,1|1,0,0]=3 5366 B13R1.1711 CC(CO)SCC1CCCCCC1 62a_100012180447_200000696569 [0,1,0,0,0,1|1,0,0]=3 5367 B13R1.1711 CCC(=O)CCN1CCCCCC1 1458a_100000210414_100000722644 [0,1,0,0,0,1|0,0,2]=4 5368 B13R1.1711 CCC(=O)CCN1CCCCCC1 1458a_100000740320_100000210202 [0,1,0,0,0,1|0,0,2]=4 5369 B13R1.1711 CCC(C)CNC1CCCCCC1 2230a_100000210984_100000748023 [0,1,0,0,0,1|2,0,0]=4 5370 B13R1.1711 CCC(C)CNC1CCCCCC1 270004a_100000210984_100000243153 [0,1,0,0,0,1|2,0,0]=4 5371 B13R1.1711 CCC(C)CNC1CCCCCC1 270004a_100020588543_100000210131 [0,1,0,0,0,1|2,0,0]=4 5372 B13R1.1711 CCC(C)CNC1CCCCCC1 34a_100000210984_100000748023 [0,1,0,0,0,1|2,0,0]=4 5373 B13R1.1711 CCC(C)COC1CCCCCC1 34a_100000210887_100000748023 [0,1,0,0,0,1|2,0,0]=4 5374 B13R1.1711 CCC(C)COC1CCCCCC1 7a_100000210887_100000748023 [0,1,0,0,0,1|2,0,0]=4 5375 B13R1.1711 CCC(C)CSC1CCCCCC1 62a_100000748023_100011217769 [0,1,0,0,0,1|2,0,0]=4 5376 B13R1.1711 CCC(C)CSC1CCCCCC1 62a_100011217769_100000748023 [0,1,0,0,0,1|2,0,0]=4 5377 B13R1.1711 CCC(C)NCC1CCCCCC1 2230a_100000209981_200000696569 [0,1,0,0,0,1|2,0,0]=4 5378 B13R1.1711 CCC(C)NCC1CCCCCC1 2230a_100015204231_100000758301 [0,1,0,0,0,1|2,0,0]=4 5379 B13R1.1711 CCC(C)NCC1CCCCCC1 269862a_100000209981_200000763224 [0,1,0,0,0,1|2,0,0]=4 5380 B13R1.1711 CCC(C)NCC1CCCCCC1 34a_100015204231_100011215416 [0,1,0,0,0,1|2,0,0]=4 5381 B13R1.1711 CCC(C)OCC1CCCCCC1 34a_100000699130_100011215416 [0,1,0,0,0,1|2,0,0]=4 5382 B13R1.1711 CCC(C)OCC1CCCCCC1 7a_100000210228_200000696569 [0,1,0,0,0,1|2,0,0]=4 5383 B13R1.1711 CCC(C)OCC1CCCCCC1 7a_100000699130_100000758301 [0,1,0,0,0,1|2,0,0]=4 5384 B13R1.1711 CCC(C)SCC1CCCCCC1 62a_100000758301_200000696569 [0,1,0,0,0,1|2,0,0]=4 5385 B13R1.1711 CCC(C)SCC1CCCCCC1 62a_200000696569_100000758301 [0,1,0,0,0,1|2,0,0]=4 5386 B13R1.1711 CCC(O)CNC1CCCCCC1 2230a_100000210984_100011218378 [0,1,0,0,0,1|1,0,0]=3 5387 B13R1.1711 CCC(O)CNC1CCCCCC1 270004a_100011218483_100000210131 [0,1,0,0,0,1|1,0,0]=3 5388 B13R1.1711 CCC(O)CNC1CCCCCC1 34a_100000210984_100011218378 [0,1,0,0,0,1|1,0,0]=3 5389 B13R1.1711 CCC(O)CNC1CCCNCC1 270004a_100011218483_100015187895 [0,1,0,0,0,1|2,0,0]=4 5390 B13R1.1711 CCC(O)COC1CCCCCC1 34a_100000210887_100011218378 [0,1,0,0,0,1|1,0,0]=3 5391 B13R1.1711 CCC(O)COC1CCCCCC1 7a_100000210887_100011218378 [0,1,0,0,0,1|1,0,0]=3 5392 B13R1.1711 CCC(O)CSC1CCCCCC1 62a_100011217769_100011218378 [0,1,0,0,0,1|1,0,0]=3 5393 B13R1.1711 CCC(O)CSC1CCCCCC1 62a_100011218378_100011217769 [0,1,0,0,0,1|1,0,0]=3 5394 B13R1.1711 CCN(C)CCN1CCCCCC1 2230a_100000731084_200000210301 [0,1,0,0,0,1|2,0,0]=4 5395 B13R1.1711 CCN(C)CCN1CCCCCC1 269982a_100000225621_100000722644 [0,1,0,0,0,1|2,0,0]=4 5396 B13R1.1711 CCN(C)CCN1CCCCCC1 269982a_100000731084_200000210301 [0,1,0,0,0,1|2,0,0]=4 5397 B13R1.1711 CCN(C)CCN1CCCCCC1 269982a_106744473495_100000204670 [0,1,0,0,0,1|2,0,0]=4 5398 B13R1.1711 CCN([13CH3])CCN1CCCCCC1 2230a_100000731084_200025704644 [0,1,0,0,0,1|2,0,0]=4 5399 B13R1.1711 CCN([13CH3])CCN1CCCCCC1 269982a_100000731084_200025704644 [0,1,0,0,0,1|2,0,0]=4 5400 B13R1.1711 CC[C@H](C)CNC1CCCCCC1 2230a_100000210984_100009816398 [0,1,0,0,0,1|2,0,0]=4 5401 B13R1.1711 CC[C@H](C)CNC1CCCCCC1 34a_100000210984_100009816398 [0,1,0,0,0,1|2,0,0]=4 5402 B13R1.1711 CC[C@H](C)COC1CCCCCC1 34a_100000210887_100009816398 [0,1,0,0,0,1|2,0,0]=4 5403 B13R1.1711 CC[C@H](C)COC1CCCCCC1 7a_100000210887_100009816398 [0,1,0,0,0,1|2,0,0]=4 5404 B13R1.1711 CC[C@H](C)CSC1CCCCCC1 62a_100009816398_100011217769 [0,1,0,0,0,1|2,0,0]=4 5405 B13R1.1711 CC[C@H](C)CSC1CCCCCC1 62a_100011217769_100009816398 [0,1,0,0,0,1|2,0,0]=4 5406 B13R1.1711 CN(CF)CCN1CCCCCC1 269982a_106744473495_100015361967 [0,1,0,0,0,1|2,0,0]=4 5407 B13R1.1711 CNC(=O)CCN1CCCCCC1 2230a_100000185865_100000737683 [0,1,0,0,0,1|0,0,2]=4 5408 B13R1.1711 CNC(=O)CCN1CCCCCC1 240690a_100102657272_100000740320 [0,1,0,0,0,1|0,0,2]=4 5409 B13R1.1711 CNC(=O)CCN1CCCCCC1 269982a_100000185865_100000737683 [0,1,0,0,0,1|0,0,2]=4 5410 B13R1.1711 CNC(=O)CCN1CCCCCC1 34a_100000185865_100012179268 [0,1,0,0,0,1|0,0,2]=4 5411 B13R1.1711 COC(=O)CCN1CCCCCC1 2230a_100000185865_100000204255 [0,1,0,0,0,1|0,0,2]=4 5412 B13R1.1711 COC(=O)CCN1CCCCCC1 269982a_100000185865_100000204255 [0,1,0,0,0,1|0,0,2]=4 5413 B13R1.1711 COC(=O)CCN1CCCCCC1 34a_100000185865_100000742370 [0,1,0,0,0,1|0,0,2]=4 5414 B13R1.1711 COC(C)COC1CCCCCC1 34a_100000690652_100011217769 [0,1,0,0,0,1|1,0,0]=3 5415 B13R1.1711 COC(C)SCC1CCCCCC1 62a_100009879195_200000696569 [0,1,0,0,0,1|1,0,0]=3 5416 B13R1.1711 COC(C)SCC1CCCCCC1 62a_200000696569_100009879195 [0,1,0,0,0,1|1,0,0]=3 5417 B13R1.1711 CO[C@H](C)CNC1CCCCCC1 270004a_100020591295_100000210131 [0,1,0,0,0,1|1,0,0]=3 5418 B13R1.1711 CO[C@H](C)CNC1CCCNCC1 270004a_100020591295_100015187895 [0,1,0,0,0,1|2,0,0]=4 5419 B13R1.1711 C[C@@H](CO)CNC1CCCCCC1 2230a_100000210984_100000059175 [0,1,0,0,0,1|1,0,0]=3 5420 B13R1.1711 C[C@@H](CO)CNC1CCCCCC1 34a_100000210984_100000059175 [0,1,0,0,0,1|1,0,0]=3 5421 B13R1.1711 C[C@@H](CO)COC1CCCCCC1 34a_100000210887_100000059175 [0,1,0,0,0,1|1,0,0]=3 5422 B13R1.1711 C[C@@H](CO)COC1CCCCCC1 7a_100000210887_100000059175 [0,1,0,0,0,1|1,0,0]=3 5423 B13R1.1711 C[C@@H](CO)CSC1CCCCCC1 62a_100000059175_100011217769 [0,1,0,0,0,1|1,0,0]=3 5424 B13R1.1711 C[C@@H](CO)CSC1CCCCCC1 62a_100011217769_100000059175 [0,1,0,0,0,1|1,0,0]=3 5425 B13R1.1711 C[C@H](CF)NCC1CCCCCC1 269862a_100102880703_200000763224 [0,1,0,0,0,1|2,0,0]=4 5426 B13R1.1711 C[C@H](CO)NCC1CCCCCC1 2230a_100000737577_200000696569 [0,1,0,0,0,1|1,0,0]=3 5427 B13R1.1711 C[C@H](CO)NCC1CCCCCC1 269862a_100000737577_200000763224 [0,1,0,0,0,1|1,0,0]=3 5428 B13R1.1711 C[C@H](CO)SCC1CCCCCC1 62a_100016084084_200000696569 [0,1,0,0,0,1|1,0,0]=3 5429 B13R1.1711 C[C@H](CO)SCC1CCCCCC1 62a_200000696569_100016084084 [0,1,0,0,0,1|1,0,0]=3 5430 B13R1.1711 ClCC(Cl)COC1CCCCCC1 34a_100000033668_100011217769 [0,1,0,0,0,1|2,0,0]=4 5431 B13R1.1711 NC[C@@H](F)COC1CCCCCC1 34a_100015665980_100011217769 [0,1,0,0,0,1|2,0,0]=4 5432 B13R1.1711 O=C(CF)CCN1CCCCCC1 1458a_100000740320_100015361967 [0,1,0,0,0,1|0,0,2]=4 5433 B13R1.1711 O=C(CO)CCN1CCCCCC1 1458a_100000210174_100000722644 [0,1,0,0,0,1|0,0,2]=4 5434 B13R1.1711 OCC(O)CNC1CCCCCC1 2230a_100000210984_100011219619 [0,1,0,0,0,1|1,0,0]=3 5435 B13R1.1711 OCC(O)CNC1CCCCCC1 34a_100000210984_100011219619 [0,1,0,0,0,1|1,0,0]=3 5436 B13R1.1711 OCC(O)COC1CCCCCC1 34a_100000210887_100011219619 [0,1,0,0,0,1|1,0,0]=3 5437 B13R1.1711 OCC(O)COC1CCCCCC1 7a_100000210887_100011219619 [0,1,0,0,0,1|1,0,0]=3 5438 B13R1.1711 OCC(O)CSC1CCCCCC1 62a_100011217769_100011219619 [0,1,0,0,0,1|1,0,0]=3 5439 B13R1.1711 OCC(O)CSC1CCCCCC1 62a_100011219619_100011217769 [0,1,0,0,0,1|1,0,0]=3 5440 B13R1.1711 OC[C@H](F)CNC1CCCCCC1 270004a_100015665980_100000210131 [0,1,0,0,0,1|2,0,0]=4 5441 B13R1.1711 OC[C@H](F)CNC1CCCCCC1 34a_100015665980_100011217769 [0,1,0,0,0,1|2,0,0]=4 5442 B13R1.1711 OC[C@H](O)CNC1CCCCCC1 2230a_100000210984_100009815848 [0,1,0,0,0,1|1,0,0]=3 5443 B13R1.1711 OC[C@H](O)CNC1CCCCCC1 34a_100000210984_100009815848 [0,1,0,0,0,1|1,0,0]=3 5444 B13R1.1711 OC[C@H](O)COC1CCCCCC1 34a_100000210887_100009815848 [0,1,0,0,0,1|1,0,0]=3 5445 B13R1.1711 OC[C@H](O)COC1CCCCCC1 7a_100000210887_100009815848 [0,1,0,0,0,1|1,0,0]=3 5446 B13R1.1711 OC[C@H](O)CSC1CCCCCC1 62a_100009815848_100011217769 [0,1,0,0,0,1|1,0,0]=3 5447 B13R1.1711 OC[C@H](O)CSC1CCCCCC1 62a_100011217769_100009815848 [0,1,0,0,0,1|1,0,0]=3 5448 B13R1.1711 O[C@@H](CF)CNC1CCCCCC1 2230a_100000210984_100015614560 [0,1,0,0,0,1|1,0,0]=3 5449 B13R1.1711 O[C@@H](CF)CNC1CCCCCC1 34a_100000210984_100015614560 [0,1,0,0,0,1|1,0,0]=3 5450 B13R1.1711 O[C@@H](CF)COC1CCCCCC1 34a_100000210887_100015614560 [0,1,0,0,0,1|1,0,0]=3 5451 B13R1.1711 O[C@@H](CF)COC1CCCCCC1 7a_100000210887_100015614560 [0,1,0,0,0,1|1,0,0]=3 5452 B13R1.1711 O[C@@H](CF)CSC1CCCCCC1 62a_100011217769_100015614560 [0,1,0,0,0,1|1,0,0]=3 5453 B13R1.1711 O[C@@H](CF)CSC1CCCCCC1 62a_100015614560_100011217769 [0,1,0,0,0,1|1,0,0]=3 5454 B13R1.3501 C=C(C)CCN1CCCCC(C1)O 2230a_100025706797_100000730704 [0,1,0,0,0,1|1,0,1]=4 5455 B13R1.3501 C=C(C)CCN1CCCCC(C1)O 269982a_100025706797_100000730704 [0,1,0,0,0,1|1,0,1]=4 5456 B13R1.3501 CC(=CCN1CCCCC(C1)O)C 2230a_100025706797_100000761012 [0,1,0,0,0,1|1,0,1]=4 5457 B13R1.3501 CC(=CCN1CCCCC(C1)O)C 269982a_100025706797_100000761012 [0,1,0,0,0,1|1,0,1]=4 5458 B13R1.3501 CC(=O)CCN1CCCCC(C1)O 269982a_100025706797_100000053229 [0,1,0,0,0,1|0,0,2]=4 5459 B13R1.3501 CC(=O)OCN1CCCCC(C1)O 269982a_100025706797_100000076356 [0,1,0,0,0,1|0,0,2]=4 5460 B13R1.3501 CC(C)CCN1CCCCC(C1)O 2230a_100025706797_100000210312 [0,1,0,0,0,1|1,0,0]=3 5461 B13R1.3501 CC(C)CCN1CCCCC(C1)O 269982a_100025706797_100000210312 [0,1,0,0,0,1|1,0,0]=3 5462 B13R1.3501 CC(C)CCN1CCOC[C@@H](C1)O 2230a_100016073750_100000210312 [0,1,0,0,0,1|2,0,0]=4 5463 B13R1.3501 CC(C)CCN1CCOC[C@@H](C1)O 269982a_100016073750_100000210312 [0,1,0,0,0,1|2,0,0]=4 5464 B13R1.3501 CC(C)OCN1CCCCC(C1)O 2230a_100025706797_100000709892 [0,1,0,0,0,1|1,0,0]=3 5465 B13R1.3501 CC(C)OCN1CCCCC(C1)O 269982a_100025706797_100000709892 [0,1,0,0,0,1|1,0,0]=3 5466 B13R1.3501 CC(C)OCN1CCOC[C@@H](C1)O 2230a_100016073750_100000709892 [0,1,0,0,0,1|2,0,0]=4 5467 B13R1.3501 CC(C)OCN1CCOC[C@@H](C1)O 269982a_100016073750_100000709892 [0,1,0,0,0,1|2,0,0]=4 5468 B13R1.3501 CC(O)CCN1CCCCC(C1)O 2230a_100025706797_100012276601 [0,1,0,0,0,1|0,0,0]=2 5469 B13R1.3501 CC(O)CCN1CCCCC(C1)O 269982a_100025706797_100012276601 [0,1,0,0,0,1|0,0,0]=2 5470 B13R1.3501 CC(O)CCN1CCCNC(=O)C1 2230a_100015190381_100012276601 [0,1,0,0,0,1|1,0,1]=4 5471 B13R1.3501 CC(O)CCN1CCOC[C@@H](C1)O 2230a_100016073750_100012276601 [0,1,0,0,0,1|1,0,0]=3 5472 B13R1.3501 CC(O)CCN1CCOC[C@@H](C1)O 269982a_100016073750_100012276601 [0,1,0,0,0,1|1,0,0]=3 5473 B13R1.3501 CN(C)CCN1CCCCC(C1)O 269982a_100025706797_100000755713 [0,1,0,0,0,1|2,0,0]=4 5474 B13R1.3796 C=C(C)CCN1CCCC(CC1)C 2230a_100025706717_100000730704 [0,1,0,0,0,1|1,0,1]=4 5475 B13R1.3796 C=C(C)CCN1CCCC(CC1)C 269982a_100025706717_100000730704 [0,1,0,0,0,1|1,0,1]=4 5476 B13R1.3796 C=C(C)CCN1CCCC(CC1)C 34a_100025706717_100000730704 [0,1,0,0,0,1|1,0,1]=4 5477 B13R1.3796 C=C(C)CCN1CCCC(CC1)O 2230a_100015186869_100000730704 [0,1,0,0,0,1|1,0,1]=4 5478 B13R1.3796 C=C(C)CCN1CCCC(CC1)O 269982a_100015186869_100000730704 [0,1,0,0,0,1|1,0,1]=4 5479 B13R1.3796 CC(=CCN1CCCC(CC1)C)C 2230a_100025706717_100000761012 [0,1,0,0,0,1|1,0,1]=4 5480 B13R1.3796 CC(=CCN1CCCC(CC1)C)C 269982a_100025706717_100000761012 [0,1,0,0,0,1|1,0,1]=4 5481 B13R1.3796 CC(=CCN1CCCC(CC1)C)C 34a_100025706717_100000761012 [0,1,0,0,0,1|1,0,1]=4 5482 B13R1.3796 CC(=CCN1CCCC(CC1)O)C 2230a_100015186869_100000761012 [0,1,0,0,0,1|1,0,1]=4 5483 B13R1.3796 CC(=CCN1CCCC(CC1)O)C 269982a_100015186869_100000761012 [0,1,0,0,0,1|1,0,1]=4 5484 B13R1.3796 CC(=O)CCN1CCCC(CC1)C 269982a_100025706717_100000053229 [0,1,0,0,0,1|0,0,2]=4 5485 B13R1.3796 CC(=O)CCN1CCCC(CC1)O 269982a_100015186869_100000053229 [0,1,0,0,0,1|0,0,2]=4 5486 B13R1.3796 CC(=O)OCN1CCCC(CC1)C 269982a_100025706717_100000076356 [0,1,0,0,0,1|0,0,2]=4 5487 B13R1.3796 CC(=O)OCN1CCCC(CC1)C 34a_100025706717_100009813279 [0,1,0,0,0,1|0,0,2]=4 5488 B13R1.3796 CC(=O)OCN1CCCC(CC1)O 269982a_100015186869_100000076356 [0,1,0,0,0,1|0,0,2]=4 5489 B13R1.3796 CC(C)CCN1CCCC(CC1)C 2230a_100025706717_100000210312 [0,1,0,0,0,1|1,0,0]=3 5490 B13R1.3796 CC(C)CCN1CCCC(CC1)C 269982a_100025706717_100000210312 [0,1,0,0,0,1|1,0,0]=3 5491 B13R1.3796 CC(C)CCN1CCCC(CC1)C 34a_100025706717_100000210312 [0,1,0,0,0,1|1,0,0]=3 5492 B13R1.3796 CC(C)CCN1CCCC(CC1)O 2230a_100015186869_100000210312 [0,1,0,0,0,1|1,0,0]=3 5493 B13R1.3796 CC(C)CCN1CCCC(CC1)O 269982a_100015186869_100000210312 [0,1,0,0,0,1|1,0,0]=3 5494 B13R1.3796 CC(C)CCN1CCCN(CC1)C 2230a_100000211313_100000210312 [0,1,0,0,0,1|2,0,0]=4 5495 B13R1.3796 CC(C)CCN1CCCN(CC1)C 269982a_100000211313_100000210312 [0,1,0,0,0,1|2,0,0]=4 5496 B13R1.3796 CC(C)OCN1CCCC(CC1)O 2230a_100015186869_100000709892 [0,1,0,0,0,1|1,0,0]=3 5497 B13R1.3796 CC(C)OCN1CCCC(CC1)O 269982a_100015186869_100000709892 [0,1,0,0,0,1|1,0,0]=3 5498 B13R1.3796 CC(C)OCN1CCCN(CC1)C 2230a_100000211313_100000709892 [0,1,0,0,0,1|2,0,0]=4 5499 B13R1.3796 CC(C)OCN1CCCN(CC1)C 269982a_100000211313_100000709892 [0,1,0,0,0,1|2,0,0]=4 5500 B13R1.3796 CC(O)CCN1CCCC(CC1)C 2230a_100025706717_100012276601 [0,1,0,0,0,1|0,0,0]=2 5501 B13R1.3796 CC(O)CCN1CCCC(CC1)C 269982a_100025706717_100012276601 [0,1,0,0,0,1|0,0,0]=2 5502 B13R1.3796 CC(O)CCN1CCCC(CC1)C 34a_100025706717_100012276601 [0,1,0,0,0,1|0,0,0]=2 5503 B13R1.3796 CC(O)CCN1CCCC(CC1)O 2230a_100015186869_100012276601 [0,1,0,0,0,1|0,0,0]=2 5504 B13R1.3796 CC(O)CCN1CCCC(CC1)O 269982a_100015186869_100012276601 [0,1,0,0,0,1|0,0,0]=2 5505 B13R1.3796 CC(O)CCN1CCCN(CC1)C 2230a_100000211313_100012276601 [0,1,0,0,0,1|1,0,0]=3 5506 B13R1.3796 CC(O)CCN1CCCN(CC1)C 269982a_100000211313_100012276601 [0,1,0,0,0,1|1,0,0]=3 5507 B13R1.3796 CC(O)CCN1CCNC(=O)CC1 2230a_100000698595_100012276601 [0,1,0,0,0,1|1,0,1]=4 5508 B13R1.3796 CC(O)CCN1CCNC(=O)CC1 269982a_100000698595_100012276601 [0,1,0,0,0,1|1,0,1]=4 5509 B13R1.3796 CC1CCCN(CC1)CCN(C)C 269982a_100025706717_100000755713 [0,1,0,0,0,1|2,0,0]=4 5510 B13R1.3796 CC1CCCN(CC1)COC(C)C 2230a_100025706717_100000709892 [0,1,0,0,0,1|1,0,0]=3 5511 B13R1.3796 CC1CCCN(CC1)COC(C)C 269982a_100025706717_100000709892 [0,1,0,0,0,1|1,0,0]=3 5512 B13R1.3796 CC1CCCN(CC1)COC(C)C 34a_100025706717_100000709892 [0,1,0,0,0,1|1,0,0]=3 5513 B13R1.3796 CN(C)CCN1CCCC(CC1)O 269982a_100015186869_100000755713 [0,1,0,0,0,1|2,0,0]=4 5514 B13R1.6192 CC(=O)C(=O)CN1CCCCCC1 269982a_100000185865_100011261029 [0,1,0,0,0,1|0,0,2]=4 5515 B13R1.6192 CC(=O)C(=O)CN1CCCCCC1 34a_100000185865_100011261029 [0,1,0,0,0,1|0,0,2]=4 5516 B13R1.6192 CC(C)C(=O)CC1CCCCCC1 1458a_100000210198_200000696569 [0,1,0,0,0,1|2,0,0]=4 5517 B13R1.6192 CC(C)C(=O)CC1CCCCCC1 1458a_100000685095_100000210206 [0,1,0,0,0,1|2,0,0]=4 5518 B13R1.6192 CC(C)C(=O)CN1CCCCCC1 1458a_100000740298_100000210206 [0,1,0,0,0,1|1,0,0]=3 5519 B13R1.6192 CC(C)C(=O)CN1CCCCCC1 2230a_100000185865_100000753385 [0,1,0,0,0,1|1,0,0]=3 5520 B13R1.6192 CC(C)C(=O)CN1CCCCCC1 269982a_100000185865_100000753385 [0,1,0,0,0,1|1,0,0]=3 5521 B13R1.6192 CC(C)C(=O)CN1CCCCCC1 34a_100000185865_100000753385 [0,1,0,0,0,1|1,0,0]=3 5522 B13R1.6192 CC(C)C(=O)CN1CCCOCC1 2230a_100000685342_100000753385 [0,1,0,0,0,1|2,0,0]=4 5523 B13R1.6192 CC(C)C(=O)CN1CCCOCC1 269982a_100000685342_100000753385 [0,1,0,0,0,1|2,0,0]=4 5524 B13R1.6192 CC(C)C(=O)CN1CCCOCC1 34a_100000685342_100000753385 [0,1,0,0,0,1|2,0,0]=4 5525 B13R1.6192 CC(C)C(C)NC1CCCCCC1 270004a_100000211541_100000210131 [0,1,0,0,0,1|2,0,0]=4 5526 B13R1.6192 CC(C)N(C)CC1CCCCCC1 269982a_200000211004_200000696569 [0,1,0,0,0,1|2,0,0]=4 5527 B13R1.6192 CC(F)C(=O)CC1CCCCCC1 1458a_100000062450_200000696569 [0,1,0,0,0,1|2,0,0]=4 5528 B13R1.6192 CN(C)C(=O)CN1CCCCCC1 11a_100102631434_100000740298 [0,1,0,0,0,1|2,0,0]=4 5529 B13R1.6192 CN(C)C(=O)CN1CCCCCC1 2230a_100000185865_100000185267 [0,1,0,0,0,1|2,0,0]=4 5530 B13R1.6192 CN(C)C(=O)CN1CCCCCC1 240690a_100102631434_100000740298 [0,1,0,0,0,1|2,0,0]=4 5531 B13R1.6192 CN(C)C(=O)CN1CCCCCC1 269982a_100000185865_100000185267 [0,1,0,0,0,1|2,0,0]=4 5532 B13R1.6192 CN(C)C(=O)CN1CCCCCC1 34a_100000185865_100000692301 [0,1,0,0,0,1|2,0,0]=4 5533 B13R1.6192 CN(C)C(=O)CN1CCCCCC1 527a_100102631434_100000740298 [0,1,0,0,0,1|2,0,0]=4 5534 B13R1.6192 C[C@@H](O)C(=O)CC1CCCCCC1 1458a_100000717761_200000696569 [0,1,0,0,0,1|1,0,0]=3 5535 B13R1.6192 C[C@@H](O)C(=O)NC1CCCCCC1 240690a_100000210984_100000717761 [0,1,0,0,0,1|1,0,1]=4 5536 B13R1.6192 C[C@H](O)C(=O)CC1CCCCCC1 1458a_217856618621_200000696569 [0,1,0,0,0,1|1,0,0]=3 5537 B13R1.6192 C[C@H](O)C(=O)NC1CCCCCC1 1626a_100000210984_217856618621 [0,1,0,0,0,1|1,0,1]=4 5538 B13R1.6192 C[C@H](O)C(=O)NC1CCCCCC1 240690a_100000210984_217856618621 [0,1,0,0,0,1|1,0,1]=4 5539 B13R1.6192 O=C(CC1CCCCCC1)C(O)O 1458a_100000233687_200000696569 [0,1,0,0,0,1|2,0,0]=4 5540 B13R1.6268 CC(C)(C)CCN1CCCCCC1 2230a_100000185865_100000755188 [0,1,0,0,0,1|1,0,0]=3 5541 B13R1.6268 CC(C)(C)CCN1CCCCCC1 269982a_100000185865_100000755188 [0,1,0,0,0,1|1,0,0]=3 5542 B13R1.6268 CC(C)(C)CCN1CCCCCC1 34a_100000185865_100000755188 [0,1,0,0,0,1|1,0,0]=3 5543 B13R1.6268 CC(C)(C)CCN1CCCOCC1 2230a_100000685342_100000755188 [0,1,0,0,0,1|2,0,0]=4 5544 B13R1.6268 CC(C)(C)CCN1CCCOCC1 269982a_100000685342_100000755188 [0,1,0,0,0,1|2,0,0]=4 5545 B13R1.6268 CC(C)(C)CCN1CCCOCC1 34a_100000685342_100000755188 [0,1,0,0,0,1|2,0,0]=4 5546 B13R1.6268 CC(C)(C)CNC1CCCCCC1 270004a_100000210984_100011204126 [0,1,0,0,0,1|2,0,0]=4 5547 B13R1.6268 CC(C)(C)CNC1CCCCCC1 270004a_100000743828_100000210131 [0,1,0,0,0,1|2,0,0]=4 5548 B13R1.6268 CC(C)(C)CNC1CCCCCC1 34a_100000210984_100011219605 [0,1,0,0,0,1|2,0,0]=4 5549 B13R1.6268 CC(C)(C)COC1CCCCCC1 34a_100000210887_100011219605 [0,1,0,0,0,1|2,0,0]=4 5550 B13R1.6268 CC(C)(C)CSC1CCCCCC1 62a_100011217769_100011219605 [0,1,0,0,0,1|2,0,0]=4 5551 B13R1.6268 CC(C)(C)CSC1CCCCCC1 62a_100011219605_100011217769 [0,1,0,0,0,1|2,0,0]=4 5552 B13R1.6268 CC(C)(C)NCC1CCCCCC1 2230a_100000715429_200000696569 [0,1,0,0,0,1|2,0,0]=4 5553 B13R1.6268 CC(C)(C)NCC1CCCCCC1 34a_100015204231_100000210625 [0,1,0,0,0,1|2,0,0]=4 5554 B13R1.6268 CC(C)(C)OCC1CCCCCC1 34a_100000699130_100000210625 [0,1,0,0,0,1|2,0,0]=4 5555 B13R1.6268 CC(C)(C)OCC1CCCCCC1 34a_100015890283_200000696569 [0,1,0,0,0,1|2,0,0]=4 5556 B13R1.6268 CC(C)(C)OCC1CCCCCC1 7a_100015890283_200000696569 [0,1,0,0,0,1|2,0,0]=4 5557 B13R1.6268 CC(C)(C)SCC1CCCCCC1 62a_100000211941_200000696569 [0,1,0,0,0,1|2,0,0]=4 5558 B13R1.6268 CC(C)(C)SCC1CCCCCC1 62a_200000696569_100000211941 [0,1,0,0,0,1|2,0,0]=4 5559 B13R1.6268 CC(C)(F)CNC1CCCCCC1 270004a_100020643315_100000210131 [0,1,0,0,0,1|2,0,0]=4 5560 B13R1.6268 CC(C)(F)CNC1CCCCCC1 34a_100000210984_100011997219 [0,1,0,0,0,1|2,0,0]=4 5561 B13R1.6268 CC(C)(F)COC1CCCCCC1 34a_100000210887_100011997219 [0,1,0,0,0,1|2,0,0]=4 5562 B13R1.6268 CC(C)(F)COC1CCCCCC1 34a_100000716592_100011217769 [0,1,0,0,0,1|2,0,0]=4 5563 B13R1.6268 CC(C)(F)CSC1CCCCCC1 62a_100011217769_100011997219 [0,1,0,0,0,1|2,0,0]=4 5564 B13R1.6268 CC(C)(F)CSC1CCCCCC1 62a_100011997219_100011217769 [0,1,0,0,0,1|2,0,0]=4 5565 B13R1.6268 CC(C)(O)CCN1CCCCCC1 2230a_100000185865_100000702414 [0,1,0,0,0,1|0,0,0]=2 5566 B13R1.6268 CC(C)(O)CCN1CCCCCC1 34a_100000185865_100000702414 [0,1,0,0,0,1|0,0,0]=2 5567 B13R1.6268 CC(C)(O)CCN1CCCOCC1 2230a_100000685342_100000702414 [0,1,0,0,0,1|1,0,0]=3 5568 B13R1.6268 CC(C)(O)CCN1CCCOCC1 34a_100000685342_100000702414 [0,1,0,0,0,1|1,0,0]=3 5569 B13R1.6268 CC(C)(O)CNC1CCCCCC1 270004a_100000751335_100000210131 [0,1,0,0,0,1|1,0,0]=3 5570 B13R1.6268 CC(C)(O)CNC1CCCCCC1 34a_100000210984_100000764493 [0,1,0,0,0,1|1,0,0]=3 5571 B13R1.6268 CC(C)(O)CNC1CCCNCC1 270004a_100000751335_100015187895 [0,1,0,0,0,1|2,0,0]=4 5572 B13R1.6268 CC(C)(O)COC1CCCCCC1 34a_100000210887_100000764493 [0,1,0,0,0,1|1,0,0]=3 5573 B13R1.6268 CC(C)(O)COC1CCCCCC1 7a_100000210887_100000764493 [0,1,0,0,0,1|1,0,0]=3 5574 B13R1.6268 CC(C)(O)CSC1CCCCCC1 62a_100000764493_100011217769 [0,1,0,0,0,1|1,0,0]=3 5575 B13R1.6268 CC(C)(O)CSC1CCCCCC1 62a_100011217769_100000764493 [0,1,0,0,0,1|1,0,0]=3 5576 B13R1.6268 CC(F)(F)CNC1CCCCCC1 270004a_100000731000_100000210131 [0,1,0,0,0,1|2,0,0]=4 5577 B13R1.6268 CC(F)(F)COC1CCCCCC1 34a_100000068830_100011217769 [0,1,0,0,0,1|2,0,0]=4 5578 B13R1.6268 CS(=O)(=O)CCN1CCCCCC1 2230a_100000185865_100000731031 [0,1,0,0,0,1|1,0,1]=4 5579 B13R1.6268 CS(=O)(=O)CCN1CCCCCC1 269982a_100000185865_100000731031 [0,1,0,0,0,1|1,0,1]=4 5580 B13R1.6268 CS(=O)(=O)CCN1CCCCCC1 34a_100000185865_100000731031 [0,1,0,0,0,1|1,0,1]=4 5581 B13R1.6268 C[N+](C)(C)CCN1CCCCCC1 269982a_100000185865_100000085578 [0,1,0,0,0,1|2,0,0]=4 5582 B13R1.6268 C[N+](C)(C)CCN1CCCCCC1 34a_100000185865_100000085578 [0,1,0,0,0,1|2,0,0]=4 5583 B13R1.6268 C[Si](C)(C)CCN1CCCCCC1 2230a_100000185865_200000733723 [0,1,0,0,0,1|1,1,0]=4 5584 B13R1.6268 C[Si](C)(C)CCN1CCCCCC1 269982a_100000185865_200000733723 [0,1,0,0,0,1|1,1,0]=4 5585 B13R1.6268 C[Si](C)(C)CCN1CCCCCC1 34a_100000185865_200000733723 [0,1,0,0,0,1|1,1,0]=4 5586 B13R1.6268 FC(F)(F)CCN1CCCCCC1 34a_100000185865_100011219754 [0,1,0,0,0,1|2,0,0]=4 5587 B13R1.7456 CC(=O)CC(=O)N1CCCCCC1 1458a_100000070787_100000182869 [0,1,0,0,0,1|0,0,2]=4 5588 B13R1.7456 CC(=O)CC(C)N1CCCCCC1 1458a_100015185830_200000210301 [0,1,0,0,0,1|0,0,2]=4 5589 B13R1.7456 CC(=O)OC(C)N1CCCCCC1 269982a_100000185865_100009818208 [0,1,0,0,0,1|0,0,2]=4 5590 B13R1.7456 CC(C)CC(=O)C1CCCCCC1 1458a_100000210554_100011217769 [0,1,0,0,0,1|2,0,0]=4 5591 B13R1.7456 CC(C)CC(=O)C1CCCCCC1 1458a_100000749507_100000210624 [0,1,0,0,0,1|2,0,0]=4 5592 B13R1.7456 CC(C)CC(=O)N1CCCCCC1 11a_100000185865_100000210554 [0,1,0,0,0,1|1,0,0]=3 5593 B13R1.7456 CC(C)CC(=O)N1CCCCCC1 1626a_100000185865_100000210554 [0,1,0,0,0,1|1,0,0]=3 5594 B13R1.7456 CC(C)CC(=O)N1CCCCCC1 240690a_100000185865_100000210554 [0,1,0,0,0,1|1,0,0]=3 5595 B13R1.7456 CC(C)CC(=O)N1CCCCCC1 527a_100000185865_100000210554 [0,1,0,0,0,1|1,0,0]=3 5596 B13R1.7456 CC(C)CC(=O)N1CCCOCC1 11a_100000685342_100000210554 [0,1,0,0,0,1|2,0,0]=4 5597 B13R1.7456 CC(C)CC(=O)N1CCCOCC1 1626a_100000685342_100000210554 [0,1,0,0,0,1|2,0,0]=4 5598 B13R1.7456 CC(C)CC(=O)N1CCCOCC1 240690a_100000685342_100000210554 [0,1,0,0,0,1|2,0,0]=4 5599 B13R1.7456 CC(C)CC(=O)N1CCCOCC1 527a_100000685342_100000210554 [0,1,0,0,0,1|2,0,0]=4 5600 B13R1.7456 CC(C)CC(C)N1CCCCCC1 2230a_100000185865_100000731052 [0,1,0,0,0,1|1,0,0]=3 5601 B13R1.7456 CC(C)CC(C)N1CCCCCC1 269982a_100000185865_100000731052 [0,1,0,0,0,1|1,0,0]=3 5602 B13R1.7456 CC(C)CC(C)N1CCCCCC1 34a_100000185865_100000731052 [0,1,0,0,0,1|1,0,0]=3 5603 B13R1.7456 CC(C)CC(C)N1CCCOCC1 2230a_100000685342_100000731052 [0,1,0,0,0,1|2,0,0]=4 5604 B13R1.7456 CC(C)CC(C)N1CCCOCC1 269982a_100000685342_100000731052 [0,1,0,0,0,1|2,0,0]=4 5605 B13R1.7456 CC(C)CC(C)N1CCCOCC1 34a_100000685342_100000731052 [0,1,0,0,0,1|2,0,0]=4 5606 B13R1.7456 CC(C)CN(C)C1CCCCCC1 2230a_100015185097_100000210760 [0,1,0,0,0,1|2,0,0]=4 5607 B13R1.7456 CC(C)CN(C)C1CCCCCC1 269982a_100000747067_100011217769 [0,1,0,0,0,1|2,0,0]=4 5608 B13R1.7456 CC(C)CN(C)C1CCCCCC1 269982a_100015185097_100000210624 [0,1,0,0,0,1|2,0,0]=4 5609 B13R1.7456 CC(C)CN(C)C1CCCCCC1 270004a_100000747067_100000210131 [0,1,0,0,0,1|2,0,0]=4 5610 B13R1.7456 CC(C)CN(C)C1CCCCCC1 270004a_100015185097_100000210432 [0,1,0,0,0,1|2,0,0]=4 5611 B13R1.7456 CC(C)CN(C)C1CCCCCC1 34a_100015185097_100000210624 [0,1,0,0,0,1|2,0,0]=4 5612 B13R1.7456 CC(C)NC(=O)N1CCCCCC1 2708a_100138425928_100000185865 [0,1,0,0,0,1|1,0,1]=4 5613 B13R1.7456 CC(C)NC(=O)N1CCCCCC1 273464a_100138425928_100000185865 [0,1,0,0,0,1|1,0,1]=4 5614 B13R1.7456 CC(CC(=O)[13CH3])N1CCCCCC1 1458a_100015185830_200025704644 [0,1,0,0,0,1|0,0,2]=4 5615 B13R1.7456 CC(CN(C)C)N1CCCCCC1 269982a_100000185865_100020606517 [0,1,0,0,0,1|2,0,0]=4 5616 B13R1.7456 CC(O)CC(=O)C1CCCCCC1 1458a_100000749507_100011218427 [0,1,0,0,0,1|1,0,0]=3 5617 B13R1.7456 CC(O)CN(C)C1CCCCCC1 2230a_100015185097_100011218427 [0,1,0,0,0,1|1,0,0]=3 5618 B13R1.7456 CC(O)CN(C)C1CCCCCC1 269982a_100000227577_100011217769 [0,1,0,0,0,1|1,0,0]=3 5619 B13R1.7456 CC(O)CN(C)C1CCCCCC1 269982a_100015185097_100011218427 [0,1,0,0,0,1|1,0,0]=3 5620 B13R1.7456 CC(O)CN(C)C1CCCCCC1 270004a_100000227577_100000210131 [0,1,0,0,0,1|1,0,0]=3 5621 B13R1.7456 CC(O)CN(C)C1CCCCCC1 34a_100015185097_100011218427 [0,1,0,0,0,1|1,0,0]=3 5622 B13R1.7456 CC(O)CN(C)C1CCCNCC1 270004a_100000227577_100015187895 [0,1,0,0,0,1|2,0,0]=4 5623 B13R1.7456 CN(C)CC(=O)N1CCCCCC1 11a_100000185865_100000750896 [0,1,0,0,0,1|2,0,0]=4 5624 B13R1.7456 CN(C)CC(=O)N1CCCCCC1 2230a_100102631434_100000182869 [0,1,0,0,0,1|2,0,0]=4 5625 B13R1.7456 CN(C)CC(=O)N1CCCCCC1 240690a_100000185865_100000750896 [0,1,0,0,0,1|2,0,0]=4 5626 B13R1.7456 CN(C)CC(=O)N1CCCCCC1 269982a_100102631434_100000182869 [0,1,0,0,0,1|2,0,0]=4 5627 B13R1.7456 CN(C)CC(=O)N1CCCCCC1 527a_100000185865_100000750896 [0,1,0,0,0,1|2,0,0]=4 5628 B13R1.7456 C[C@@H](O)CC(=O)C1CCCCCC1 1458a_100011933948_100011217769 [0,1,0,0,0,1|1,0,0]=3 5629 B13R1.7456 C[C@@H](O)CC(=O)N1CCCCCC1 240690a_100000185865_100011933948 [0,1,0,0,0,1|0,0,0]=2 5630 B13R1.7456 C[C@@H](O)CC(=O)N1CCCOCC1 240690a_100000685342_100011933948 [0,1,0,0,0,1|1,0,0]=3 5631 B13R1.7456 C[C@@H](O)CN(C)C1CCCCCC1 2230a_100015185097_100009817552 [0,1,0,0,0,1|1,0,0]=3 5632 B13R1.7456 C[C@@H](O)CN(C)C1CCCCCC1 269982a_100015185097_100009817552 [0,1,0,0,0,1|1,0,0]=3 5633 B13R1.7456 C[C@@H](O)CN(C)C1CCCCCC1 34a_100015185097_100009817552 [0,1,0,0,0,1|1,0,0]=3 5634 B13R1.7456 C[S+](C)CC(=O)N1CCCCCC1 11a_100000185865_200159257847 [0,1,0,0,0,1|2,0,0]=4 5635 B13R1.7456 C[S+](C)CC(=O)N1CCCCCC1 1626a_100000185865_200159257847 [0,1,0,0,0,1|2,0,0]=4 5636 B13R1.7456 C[S+](C)CC(=O)N1CCCCCC1 240690a_100000185865_200159257847 [0,1,0,0,0,1|2,0,0]=4 5637 B13R1.7456 C[S+](C)CC(=O)N1CCCCCC1 527a_100000185865_200159257847 [0,1,0,0,0,1|2,0,0]=4 5638 B13R1.8682 CC(C)CNC1(CCCCCC1)C 2230a_100000704638_100000210760 [0,1,0,0,0,1|2,0,0]=4 5639 B13R1.8682 CC(C)CNC1(CCCCCC1)C 270004a_100000704638_100000210432 [0,1,0,0,0,1|2,0,0]=4 5640 B13R1.8682 CC(C)CNC1(CCCCCC1)C 34a_100000704638_100000210624 [0,1,0,0,0,1|2,0,0]=4 5641 B13R1.8682 CC(C)COC1(CCCCCC1)C 34a_100000708895_100000210624 [0,1,0,0,0,1|2,0,0]=4 5642 B13R1.8682 CC(C)COC1(CCCCCC1)C 7a_100000708895_100000210760 [0,1,0,0,0,1|2,0,0]=4 5643 B13R1.8682 CC(O)CNC1(CCCCCC1)C 2230a_100000704638_100011218427 [0,1,0,0,0,1|1,0,0]=3 5644 B13R1.8682 CC(O)CNC1(CCCCCC1)C 34a_100000704638_100011218427 [0,1,0,0,0,1|1,0,0]=3 5645 B13R1.8682 CC(O)COC1(CCCCCC1)C 34a_100000708895_100011218427 [0,1,0,0,0,1|1,0,0]=3 5646 B13R1.8682 CC(O)COC1(CCCCCC1)C 7a_100000708895_100011218427 [0,1,0,0,0,1|1,0,0]=3 5647 B13R1.8682 CC(O)COC1(CCCNCC1)C 34a_100000723723_100011218427 [0,1,0,0,0,1|2,0,0]=4 5648 B13R1.8682 C[C@@H](O)CNC1(CCCCCC1)C 2230a_100000704638_100009817552 [0,1,0,0,0,1|1,0,0]=3 5649 B13R1.8682 C[C@@H](O)CNC1(CCCCCC1)C 34a_100000704638_100009817552 [0,1,0,0,0,1|1,0,0]=3 5650 B13R1.8682 C[C@@H](O)COC1(CCCCCC1)C 34a_100000708895_100009817552 [0,1,0,0,0,1|1,0,0]=3 5651 B13R1.8682 C[C@@H](O)COC1(CCCCCC1)C 7a_100000708895_100009817552 [0,1,0,0,0,1|1,0,0]=3 5652 B13R1.8682 C[C@@H](O)COC1(CCCNCC1)C 34a_100000723723_100009817552 [0,1,0,0,0,1|2,0,0]=4 5653 B13R1.1870 C=CC(O)CN1CCCCCCC1 2230a_100000211400_100000730141 [0,1,0,0,0,1|0,0,1]=3 5654 B13R1.1870 C=CC(O)CN1CCCCCCC1 34a_100000211400_100000730141 [0,1,0,0,0,1|0,0,1]=3 5655 B13R1.1870 CC(CO)NC1CCCCCCC1 2230a_100000211152_100012180447 [0,1,0,0,0,1|2,0,0]=4 5656 B13R1.1870 CC(CO)NC1CCCCCCC1 34a_100000211152_100012180447 [0,1,0,0,0,1|2,0,0]=4 5657 B13R1.1870 CC(CO)OC1CCCCCCC1 34a_100000210054_100012180447 [0,1,0,0,0,1|2,0,0]=4 5658 B13R1.1870 CC(CO)OC1CCCCCCC1 7a_100000210054_100012180447 [0,1,0,0,0,1|2,0,0]=4 5659 B13R1.1870 CCC(=O)CN1CCCCCCC1 269982a_100000211400_100000747405 [0,1,0,0,0,1|0,0,2]=4 5660 B13R1.1870 CCC(C)CN1CCCCCCC1 2230a_100000211400_100000748023 [0,1,0,0,0,1|1,0,0]=3 5661 B13R1.1870 CCC(C)CN1CCCCCCC1 269982a_100000211400_100000748023 [0,1,0,0,0,1|1,0,0]=3 5662 B13R1.1870 CCC(C)CN1CCCCCCC1 270004a_100000211400_100000243153 [0,1,0,0,0,1|1,0,0]=3 5663 B13R1.1870 CCC(C)CN1CCCCCCC1 34a_100000211400_100000748023 [0,1,0,0,0,1|1,0,0]=3 5664 B13R1.1870 CCC(O)CN1CCCCCCC1 2230a_100000211400_100011218378 [0,1,0,0,0,1|0,0,0]=2 5665 B13R1.1870 CCC(O)CN1CCCCCCC1 269982a_100000211400_100011218378 [0,1,0,0,0,1|0,0,0]=2 5666 B13R1.1870 CCC(O)CN1CCCCCCC1 34a_100000211400_100011218378 [0,1,0,0,0,1|0,0,0]=2 5667 B13R1.1870 CC[C@H](C)CN1CCCCCCC1 2230a_100000211400_100009816398 [0,1,0,0,0,1|1,0,0]=3 5668 B13R1.1870 CC[C@H](C)CN1CCCCCCC1 269982a_100000211400_100009816398 [0,1,0,0,0,1|1,0,0]=3 5669 B13R1.1870 CC[C@H](C)CN1CCCCCCC1 34a_100000211400_100009816398 [0,1,0,0,0,1|1,0,0]=3 5670 B13R1.1870 CNC(=O)CN1CCCCCCC1 2230a_100000211400_100000183359 [0,1,0,0,0,1|0,0,2]=4 5671 B13R1.1870 CNC(=O)CN1CCCCCCC1 269982a_100000211400_100000183359 [0,1,0,0,0,1|0,0,2]=4 5672 B13R1.1870 CNC(=O)CN1CCCCCCC1 34a_100000211400_100000183359 [0,1,0,0,0,1|0,0,2]=4 5673 B13R1.1870 COC(=O)CN1CCCCCCC1 2230a_100000211400_100000747449 [0,1,0,0,0,1|0,0,2]=4 5674 B13R1.1870 COC(=O)CN1CCCCCCC1 269982a_100000211400_100000747449 [0,1,0,0,0,1|0,0,2]=4 5675 B13R1.1870 COC(=O)CN1CCCCCCC1 34a_100000211400_100000747449 [0,1,0,0,0,1|0,0,2]=4 5676 B13R1.1870 C[C@@H](CO)CN1CCCCCCC1 2230a_100000211400_100000059175 [0,1,0,0,0,1|0,0,0]=2 5677 B13R1.1870 C[C@@H](CO)CN1CCCCCCC1 269982a_100000211400_100000059175 [0,1,0,0,0,1|0,0,0]=2 5678 B13R1.1870 C[C@@H](CO)CN1CCCCCCC1 34a_100000211400_100000059175 [0,1,0,0,0,1|0,0,0]=2 5679 B13R1.1870 C[C@H](CO)NC1CCCCCCC1 270004a_100000737577_100000210524 [0,1,0,0,0,1|2,0,0]=4 5680 B13R1.1870 OCC(O)CN1CCCCCCC1 2230a_100000211400_100011219619 [0,1,0,0,0,1|0,0,0]=2 5681 B13R1.1870 OCC(O)CN1CCCCCCC1 34a_100000211400_100011219619 [0,1,0,0,0,1|0,0,0]=2 5682 B13R1.1870 OC[C@H](O)CN1CCCCCCC1 2230a_100000211400_100009815848 [0,1,0,0,0,1|0,0,0]=2 5683 B13R1.1870 OC[C@H](O)CN1CCCCCCC1 34a_100000211400_100009815848 [0,1,0,0,0,1|0,0,0]=2 5684 B13R1.1870 O[C@@H](CF)CN1CCCCCCC1 2230a_100000211400_100015614560 [0,1,0,0,0,1|0,0,0]=2 5685 B13R1.1870 O[C@@H](CF)CN1CCCCCCC1 34a_100000211400_100015614560 [0,1,0,0,0,1|0,0,0]=2 5686 B13R1.6161 CC(=O)C(C)N1CCCCCCC1 2230a_100000211400_100009814033 [0,1,0,0,0,1|0,0,2]=4 5687 B13R1.6161 CC(=O)C(C)N1CCCCCCC1 269982a_100000211400_100009814033 [0,1,0,0,0,1|0,0,2]=4 5688 B13R1.6161 CC(C)C(=O)N1CCCCCCC1 11a_100000211400_100000210198 [0,1,0,0,0,1|1,0,1]=4 5689 B13R1.6161 CC(C)C(=O)N1CCCCCCC1 1626a_100000211400_100000210198 [0,1,0,0,0,1|1,0,1]=4 5690 B13R1.6161 CC(C)C(=O)N1CCCCCCC1 240690a_100000211400_100000210198 [0,1,0,0,0,1|1,0,1]=4 5691 B13R1.6161 CC(C)C(=O)N1CCCCCCC1 527a_100000211400_100000210198 [0,1,0,0,0,1|1,0,1]=4 5692 B13R1.6161 CC(F)C(=O)N1CCCCCCC1 11a_100000211400_100000062450 [0,1,0,0,0,1|1,0,1]=4 5693 B13R1.6161 CC(F)C(=O)N1CCCCCCC1 1626a_100000211400_100000062450 [0,1,0,0,0,1|1,0,1]=4 5694 B13R1.6161 CC(F)C(=O)N1CCCCCCC1 240690a_100000211400_100000062450 [0,1,0,0,0,1|1,0,1]=4 5695 B13R1.6161 CC(F)C(=O)N1CCCCCCC1 527a_100000211400_100000062450 [0,1,0,0,0,1|1,0,1]=4 5696 B13R1.6161 C[C@@H](O)C(=O)N1CCCCCCC1 240690a_100000211400_100000717761 [0,1,0,0,0,1|0,0,1]=3 5697 B13R1.6161 C[C@H](O)C(=O)N1CCCCCCC1 1626a_100000211400_217856618621 [0,1,0,0,0,1|0,0,1]=3 5698 B13R1.6161 C[C@H](O)C(=O)N1CCCCCCC1 240690a_100000211400_217856618621 [0,1,0,0,0,1|0,0,1]=3 5699 B13R1.6161 O=C(C(O)O)N1CCCCCCC1 240690a_100000211400_100000233687 [0,1,0,0,0,1|1,0,1]=4 5700 B13R1.6279 CC(C)(C)CN1CCCCCCC1 270004a_100000211400_100011204126 [0,1,0,0,0,1|1,0,0]=3 5701 B13R1.6279 CC(C)(C)CN1CCCCCCC1 34a_100000211400_100011219605 [0,1,0,0,0,1|1,0,0]=3 5702 B13R1.6279 CC(C)(F)CN1CCCCCCC1 34a_100000211400_100011997219 [0,1,0,0,0,1|1,0,0]=3 5703 B13R1.6279 CC(C)(O)CN1CCCCCCC1 34a_100000211400_100000764493 [0,1,0,0,0,1|0,0,0]=2 5704 B13R1.6279 C[N+](C)(C)CN1CCCCCCC1 269982a_100000211400_200000036245 [0,1,0,0,0,1|2,0,0]=4 5705 B13R1.6279 C[Si](C)(C)CN1CCCCCCC1 2230a_100000211400_100000037933 [0,1,0,0,0,1|1,1,0]=4 5706 B13R1.6279 FC(F)(F)CN1CCCCCCC1 2230a_100000211400_100000763148 [0,1,0,0,0,1|2,0,0]=4 5707 B13R1.803 CC(O)CN1CCC(=O)NC[C@@H]1C 2230a_102125656889_100011218427 [0,2,0,0,0,0|1,0,1]=4 5708 B13R1.803 CC(O)CN1CCC(=O)NC[C@@H]1C 269982a_102125656889_100011218427 [0,2,0,0,0,0|1,0,1]=4 5709 B13R1.803 CC(O)CN1CCC(=O)NC[C@@H]1C 34a_102125656889_100011218427 [0,2,0,0,0,0|1,0,1]=4 5710 B13R1.803 C[C@@H](O)CN1CCC(=O)NC[C@@H]1C 2230a_102125656889_100009817552 [0,2,0,0,0,0|1,0,1]=4 5711 B13R1.803 C[C@@H](O)CN1CCC(=O)NC[C@@H]1C 269982a_102125656889_100009817552 [0,2,0,0,0,0|1,0,1]=4 5712 B13R1.803 C[C@@H](O)CN1CCC(=O)NC[C@@H]1C 34a_102125656889_100009817552 [0,2,0,0,0,0|1,0,1]=4 5713 B13R1.3506 CC(C)CN1CCCN(CC1C)C 269982a_100011935175_100000210624 [0,2,0,0,0,0|2,0,0]=4 5714 B13R1.3506 CC(O)CN1CCCN(CC1C)C 269982a_100011935175_100011218427 [0,2,0,0,0,0|1,0,0]=3 5715 B13R1.3506 CC1CN(CCCN1C[C@@H](C)O)C 269982a_100011935175_100009817552 [0,2,0,0,0,0|1,0,0]=3 5716 B13R1.1868 C=CC(O)CN1CCCCC(C1)O 2230a_100025706797_100000730141 [0,2,0,0,0,0|0,0,1]=3 5717 B13R1.1868 C=CC(O)CN1CCOC[C@@H](C1)O 2230a_100016073750_100000730141 [0,2,0,0,0,0|1,0,1]=4 5718 B13R1.1868 CCC(=O)CN1CCCCC(C1)O 269982a_100025706797_100000747405 [0,2,0,0,0,0|0,0,2]=4 5719 B13R1.1868 CCC(C)CN1CCCCC(C1)O 2230a_100025706797_100000748023 [0,2,0,0,0,0|1,0,0]=3 5720 B13R1.1868 CCC(C)CN1CCCCC(C1)O 269982a_100025706797_100000748023 [0,2,0,0,0,0|1,0,0]=3 5721 B13R1.1868 CCC(C)CN1CCCCC(C1)O 270004a_100025706797_100000243153 [0,2,0,0,0,0|1,0,0]=3 5722 B13R1.1868 CCC(C)CN1CCOC[C@@H](C1)O 2230a_100016073750_100000748023 [0,2,0,0,0,0|2,0,0]=4 5723 B13R1.1868 CCC(C)CN1CCOC[C@@H](C1)O 269982a_100016073750_100000748023 [0,2,0,0,0,0|2,0,0]=4 5724 B13R1.1868 CCC(C)CN1CCOC[C@@H](C1)O 270004a_100016073750_100000243153 [0,2,0,0,0,0|2,0,0]=4 5725 B13R1.1868 CCC(O)CN1CCCCC(C1)O 2230a_100025706797_100011218378 [0,2,0,0,0,0|0,0,0]=2 5726 B13R1.1868 CCC(O)CN1CCCCC(C1)O 269982a_100025706797_100011218378 [0,2,0,0,0,0|0,0,0]=2 5727 B13R1.1868 CCC(O)CN1CCCNC(=O)C1 2230a_100015190381_100011218378 [0,2,0,0,0,0|1,0,1]=4 5728 B13R1.1868 CCC(O)CN1CCOC[C@@H](C1)O 2230a_100016073750_100011218378 [0,2,0,0,0,0|1,0,0]=3 5729 B13R1.1868 CCC(O)CN1CCOC[C@@H](C1)O 269982a_100016073750_100011218378 [0,2,0,0,0,0|1,0,0]=3 5730 B13R1.1868 CC[C@H](C)CN1CCCCC(C1)O 2230a_100025706797_100009816398 [0,2,0,0,0,0|1,0,0]=3 5731 B13R1.1868 CC[C@H](C)CN1CCCCC(C1)O 269982a_100025706797_100009816398 [0,2,0,0,0,0|1,0,0]=3 5732 B13R1.1868 CC[C@H](C)CN1CCOC[C@@H](C1)O 2230a_100016073750_100009816398 [0,2,0,0,0,0|2,0,0]=4 5733 B13R1.1868 CC[C@H](C)CN1CCOC[C@@H](C1)O 269982a_100016073750_100009816398 [0,2,0,0,0,0|2,0,0]=4 5734 B13R1.1868 CNC(=O)CN1CCCCC(C1)O 2230a_100025706797_100000183359 [0,2,0,0,0,0|0,0,2]=4 5735 B13R1.1868 CNC(=O)CN1CCCCC(C1)O 269982a_100025706797_100000183359 [0,2,0,0,0,0|0,0,2]=4 5736 B13R1.1868 COC(=O)CN1CCCCC(C1)O 2230a_100025706797_100000747449 [0,2,0,0,0,0|0,0,2]=4 5737 B13R1.1868 COC(=O)CN1CCCCC(C1)O 269982a_100025706797_100000747449 [0,2,0,0,0,0|0,0,2]=4 5738 B13R1.1868 C[C@@H](CO)CN1CCCCC(C1)O 2230a_100025706797_100000059175 [0,2,0,0,0,0|0,0,0]=2 5739 B13R1.1868 C[C@@H](CO)CN1CCCCC(C1)O 269982a_100025706797_100000059175 [0,2,0,0,0,0|0,0,0]=2 5740 B13R1.1868 C[C@@H](CO)CN1CCCNC(=O)C1 2230a_100015190381_100000059175 [0,2,0,0,0,0|1,0,1]=4 5741 B13R1.1868 C[C@@H](CO)CN1CCOC[C@@H](C1)O 2230a_100016073750_100000059175 [0,2,0,0,0,0|1,0,0]=3 5742 B13R1.1868 C[C@@H](CO)CN1CCOC[C@@H](C1)O 269982a_100016073750_100000059175 [0,2,0,0,0,0|1,0,0]=3 5743 B13R1.1868 O=C1CN(CCCN1)CC(O)CO 2230a_100015190381_100011219619 [0,2,0,0,0,0|1,0,1]=4 5744 B13R1.1868 O=C1CN(CCCN1)C[C@@H](O)CF 2230a_100015190381_100015614560 [0,2,0,0,0,0|1,0,1]=4 5745 B13R1.1868 O=C1CN(CCCN1)C[C@@H](O)CO 2230a_100015190381_100009815848 [0,2,0,0,0,0|1,0,1]=4 5746 B13R1.1868 OC1CCCCN(C1)C[C@@H](O)CF 2230a_100025706797_100015614560 [0,2,0,0,0,0|0,0,0]=2 5747 B13R1.1868 OCC(O)CN1CCCCC(C1)O 2230a_100025706797_100011219619 [0,2,0,0,0,0|0,0,0]=2 5748 B13R1.1868 OCC(O)CN1CCOC[C@@H](C1)O 2230a_100016073750_100011219619 [0,2,0,0,0,0|1,0,0]=3 5749 B13R1.1868 OC[C@H](O)CN1CCCCC(C1)O 2230a_100025706797_100009815848 [0,2,0,0,0,0|0,0,0]=2 5750 B13R1.1868 OC[C@H](O)CN1CCOC[C@@H](C1)O 2230a_100016073750_100009815848 [0,2,0,0,0,0|1,0,0]=3 5751 B13R1.1868 O[C@@H](CF)CN1CCOC[C@@H](C1)O 2230a_100016073750_100015614560 [0,2,0,0,0,0|1,0,0]=3 5752 B13R1.2003 CC(C)CN1CCOCC(C1)(C)O 2230a_100011091861_100000210760 [0,2,0,0,0,0|2,0,0]=4 5753 B13R1.2003 CC(C)CN1CCOCC(C1)(C)O 269982a_100011091861_100000210624 [0,2,0,0,0,0|2,0,0]=4 5754 B13R1.2003 CC(C)CN1CCOCC(C1)(C)O 270004a_100011091861_100000210432 [0,2,0,0,0,0|2,0,0]=4 5755 B13R1.2003 CC(O)CN1CCOCC(C1)(C)O 2230a_100011091861_100011218427 [0,2,0,0,0,0|1,0,0]=3 5756 B13R1.2003 CC(O)CN1CCOCC(C1)(C)O 269982a_100011091861_100011218427 [0,2,0,0,0,0|1,0,0]=3 5757 B13R1.2003 C[C@@H](O)CN1CCOCC(C1)(C)O 2230a_100011091861_100009817552 [0,2,0,0,0,0|1,0,0]=3 5758 B13R1.2003 C[C@@H](O)CN1CCOCC(C1)(C)O 269982a_100011091861_100009817552 [0,2,0,0,0,0|1,0,0]=3 5759 B13R1.3051 CC(C)CN1CCOCC(C1)CO 2230a_100103147999_100000210760 [0,2,0,0,0,0|2,0,0]=4 5760 B13R1.3051 CC(C)CN1CCOCC(C1)CO 269982a_100103147999_100000210624 [0,2,0,0,0,0|2,0,0]=4 5761 B13R1.3051 CC(C)CN1CCOCC(C1)CO 270004a_100103147999_100000210432 [0,2,0,0,0,0|2,0,0]=4 5762 B13R1.3051 CC(C)CN1CCOCC(C1)CO 34a_100103147999_100000210624 [0,2,0,0,0,0|2,0,0]=4 5763 B13R1.3051 CC(O)CN1CCOCC(C1)CO 2230a_100103147999_100011218427 [0,2,0,0,0,0|1,0,0]=3 5764 B13R1.3051 CC(O)CN1CCOCC(C1)CO 269982a_100103147999_100011218427 [0,2,0,0,0,0|1,0,0]=3 5765 B13R1.3051 CC(O)CN1CCOCC(C1)CO 34a_100103147999_100011218427 [0,2,0,0,0,0|1,0,0]=3 5766 B13R1.3051 C[C@@H](O)CN1CCOCC(C1)CO 2230a_100103147999_100009817552 [0,2,0,0,0,0|1,0,0]=3 5767 B13R1.3051 C[C@@H](O)CN1CCOCC(C1)CO 269982a_100103147999_100009817552 [0,2,0,0,0,0|1,0,0]=3 5768 B13R1.3051 C[C@@H](O)CN1CCOCC(C1)CO 34a_100103147999_100009817552 [0,2,0,0,0,0|1,0,0]=3 5769 B13R1.3500 CC(=O)C(C)N1CCCCC(C1)O 2230a_100025706797_100009814033 [0,2,0,0,0,0|0,0,2]=4 5770 B13R1.3500 CC(=O)C(C)N1CCCCC(C1)O 269982a_100025706797_100009814033 [0,2,0,0,0,0|0,0,2]=4 5771 B13R1.3500 CC(C)C(=O)N1CCCCC(C1)O 240690a_100025706797_100000210198 [0,2,0,0,0,0|1,0,1]=4 5772 B13R1.3500 CC(F)C(=O)N1CCCCC(C1)O 240690a_100025706797_100000062450 [0,2,0,0,0,0|1,0,1]=4 5773 B13R1.3500 C[C@@H](O)C(=O)N1CCCCC(C1)O 240690a_100025706797_100000717761 [0,2,0,0,0,0|0,0,1]=3 5774 B13R1.3500 C[C@@H](O)C(=O)N1CCOC[C@@H](C1)O 240690a_100016073750_100000717761 [0,2,0,0,0,0|1,0,1]=4 5775 B13R1.3500 C[C@H](O)C(=O)N1CCCCC(C1)O 240690a_100025706797_217856618621 [0,2,0,0,0,0|0,0,1]=3 5776 B13R1.3500 C[C@H](O)C(=O)N1CCOC[C@@H](C1)O 240690a_100016073750_217856618621 [0,2,0,0,0,0|1,0,1]=4 5777 B13R1.3500 O=C(C(O)O)N1CCCCC(C1)O 240690a_100025706797_100000233687 [0,2,0,0,0,0|1,0,1]=4 5778 B13R1.3769 CC(C)(C)CN1CCCCC(C1)O 270004a_100025706797_100011204126 [0,2,0,0,0,0|1,0,0]=3 5779 B13R1.3769 CC(C)(C)CN1CCOC[C@@H](C1)O 270004a_100016073750_100011204126 [0,2,0,0,0,0|2,0,0]=4 5780 B13R1.3769 C[N+](C)(C)CN1CCCCC(C1)O 269982a_100025706797_200000036245 [0,2,0,0,0,0|2,0,0]=4 5781 B13R1.3769 C[Si](C)(C)CN1CCCCC(C1)O 2230a_100025706797_100000037933 [0,2,0,0,0,0|1,1,0]=4 5782 B13R1.3769 OC1CCCCN(C1)CC(F)(F)F 2230a_100025706797_100000763148 [0,2,0,0,0,0|2,0,0]=4 5783 B13R1.3794 CC(O)CN1CCCN(C(=O)C1)C 2230a_100000709885_100011218427 [0,2,0,0,0,0|1,0,1]=4 5784 B13R1.3794 CC(O)CN1CCCN(C(=O)C1)C 269982a_100000709885_100011218427 [0,2,0,0,0,0|1,0,1]=4 5785 B13R1.3794 CC(O)CN1CCCN(C(=O)C1)C 34a_100000709885_100011218427 [0,2,0,0,0,0|1,0,1]=4 5786 B13R1.3794 C[C@@H](O)CN1CCCN(C(=O)C1)C 2230a_100000709885_100009817552 [0,2,0,0,0,0|1,0,1]=4 5787 B13R1.3794 C[C@@H](O)CN1CCCN(C(=O)C1)C 269982a_100000709885_100009817552 [0,2,0,0,0,0|1,0,1]=4 5788 B13R1.3794 C[C@@H](O)CN1CCCN(C(=O)C1)C 34a_100000709885_100009817552 [0,2,0,0,0,0|1,0,1]=4 5789 B13R1.1869 C=CC(O)CN1CCCC(CC1)C 2230a_100025706717_100000730141 [0,2,0,0,0,0|0,0,1]=3 5790 B13R1.1869 C=CC(O)CN1CCCC(CC1)C 34a_100025706717_100000730141 [0,2,0,0,0,0|0,0,1]=3 5791 B13R1.1869 C=CC(O)CN1CCCC(CC1)O 2230a_100015186869_100000730141 [0,2,0,0,0,0|0,0,1]=3 5792 B13R1.1869 C=CC(O)CN1CCCN(CC1)C 2230a_100000211313_100000730141 [0,2,0,0,0,0|1,0,1]=4 5793 B13R1.1869 CC1CCCN(CC1)CC(O)CO 2230a_100025706717_100011219619 [0,2,0,0,0,0|0,0,0]=2 5794 B13R1.1869 CC1CCCN(CC1)CC(O)CO 34a_100025706717_100011219619 [0,2,0,0,0,0|0,0,0]=2 5795 B13R1.1869 CC1CCCN(CC1)C[C@@H](C)CO 2230a_100025706717_100000059175 [0,2,0,0,0,0|0,0,0]=2 5796 B13R1.1869 CC1CCCN(CC1)C[C@@H](C)CO 269982a_100025706717_100000059175 [0,2,0,0,0,0|0,0,0]=2 5797 B13R1.1869 CC1CCCN(CC1)C[C@@H](C)CO 34a_100025706717_100000059175 [0,2,0,0,0,0|0,0,0]=2 5798 B13R1.1869 CC1CCCN(CC1)C[C@@H](O)CF 2230a_100025706717_100015614560 [0,2,0,0,0,0|0,0,0]=2 5799 B13R1.1869 CC1CCCN(CC1)C[C@@H](O)CF 34a_100025706717_100015614560 [0,2,0,0,0,0|0,0,0]=2 5800 B13R1.1869 CC1CCCN(CC1)C[C@@H](O)CO 2230a_100025706717_100009815848 [0,2,0,0,0,0|0,0,0]=2 5801 B13R1.1869 CC1CCCN(CC1)C[C@@H](O)CO 34a_100025706717_100009815848 [0,2,0,0,0,0|0,0,0]=2 5802 B13R1.1869 CCC(=O)CN1CCCC(CC1)C 269982a_100025706717_100000747405 [0,2,0,0,0,0|0,0,2]=4 5803 B13R1.1869 CCC(=O)CN1CCCC(CC1)O 269982a_100015186869_100000747405 [0,2,0,0,0,0|0,0,2]=4 5804 B13R1.1869 CCC(C)CN1CCCC(CC1)C 2230a_100025706717_100000748023 [0,2,0,0,0,0|1,0,0]=3 5805 B13R1.1869 CCC(C)CN1CCCC(CC1)C 269982a_100025706717_100000748023 [0,2,0,0,0,0|1,0,0]=3 5806 B13R1.1869 CCC(C)CN1CCCC(CC1)C 270004a_100025706717_100000243153 [0,2,0,0,0,0|1,0,0]=3 5807 B13R1.1869 CCC(C)CN1CCCC(CC1)C 34a_100025706717_100000748023 [0,2,0,0,0,0|1,0,0]=3 5808 B13R1.1869 CCC(C)CN1CCCC(CC1)O 2230a_100015186869_100000748023 [0,2,0,0,0,0|1,0,0]=3 5809 B13R1.1869 CCC(C)CN1CCCC(CC1)O 269982a_100015186869_100000748023 [0,2,0,0,0,0|1,0,0]=3 5810 B13R1.1869 CCC(C)CN1CCCC(CC1)O 270004a_100015186869_100000243153 [0,2,0,0,0,0|1,0,0]=3 5811 B13R1.1869 CCC(C)CN1CCCN(CC1)C 2230a_100000211313_100000748023 [0,2,0,0,0,0|2,0,0]=4 5812 B13R1.1869 CCC(C)CN1CCCN(CC1)C 269982a_100000211313_100000748023 [0,2,0,0,0,0|2,0,0]=4 5813 B13R1.1869 CCC(C)CN1CCCN(CC1)C 270004a_100000211313_100000243153 [0,2,0,0,0,0|2,0,0]=4 5814 B13R1.1869 CCC(O)CN1CCCC(CC1)C 2230a_100025706717_100011218378 [0,2,0,0,0,0|0,0,0]=2 5815 B13R1.1869 CCC(O)CN1CCCC(CC1)C 269982a_100025706717_100011218378 [0,2,0,0,0,0|0,0,0]=2 5816 B13R1.1869 CCC(O)CN1CCCC(CC1)C 34a_100025706717_100011218378 [0,2,0,0,0,0|0,0,0]=2 5817 B13R1.1869 CCC(O)CN1CCCC(CC1)O 2230a_100015186869_100011218378 [0,2,0,0,0,0|0,0,0]=2 5818 B13R1.1869 CCC(O)CN1CCCC(CC1)O 269982a_100015186869_100011218378 [0,2,0,0,0,0|0,0,0]=2 5819 B13R1.1869 CCC(O)CN1CCCN(CC1)C 2230a_100000211313_100011218378 [0,2,0,0,0,0|1,0,0]=3 5820 B13R1.1869 CCC(O)CN1CCCN(CC1)C 269982a_100000211313_100011218378 [0,2,0,0,0,0|1,0,0]=3 5821 B13R1.1869 CCC(O)CN1CCNC(=O)CC1 2230a_100000698595_100011218378 [0,2,0,0,0,0|1,0,1]=4 5822 B13R1.1869 CCC(O)CN1CCNC(=O)CC1 269982a_100000698595_100011218378 [0,2,0,0,0,0|1,0,1]=4 5823 B13R1.1869 CC[C@H](C)CN1CCCC(CC1)C 2230a_100025706717_100009816398 [0,2,0,0,0,0|1,0,0]=3 5824 B13R1.1869 CC[C@H](C)CN1CCCC(CC1)C 269982a_100025706717_100009816398 [0,2,0,0,0,0|1,0,0]=3 5825 B13R1.1869 CC[C@H](C)CN1CCCC(CC1)C 34a_100025706717_100009816398 [0,2,0,0,0,0|1,0,0]=3 5826 B13R1.1869 CC[C@H](C)CN1CCCC(CC1)O 2230a_100015186869_100009816398 [0,2,0,0,0,0|1,0,0]=3 5827 B13R1.1869 CC[C@H](C)CN1CCCC(CC1)O 269982a_100015186869_100009816398 [0,2,0,0,0,0|1,0,0]=3 5828 B13R1.1869 CC[C@H](C)CN1CCCN(CC1)C 2230a_100000211313_100009816398 [0,2,0,0,0,0|2,0,0]=4 5829 B13R1.1869 CC[C@H](C)CN1CCCN(CC1)C 269982a_100000211313_100009816398 [0,2,0,0,0,0|2,0,0]=4 5830 B13R1.1869 CN1CCCN(CC1)CC(O)CO 2230a_100000211313_100011219619 [0,2,0,0,0,0|1,0,0]=3 5831 B13R1.1869 CN1CCCN(CC1)C[C@@H](O)CF 2230a_100000211313_100015614560 [0,2,0,0,0,0|1,0,0]=3 5832 B13R1.1869 CN1CCCN(CC1)C[C@@H](O)CO 2230a_100000211313_100009815848 [0,2,0,0,0,0|1,0,0]=3 5833 B13R1.1869 CNC(=O)CN1CCCC(CC1)C 2230a_100025706717_100000183359 [0,2,0,0,0,0|0,0,2]=4 5834 B13R1.1869 CNC(=O)CN1CCCC(CC1)C 269982a_100025706717_100000183359 [0,2,0,0,0,0|0,0,2]=4 5835 B13R1.1869 CNC(=O)CN1CCCC(CC1)C 34a_100025706717_100000183359 [0,2,0,0,0,0|0,0,2]=4 5836 B13R1.1869 CNC(=O)CN1CCCC(CC1)O 2230a_100015186869_100000183359 [0,2,0,0,0,0|0,0,2]=4 5837 B13R1.1869 CNC(=O)CN1CCCC(CC1)O 269982a_100015186869_100000183359 [0,2,0,0,0,0|0,0,2]=4 5838 B13R1.1869 COC(=O)CN1CCCC(CC1)C 2230a_100025706717_100000747449 [0,2,0,0,0,0|0,0,2]=4 5839 B13R1.1869 COC(=O)CN1CCCC(CC1)C 269982a_100025706717_100000747449 [0,2,0,0,0,0|0,0,2]=4 5840 B13R1.1869 COC(=O)CN1CCCC(CC1)C 34a_100025706717_100000747449 [0,2,0,0,0,0|0,0,2]=4 5841 B13R1.1869 COC(=O)CN1CCCC(CC1)O 2230a_100015186869_100000747449 [0,2,0,0,0,0|0,0,2]=4 5842 B13R1.1869 COC(=O)CN1CCCC(CC1)O 269982a_100015186869_100000747449 [0,2,0,0,0,0|0,0,2]=4 5843 B13R1.1869 C[C@@H](CO)CN1CCCC(CC1)O 2230a_100015186869_100000059175 [0,2,0,0,0,0|0,0,0]=2 5844 B13R1.1869 C[C@@H](CO)CN1CCCC(CC1)O 269982a_100015186869_100000059175 [0,2,0,0,0,0|0,0,0]=2 5845 B13R1.1869 C[C@@H](CO)CN1CCCN(CC1)C 2230a_100000211313_100000059175 [0,2,0,0,0,0|1,0,0]=3 5846 B13R1.1869 C[C@@H](CO)CN1CCCN(CC1)C 269982a_100000211313_100000059175 [0,2,0,0,0,0|1,0,0]=3 5847 B13R1.1869 C[C@@H](CO)CN1CCNC(=O)CC1 2230a_100000698595_100000059175 [0,2,0,0,0,0|1,0,1]=4 5848 B13R1.1869 C[C@@H](CO)CN1CCNC(=O)CC1 269982a_100000698595_100000059175 [0,2,0,0,0,0|1,0,1]=4 5849 B13R1.1869 O=C1CCN(CCN1)CC(O)CO 2230a_100000698595_100011219619 [0,2,0,0,0,0|1,0,1]=4 5850 B13R1.1869 O=C1CCN(CCN1)C[C@@H](O)CF 2230a_100000698595_100015614560 [0,2,0,0,0,0|1,0,1]=4 5851 B13R1.1869 O=C1CCN(CCN1)C[C@@H](O)CO 2230a_100000698595_100009815848 [0,2,0,0,0,0|1,0,1]=4 5852 B13R1.1869 OC1CCCN(CC1)C[C@@H](O)CF 2230a_100015186869_100015614560 [0,2,0,0,0,0|0,0,0]=2 5853 B13R1.1869 OCC(O)CN1CCCC(CC1)O 2230a_100015186869_100011219619 [0,2,0,0,0,0|0,0,0]=2 5854 B13R1.1869 OC[C@H](O)CN1CCCC(CC1)O 2230a_100015186869_100009815848 [0,2,0,0,0,0|0,0,0]=2 5855 B13R1.2174 C=C(C)CN1CCCC(CC1)CC 2230a_100000757272_100000748629 [0,2,0,0,0,0|1,0,1]=4 5856 B13R1.2174 C=C(C)CN1CCCC(CC1)CC 269982a_100000757272_100000748629 [0,2,0,0,0,0|1,0,1]=4 5857 B13R1.2174 C=C(C)CN1CCCC(CC1)CC 34a_100000757272_100000748629 [0,2,0,0,0,0|1,0,1]=4 5858 B13R1.2174 C=C(C)CN1CCCC(CC1)OC 2230a_100016993962_100000748629 [0,2,0,0,0,0|1,0,1]=4 5859 B13R1.2174 C=C(C)CN1CCCC(CC1)OC 269982a_100016993962_100000748629 [0,2,0,0,0,0|1,0,1]=4 5860 B13R1.2174 C=C(C)CN1CCCC(CC1)OC 34a_100016993962_100000748629 [0,2,0,0,0,0|1,0,1]=4 5861 B13R1.2174 CC(C)CN1CCCN(CC1)CF 269982a_100015187271_100015361967 [0,2,0,0,0,0|2,0,0]=4 5862 B13R1.2174 CCC1CCCN(CC1)CC(C)C 2230a_100000757272_100000210760 [0,2,0,0,0,0|1,0,0]=3 5863 B13R1.2174 CCC1CCCN(CC1)CC(C)C 269982a_100000757272_100000210624 [0,2,0,0,0,0|1,0,0]=3 5864 B13R1.2174 CCC1CCCN(CC1)CC(C)C 270004a_100000757272_100000210432 [0,2,0,0,0,0|1,0,0]=3 5865 B13R1.2174 CCC1CCCN(CC1)CC(C)C 34a_100000757272_100000210624 [0,2,0,0,0,0|1,0,0]=3 5866 B13R1.2174 CCC1CCCN(CC1)CC(C)O 2230a_100000757272_100011218427 [0,2,0,0,0,0|0,0,0]=2 5867 B13R1.2174 CCC1CCCN(CC1)CC(C)O 269982a_100000757272_100011218427 [0,2,0,0,0,0|0,0,0]=2 5868 B13R1.2174 CCC1CCCN(CC1)CC(C)O 34a_100000757272_100011218427 [0,2,0,0,0,0|0,0,0]=2 5869 B13R1.2174 CCC1CCCN(CC1)CC(F)F 2230a_100000757272_100011934356 [0,2,0,0,0,0|2,0,0]=4 5870 B13R1.2174 CCC1CCCN(CC1)CC(F)F 269982a_100000757272_100011934356 [0,2,0,0,0,0|2,0,0]=4 5871 B13R1.2174 CCC1CCCN(CC1)CC(F)F 34a_100000757272_100011934356 [0,2,0,0,0,0|2,0,0]=4 5872 B13R1.2174 CCC1CCCN(CC1)C[C@@H](C)O 2230a_100000757272_100009817552 [0,2,0,0,0,0|0,0,0]=2 5873 B13R1.2174 CCC1CCCN(CC1)C[C@@H](C)O 269982a_100000757272_100009817552 [0,2,0,0,0,0|0,0,0]=2 5874 B13R1.2174 CCC1CCCN(CC1)C[C@@H](C)O 34a_100000757272_100009817552 [0,2,0,0,0,0|0,0,0]=2 5875 B13R1.2174 CCN1CCCN(CC1)CC(C)C 2230a_100000748291_100000210760 [0,2,0,0,0,0|2,0,0]=4 5876 B13R1.2174 CCN1CCCN(CC1)CC(C)C 2230a_100015187271_100000210202 [0,2,0,0,0,0|2,0,0]=4 5877 B13R1.2174 CCN1CCCN(CC1)CC(C)C 269982a_100000748291_100000210624 [0,2,0,0,0,0|2,0,0]=4 5878 B13R1.2174 CCN1CCCN(CC1)CC(C)C 269982a_100015187271_100000204670 [0,2,0,0,0,0|2,0,0]=4 5879 B13R1.2174 CCN1CCCN(CC1)CC(C)C 270004a_100000748291_100000210432 [0,2,0,0,0,0|2,0,0]=4 5880 B13R1.2174 CCN1CCCN(CC1)CC(C)O 2230a_100000748291_100011218427 [0,2,0,0,0,0|1,0,0]=3 5881 B13R1.2174 CCN1CCCN(CC1)CC(C)O 269982a_100000748291_100011218427 [0,2,0,0,0,0|1,0,0]=3 5882 B13R1.2174 CCN1CCCN(CC1)C[C@@H](C)O 2230a_100000748291_100009817552 [0,2,0,0,0,0|1,0,0]=3 5883 B13R1.2174 CCN1CCCN(CC1)C[C@@H](C)O 269982a_100000748291_100009817552 [0,2,0,0,0,0|1,0,0]=3 5884 B13R1.2174 COC1CCCN(CC1)CC(C)C 2230a_100016993962_100000210760 [0,2,0,0,0,0|1,0,0]=3 5885 B13R1.2174 COC1CCCN(CC1)CC(C)C 269982a_100016993962_100000210624 [0,2,0,0,0,0|1,0,0]=3 5886 B13R1.2174 COC1CCCN(CC1)CC(C)C 270004a_100016993962_100000210432 [0,2,0,0,0,0|1,0,0]=3 5887 B13R1.2174 COC1CCCN(CC1)CC(C)C 34a_100016993962_100000210624 [0,2,0,0,0,0|1,0,0]=3 5888 B13R1.2174 COC1CCCN(CC1)CC(C)O 2230a_100016993962_100011218427 [0,2,0,0,0,0|0,0,0]=2 5889 B13R1.2174 COC1CCCN(CC1)CC(C)O 269982a_100016993962_100011218427 [0,2,0,0,0,0|0,0,0]=2 5890 B13R1.2174 COC1CCCN(CC1)CC(C)O 34a_100016993962_100011218427 [0,2,0,0,0,0|0,0,0]=2 5891 B13R1.2174 COC1CCCN(CC1)CC(F)F 2230a_100016993962_100011934356 [0,2,0,0,0,0|2,0,0]=4 5892 B13R1.2174 COC1CCCN(CC1)CC(F)F 269982a_100016993962_100011934356 [0,2,0,0,0,0|2,0,0]=4 5893 B13R1.2174 COC1CCCN(CC1)CC(F)F 34a_100016993962_100011934356 [0,2,0,0,0,0|2,0,0]=4 5894 B13R1.2174 COC1CCCN(CC1)C[C@@H](C)O 2230a_100016993962_100009817552 [0,2,0,0,0,0|0,0,0]=2 5895 B13R1.2174 COC1CCCN(CC1)C[C@@H](C)O 269982a_100016993962_100009817552 [0,2,0,0,0,0|0,0,0]=2 5896 B13R1.2174 COC1CCCN(CC1)C[C@@H](C)O 34a_100016993962_100009817552 [0,2,0,0,0,0|0,0,0]=2 5897 B13R1.3524 CC(O)CN1CCC(=O)N(CC1)C 2230a_100020591582_100011218427 [0,2,0,0,0,0|1,0,1]=4 5898 B13R1.3524 CC(O)CN1CCC(=O)N(CC1)C 269982a_100020591582_100011218427 [0,2,0,0,0,0|1,0,1]=4 5899 B13R1.3524 CC(O)CN1CCC(=O)N(CC1)C 34a_100020591582_100011218427 [0,2,0,0,0,0|1,0,1]=4 5900 B13R1.3524 C[C@@H](O)CN1CCC(=O)N(CC1)C 2230a_100020591582_100009817552 [0,2,0,0,0,0|1,0,1]=4 5901 B13R1.3524 C[C@@H](O)CN1CCC(=O)N(CC1)C 269982a_100020591582_100009817552 [0,2,0,0,0,0|1,0,1]=4 5902 B13R1.3524 C[C@@H](O)CN1CCC(=O)N(CC1)C 34a_100020591582_100009817552 [0,2,0,0,0,0|1,0,1]=4 5903 B13R1.3782 CC(C)(C)CN1CCCC(CC1)O 270004a_100015186869_100011204126 [0,2,0,0,0,0|1,0,0]=3 5904 B13R1.3782 CC1CCCN(CC1)CC(C)(C)C 270004a_100025706717_100011204126 [0,2,0,0,0,0|1,0,0]=3 5905 B13R1.3782 CC1CCCN(CC1)CC(C)(C)C 34a_100025706717_100011219605 [0,2,0,0,0,0|1,0,0]=3 5906 B13R1.3782 CC1CCCN(CC1)CC(C)(C)F 34a_100025706717_100011997219 [0,2,0,0,0,0|1,0,0]=3 5907 B13R1.3782 CC1CCCN(CC1)CC(C)(C)O 34a_100025706717_100000764493 [0,2,0,0,0,0|0,0,0]=2 5908 B13R1.3782 CC1CCCN(CC1)CC(F)(F)F 2230a_100025706717_100000763148 [0,2,0,0,0,0|2,0,0]=4 5909 B13R1.3782 CC1CCCN(CC1)C[N+](C)(C)C 269982a_100025706717_200000036245 [0,2,0,0,0,0|2,0,0]=4 5910 B13R1.3782 CC1CCCN(CC1)C[Si](C)(C)C 2230a_100025706717_100000037933 [0,2,0,0,0,0|1,1,0]=4 5911 B13R1.3782 CN1CCCN(CC1)CC(C)(C)C 270004a_100000211313_100011204126 [0,2,0,0,0,0|2,0,0]=4 5912 B13R1.3782 C[N+](C)(C)CN1CCCC(CC1)O 269982a_100015186869_200000036245 [0,2,0,0,0,0|2,0,0]=4 5913 B13R1.3782 C[Si](C)(C)CN1CCCC(CC1)O 2230a_100015186869_100000037933 [0,2,0,0,0,0|1,1,0]=4 5914 B13R1.3782 OC1CCCN(CC1)CC(F)(F)F 2230a_100015186869_100000763148 [0,2,0,0,0,0|2,0,0]=4 5915 B13R1.3795 CC(=O)C(C)N1CCCC(CC1)C 2230a_100025706717_100009814033 [0,2,0,0,0,0|0,0,2]=4 5916 B13R1.3795 CC(=O)C(C)N1CCCC(CC1)C 269982a_100025706717_100009814033 [0,2,0,0,0,0|0,0,2]=4 5917 B13R1.3795 CC(=O)C(C)N1CCCC(CC1)O 2230a_100015186869_100009814033 [0,2,0,0,0,0|0,0,2]=4 5918 B13R1.3795 CC(=O)C(C)N1CCCC(CC1)O 269982a_100015186869_100009814033 [0,2,0,0,0,0|0,0,2]=4 5919 B13R1.3795 CC(C)C(=O)N1CCCC(CC1)O 240690a_100015186869_100000210198 [0,2,0,0,0,0|1,0,1]=4 5920 B13R1.3795 CC(C)C(=O)N1CCCC(CC1)O 527a_100015186869_100000210198 [0,2,0,0,0,0|1,0,1]=4 5921 B13R1.3795 CC(F)C(=O)N1CCCC(CC1)O 240690a_100015186869_100000062450 [0,2,0,0,0,0|1,0,1]=4 5922 B13R1.3795 CC(F)C(=O)N1CCCC(CC1)O 527a_100015186869_100000062450 [0,2,0,0,0,0|1,0,1]=4 5923 B13R1.3795 CC1CCCN(CC1)C(=O)C(C)C 11a_100025706717_100000210198 [0,2,0,0,0,0|1,0,1]=4 5924 B13R1.3795 CC1CCCN(CC1)C(=O)C(C)C 1626a_100025706717_100000210198 [0,2,0,0,0,0|1,0,1]=4 5925 B13R1.3795 CC1CCCN(CC1)C(=O)C(C)C 240690a_100025706717_100000210198 [0,2,0,0,0,0|1,0,1]=4 5926 B13R1.3795 CC1CCCN(CC1)C(=O)C(C)C 527a_100025706717_100000210198 [0,2,0,0,0,0|1,0,1]=4 5927 B13R1.3795 CC1CCCN(CC1)C(=O)C(C)F 11a_100025706717_100000062450 [0,2,0,0,0,0|1,0,1]=4 5928 B13R1.3795 CC1CCCN(CC1)C(=O)C(C)F 1626a_100025706717_100000062450 [0,2,0,0,0,0|1,0,1]=4 5929 B13R1.3795 CC1CCCN(CC1)C(=O)C(C)F 240690a_100025706717_100000062450 [0,2,0,0,0,0|1,0,1]=4 5930 B13R1.3795 CC1CCCN(CC1)C(=O)C(C)F 527a_100025706717_100000062450 [0,2,0,0,0,0|1,0,1]=4 5931 B13R1.3795 CC1CCCN(CC1)C(=O)C(O)O 240690a_100025706717_100000233687 [0,2,0,0,0,0|1,0,1]=4 5932 B13R1.3795 CC1CCCN(CC1)C(=O)[C@@H](C)O 240690a_100025706717_100000717761 [0,2,0,0,0,0|0,0,1]=3 5933 B13R1.3795 CC1CCCN(CC1)C(=O)[C@H](C)O 1626a_100025706717_217856618621 [0,2,0,0,0,0|0,0,1]=3 5934 B13R1.3795 CC1CCCN(CC1)C(=O)[C@H](C)O 240690a_100025706717_217856618621 [0,2,0,0,0,0|0,0,1]=3 5935 B13R1.3795 C[C@@H](O)C(=O)N1CCCC(CC1)O 240690a_100015186869_100000717761 [0,2,0,0,0,0|0,0,1]=3 5936 B13R1.3795 C[C@@H](O)C(=O)N1CCCN(CC1)C 240690a_100000211313_100000717761 [0,2,0,0,0,0|1,0,1]=4 5937 B13R1.3795 C[C@H](O)C(=O)N1CCCC(CC1)O 240690a_100015186869_217856618621 [0,2,0,0,0,0|0,0,1]=3 5938 B13R1.3795 C[C@H](O)C(=O)N1CCCN(CC1)C 240690a_100000211313_217856618621 [0,2,0,0,0,0|1,0,1]=4 5939 B13R1.3795 O=C(C(O)O)N1CCCC(CC1)O 240690a_100015186869_100000233687 [0,2,0,0,0,0|1,0,1]=4 5940 B13R1.8833 C=C(C)CN1CCCC(CC1)(C)O 2230a_100000723723_100000748629 [0,2,0,0,0,0|1,0,1]=4 5941 B13R1.8833 C=C(C)CN1CCCC(CC1)(C)O 269982a_100000723723_100000748629 [0,2,0,0,0,0|1,0,1]=4 5942 B13R1.8833 C=C(C)CN1CCCC(CC1)(C)O 34a_100000723723_100000748629 [0,2,0,0,0,0|1,0,1]=4 5943 B13R1.8833 C=C(C)CN1CCCC(CC1)(F)F 2230a_100020621504_100000748629 [0,2,0,0,0,0|1,0,1]=4 5944 B13R1.8833 C=C(C)CN1CCCC(CC1)(F)F 269982a_100020621504_100000748629 [0,2,0,0,0,0|1,0,1]=4 5945 B13R1.8833 C=C(C)CN1CCCC(CC1)(F)F 34a_100020621504_100000748629 [0,2,0,0,0,0|1,0,1]=4 5946 B13R1.8833 CC(C)CN1CCCC(CC1)(C)O 2230a_100000723723_100000210760 [0,2,0,0,0,0|1,0,0]=3 5947 B13R1.8833 CC(C)CN1CCCC(CC1)(C)O 269982a_100000723723_100000210624 [0,2,0,0,0,0|1,0,0]=3 5948 B13R1.8833 CC(C)CN1CCCC(CC1)(C)O 270004a_100000723723_100000210432 [0,2,0,0,0,0|1,0,0]=3 5949 B13R1.8833 CC(C)CN1CCCC(CC1)(C)O 34a_100000723723_100000210624 [0,2,0,0,0,0|1,0,0]=3 5950 B13R1.8833 CC(C)CN1CCCC(CC1)(F)F 2230a_100020621504_100000210760 [0,2,0,0,0,0|1,0,0]=3 5951 B13R1.8833 CC(C)CN1CCCC(CC1)(F)F 269982a_100020621504_100000210624 [0,2,0,0,0,0|1,0,0]=3 5952 B13R1.8833 CC(C)CN1CCCC(CC1)(F)F 270004a_100020621504_100000210432 [0,2,0,0,0,0|1,0,0]=3 5953 B13R1.8833 CC(C)CN1CCCC(CC1)(F)F 34a_100020621504_100000210624 [0,2,0,0,0,0|1,0,0]=3 5954 B13R1.8833 CC(O)CN1CCCC(CC1)(C)O 2230a_100000723723_100011218427 [0,2,0,0,0,0|0,0,0]=2 5955 B13R1.8833 CC(O)CN1CCCC(CC1)(C)O 269982a_100000723723_100011218427 [0,2,0,0,0,0|0,0,0]=2 5956 B13R1.8833 CC(O)CN1CCCC(CC1)(C)O 34a_100000723723_100011218427 [0,2,0,0,0,0|0,0,0]=2 5957 B13R1.8833 CC(O)CN1CCCC(CC1)(F)F 2230a_100020621504_100011218427 [0,2,0,0,0,0|0,0,0]=2 5958 B13R1.8833 CC(O)CN1CCCC(CC1)(F)F 269982a_100020621504_100011218427 [0,2,0,0,0,0|0,0,0]=2 5959 B13R1.8833 CC(O)CN1CCCC(CC1)(F)F 34a_100020621504_100011218427 [0,2,0,0,0,0|0,0,0]=2 5960 B13R1.8833 CC1(CCCN(CC1)CC(F)F)O 2230a_100000723723_100011934356 [0,2,0,0,0,0|2,0,0]=4 5961 B13R1.8833 CC1(CCCN(CC1)CC(F)F)O 269982a_100000723723_100011934356 [0,2,0,0,0,0|2,0,0]=4 5962 B13R1.8833 CC1(CCCN(CC1)CC(F)F)O 34a_100000723723_100011934356 [0,2,0,0,0,0|2,0,0]=4 5963 B13R1.8833 C[C@@H](O)CN1CCCC(CC1)(C)O 2230a_100000723723_100009817552 [0,2,0,0,0,0|0,0,0]=2 5964 B13R1.8833 C[C@@H](O)CN1CCCC(CC1)(C)O 269982a_100000723723_100009817552 [0,2,0,0,0,0|0,0,0]=2 5965 B13R1.8833 C[C@@H](O)CN1CCCC(CC1)(C)O 34a_100000723723_100009817552 [0,2,0,0,0,0|0,0,0]=2 5966 B13R1.8833 C[C@@H](O)CN1CCCC(CC1)(F)F 2230a_100020621504_100009817552 [0,2,0,0,0,0|0,0,0]=2 5967 B13R1.8833 C[C@@H](O)CN1CCCC(CC1)(F)F 269982a_100020621504_100009817552 [0,2,0,0,0,0|0,0,0]=2 5968 B13R1.8833 C[C@@H](O)CN1CCCC(CC1)(F)F 34a_100020621504_100009817552 [0,2,0,0,0,0|0,0,0]=2 5969 B13R1.8833 FC(F)CN1CCCC(CC1)(F)F 2230a_100020621504_100011934356 [0,2,0,0,0,0|2,0,0]=4 5970 B13R1.8833 FC(F)CN1CCCC(CC1)(F)F 269982a_100020621504_100011934356 [0,2,0,0,0,0|2,0,0]=4 5971 B13R1.8833 FC(F)CN1CCCC(CC1)(F)F 34a_100020621504_100011934356 [0,2,0,0,0,0|2,0,0]=4 5972 B13R1.752 C=C[Si](C)(C)CN1CCCCCC1 2230a_100000185865_100000038793 [0,2,0,0,0,0|1,1,0]=4 5973 B13R1.752 CC(C)(CO)CN1CCCCCC1 34a_100000185865_100009813988 [0,2,0,0,0,0|0,0,0]=2 5974 B13R1.752 CC(C)(CO)CN1CCCOCC1 34a_100000685342_100009813988 [0,2,0,0,0,0|1,0,0]=3 5975 B13R1.752 CC(C)(CO)NC1CCCCCC1 270004a_100000210608_100000210131 [0,2,0,0,0,0|2,0,0]=4 5976 B13R1.752 COC(C)(C)CN1CCCCCC1 269982a_100000185865_100000701081 [0,2,0,0,0,0|0,0,0]=2 5977 B13R1.752 COC(C)(C)CN1CCCCCC1 34a_100000185865_100000701081 [0,2,0,0,0,0|0,0,0]=2 5978 B13R1.752 COC(C)(C)CN1CCCOCC1 269982a_100000685342_100000701081 [0,2,0,0,0,0|1,0,0]=3 5979 B13R1.752 COC(C)(C)CN1CCCOCC1 34a_100000685342_100000701081 [0,2,0,0,0,0|1,0,0]=3 5980 B13R1.752 CSC(C)(C)CN1CCCCCC1 270004a_100000185865_100009845794 [0,2,0,0,0,0|0,1,0]=3 5981 B13R1.752 CSC(C)(C)CN1CCCOCC1 270004a_100000685342_100009845794 [0,2,0,0,0,0|1,1,0]=4 5982 B13R1.1001 CCC(CC)CN1CCCCCC1 2230a_100000185865_100011215472 [0,2,0,0,0,0|1,0,0]=3 5983 B13R1.1001 CCC(CC)CN1CCCCCC1 269982a_100000185865_100011215472 [0,2,0,0,0,0|1,0,0]=3 5984 B13R1.1001 CCC(CC)CN1CCCCCC1 270004a_100000185865_100000211137 [0,2,0,0,0,0|1,0,0]=3 5985 B13R1.1001 CCC(CC)CN1CCCCCC1 34a_100000185865_100011215472 [0,2,0,0,0,0|1,0,0]=3 5986 B13R1.1001 CCC(CC)CN1CCCOCC1 2230a_100000685342_100011215472 [0,2,0,0,0,0|2,0,0]=4 5987 B13R1.1001 CCC(CC)CN1CCCOCC1 269982a_100000685342_100011215472 [0,2,0,0,0,0|2,0,0]=4 5988 B13R1.1001 CCC(CC)CN1CCCOCC1 270004a_100000685342_100000211137 [0,2,0,0,0,0|2,0,0]=4 5989 B13R1.1001 CCC(CC)CN1CCCOCC1 34a_100000685342_100011215472 [0,2,0,0,0,0|2,0,0]=4 5990 B13R1.1001 CC[C@@H](CO)NC1CCCCCC1 270004a_100000709445_100000210131 [0,2,0,0,0,0|2,0,0]=4 5991 B13R1.1001 COC(CN1CCCCCC1)OC 2230a_100000185865_100000751394 [0,2,0,0,0,0|0,0,0]=2 5992 B13R1.1001 COC(CN1CCCCCC1)OC 270004a_100000185865_100000752162 [0,2,0,0,0,0|0,0,0]=2 5993 B13R1.1001 COC(CN1CCCCCC1)OC 34a_100000185865_100000211822 [0,2,0,0,0,0|0,0,0]=2 5994 B13R1.1001 COC(CN1CCCOCC1)OC 2230a_100000685342_100000751394 [0,2,0,0,0,0|1,0,0]=3 5995 B13R1.1001 COC(CN1CCCOCC1)OC 270004a_100000685342_100000752162 [0,2,0,0,0,0|1,0,0]=3 5996 B13R1.1001 COC(CN1CCCOCC1)OC 34a_100000685342_100000211822 [0,2,0,0,0,0|1,0,0]=3 5997 B13R1.1575 C#CCC(=O)CN1CCCCCC1 1458a_100000740298_100000184674 [0,2,0,0,0,0|0,0,2]=4 5998 B13R1.1575 C=CCC(=O)CN1CCCCCC1 1458a_100000740298_100000210623 [0,2,0,0,0,0|0,0,2]=4 5999 B13R1.1575 C=COC(=O)CN1CCCCCC1 2230a_100000185865_100000036128 [0,2,0,0,0,0|1,0,1]=4 6000 B13R1.1575 C=COC(=O)CN1CCCCCC1 269982a_100000185865_100000036128 [0,2,0,0,0,0|1,0,1]=4 6001 B13R1.1575 C=COC(=O)CN1CCCCCC1 34a_100000185865_100000036128 [0,2,0,0,0,0|1,0,1]=4 6002 B13R1.1575 CC(CCO)NC1CCCCCC1 2230a_100000210984_100009893172 [0,2,0,0,0,0|2,0,0]=4 6003 B13R1.1575 CC(CCO)NC1CCCCCC1 34a_100000210984_100009893172 [0,2,0,0,0,0|2,0,0]=4 6004 B13R1.1575 CC(CCO)OC1CCCCCC1 34a_100000210887_100009893172 [0,2,0,0,0,0|2,0,0]=4 6005 B13R1.1575 CC(CCO)OC1CCCCCC1 7a_100000210887_100009893172 [0,2,0,0,0,0|2,0,0]=4 6006 B13R1.1575 CC(CCO)SC1CCCCCC1 62a_100009893172_100011217769 [0,2,0,0,0,0|2,0,0]=4 6007 B13R1.1575 CC(CCO)SC1CCCCCC1 62a_100011217769_100009893172 [0,2,0,0,0,0|2,0,0]=4 6008 B13R1.1575 CCCC(=O)CN1CCCCCC1 1458a_100000740298_100000210303 [0,2,0,0,0,0|0,0,2]=4 6009 B13R1.1575 CCCC(=O)CN1CCCCCC1 2230a_100000185865_100000747444 [0,2,0,0,0,0|0,0,2]=4 6010 B13R1.1575 CCCC(=O)CN1CCCCCC1 269982a_100000185865_100000747444 [0,2,0,0,0,0|0,0,2]=4 6011 B13R1.1575 CCCC(C)CN1CCCCCC1 2230a_100000185865_100011216630 [0,2,0,0,0,0|1,0,0]=3 6012 B13R1.1575 CCCC(C)CN1CCCCCC1 269982a_100000185865_100011216630 [0,2,0,0,0,0|1,0,0]=3 6013 B13R1.1575 CCCC(C)CN1CCCCCC1 270004a_100000185865_100000243154 [0,2,0,0,0,0|1,0,0]=3 6014 B13R1.1575 CCCC(C)CN1CCCCCC1 34a_100000185865_100011216630 [0,2,0,0,0,0|1,0,0]=3 6015 B13R1.1575 CCCC(C)CN1CCCOCC1 2230a_100000685342_100011216630 [0,2,0,0,0,0|2,0,0]=4 6016 B13R1.1575 CCCC(C)CN1CCCOCC1 269982a_100000685342_100011216630 [0,2,0,0,0,0|2,0,0]=4 6017 B13R1.1575 CCCC(C)CN1CCCOCC1 270004a_100000685342_100000243154 [0,2,0,0,0,0|2,0,0]=4 6018 B13R1.1575 CCCC(C)CN1CCCOCC1 34a_100000685342_100011216630 [0,2,0,0,0,0|2,0,0]=4 6019 B13R1.1575 CCNC(=O)CN1CCCCCC1 11a_100015525214_100000740298 [0,2,0,0,0,0|0,0,2]=4 6020 B13R1.1575 CCNC(=O)CN1CCCCCC1 2230a_100000185865_100000183381 [0,2,0,0,0,0|0,0,2]=4 6021 B13R1.1575 CCNC(=O)CN1CCCCCC1 240690a_100015525214_100000740298 [0,2,0,0,0,0|0,0,2]=4 6022 B13R1.1575 CCNC(=O)CN1CCCCCC1 269982a_100000185865_100000183381 [0,2,0,0,0,0|0,0,2]=4 6023 B13R1.1575 CCNC(=O)CN1CCCCCC1 34a_100000185865_100000183381 [0,2,0,0,0,0|0,0,2]=4 6024 B13R1.1575 CCNC(=O)CN1CCCCCC1 527a_100015525214_100000740298 [0,2,0,0,0,0|0,0,2]=4 6025 B13R1.1575 CCOC(=O)CN1CCCCCC1 2230a_100000185865_100000188475 [0,2,0,0,0,0|0,0,2]=4 6026 B13R1.1575 CCOC(=O)CN1CCCCCC1 269982a_100000185865_100000188475 [0,2,0,0,0,0|0,0,2]=4 6027 B13R1.1575 CCOC(=O)CN1CCCCCC1 34a_100000185865_100000188475 [0,2,0,0,0,0|0,0,2]=4 6028 B13R1.1575 CN(CCO)CC1CCCCCC1 2230a_100000210263_200000696569 [0,2,0,0,0,0|2,0,0]=4 6029 B13R1.1575 CN(CCO)CC1CCCCCC1 269982a_100000210263_200000696569 [0,2,0,0,0,0|2,0,0]=4 6030 B13R1.1575 CNNC(=O)CN1CCCCCC1 22a_100016993582_100000740298 [0,2,0,0,0,0|0,0,2]=4 6031 B13R1.1575 COCC(C)NC1CCCCCC1 2230a_100000210984_100000765312 [0,2,0,0,0,0|2,0,0]=4 6032 B13R1.1575 COCC(C)NC1CCCCCC1 270004a_100000210984_100000749346 [0,2,0,0,0,0|2,0,0]=4 6033 B13R1.1575 COCC(C)NC1CCCCCC1 34a_100000210984_100000765312 [0,2,0,0,0,0|2,0,0]=4 6034 B13R1.1575 COCC(C)OC1CCCCCC1 34a_100000210887_100000765312 [0,2,0,0,0,0|2,0,0]=4 6035 B13R1.1575 COCC(C)OC1CCCCCC1 7a_100000210887_100000765312 [0,2,0,0,0,0|2,0,0]=4 6036 B13R1.1575 COCC(C)SC1CCCCCC1 62a_100000765312_100011217769 [0,2,0,0,0,0|2,0,0]=4 6037 B13R1.1575 COCC(C)SC1CCCCCC1 62a_100011217769_100000765312 [0,2,0,0,0,0|2,0,0]=4 6038 B13R1.1575 COCC(O)CN1CCCCCC1 34a_100000185865_100011215053 [0,2,0,0,0,0|0,0,0]=2 6039 B13R1.1575 COCC(O)CN1CCCOCC1 34a_100000685342_100011215053 [0,2,0,0,0,0|1,0,0]=3 6040 B13R1.1575 COC[C@@H](C)NC1CCCCCC1 270004a_100000764878_100000210131 [0,2,0,0,0,0|2,0,0]=4 6041 B13R1.1575 COC[C@@H](C)OC1CCCCCC1 34a_100011934205_100011217769 [0,2,0,0,0,0|2,0,0]=4 6042 B13R1.1575 C[C@H](CCO)NC1CCCCCC1 270004a_100000706166_100000210131 [0,2,0,0,0,0|2,0,0]=4 6043 B13R1.1575 C[C@H](CCO)NC1CCCCCC1 34a_100000706166_100011217769 [0,2,0,0,0,0|2,0,0]=4 6044 B13R1.1575 N#CCC(=O)CN1CCCCCC1 1458a_100000740298_100011214920 [0,2,0,0,0,0|0,0,2]=4 6045 B13R1.1575 N#CC[C@H](O)CN1CCCCCC1 2230a_100000185865_100000001066 [0,2,0,0,0,0|0,0,0]=2 6046 B13R1.1575 N#CC[C@H](O)CN1CCCOCC1 2230a_100000685342_100000001066 [0,2,0,0,0,0|1,0,0]=3 6047 B13R1.1575 O=C(CCF)CN1CCCCCC1 1458a_100000740298_100011217306 [0,2,0,0,0,0|0,0,2]=4 6048 B13R1.1575 O=C(CCO)CN1CCCCCC1 1458a_100000740298_100000211926 [0,2,0,0,0,0|0,0,2]=4 6049 B13R1.1575 O=C(CN1CCCCCC1)NCO 2230a_100000185865_100000185155 [0,2,0,0,0,0|0,0,2]=4 6050 B13R1.1575 O=C(CN1CCCCCC1)NCO 269982a_100000185865_100000185155 [0,2,0,0,0,0|0,0,2]=4 6051 B13R1.1575 O=C(CN1CCCCCC1)NCO 34a_100000185865_100000185155 [0,2,0,0,0,0|0,0,2]=4 6052 B13R1.2620 C=CC(C)C(=O)N1CCCCCC1 11a_100000185865_100011216780 [0,2,0,0,0,0|1,0,1]=4 6053 B13R1.2620 C=CC(C)C(=O)N1CCCCCC1 1626a_100000185865_100011216780 [0,2,0,0,0,0|1,0,1]=4 6054 B13R1.2620 C=CC(C)C(=O)N1CCCCCC1 240690a_100000185865_100011216780 [0,2,0,0,0,0|1,0,1]=4 6055 B13R1.2620 C=CC(C)C(=O)N1CCCCCC1 527a_100000185865_100011216780 [0,2,0,0,0,0|1,0,1]=4 6056 B13R1.2620 CC(C#N)C(=O)N1CCCCCC1 11a_100000185865_100000753662 [0,2,0,0,0,0|1,0,1]=4 6057 B13R1.2620 CC(C#N)C(=O)N1CCCCCC1 1626a_100000185865_100000753662 [0,2,0,0,0,0|1,0,1]=4 6058 B13R1.2620 CC(C#N)C(=O)N1CCCCCC1 240690a_100000185865_100000753662 [0,2,0,0,0,0|1,0,1]=4 6059 B13R1.2620 CC(C#N)C(=O)N1CCCCCC1 527a_100000185865_100000753662 [0,2,0,0,0,0|1,0,1]=4 6060 B13R1.2620 CC(C(=O)CF)N1CCCCCC1 1458a_100000755792_100015361967 [0,2,0,0,0,0|0,0,2]=4 6061 B13R1.2620 CC(CO)N(C)C1CCCCCC1 2230a_100015185097_100012180447 [0,2,0,0,0,0|2,0,0]=4 6062 B13R1.2620 CC(CO)N(C)C1CCCCCC1 269982a_100000693034_100011217769 [0,2,0,0,0,0|2,0,0]=4 6063 B13R1.2620 CC(CO)N(C)C1CCCCCC1 270004a_100000693034_100000210131 [0,2,0,0,0,0|2,0,0]=4 6064 B13R1.2620 CC(CO)N(C)C1CCCCCC1 34a_100015185097_100012180447 [0,2,0,0,0,0|2,0,0]=4 6065 B13R1.2620 CC(S[13CH3])C(=O)N1CCCCCC1 62a_100000230324_200025704644 [0,2,0,0,0,0|0,1,1]=4 6066 B13R1.2620 CC(S[13CH3])C(=O)N1CCCCCC1 62a_200025704644_100000230324 [0,2,0,0,0,0|0,1,1]=4 6067 B13R1.2620 CCC(=O)C(C)N1CCCCCC1 1458a_100000755792_100000210202 [0,2,0,0,0,0|0,0,2]=4 6068 B13R1.2620 CCC(=O)C(C)N1CCCCCC1 2230a_100000185865_100000742827 [0,2,0,0,0,0|0,0,2]=4 6069 B13R1.2620 CCC(=O)C(C)N1CCCCCC1 269982a_100000185865_100000742827 [0,2,0,0,0,0|0,0,2]=4 6070 B13R1.2620 CCC(C)C(=O)N1CCCCCC1 11a_100000185865_100011192722 [0,2,0,0,0,0|1,0,1]=4 6071 B13R1.2620 CCC(C)C(=O)N1CCCCCC1 1626a_100000185865_100011192722 [0,2,0,0,0,0|1,0,1]=4 6072 B13R1.2620 CCC(C)C(=O)N1CCCCCC1 240690a_100000185865_100011192722 [0,2,0,0,0,0|1,0,1]=4 6073 B13R1.2620 CCC(C)C(=O)N1CCCCCC1 527a_100000185865_100011192722 [0,2,0,0,0,0|1,0,1]=4 6074 B13R1.2620 CCC(C)C(C)N1CCCCCC1 270004a_100000185865_100000210599 [0,2,0,0,0,0|1,0,0]=3 6075 B13R1.2620 CCC(C)C(C)N1CCCOCC1 270004a_100000685342_100000210599 [0,2,0,0,0,0|2,0,0]=4 6076 B13R1.2620 CCC(O)C(=O)C1CCCCCC1 1458a_100011196387_100011217769 [0,2,0,0,0,0|1,0,1]=4 6077 B13R1.2620 CCC(O)C(=O)N1CCCCCC1 240690a_100000185865_100011196387 [0,2,0,0,0,0|0,0,1]=3 6078 B13R1.2620 CCC(O)C(=O)N1CCCOCC1 240690a_100000685342_100011196387 [0,2,0,0,0,0|1,0,1]=4 6079 B13R1.2620 CNC(=O)C(C)N1CCCCCC1 2230a_100000185865_100000731044 [0,2,0,0,0,0|0,0,2]=4 6080 B13R1.2620 CNC(=O)C(C)N1CCCCCC1 240690a_100102657272_100000755792 [0,2,0,0,0,0|0,0,2]=4 6081 B13R1.2620 CNC(=O)C(C)N1CCCCCC1 269982a_100000185865_100000209862 [0,2,0,0,0,0|0,0,2]=4 6082 B13R1.2620 CNC(=O)C(C)N1CCCCCC1 34a_100000185865_100000731044 [0,2,0,0,0,0|0,0,2]=4 6083 B13R1.2620 CNC(=O)C(C)N1CCCCCC1 527a_100102657272_100000755792 [0,2,0,0,0,0|0,0,2]=4 6084 B13R1.2620 CNC(=O)C(F)N1CCCCCC1 2230a_100000185865_100009813575 [0,2,0,0,0,0|0,0,2]=4 6085 B13R1.2620 CNC(=O)C(F)N1CCCCCC1 269982a_100000185865_100009813575 [0,2,0,0,0,0|0,0,2]=4 6086 B13R1.2620 CNC(=O)C(F)N1CCCCCC1 34a_100000185865_100009813575 [0,2,0,0,0,0|0,0,2]=4 6087 B13R1.2620 CNC(C)C(=O)N1CCCCCC1 2230a_106832991635_100000230324 [0,2,0,0,0,0|1,0,1]=4 6088 B13R1.2620 CNC(C)C(=O)N1CCCCCC1 34a_100102657272_100000230324 [0,2,0,0,0,0|1,0,1]=4 6089 B13R1.2620 CNC(C)C(=O)N1CCCCCC1 7a_106832991635_100000230324 [0,2,0,0,0,0|1,0,1]=4 6090 B13R1.2620 COC(=O)C(C)N1CCCCCC1 2230a_100000185865_100000211248 [0,2,0,0,0,0|0,0,2]=4 6091 B13R1.2620 COC(=O)C(C)N1CCCCCC1 269982a_100000185865_100000211248 [0,2,0,0,0,0|0,0,2]=4 6092 B13R1.2620 COC(=O)C(C)N1CCCCCC1 34a_100000185865_100000211248 [0,2,0,0,0,0|0,0,2]=4 6093 B13R1.2620 COC(C)C(=O)C1CCCCCC1 1458a_100000743197_100011217769 [0,2,0,0,0,0|1,0,1]=4 6094 B13R1.2620 COC(C)C(=O)N1CCCCCC1 11a_100000185865_100000743197 [0,2,0,0,0,0|0,0,1]=3 6095 B13R1.2620 COC(C)C(=O)N1CCCCCC1 1626a_100000185865_100000743197 [0,2,0,0,0,0|0,0,1]=3 6096 B13R1.2620 COC(C)C(=O)N1CCCCCC1 240690a_100000185865_100000743197 [0,2,0,0,0,0|0,0,1]=3 6097 B13R1.2620 COC(C)C(=O)N1CCCCCC1 34a_100138415774_100000230324 [0,2,0,0,0,0|0,0,1]=3 6098 B13R1.2620 COC(C)C(=O)N1CCCCCC1 527a_100000185865_100000743197 [0,2,0,0,0,0|0,0,1]=3 6099 B13R1.2620 COC(C)C(=O)N1CCCOCC1 11a_100000685342_100000743197 [0,2,0,0,0,0|1,0,1]=4 6100 B13R1.2620 COC(C)C(=O)N1CCCOCC1 1626a_100000685342_100000743197 [0,2,0,0,0,0|1,0,1]=4 6101 B13R1.2620 COC(C)C(=O)N1CCCOCC1 240690a_100000685342_100000743197 [0,2,0,0,0,0|1,0,1]=4 6102 B13R1.2620 COC(C)C(=O)N1CCCOCC1 527a_100000685342_100000743197 [0,2,0,0,0,0|1,0,1]=4 6103 B13R1.2620 COC(C)N(C)C1CCCCCC1 269982a_100015185097_100009879195 [0,2,0,0,0,0|2,0,0]=4 6104 B13R1.2620 CSC(C)C(=O)N1CCCCCC1 11a_100000185865_100000149566 [0,2,0,0,0,0|0,1,1]=4 6105 B13R1.2620 CSC(C)C(=O)N1CCCCCC1 1626a_100000185865_100000149566 [0,2,0,0,0,0|0,1,1]=4 6106 B13R1.2620 CSC(C)C(=O)N1CCCCCC1 240690a_100000185865_100000149566 [0,2,0,0,0,0|0,1,1]=4 6107 B13R1.2620 CSC(C)C(=O)N1CCCCCC1 527a_100000185865_100000149566 [0,2,0,0,0,0|0,1,1]=4 6108 B13R1.2620 CSC(C)C(=O)N1CCCCCC1 62a_100000230324_200000210301 [0,2,0,0,0,0|0,1,1]=4 6109 B13R1.2620 CSC(C)C(=O)N1CCCCCC1 62a_200000210301_100000230324 [0,2,0,0,0,0|0,1,1]=4 6110 B13R1.2620 C[C@H](CO)N(C)C1CCCCCC1 269982a_100015185097_100016084084 [0,2,0,0,0,0|2,0,0]=4 6111 B13R1.2620 O=C(C(O)CO)C1CCCCCC1 1458a_100011215603_100011217769 [0,2,0,0,0,0|1,0,1]=4 6112 B13R1.2620 O=C(C(O)CO)N1CCCCCC1 240690a_100000185865_100011215603 [0,2,0,0,0,0|0,0,1]=3 6113 B13R1.2620 O=C(C(O)CO)N1CCCOCC1 240690a_100000685342_100011215603 [0,2,0,0,0,0|1,0,1]=4 6114 B13R1.4917 CC(CO)NC1(CCCCCC1)C 2230a_100000704638_100012180447 [0,2,0,0,0,0|2,0,0]=4 6115 B13R1.4917 CC(CO)NC1(CCCCCC1)C 34a_100000704638_100012180447 [0,2,0,0,0,0|2,0,0]=4 6116 B13R1.4917 CC(CO)OC1(CCCCCC1)C 34a_100000708895_100012180447 [0,2,0,0,0,0|2,0,0]=4 6117 B13R1.4917 CC(CO)OC1(CCCCCC1)C 7a_100000708895_100012180447 [0,2,0,0,0,0|2,0,0]=4 6118 B13R1.2675 CC(C)(C)C(=O)N1CCCCCC1 11a_100000185865_106744555173 [0,2,0,0,0,0|1,0,1]=4 6119 B13R1.2675 CC(C)(C)C(=O)N1CCCCCC1 1626a_100000185865_106744555173 [0,2,0,0,0,0|1,0,1]=4 6120 B13R1.2675 CC(C)(C)C(=O)N1CCCCCC1 240690a_100000185865_106744555173 [0,2,0,0,0,0|1,0,1]=4 6121 B13R1.2675 CC(C)(C)C(=O)N1CCCCCC1 527a_100000185865_106744555173 [0,2,0,0,0,0|1,0,1]=4 6122 B13R1.2675 CC(C)(F)C(=O)N1CCCCCC1 11a_100000185865_100000765255 [0,2,0,0,0,0|1,0,1]=4 6123 B13R1.2675 CC(C)(F)C(=O)N1CCCCCC1 1626a_100000185865_100000765255 [0,2,0,0,0,0|1,0,1]=4 6124 B13R1.2675 CC(C)(F)C(=O)N1CCCCCC1 240690a_100000185865_100000765255 [0,2,0,0,0,0|1,0,1]=4 6125 B13R1.2675 CC(C)(F)C(=O)N1CCCCCC1 527a_100000185865_100000765255 [0,2,0,0,0,0|1,0,1]=4 6126 B13R1.2675 CC(C)(O)C(=O)C1CCCCCC1 1458a_100000242741_100011217769 [0,2,0,0,0,0|1,0,1]=4 6127 B13R1.2675 CC(C)(O)C(=O)N1CCCCCC1 240690a_100000185865_100000242741 [0,2,0,0,0,0|0,0,1]=3 6128 B13R1.2675 CC(C)(O)C(=O)N1CCCOCC1 240690a_100000685342_100000242741 [0,2,0,0,0,0|1,0,1]=4 6129 B13R1.2675 CC(F)(F)C(=O)N1CCCCCC1 11a_100000185865_100000042251 [0,2,0,0,0,0|1,0,1]=4 6130 B13R1.2675 CC(F)(F)C(=O)N1CCCCCC1 1626a_100000185865_100000042251 [0,2,0,0,0,0|1,0,1]=4 6131 B13R1.2675 CC(F)(F)C(=O)N1CCCCCC1 240690a_100000185865_100000042251 [0,2,0,0,0,0|1,0,1]=4 6132 B13R1.2675 CC(F)(F)C(=O)N1CCCCCC1 527a_100000185865_100000042251 [0,2,0,0,0,0|1,0,1]=4 6133 B13R1.2675 FC(N1CCCCCC1)C(F)(F)F 34a_100000185865_200000036121 [0,2,0,0,0,0|2,0,0]=4 6134 B13R1.6335 CCC(C(C)C)N1CCCCCC1 270004a_100000185865_100000210600 [0,2,0,0,0,0|1,0,0]=3 6135 B13R1.6335 CCC(C(C)C)N1CCCOCC1 270004a_100000685342_100000210600 [0,2,0,0,0,0|2,0,0]=4 6136 B13R1.8692 CC(=O)C(C)(C)N1CCCCCC1 269982a_100000185865_100000075568 [0,2,0,0,0,0|0,0,2]=4 6137 B13R1.8692 CC(C)S(=O)(=O)N1CCCCCC1 270084a_100000185865_100000742656 [0,2,0,0,0,0|2,0,0]=4 6138 B13R1.8692 CC(C)S(=O)(=O)N1CCCCCC1 274078a_100000185865_100000742656 [0,2,0,0,0,0|2,0,0]=4 6139 B13R1.8692 CN(C)C(C)(C)N1CCCCCC1 269982a_100000185865_217856628674 [0,2,0,0,0,0|2,0,0]=4 6140 B13R1.8692 FC(F)C(F)(F)N1CCCCCC1 34a_100000185865_100000034128 [0,2,0,0,0,0|2,0,0]=4 6141 B11R1.24 CCCCN1CCCC(C1)O 2230a_100000211013_100000210211 [0,0,1,1,0,0|2,0,0]=4 6142 B11R1.24 CCCCN1CCCC(C1)O 269982a_100000211013_100000210211 [0,0,1,1,0,0|2,0,0]=4 6143 B11R1.24 CCCNC1CCCC(C1)O 2230a_100015190357_100000210303 [0,0,1,1,0,0|2,0,0]=4 6144 B11R1.24 CCCNC1CCCC(C1)O 270004a_100020643023_100012613340 [0,0,1,1,0,0|2,0,0]=4 6145 B11R1.24 CCNCC1CCCC(C1)O 2230a_100011254705_100000210202 [0,0,1,1,0,0|2,0,0]=4 6146 B11R1.24 CCOCC1CNCC(C1)C 34a_200012821172_100000210202 [0,0,1,1,0,0|2,0,0]=4 6147 B11R1.27 CCCCCN1CCC(C1)O 2230a_100011215560_100000210326 [0,0,1,1,0,0|2,0,0]=4 6148 B11R1.27 CCCCCN1CCC(C1)O 269982a_100011215560_100000210215 [0,0,1,1,0,0|2,0,0]=4 6149 B11R1.27 CCCCNC1CCC(C1)O 270004a_100000102301_100012614533 [0,0,1,1,0,0|2,0,0]=4 6150 B11R1.27 CCCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000210211 [0,0,1,1,0,0|2,0,0]=4 6151 B11R1.27 CCCOC[C@@H]1C[C@@H](CN1)F 34a_100015204000_100000210303 [0,0,1,1,0,0|2,0,0]=4 6152 B11R1.46 CCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000210314 [0,0,1,1,0,0|1,0,0]=3 6153 B11R1.46 CCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000210314 [0,0,1,1,0,0|1,0,0]=3 6154 B11R1.46 CCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000210314 [0,0,1,1,0,0|1,0,0]=3 6155 B11R1.46 CCCCOCN[C@@H]1C[C@@H]1F 2230a_100015190264_100011995733 [0,0,1,1,0,0|2,0,0]=4 6156 B11R1.46 CCCCOCN[C@@H]1C[C@H]1F 2230a_100025746932_100011995733 [0,0,1,1,0,0|2,0,0]=4 6157 B11R1.46 CCCCOCN[C@@H]1C[C@H]1F 34a_100025746932_100011995733 [0,0,1,1,0,0|2,0,0]=4 6158 B11R1.46 CCCOCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100011215938 [0,0,1,1,0,0|2,0,0]=4 6159 B11R1.46 CCCOCCN[C@@H]1C[C@H]1F 2230a_100025746932_100011215938 [0,0,1,1,0,0|2,0,0]=4 6160 B11R1.46 CCCOCCN[C@@H]1C[C@H]1F 34a_100025746932_100011215938 [0,0,1,1,0,0|2,0,0]=4 6161 B11R1.46 CCOCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100012232248 [0,0,1,1,0,0|2,0,0]=4 6162 B11R1.46 CCOCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100012232248 [0,0,1,1,0,0|2,0,0]=4 6163 B11R1.46 CCOCCCN[C@@H]1C[C@H]1F 34a_100025746932_100012232248 [0,0,1,1,0,0|2,0,0]=4 6164 B11R1.46 COCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000730899 [0,0,1,1,0,0|2,0,0]=4 6165 B11R1.46 COCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000730899 [0,0,1,1,0,0|2,0,0]=4 6166 B11R1.46 COCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000755781 [0,0,1,1,0,0|2,0,0]=4 6167 B11R1.46 FCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000729378 [0,0,1,1,0,0|2,0,0]=4 6168 B11R1.46 FCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000729378 [0,0,1,1,0,0|2,0,0]=4 6169 B11R1.46 FCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000729378 [0,0,1,1,0,0|2,0,0]=4 6170 B11R1.46 OCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000746330 [0,0,1,1,0,0|2,0,0]=4 6171 B11R1.46 OCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000746330 [0,0,1,1,0,0|2,0,0]=4 6172 B11R1.46 OCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000746330 [0,0,1,1,0,0|2,0,0]=4 6173 B11R1.57 C=C(C)CN1CCCC1CC 2230a_100000754278_100000748629 [0,0,1,1,0,0|1,0,1]=4 6174 B11R1.57 C=C(C)CN1CCCC1CC 269982a_100000754278_100000748629 [0,0,1,1,0,0|1,0,1]=4 6175 B11R1.57 C=C(C)CN1CCCC1CC 34a_100000754278_100000748629 [0,0,1,1,0,0|1,0,1]=4 6176 B11R1.57 CC(C)CN1CCC[C@@H]1CO 2230a_100000745186_100000210760 [0,0,1,1,0,0|2,0,0]=4 6177 B11R1.57 CC(C)CN1CCC[C@@H]1CO 269982a_100000745186_100000210624 [0,0,1,1,0,0|2,0,0]=4 6178 B11R1.57 CC(C)CN1CCC[C@@H]1CO 270004a_100000745186_100000210432 [0,0,1,1,0,0|2,0,0]=4 6179 B11R1.57 CC(C)CN1CCC[C@@H]1CO 34a_100000745186_100000210624 [0,0,1,1,0,0|2,0,0]=4 6180 B11R1.57 CC(O)CN1CCCC1C#N 2230a_100000701862_100011218427 [0,0,1,1,0,0|1,0,1]=4 6181 B11R1.57 CC(O)CN1CCC[C@@H]1C#N 2230a_106645074975_100011218427 [0,0,1,1,0,0|1,0,1]=4 6182 B11R1.57 CC(O)CN1CCC[C@@H]1C#N 269982a_106645074975_100011218427 [0,0,1,1,0,0|1,0,1]=4 6183 B11R1.57 CC(O)CN1CCC[C@@H]1CO 2230a_100000745186_100011218427 [0,0,1,1,0,0|1,0,0]=3 6184 B11R1.57 CC(O)CN1CCC[C@@H]1CO 269982a_100000745186_100011218427 [0,0,1,1,0,0|1,0,0]=3 6185 B11R1.57 CC(O)CN1CCC[C@@H]1CO 34a_100000745186_100011218427 [0,0,1,1,0,0|1,0,0]=3 6186 B11R1.57 CCC1C=CCN1CC(C)O 2230a_100000730860_100011218427 [0,0,1,1,0,0|0,0,2]=4 6187 B11R1.57 CCC1C=CCN1CC(C)O 269982a_100000730860_100011218427 [0,0,1,1,0,0|0,0,2]=4 6188 B11R1.57 CCC1C=CCN1CC(C)O 34a_100000730860_100011218427 [0,0,1,1,0,0|0,0,2]=4 6189 B11R1.57 CCC1C=CCN1C[C@@H](C)O 2230a_100000730860_100009817552 [0,0,1,1,0,0|0,0,2]=4 6190 B11R1.57 CCC1C=CCN1C[C@@H](C)O 269982a_100000730860_100009817552 [0,0,1,1,0,0|0,0,2]=4 6191 B11R1.57 CCC1C=CCN1C[C@@H](C)O 34a_100000730860_100009817552 [0,0,1,1,0,0|0,0,2]=4 6192 B11R1.57 CCC1CCCN1CC(C)C 2230a_100000754278_100000210760 [0,0,1,1,0,0|1,0,0]=3 6193 B11R1.57 CCC1CCCN1CC(C)C 269982a_100000754278_100000210624 [0,0,1,1,0,0|1,0,0]=3 6194 B11R1.57 CCC1CCCN1CC(C)C 270004a_100000754278_100000210432 [0,0,1,1,0,0|1,0,0]=3 6195 B11R1.57 CCC1CCCN1CC(C)C 34a_100000754278_100000210624 [0,0,1,1,0,0|1,0,0]=3 6196 B11R1.57 CCC1CCCN1CC(C)O 2230a_100000754278_100011218427 [0,0,1,1,0,0|0,0,0]=2 6197 B11R1.57 CCC1CCCN1CC(C)O 269982a_100000754278_100011218427 [0,0,1,1,0,0|0,0,0]=2 6198 B11R1.57 CCC1CCCN1CC(C)O 34a_100000754278_100011218427 [0,0,1,1,0,0|0,0,0]=2 6199 B11R1.57 CCC1CCCN1CC(F)F 2230a_100000754278_100011934356 [0,0,1,1,0,0|2,0,0]=4 6200 B11R1.57 CCC1CCCN1CC(F)F 269982a_100000754278_100011934356 [0,0,1,1,0,0|2,0,0]=4 6201 B11R1.57 CCC1CCCN1CC(F)F 34a_100000754278_100011934356 [0,0,1,1,0,0|2,0,0]=4 6202 B11R1.57 CCC1CCCN1C[C@@H](C)O 2230a_100000754278_100009817552 [0,0,1,1,0,0|0,0,0]=2 6203 B11R1.57 CCC1CCCN1C[C@@H](C)O 269982a_100000754278_100009817552 [0,0,1,1,0,0|0,0,0]=2 6204 B11R1.57 CCC1CCCN1C[C@@H](C)O 34a_100000754278_100009817552 [0,0,1,1,0,0|0,0,0]=2 6205 B11R1.57 C[C@@H](O)CN1CCCC1C#N 2230a_100000701862_100009817552 [0,0,1,1,0,0|1,0,1]=4 6206 B11R1.57 C[C@@H](O)CN1CCC[C@@H]1C#N 2230a_106645074975_100009817552 [0,0,1,1,0,0|1,0,1]=4 6207 B11R1.57 C[C@@H](O)CN1CCC[C@@H]1C#N 269982a_106645074975_100009817552 [0,0,1,1,0,0|1,0,1]=4 6208 B11R1.57 C[C@@H](O)CN1CCC[C@@H]1CO 2230a_100000745186_100009817552 [0,0,1,1,0,0|1,0,0]=3 6209 B11R1.57 C[C@@H](O)CN1CCC[C@@H]1CO 269982a_100000745186_100009817552 [0,0,1,1,0,0|1,0,0]=3 6210 B11R1.57 C[C@@H](O)CN1CCC[C@@H]1CO 34a_100000745186_100009817552 [0,0,1,1,0,0|1,0,0]=3 6211 B11R1.78 C#CCCCCN1CC(C1)O 269982a_100000749847_100010269958 [0,0,1,1,0,0|0,0,2]=4 6212 B11R1.78 C=CCCCCN1CC(C1)O 269982a_100000749847_100011215482 [0,0,1,1,0,0|0,0,2]=4 6213 B11R1.78 CC/C=C\CCN1CC(C1)O 269982a_100000749847_100015370543 [0,0,1,1,0,0|0,0,2]=4 6214 B11R1.78 CC1CN(C1)CCCCCF 2230a_100000702820_100000729378 [0,0,1,1,0,0|2,0,0]=4 6215 B11R1.78 CC1CN(C1)CCCCCF 269982a_100000702820_100000729378 [0,0,1,1,0,0|2,0,0]=4 6216 B11R1.78 CC1CN(C1)CCCCCF 34a_100000702820_100000729378 [0,0,1,1,0,0|2,0,0]=4 6217 B11R1.78 CC1CN(C1)CCCCCO 2230a_100000702820_100000746330 [0,0,1,1,0,0|2,0,0]=4 6218 B11R1.78 CC1CN(C1)CCCCCO 269982a_100000702820_100000746330 [0,0,1,1,0,0|2,0,0]=4 6219 B11R1.78 CC1CN(C1)CCCCCO 34a_100000702820_100000746330 [0,0,1,1,0,0|2,0,0]=4 6220 B11R1.78 CCCCCCN1CC(C1)C 2230a_100000702820_100000210314 [0,0,1,1,0,0|1,0,0]=3 6221 B11R1.78 CCCCCCN1CC(C1)C 269982a_100000702820_100000210757 [0,0,1,1,0,0|1,0,0]=3 6222 B11R1.78 CCCCCCN1CC(C1)C 34a_100000702820_100000210314 [0,0,1,1,0,0|1,0,0]=3 6223 B11R1.78 CCCCCCN1CC(C1)F 2230a_100000690557_100000210314 [0,0,1,1,0,0|1,0,0]=3 6224 B11R1.78 CCCCCCN1CC(C1)F 269982a_100000690557_100000210757 [0,0,1,1,0,0|1,0,0]=3 6225 B11R1.78 CCCCCCN1CC(C1)F 34a_100000690557_100000210314 [0,0,1,1,0,0|1,0,0]=3 6226 B11R1.78 CCCCCCN1CC(C1)O 269982a_100000749847_100000210757 [0,0,1,1,0,0|0,0,0]=2 6227 B11R1.78 CCCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000210326 [0,0,1,1,0,0|2,0,0]=4 6228 B11R1.78 CCCCNCC1CC(C1)O 2230a_100016992100_100000210211 [0,0,1,1,0,0|2,0,0]=4 6229 B11R1.78 CCCCOCN1CC(C1)C 2230a_100000702820_100011995733 [0,0,1,1,0,0|2,0,0]=4 6230 B11R1.78 CCCCOCN1CC(C1)C 269982a_100000702820_100011995733 [0,0,1,1,0,0|2,0,0]=4 6231 B11R1.78 CCCCOCN1CC(C1)C 34a_100000702820_100011995733 [0,0,1,1,0,0|2,0,0]=4 6232 B11R1.78 CCCCOCN1CC(C1)F 2230a_100000690557_100011995733 [0,0,1,1,0,0|2,0,0]=4 6233 B11R1.78 CCCCOCN1CC(C1)F 269982a_100000690557_100011995733 [0,0,1,1,0,0|2,0,0]=4 6234 B11R1.78 CCCCOCN1CC(C1)F 34a_100000690557_100011995733 [0,0,1,1,0,0|2,0,0]=4 6235 B11R1.78 CCCCOCN1CC(C1)O 269982a_100000749847_100011995733 [0,0,1,1,0,0|1,0,0]=3 6236 B11R1.78 CCCOCCN1CC(C1)C 2230a_100000702820_100011215938 [0,0,1,1,0,0|2,0,0]=4 6237 B11R1.78 CCCOCCN1CC(C1)C 269982a_100000702820_100011215938 [0,0,1,1,0,0|2,0,0]=4 6238 B11R1.78 CCCOCCN1CC(C1)C 34a_100000702820_100011215938 [0,0,1,1,0,0|2,0,0]=4 6239 B11R1.78 CCCOCCN1CC(C1)F 2230a_100000690557_100011215938 [0,0,1,1,0,0|2,0,0]=4 6240 B11R1.78 CCCOCCN1CC(C1)F 269982a_100000690557_100011215938 [0,0,1,1,0,0|2,0,0]=4 6241 B11R1.78 CCCOCCN1CC(C1)F 34a_100000690557_100011215938 [0,0,1,1,0,0|2,0,0]=4 6242 B11R1.78 CCCOCCN1CC(C1)O 269982a_100000749847_100011215938 [0,0,1,1,0,0|1,0,0]=3 6243 B11R1.78 CCOCCCN1CC(C1)C 2230a_100000702820_100012232248 [0,0,1,1,0,0|2,0,0]=4 6244 B11R1.78 CCOCCCN1CC(C1)C 269982a_100000702820_100012232248 [0,0,1,1,0,0|2,0,0]=4 6245 B11R1.78 CCOCCCN1CC(C1)C 34a_100000702820_100012232248 [0,0,1,1,0,0|2,0,0]=4 6246 B11R1.78 CCOCCCN1CC(C1)F 2230a_100000690557_100012232248 [0,0,1,1,0,0|2,0,0]=4 6247 B11R1.78 CCOCCCN1CC(C1)F 269982a_100000690557_100012232248 [0,0,1,1,0,0|2,0,0]=4 6248 B11R1.78 CCOCCCN1CC(C1)F 34a_100000690557_100012232248 [0,0,1,1,0,0|2,0,0]=4 6249 B11R1.78 CCOCCCN1CC(C1)O 269982a_100000749847_100012232248 [0,0,1,1,0,0|1,0,0]=3 6250 B11R1.78 COCCCCN1CC(C1)C 2230a_100000702820_100000730899 [0,0,1,1,0,0|2,0,0]=4 6251 B11R1.78 COCCCCN1CC(C1)C 269982a_100000702820_100000730899 [0,0,1,1,0,0|2,0,0]=4 6252 B11R1.78 COCCCCN1CC(C1)C 34a_100000702820_100000755781 [0,0,1,1,0,0|2,0,0]=4 6253 B11R1.78 COCCCCN1CC(C1)F 2230a_100000690557_100000730899 [0,0,1,1,0,0|2,0,0]=4 6254 B11R1.78 COCCCCN1CC(C1)F 269982a_100000690557_100000730899 [0,0,1,1,0,0|2,0,0]=4 6255 B11R1.78 COCCCCN1CC(C1)F 34a_100000690557_100000755781 [0,0,1,1,0,0|2,0,0]=4 6256 B11R1.78 COCCCCN1CC(C1)O 269982a_100000749847_100000730899 [0,0,1,1,0,0|1,0,0]=3 6257 B11R1.78 COCCOCN1CC(C1)O 269982a_100000749847_100000231047 [0,0,1,1,0,0|2,0,0]=4 6258 B11R1.78 FCCCCCN1CC(C1)F 2230a_100000690557_100000729378 [0,0,1,1,0,0|2,0,0]=4 6259 B11R1.78 FCCCCCN1CC(C1)F 269982a_100000690557_100000729378 [0,0,1,1,0,0|2,0,0]=4 6260 B11R1.78 FCCCCCN1CC(C1)F 34a_100000690557_100000729378 [0,0,1,1,0,0|2,0,0]=4 6261 B11R1.78 N#CCCCCN1CC(C1)O 269982a_100000749847_100011219923 [0,0,1,1,0,0|1,0,1]=4 6262 B11R1.78 O=CCCCCN1CC(C1)O 269982a_100000749847_100000139335 [0,0,1,1,0,0|1,0,1]=4 6263 B11R1.78 OC1CN(C1)CCCCCF 269982a_100000749847_100000729378 [0,0,1,1,0,0|1,0,0]=3 6264 B11R1.78 OCCCCCN1CC(C1)F 2230a_100000690557_100000746330 [0,0,1,1,0,0|2,0,0]=4 6265 B11R1.78 OCCCCCN1CC(C1)F 269982a_100000690557_100000746330 [0,0,1,1,0,0|2,0,0]=4 6266 B11R1.78 OCCCCCN1CC(C1)F 34a_100000690557_100000746330 [0,0,1,1,0,0|2,0,0]=4 6267 B11R1.78 OCCCCCN1CC(C1)O 269982a_100000749847_100000746330 [0,0,1,1,0,0|1,0,0]=3 6268 B11R1.78 OCCOCCN1CC(C1)O 269982a_100000749847_100011215305 [0,0,1,1,0,0|2,0,0]=4 6269 B11R1.90 CC(C)CNC1CCCC1C 269862a_100000210953_100000752053 [0,0,1,1,0,0|1,0,0]=3 6270 B11R1.90 CC(C)CNC1CCOC1C 270004a_100000210953_100000691750 [0,0,1,1,0,0|2,0,0]=4 6271 B11R1.90 CC(C)CN[C@H]1CCC[C@@H]1O 270004a_100000748460_100000210432 [0,0,1,1,0,0|2,0,0]=4 6272 B11R1.90 CC(C)COC1CCCC1C 34a_100011216460_100000210624 [0,0,1,1,0,0|2,0,0]=4 6273 B11R1.90 CC(C)COC1CCCC1C 7a_100011216460_100000210760 [0,0,1,1,0,0|2,0,0]=4 6274 B11R1.90 CC(O)CCN1CCC[C@@H]1C 2230a_100020605311_100012276601 [0,0,1,1,0,0|2,0,0]=4 6275 B11R1.90 CC(O)CCN1CCC[C@@H]1C 269982a_100020605311_100012276601 [0,0,1,1,0,0|2,0,0]=4 6276 B11R1.90 CC(O)CCN1CCC[C@H]1C 2230a_100015189458_100012276601 [0,0,1,1,0,0|2,0,0]=4 6277 B11R1.90 CC(O)CCN1CCC[C@H]1C 269982a_100015189458_100012276601 [0,0,1,1,0,0|2,0,0]=4 6278 B11R1.90 CC(O)CCN1CCC[C@H]1C 34a_100015189458_100012276601 [0,0,1,1,0,0|2,0,0]=4 6279 B11R1.90 CC(O)CNC1CCCC1=O 2230a_100000210904_100000211823 [0,0,1,1,0,0|1,0,1]=4 6280 B11R1.90 CC(O)CNC1CCCC1=O 34a_100000210904_100000709159 [0,0,1,1,0,0|1,0,1]=4 6281 B11R1.90 CC(O)CNC1CCCC1C 269862a_100000210904_100000752053 [0,0,1,1,0,0|0,0,0]=2 6282 B11R1.90 CC(O)CNC1CCOC1C 270004a_100000210904_100000691750 [0,0,1,1,0,0|1,0,0]=3 6283 B11R1.90 CC(O)CNC1COCC1O 34a_100000210904_200000725654 [0,0,1,1,0,0|2,0,0]=4 6284 B11R1.90 CC(O)CN[C@H]1COC[C@@H]1O 2230a_100015191717_100011218427 [0,0,1,1,0,0|2,0,0]=4 6285 B11R1.90 CC(O)COC1CCCC1C 34a_100011216460_100011218427 [0,0,1,1,0,0|1,0,0]=3 6286 B11R1.90 CC(O)COC1CCCC1C 7a_100011216460_100011218427 [0,0,1,1,0,0|1,0,0]=3 6287 B11R1.90 CC(O)CO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100011218427 [0,0,1,1,0,0|2,0,0]=4 6288 B11R1.90 CC(O)CO[C@H]1CCC[C@@H]1N 34a_100000748460_100011218427 [0,0,1,1,0,0|2,0,0]=4 6289 B11R1.90 CC(O)CO[C@H]1CNC[C@H]1C 34a_200015306588_100011218427 [0,0,1,1,0,0|2,0,0]=4 6290 B11R1.90 CC(O)CS[C@@H]1CCC[C@H]1O 62a_100011218427_200016002552 [0,0,1,1,0,0|2,0,0]=4 6291 B11R1.90 CC(O)CS[C@@H]1CCC[C@H]1O 62a_200016002552_100011218427 [0,0,1,1,0,0|2,0,0]=4 6292 B11R1.90 CC1CCCC1OC[C@@H](C)O 34a_100011216460_100009817552 [0,0,1,1,0,0|1,0,0]=3 6293 B11R1.90 CC1CCCC1OC[C@@H](C)O 7a_100011216460_100009817552 [0,0,1,1,0,0|1,0,0]=3 6294 B11R1.90 C[C@@H](O)CN[C@H]1COC[C@@H]1O 2230a_100015191717_100009817552 [0,0,1,1,0,0|2,0,0]=4 6295 B11R1.90 C[C@@H](O)CO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100009817552 [0,0,1,1,0,0|2,0,0]=4 6296 B11R1.90 C[C@@H](O)CO[C@H]1CCC[C@@H]1N 34a_100000748460_100009817552 [0,0,1,1,0,0|2,0,0]=4 6297 B11R1.90 C[C@@H](O)CS[C@@H]1CCC[C@H]1O 62a_100009817552_200016002552 [0,0,1,1,0,0|2,0,0]=4 6298 B11R1.90 C[C@@H](O)CS[C@@H]1CCC[C@H]1O 62a_200016002552_100009817552 [0,0,1,1,0,0|2,0,0]=4 6299 B11R1.90 C[C@@H]1CNC[C@@H]1OC[C@@H](C)O 34a_200015306588_100009817552 [0,0,1,1,0,0|2,0,0]=4 6300 B11R1.91 C=C(C)CNC1CCCCC1 2230a_100000182618_100000748629 [0,0,1,1,0,0|1,0,1]=4 6301 B11R1.91 C=C(C)CNC1CCCCC1 34a_100000182618_100000748629 [0,0,1,1,0,0|1,0,1]=4 6302 B11R1.91 CC(Br)COC1CCCCC1 34a_100012180447_100000210327 [0,0,1,1,0,0|2,0,0]=4 6303 B11R1.91 CC(C)CNC1CCCCC1 2230a_100000182618_100000210760 [0,0,1,1,0,0|1,0,0]=3 6304 B11R1.91 CC(C)CNC1CCCCC1 270004a_100000182618_100000210432 [0,0,1,1,0,0|1,0,0]=3 6305 B11R1.91 CC(C)CNC1CCCCC1 270004a_100000210953_100000210434 [0,0,1,1,0,0|1,0,0]=3 6306 B11R1.91 CC(C)CNC1CCCCC1 34a_100000182618_100000210624 [0,0,1,1,0,0|1,0,0]=3 6307 B11R1.91 CC(C)CNC1CCCCC1 34a_100000210953_100000210327 [0,0,1,1,0,0|1,0,0]=3 6308 B11R1.91 CC(C)CNC1CCCOC1 2230a_100000719290_100000210760 [0,0,1,1,0,0|2,0,0]=4 6309 B11R1.91 CC(C)CNC1CCCOC1 270004a_100000210953_100000753404 [0,0,1,1,0,0|2,0,0]=4 6310 B11R1.91 CC(C)CNC1CCCOC1 270004a_100000719290_100000210432 [0,0,1,1,0,0|2,0,0]=4 6311 B11R1.91 CC(C)CNC1CCCOC1 34a_100000210953_100000693364 [0,0,1,1,0,0|2,0,0]=4 6312 B11R1.91 CC(C)CNC1CCCOC1 34a_100000719290_100000210624 [0,0,1,1,0,0|2,0,0]=4 6313 B11R1.91 CC(C)CNC1CCCSC1 270004a_100000210953_100000057913 [0,0,1,1,0,0|2,0,0]=4 6314 B11R1.91 CC(C)CNC1CCNCC1 270004a_100000210953_100015192401 [0,0,1,1,0,0|2,0,0]=4 6315 B11R1.91 CC(C)CNC1CCOCC1 2230a_100000741149_100000210760 [0,0,1,1,0,0|2,0,0]=4 6316 B11R1.91 CC(C)CNC1CCOCC1 270004a_100000210953_100011217826 [0,0,1,1,0,0|2,0,0]=4 6317 B11R1.91 CC(C)CNC1CCOCC1 270004a_100000741149_100000210432 [0,0,1,1,0,0|2,0,0]=4 6318 B11R1.91 CC(C)CNC1CCOCC1 34a_100000741149_100000210624 [0,0,1,1,0,0|2,0,0]=4 6319 B11R1.91 CC(C)CNC1CCSCC1 2230a_100000748639_100000210760 [0,0,1,1,0,0|2,0,0]=4 6320 B11R1.91 CC(C)CNC1CCSCC1 270004a_100000210953_100000203788 [0,0,1,1,0,0|2,0,0]=4 6321 B11R1.91 CC(C)CNC1CCSCC1 270004a_100000748639_100000210432 [0,0,1,1,0,0|2,0,0]=4 6322 B11R1.91 CC(C)CNC1CCSCC1 34a_100000210953_100000069128 [0,0,1,1,0,0|2,0,0]=4 6323 B11R1.91 CC(C)CNC1CCSCC1 34a_100000748639_100000210624 [0,0,1,1,0,0|2,0,0]=4 6324 B11R1.91 CC(C)COC1CCCCC1 34a_100000210231_100000210624 [0,0,1,1,0,0|2,0,0]=4 6325 B11R1.91 CC(C)COC1CCCCC1 34a_100000210257_100000210327 [0,0,1,1,0,0|2,0,0]=4 6326 B11R1.91 CC(C)COC1CCCCC1 7a_100000210231_100000210760 [0,0,1,1,0,0|2,0,0]=4 6327 B11R1.91 CC(C)CSC1CCCCC1 62a_100000210327_100000210760 [0,0,1,1,0,0|2,0,0]=4 6328 B11R1.91 CC(C)CSC1CCCCC1 62a_100000210624_100000210327 [0,0,1,1,0,0|2,0,0]=4 6329 B11R1.91 CC(F)COC1CCCCC1 34a_100015925927_100000210327 [0,0,1,1,0,0|2,0,0]=4 6330 B11R1.91 CC(O)CNC1C=CCCC1 2230a_100000210904_100000751183 [0,0,1,1,0,0|0,0,2]=4 6331 B11R1.91 CC(O)CNC1CCCCC1 2230a_100000182618_100011218427 [0,0,1,1,0,0|0,0,0]=2 6332 B11R1.91 CC(O)CNC1CCCCC1 270004a_100000210904_100000210434 [0,0,1,1,0,0|0,0,0]=2 6333 B11R1.91 CC(O)CNC1CCCCC1 34a_100000182618_100011218427 [0,0,1,1,0,0|0,0,0]=2 6334 B11R1.91 CC(O)CNC1CCCCC1 34a_100000210904_100000210327 [0,0,1,1,0,0|0,0,0]=2 6335 B11R1.91 CC(O)CNC1CCCOC1 2230a_100000719290_100011218427 [0,0,1,1,0,0|1,0,0]=3 6336 B11R1.91 CC(O)CNC1CCCOC1 270004a_100000210904_100000753404 [0,0,1,1,0,0|1,0,0]=3 6337 B11R1.91 CC(O)CNC1CCCOC1 34a_100000210904_100000693364 [0,0,1,1,0,0|1,0,0]=3 6338 B11R1.91 CC(O)CNC1CCCOC1 34a_100000719290_100011218427 [0,0,1,1,0,0|1,0,0]=3 6339 B11R1.91 CC(O)CNC1CCCSC1 270004a_100000210904_100000057913 [0,0,1,1,0,0|1,0,0]=3 6340 B11R1.91 CC(O)CNC1CCNCC1 270004a_100000210904_100015192401 [0,0,1,1,0,0|1,0,0]=3 6341 B11R1.91 CC(O)CNC1CCOCC1 2230a_100000741149_100011218427 [0,0,1,1,0,0|1,0,0]=3 6342 B11R1.91 CC(O)CNC1CCOCC1 270004a_100000210904_100011217826 [0,0,1,1,0,0|1,0,0]=3 6343 B11R1.91 CC(O)CNC1CCOCC1 34a_100000741149_100011218427 [0,0,1,1,0,0|1,0,0]=3 6344 B11R1.91 CC(O)CNC1CCSCC1 2230a_100000748639_100011218427 [0,0,1,1,0,0|1,0,0]=3 6345 B11R1.91 CC(O)CNC1CCSCC1 270004a_100000210904_100000203788 [0,0,1,1,0,0|1,0,0]=3 6346 B11R1.91 CC(O)CNC1CCSCC1 34a_100000210904_100000069128 [0,0,1,1,0,0|1,0,0]=3 6347 B11R1.91 CC(O)CNC1CCSCC1 34a_100000748639_100011218427 [0,0,1,1,0,0|1,0,0]=3 6348 B11R1.91 CC(O)COC1CCCCC1 34a_100000210231_100011218427 [0,0,1,1,0,0|1,0,0]=3 6349 B11R1.91 CC(O)COC1CCCCC1 7a_100000210231_100011218427 [0,0,1,1,0,0|1,0,0]=3 6350 B11R1.91 CC(O)COC1CCCCO1 34a_100000033831_100011218427 [0,0,1,1,0,0|2,0,0]=4 6351 B11R1.91 CC(O)COC1CCCOC1 34a_100000754041_100011218427 [0,0,1,1,0,0|2,0,0]=4 6352 B11R1.91 CC(O)COC1CCCSC1 7a_100015962668_100011218427 [0,0,1,1,0,0|2,0,0]=4 6353 B11R1.91 CC(O)COC1CCOCC1 34a_100000744328_100011218427 [0,0,1,1,0,0|2,0,0]=4 6354 B11R1.91 CC(O)COC1CCSCC1 34a_100000731022_100011218427 [0,0,1,1,0,0|2,0,0]=4 6355 B11R1.91 CC(O)COC1CCSCC1 7a_100000731022_100011218427 [0,0,1,1,0,0|2,0,0]=4 6356 B11R1.91 CC(O)CSC1CCCCC1 62a_100000210327_100011218427 [0,0,1,1,0,0|1,0,0]=3 6357 B11R1.91 CC(O)CSC1CCCCC1 62a_100011218427_100000210327 [0,0,1,1,0,0|1,0,0]=3 6358 B11R1.91 CC(O)CSC1CCCOC1 62a_100011218427_100000693364 [0,0,1,1,0,0|2,0,0]=4 6359 B11R1.91 CC(O)CSC1CCOCC1 62a_100011218427_100011324220 [0,0,1,1,0,0|2,0,0]=4 6360 B11R1.91 CC(O)CSC1CCSCC1 62a_100011218427_100000069128 [0,0,1,1,0,0|2,0,0]=4 6361 B11R1.91 C[C@@H](Cl)COC1CCCCC1 34a_100016084084_100000210327 [0,0,1,1,0,0|2,0,0]=4 6362 B11R1.91 C[C@@H](N)COC1CCCCC1 34a_100000737577_100000210327 [0,0,1,1,0,0|2,0,0]=4 6363 B11R1.91 C[C@@H](O)CNC1CCCCC1 2230a_100000182618_100009817552 [0,0,1,1,0,0|0,0,0]=2 6364 B11R1.91 C[C@@H](O)CNC1CCCCC1 34a_100000182618_100009817552 [0,0,1,1,0,0|0,0,0]=2 6365 B11R1.91 C[C@@H](O)CNC1CCCOC1 2230a_100000719290_100009817552 [0,0,1,1,0,0|1,0,0]=3 6366 B11R1.91 C[C@@H](O)CNC1CCCOC1 34a_100000719290_100009817552 [0,0,1,1,0,0|1,0,0]=3 6367 B11R1.91 C[C@@H](O)CNC1CCOCC1 2230a_100000741149_100009817552 [0,0,1,1,0,0|1,0,0]=3 6368 B11R1.91 C[C@@H](O)CNC1CCOCC1 34a_100000741149_100009817552 [0,0,1,1,0,0|1,0,0]=3 6369 B11R1.91 C[C@@H](O)CNC1CCSCC1 2230a_100000748639_100009817552 [0,0,1,1,0,0|1,0,0]=3 6370 B11R1.91 C[C@@H](O)CNC1CCSCC1 34a_100000748639_100009817552 [0,0,1,1,0,0|1,0,0]=3 6371 B11R1.91 C[C@@H](O)COC1CCCCC1 34a_100000210231_100009817552 [0,0,1,1,0,0|1,0,0]=3 6372 B11R1.91 C[C@@H](O)COC1CCCCC1 7a_100000210231_100009817552 [0,0,1,1,0,0|1,0,0]=3 6373 B11R1.91 C[C@@H](O)COC1CCCCO1 34a_100000033831_100009817552 [0,0,1,1,0,0|2,0,0]=4 6374 B11R1.91 C[C@@H](O)COC1CCCOC1 34a_100000754041_100009817552 [0,0,1,1,0,0|2,0,0]=4 6375 B11R1.91 C[C@@H](O)COC1CCCSC1 7a_100015962668_100009817552 [0,0,1,1,0,0|2,0,0]=4 6376 B11R1.91 C[C@@H](O)COC1CCOCC1 34a_100000744328_100009817552 [0,0,1,1,0,0|2,0,0]=4 6377 B11R1.91 C[C@@H](O)COC1CCSCC1 34a_100000731022_100009817552 [0,0,1,1,0,0|2,0,0]=4 6378 B11R1.91 C[C@@H](O)COC1CCSCC1 7a_100000731022_100009817552 [0,0,1,1,0,0|2,0,0]=4 6379 B11R1.91 C[C@@H](O)CSC1CCCCC1 62a_100000210327_100009817552 [0,0,1,1,0,0|1,0,0]=3 6380 B11R1.91 C[C@@H](O)CSC1CCCCC1 62a_100009817552_100000210327 [0,0,1,1,0,0|1,0,0]=3 6381 B11R1.91 C[C@@H](O)CSC1CCCOC1 62a_100009817552_100000693364 [0,0,1,1,0,0|2,0,0]=4 6382 B11R1.91 C[C@@H](O)CSC1CCOCC1 62a_100009817552_100011324220 [0,0,1,1,0,0|2,0,0]=4 6383 B11R1.91 C[C@@H](O)CSC1CCSCC1 62a_100009817552_100000069128 [0,0,1,1,0,0|2,0,0]=4 6384 B11R1.91 FC(F)CNC1CCCCC1 2230a_100000182618_100011934356 [0,0,1,1,0,0|2,0,0]=4 6385 B11R1.91 FC(F)CNC1CCCCC1 270004a_100000765723_100000210434 [0,0,1,1,0,0|2,0,0]=4 6386 B11R1.91 FC(F)CNC1CCCCC1 34a_100000182618_100011934356 [0,0,1,1,0,0|2,0,0]=4 6387 B11R1.91 FC(F)CNC1CCCCC1 34a_100000765723_100000210327 [0,0,1,1,0,0|2,0,0]=4 6388 B11R1.91 O=C(O)CNC1CCCCC1 269956a_100016091260_100000210327 [0,0,1,1,0,0|1,0,1]=4 6389 B11R1.99 BrCCCCCOCC1CO1 34a_100000746331_102125554688 [0,0,1,1,0,0|2,0,0]=4 6390 B11R1.99 BrCCCCCOCC1CO1 7a_100000746331_102125554688 [0,0,1,1,0,0|2,0,0]=4 6391 B11R1.99 BrCCCCCOC[C@@H]1CO1 7a_100000746331_100000745022 [0,0,1,1,0,0|2,0,0]=4 6392 B11R1.99 C#CCCCCNCC1CO1 2230a_100000706060_100011216344 [0,0,1,1,0,0|0,0,2]=4 6393 B11R1.99 C#CCCCCNCC1CO1 34a_100000706060_102125554688 [0,0,1,1,0,0|0,0,2]=4 6394 B11R1.99 C=CCCCCNCC1CO1 2230a_100000703577_100011216344 [0,0,1,1,0,0|0,0,2]=4 6395 B11R1.99 C=CCCCCNCC1CO1 34a_100000703577_102125554688 [0,0,1,1,0,0|0,0,2]=4 6396 B11R1.99 CCCCCCNCC1CC1 2230a_100000210581_100000742324 [0,0,1,1,0,0|1,0,0]=3 6397 B11R1.99 CCCCCCNCC1CC1 2230a_100000735609_100000210314 [0,0,1,1,0,0|1,0,0]=3 6398 B11R1.99 CCCCCCNCC1CC1 269862a_100000210581_100000741477 [0,0,1,1,0,0|1,0,0]=3 6399 B11R1.99 CCCCCCNCC1CC1 34a_100000735609_100000210314 [0,0,1,1,0,0|1,0,0]=3 6400 B11R1.99 CCCCCCNCC1CO1 2230a_100000210581_100011216344 [0,0,1,1,0,0|0,0,0]=2 6401 B11R1.99 CCCCCCOCC1CC1 34a_100000210259_100000742324 [0,0,1,1,0,0|2,0,0]=4 6402 B11R1.99 CCCCCCOCC1CC1 34a_100000211283_100000210314 [0,0,1,1,0,0|2,0,0]=4 6403 B11R1.99 CCCCCCOCC1CC1 7a_100000210259_100000742324 [0,0,1,1,0,0|2,0,0]=4 6404 B11R1.99 CCCCCCOCC1CO1 34a_100000210259_102125554688 [0,0,1,1,0,0|1,0,0]=3 6405 B11R1.99 CCCCCCOCC1CO1 7a_100000210259_102125554688 [0,0,1,1,0,0|1,0,0]=3 6406 B11R1.99 CCCCCCOCC1CS1 7a_100000210259_100000031435 [0,0,1,1,0,0|1,1,0]=4 6407 B11R1.99 CCCCCCOC[C@@H]1CO1 34a_100000757423_100000210314 [0,0,1,1,0,0|1,0,0]=3 6408 B11R1.99 CCCCCCOC[C@@H]1CO1 7a_100000210259_100000745022 [0,0,1,1,0,0|1,0,0]=3 6409 B11R1.99 CCCCCCSCC1CC1 62a_100000210314_100000742324 [0,0,1,1,0,0|2,0,0]=4 6410 B11R1.99 CCCCCCSCC1CC1 62a_100000756562_100000210757 [0,0,1,1,0,0|2,0,0]=4 6411 B11R1.99 CCCCCCSCC1CO1 62a_100000210314_102125554688 [0,0,1,1,0,0|1,0,0]=3 6412 B11R1.99 CCCCCCSCC1CO1 62a_102125554688_100000210757 [0,0,1,1,0,0|1,0,0]=3 6413 B11R1.99 CCCCCCSCC1CS1 62a_100000031435_100000210757 [0,0,1,1,0,0|1,1,0]=4 6414 B11R1.99 CCCCCCSCC1CS1 62a_100000210314_100000031435 [0,0,1,1,0,0|1,1,0]=4 6415 B11R1.99 CCCCCCSC[C@@H]1CO1 62a_100000210314_100000745022 [0,0,1,1,0,0|1,0,0]=3 6416 B11R1.99 CCCCCCSC[C@@H]1CO1 62a_100000745022_100000210757 [0,0,1,1,0,0|1,0,0]=3 6417 B11R1.99 CCCCCNCCC1CO1 2230a_100000209983_100000732470 [0,0,1,1,0,0|2,0,0]=4 6418 B11R1.99 CCCCCOCCC1CO1 34a_100000210253_100000732470 [0,0,1,1,0,0|2,0,0]=4 6419 B11R1.99 CCCCCOCCC1CO1 7a_100000210253_100000732470 [0,0,1,1,0,0|2,0,0]=4 6420 B11R1.99 CCCCCOCC[C@@H]1CO1 34a_100009820653_100000718602 [0,0,1,1,0,0|2,0,0]=4 6421 B11R1.99 CCCCCSCCC1CO1 62a_100000210326_100000732470 [0,0,1,1,0,0|2,0,0]=4 6422 B11R1.99 CCCCCSCCC1CO1 62a_100000732470_100000210326 [0,0,1,1,0,0|2,0,0]=4 6423 B11R1.99 CCCCNCCCC1CO1 2230a_100000102301_100000733510 [0,0,1,1,0,0|2,0,0]=4 6424 B11R1.99 CCCCNCCCC1CO1 7a_106832991798_100000733510 [0,0,1,1,0,0|2,0,0]=4 6425 B11R1.99 CCCCOCCCC1CO1 34a_100000210227_100000733510 [0,0,1,1,0,0|2,0,0]=4 6426 B11R1.99 CCCCOCCCC1CO1 7a_100000210227_100000733510 [0,0,1,1,0,0|2,0,0]=4 6427 B11R1.99 CCCCOCNCC1CC1 2230a_100000735609_100011995733 [0,0,1,1,0,0|2,0,0]=4 6428 B11R1.99 CCCCOCNCC1CC1 34a_100000735609_100011995733 [0,0,1,1,0,0|2,0,0]=4 6429 B11R1.99 CCCCOCOC[C@@H]1CO1 34a_100000757423_100011995733 [0,0,1,1,0,0|2,0,0]=4 6430 B11R1.99 CCCCOCSCC1CO1 62a_100011995733_102125554688 [0,0,1,1,0,0|2,0,0]=4 6431 B11R1.99 CCCCOCSCC1CO1 62a_102125554688_100011995733 [0,0,1,1,0,0|2,0,0]=4 6432 B11R1.99 CCCCOCSC[C@@H]1CO1 62a_100000745022_100011995733 [0,0,1,1,0,0|2,0,0]=4 6433 B11R1.99 CCCCOCSC[C@@H]1CO1 62a_100011995733_100000745022 [0,0,1,1,0,0|2,0,0]=4 6434 B11R1.99 CCCCSCCCC1CO1 62a_100000210211_100000733510 [0,0,1,1,0,0|2,0,0]=4 6435 B11R1.99 CCCCSCCCC1CO1 62a_100000733510_100000210210 [0,0,1,1,0,0|2,0,0]=4 6436 B11R1.99 CCCOCCNCC1CC1 2230a_100000735609_100011215938 [0,0,1,1,0,0|2,0,0]=4 6437 B11R1.99 CCCOCCNCC1CC1 2230a_100161115042_100000742324 [0,0,1,1,0,0|2,0,0]=4 6438 B11R1.99 CCCOCCNCC1CC1 269862a_100161115042_100000741477 [0,0,1,1,0,0|2,0,0]=4 6439 B11R1.99 CCCOCCNCC1CC1 34a_100000735609_100011215938 [0,0,1,1,0,0|2,0,0]=4 6440 B11R1.99 CCCOCCNCC1CC1 34a_100161115042_100000742324 [0,0,1,1,0,0|2,0,0]=4 6441 B11R1.99 CCCOCCNCC1CO1 2230a_100161115042_100011216344 [0,0,1,1,0,0|1,0,0]=3 6442 B11R1.99 CCCOCCNCC1CO1 34a_100161115042_102125554688 [0,0,1,1,0,0|1,0,0]=3 6443 B11R1.99 CCCOCCOCC1CO1 34a_100000752267_102125554688 [0,0,1,1,0,0|2,0,0]=4 6444 B11R1.99 CCCOCCOCC1CO1 7a_100000752267_102125554688 [0,0,1,1,0,0|2,0,0]=4 6445 B11R1.99 CCCOCCOC[C@@H]1CO1 34a_100000757423_100011215938 [0,0,1,1,0,0|2,0,0]=4 6446 B11R1.99 CCCOCCOC[C@@H]1CO1 7a_100000752267_100000745022 [0,0,1,1,0,0|2,0,0]=4 6447 B11R1.99 CCCOCCSCC1CO1 62a_100011215938_102125554688 [0,0,1,1,0,0|2,0,0]=4 6448 B11R1.99 CCCOCCSCC1CO1 62a_102125554688_100011215938 [0,0,1,1,0,0|2,0,0]=4 6449 B11R1.99 CCCOCCSC[C@@H]1CO1 62a_100000745022_100011215938 [0,0,1,1,0,0|2,0,0]=4 6450 B11R1.99 CCCOCCSC[C@@H]1CO1 62a_100011215938_100000745022 [0,0,1,1,0,0|2,0,0]=4 6451 B11R1.99 CCCSCCNCC1CC1 2230a_100020603323_100000742324 [0,0,1,1,0,0|2,0,0]=4 6452 B11R1.99 CCCSCCNCC1CC1 269862a_100020603323_100000741477 [0,0,1,1,0,0|2,0,0]=4 6453 B11R1.99 CCCSCCNCC1CO1 2230a_100020603323_100011216344 [0,0,1,1,0,0|1,0,0]=3 6454 B11R1.99 CCCSCCOCC1CO1 34a_200000230433_102125554688 [0,0,1,1,0,0|2,0,0]=4 6455 B11R1.99 CCCSCCOCC1CO1 7a_200000230433_102125554688 [0,0,1,1,0,0|2,0,0]=4 6456 B11R1.99 CCCSCCOC[C@@H]1CO1 7a_200000230433_100000745022 [0,0,1,1,0,0|2,0,0]=4 6457 B11R1.99 CCOCCCNCC1CC1 2230a_100000210961_100000742324 [0,0,1,1,0,0|2,0,0]=4 6458 B11R1.99 CCOCCCNCC1CC1 2230a_100000735609_100012232248 [0,0,1,1,0,0|2,0,0]=4 6459 B11R1.99 CCOCCCNCC1CC1 269862a_100000210961_100000741477 [0,0,1,1,0,0|2,0,0]=4 6460 B11R1.99 CCOCCCNCC1CC1 34a_100000210961_100000742324 [0,0,1,1,0,0|2,0,0]=4 6461 B11R1.99 CCOCCCNCC1CC1 34a_100000735609_100012232248 [0,0,1,1,0,0|2,0,0]=4 6462 B11R1.99 CCOCCCNCC1CO1 2230a_100000210961_100011216344 [0,0,1,1,0,0|1,0,0]=3 6463 B11R1.99 CCOCCCNCC1CO1 34a_100000210961_102125554688 [0,0,1,1,0,0|1,0,0]=3 6464 B11R1.99 CCOCCCOCC1CO1 34a_100000757476_102125554688 [0,0,1,1,0,0|2,0,0]=4 6465 B11R1.99 CCOCCCOCC1CO1 7a_100000757476_102125554688 [0,0,1,1,0,0|2,0,0]=4 6466 B11R1.99 CCOCCCOC[C@@H]1CO1 34a_100000757423_100012232248 [0,0,1,1,0,0|2,0,0]=4 6467 B11R1.99 CCOCCCOC[C@@H]1CO1 7a_100000757476_100000745022 [0,0,1,1,0,0|2,0,0]=4 6468 B11R1.99 CCOCCCSCC1CO1 62a_100012232248_102125554688 [0,0,1,1,0,0|2,0,0]=4 6469 B11R1.99 CCOCCCSCC1CO1 62a_102125554688_100012232248 [0,0,1,1,0,0|2,0,0]=4 6470 B11R1.99 CCOCCCSC[C@@H]1CO1 62a_100000745022_100012232248 [0,0,1,1,0,0|2,0,0]=4 6471 B11R1.99 CCOCCCSC[C@@H]1CO1 62a_100012232248_100000745022 [0,0,1,1,0,0|2,0,0]=4 6472 B11R1.99 CCSCCCOCC1CO1 34a_100011216438_102125554688 [0,0,1,1,0,0|2,0,0]=4 6473 B11R1.99 CCSCCCOCC1CO1 7a_100011216438_102125554688 [0,0,1,1,0,0|2,0,0]=4 6474 B11R1.99 CCSCCCOC[C@@H]1CO1 7a_100011216438_100000745022 [0,0,1,1,0,0|2,0,0]=4 6475 B11R1.99 COCCCCNCC1CC1 2230a_100000735609_100000730899 [0,0,1,1,0,0|2,0,0]=4 6476 B11R1.99 COCCCCNCC1CC1 34a_100000735609_100000755781 [0,0,1,1,0,0|2,0,0]=4 6477 B11R1.99 COCCCCOCC1CO1 34a_100000740925_102125554688 [0,0,1,1,0,0|2,0,0]=4 6478 B11R1.99 COCCCCOCC1CO1 34a_100010889290_200000210301 [0,0,1,1,0,0|2,0,0]=4 6479 B11R1.99 COCCCCOCC1CO1 7a_100010889290_200000210301 [0,0,1,1,0,0|2,0,0]=4 6480 B11R1.99 COCCCCOC[C@@H]1CO1 34a_100000757423_100000755781 [0,0,1,1,0,0|2,0,0]=4 6481 B11R1.99 COCCCCSCC1CO1 62a_100000730899_102125554688 [0,0,1,1,0,0|2,0,0]=4 6482 B11R1.99 COCCCCSCC1CO1 62a_102125554688_100000730899 [0,0,1,1,0,0|2,0,0]=4 6483 B11R1.99 COCCCCSC[C@@H]1CO1 62a_100000730899_100000745022 [0,0,1,1,0,0|2,0,0]=4 6484 B11R1.99 COCCCCSC[C@@H]1CO1 62a_100000745022_100000730899 [0,0,1,1,0,0|2,0,0]=4 6485 B11R1.99 CSCCCCOCC1CO1 34a_100011217163_102125554688 [0,0,1,1,0,0|2,0,0]=4 6486 B11R1.99 CSCCCCOCC1CO1 7a_100011217163_102125554688 [0,0,1,1,0,0|2,0,0]=4 6487 B11R1.99 CSCCCCOC[C@@H]1CO1 7a_100011217163_100000745022 [0,0,1,1,0,0|2,0,0]=4 6488 B11R1.99 ClCCCCCOCC1CO1 34a_100000746330_102125554688 [0,0,1,1,0,0|2,0,0]=4 6489 B11R1.99 ClCCCCCOCC1CO1 7a_100000746330_102125554688 [0,0,1,1,0,0|2,0,0]=4 6490 B11R1.99 ClCCCCCOC[C@@H]1CO1 7a_100000746330_100000745022 [0,0,1,1,0,0|2,0,0]=4 6491 B11R1.99 FCCCCCNCC1CC1 2230a_100000735609_100000729378 [0,0,1,1,0,0|2,0,0]=4 6492 B11R1.99 FCCCCCNCC1CC1 34a_100000735609_100000729378 [0,0,1,1,0,0|2,0,0]=4 6493 B11R1.99 FCCCCCOC[C@@H]1CO1 34a_100000757423_100000729378 [0,0,1,1,0,0|2,0,0]=4 6494 B11R1.99 FCCCCCSCC1CO1 62a_100000729378_102125554688 [0,0,1,1,0,0|2,0,0]=4 6495 B11R1.99 FCCCCCSCC1CO1 62a_102125554688_100000729378 [0,0,1,1,0,0|2,0,0]=4 6496 B11R1.99 FCCCCCSC[C@@H]1CO1 62a_100000729378_100000745022 [0,0,1,1,0,0|2,0,0]=4 6497 B11R1.99 FCCCCCSC[C@@H]1CO1 62a_100000745022_100000729378 [0,0,1,1,0,0|2,0,0]=4 6498 B11R1.99 ICCCCCOCC1CO1 34a_200012148887_102125554688 [0,0,1,1,0,0|2,0,0]=4 6499 B11R1.99 ICCCCCOCC1CO1 7a_200012148887_102125554688 [0,0,1,1,0,0|2,0,0]=4 6500 B11R1.99 ICCCCCOC[C@@H]1CO1 7a_200012148887_100000745022 [0,0,1,1,0,0|2,0,0]=4 6501 B11R1.99 NCCCCCOCC1CO1 34a_100000762737_102125554688 [0,0,1,1,0,0|2,0,0]=4 6502 B11R1.99 OCCCCCNCC1CC1 2230a_100000735609_100000746330 [0,0,1,1,0,0|2,0,0]=4 6503 B11R1.99 OCCCCCNCC1CC1 2230a_100000762737_100000742324 [0,0,1,1,0,0|2,0,0]=4 6504 B11R1.99 OCCCCCNCC1CC1 269862a_100000762737_100000741477 [0,0,1,1,0,0|2,0,0]=4 6505 B11R1.99 OCCCCCNCC1CC1 34a_100000735609_100000746330 [0,0,1,1,0,0|2,0,0]=4 6506 B11R1.99 OCCCCCNCC1CC1 34a_100000762737_100000742324 [0,0,1,1,0,0|2,0,0]=4 6507 B11R1.99 OCCCCCNCC1CO1 2230a_100000762737_100011216344 [0,0,1,1,0,0|1,0,0]=3 6508 B11R1.99 OCCCCCNCC1CO1 34a_100000762737_102125554688 [0,0,1,1,0,0|1,0,0]=3 6509 B11R1.99 OCCCCCOC[C@@H]1CO1 34a_100000757423_100000746330 [0,0,1,1,0,0|2,0,0]=4 6510 B11R1.99 OCCCCCSCC1CO1 62a_100000746330_102125554688 [0,0,1,1,0,0|2,0,0]=4 6511 B11R1.99 OCCCCCSCC1CO1 62a_102125554688_100000746330 [0,0,1,1,0,0|2,0,0]=4 6512 B11R1.99 OCCCCCSC[C@@H]1CO1 62a_100000745022_100000746330 [0,0,1,1,0,0|2,0,0]=4 6513 B11R1.99 OCCCCCSC[C@@H]1CO1 62a_100000746330_100000745022 [0,0,1,1,0,0|2,0,0]=4 6514 B11R1.99 OCCOCCNCC1CO1 2230a_100000211614_100011216344 [0,0,1,1,0,0|2,0,0]=4 6515 B11R1.99 OCCOCCNCC1CO1 34a_100000211614_102125554688 [0,0,1,1,0,0|2,0,0]=4 6516 B11R1.99 OCCSCCNCC1CO1 2230a_100011219999_100011216344 [0,0,1,1,0,0|2,0,0]=4 6517 B11R1.99 [13CH3]OCCCCOCC1CO1 34a_100010889290_200025704644 [0,0,1,1,0,0|2,0,0]=4 6518 B11R1.99 [13CH3]OCCCCOCC1CO1 7a_100010889290_200025704644 [0,0,1,1,0,0|2,0,0]=4 6519 B11R1.102 CC(O)CCOCC1CC1C 34a_100000744939_100012276601 [0,0,1,1,0,0|2,0,0]=4 6520 B11R1.102 CC(O)CCOCC1CC1C 7a_100000744939_100012276601 [0,0,1,1,0,0|2,0,0]=4 6521 B11R1.113 COCC1CCN1CC(C)C 2230a_100015195929_100000210760 [0,0,1,1,0,0|2,0,0]=4 6522 B11R1.113 COCC1CCN1CC(C)C 269982a_100015195929_100000210624 [0,0,1,1,0,0|2,0,0]=4 6523 B11R1.113 COCC1CCN1CC(C)C 270004a_100015195929_100000210432 [0,0,1,1,0,0|2,0,0]=4 6524 B11R1.113 COCC1CCN1CC(C)C 34a_100015195929_100000210624 [0,0,1,1,0,0|2,0,0]=4 6525 B11R1.113 COCC1CCN1CC(C)O 2230a_100015195929_100011218427 [0,0,1,1,0,0|1,0,0]=3 6526 B11R1.113 COCC1CCN1CC(C)O 269982a_100015195929_100011218427 [0,0,1,1,0,0|1,0,0]=3 6527 B11R1.113 COCC1CCN1CC(C)O 34a_100015195929_100011218427 [0,0,1,1,0,0|1,0,0]=3 6528 B11R1.113 COCC1CCN1C[C@@H](C)O 2230a_100015195929_100009817552 [0,0,1,1,0,0|1,0,0]=3 6529 B11R1.113 COCC1CCN1C[C@@H](C)O 269982a_100015195929_100009817552 [0,0,1,1,0,0|1,0,0]=3 6530 B11R1.113 COCC1CCN1C[C@@H](C)O 34a_100015195929_100009817552 [0,0,1,1,0,0|1,0,0]=3 6531 B11R1.161 CC(O)CCCN1CCC1C 269982a_100000755817_200000718107 [0,0,1,1,0,0|2,0,0]=4 6532 B11R1.161 CC(O)CCCN1CCC1C 34a_100000755817_200000718107 [0,0,1,1,0,0|2,0,0]=4 6533 B11R1.172 C=C(C)CNCC1CCCC1 2230a_100000737975_100000748629 [0,0,1,1,0,0|1,0,1]=4 6534 B11R1.172 C=C(C)CNCC1CCCC1 34a_100000737975_100000748629 [0,0,1,1,0,0|1,0,1]=4 6535 B11R1.172 CC(Br)COCC1CCCC1 34a_100012180447_100000740388 [0,0,1,1,0,0|2,0,0]=4 6536 B11R1.172 CC(C)CNCC1CCCC1 2230a_100000210953_100000740388 [0,0,1,1,0,0|1,0,0]=3 6537 B11R1.172 CC(C)CNCC1CCCC1 2230a_100000737975_100000210760 [0,0,1,1,0,0|1,0,0]=3 6538 B11R1.172 CC(C)CNCC1CCCC1 269862a_100000210953_100000746403 [0,0,1,1,0,0|1,0,0]=3 6539 B11R1.172 CC(C)CNCC1CCCC1 270004a_100000737975_100000210432 [0,0,1,1,0,0|1,0,0]=3 6540 B11R1.172 CC(C)CNCC1CCCC1 34a_100000210953_100000740388 [0,0,1,1,0,0|1,0,0]=3 6541 B11R1.172 CC(C)CNCC1CCCC1 34a_100000737975_100000210624 [0,0,1,1,0,0|1,0,0]=3 6542 B11R1.172 CC(C)CNCC1CCCO1 2230a_100000210953_100000203698 [0,0,1,1,0,0|2,0,0]=4 6543 B11R1.172 CC(C)CNCC1CCOC1 2230a_100000210953_100000702531 [0,0,1,1,0,0|2,0,0]=4 6544 B11R1.172 CC(C)CNCC1CCOC1 2230a_100000737293_100000210760 [0,0,1,1,0,0|2,0,0]=4 6545 B11R1.172 CC(C)CNCC1CCOC1 270004a_100000737293_100000210432 [0,0,1,1,0,0|2,0,0]=4 6546 B11R1.172 CC(C)CNCC1CCOC1 34a_100000210953_100011261433 [0,0,1,1,0,0|2,0,0]=4 6547 B11R1.172 CC(C)CNCC1CCOC1 34a_100000737293_100000210624 [0,0,1,1,0,0|2,0,0]=4 6548 B11R1.172 CC(C)CNC[C@@H]1CCCO1 2230a_100020590478_100000210760 [0,0,1,1,0,0|2,0,0]=4 6549 B11R1.172 CC(C)CNC[C@@H]1CCCO1 270004a_100020590478_100000210432 [0,0,1,1,0,0|2,0,0]=4 6550 B11R1.172 CC(C)CNC[C@@H]1CCCO1 34a_100020590478_100000210624 [0,0,1,1,0,0|2,0,0]=4 6551 B11R1.172 CC(C)COCC1CCCC1 34a_100000210257_100000740388 [0,0,1,1,0,0|2,0,0]=4 6552 B11R1.172 CC(C)COCC1CCCC1 34a_100000742336_100000210624 [0,0,1,1,0,0|2,0,0]=4 6553 B11R1.172 CC(C)COCC1CCCC1 7a_100000742336_100000210760 [0,0,1,1,0,0|2,0,0]=4 6554 B11R1.172 CC(C)CSCC1CCCC1 62a_100000210624_100000740388 [0,0,1,1,0,0|2,0,0]=4 6555 B11R1.172 CC(C)CSCC1CCCC1 62a_100000740388_100000210760 [0,0,1,1,0,0|2,0,0]=4 6556 B11R1.172 CC(F)COCC1CCCC1 34a_100015925927_100000740388 [0,0,1,1,0,0|2,0,0]=4 6557 B11R1.172 CC(O)CCCN1CCCC1 2230a_100000188435_200000718107 [0,0,1,1,0,0|2,0,0]=4 6558 B11R1.172 CC(O)CCCN1CCCC1 269982a_100000188435_200000718107 [0,0,1,1,0,0|2,0,0]=4 6559 B11R1.172 CC(O)CCNC1CCCC1 2230a_100000211070_100012276601 [0,0,1,1,0,0|2,0,0]=4 6560 B11R1.172 CC(O)CCNC1CCCC1 2230a_200000755665_100000179811 [0,0,1,1,0,0|2,0,0]=4 6561 B11R1.172 CC(O)CCNC1CCCC1 270004a_200000755665_100000210133 [0,0,1,1,0,0|2,0,0]=4 6562 B11R1.172 CC(O)CCNC1CCCC1 34a_100000211070_100012276601 [0,0,1,1,0,0|2,0,0]=4 6563 B11R1.172 CC(O)CCOC1CCCC1 34a_100000210269_100012276601 [0,0,1,1,0,0|2,0,0]=4 6564 B11R1.172 CC(O)CCOC1CCCC1 7a_100000210269_100012276601 [0,0,1,1,0,0|2,0,0]=4 6565 B11R1.172 CC(O)CCSC1CCCC1 62a_100011217020_100012276601 [0,0,1,1,0,0|2,0,0]=4 6566 B11R1.172 CC(O)CCSC1CCCC1 62a_100012276601_100000179811 [0,0,1,1,0,0|2,0,0]=4 6567 B11R1.172 CC(O)CNCC1CCCC1 2230a_100000210904_100000740388 [0,0,1,1,0,0|0,0,0]=2 6568 B11R1.172 CC(O)CNCC1CCCC1 2230a_100000737975_100011218427 [0,0,1,1,0,0|0,0,0]=2 6569 B11R1.172 CC(O)CNCC1CCCC1 269862a_100000210904_100000746403 [0,0,1,1,0,0|0,0,0]=2 6570 B11R1.172 CC(O)CNCC1CCCC1 34a_100000210904_100000740388 [0,0,1,1,0,0|0,0,0]=2 6571 B11R1.172 CC(O)CNCC1CCCC1 34a_100000737975_100011218427 [0,0,1,1,0,0|0,0,0]=2 6572 B11R1.172 CC(O)CNCC1CCCO1 2230a_100000210904_100000203698 [0,0,1,1,0,0|1,0,0]=3 6573 B11R1.172 CC(O)CNCC1CCOC1 2230a_100000210904_100000702531 [0,0,1,1,0,0|1,0,0]=3 6574 B11R1.172 CC(O)CNCC1CCOC1 2230a_100000737293_100011218427 [0,0,1,1,0,0|1,0,0]=3 6575 B11R1.172 CC(O)CNCC1CCOC1 34a_100000210904_100011261433 [0,0,1,1,0,0|1,0,0]=3 6576 B11R1.172 CC(O)CNCC1CCOC1 34a_100000737293_100011218427 [0,0,1,1,0,0|1,0,0]=3 6577 B11R1.172 CC(O)CNCC1OCCO1 2230a_100000036311_100011218427 [0,0,1,1,0,0|2,0,0]=4 6578 B11R1.172 CC(O)CNCC1OCCO1 2230a_100000210904_100000755774 [0,0,1,1,0,0|2,0,0]=4 6579 B11R1.172 CC(O)CNCC1OCCO1 34a_100000036311_100011218427 [0,0,1,1,0,0|2,0,0]=4 6580 B11R1.172 CC(O)CNCC1OCCO1 34a_100000210904_100000755774 [0,0,1,1,0,0|2,0,0]=4 6581 B11R1.172 CC(O)CNC[C@@H]1CCCO1 2230a_100020590478_100011218427 [0,0,1,1,0,0|1,0,0]=3 6582 B11R1.172 CC(O)CNC[C@@H]1CCCO1 34a_100020590478_100011218427 [0,0,1,1,0,0|1,0,0]=3 6583 B11R1.172 CC(O)CNN=C1CCCC1 4a_200000730056_100000210133 [0,0,1,1,0,0|1,0,1]=4 6584 B11R1.172 CC(O)COCC1CCCC1 34a_100000742336_100011218427 [0,0,1,1,0,0|1,0,0]=3 6585 B11R1.172 CC(O)COCC1CCCC1 7a_100000742336_100011218427 [0,0,1,1,0,0|1,0,0]=3 6586 B11R1.172 CC(O)COCC1CCCO1 34a_100000210270_100011218427 [0,0,1,1,0,0|2,0,0]=4 6587 B11R1.172 CC(O)COCC1CCCO1 7a_100000210270_100011218427 [0,0,1,1,0,0|2,0,0]=4 6588 B11R1.172 CC(O)COCC1CCNC1 34a_100000748654_100011218427 [0,0,1,1,0,0|2,0,0]=4 6589 B11R1.172 CC(O)COCC1CCOC1 34a_100000740260_100011218427 [0,0,1,1,0,0|2,0,0]=4 6590 B11R1.172 CC(O)COC[C@H]1CCCN1 34a_100000745186_100011218427 [0,0,1,1,0,0|2,0,0]=4 6591 B11R1.172 CC(O)CSCC1CCCC1 62a_100000740388_100011218427 [0,0,1,1,0,0|1,0,0]=3 6592 B11R1.172 CC(O)CSCC1CCCC1 62a_100011218427_100000740388 [0,0,1,1,0,0|1,0,0]=3 6593 B11R1.172 CC(O)CSCC1CCCO1 62a_100000203698_100011218427 [0,0,1,1,0,0|2,0,0]=4 6594 B11R1.172 CC(O)CSCC1CCCO1 62a_100011218427_100000203698 [0,0,1,1,0,0|2,0,0]=4 6595 B11R1.172 CC(O)CSCC1CCOC1 62a_100000702531_100011218427 [0,0,1,1,0,0|2,0,0]=4 6596 B11R1.172 CC(O)CSCC1CCOC1 62a_100011218427_100000702531 [0,0,1,1,0,0|2,0,0]=4 6597 B11R1.172 C[C@@H](Cl)COCC1CCCC1 34a_100016084084_100000740388 [0,0,1,1,0,0|2,0,0]=4 6598 B11R1.172 C[C@@H](N)COCC1CCCC1 34a_100000737577_100000740388 [0,0,1,1,0,0|2,0,0]=4 6599 B11R1.172 C[C@@H](O)CNCC1CCCC1 2230a_100000737975_100009817552 [0,0,1,1,0,0|0,0,0]=2 6600 B11R1.172 C[C@@H](O)CNCC1CCCC1 34a_100000737975_100009817552 [0,0,1,1,0,0|0,0,0]=2 6601 B11R1.172 C[C@@H](O)CNCC1CCOC1 2230a_100000737293_100009817552 [0,0,1,1,0,0|1,0,0]=3 6602 B11R1.172 C[C@@H](O)CNCC1CCOC1 34a_100000737293_100009817552 [0,0,1,1,0,0|1,0,0]=3 6603 B11R1.172 C[C@@H](O)CNCC1OCCO1 2230a_100000036311_100009817552 [0,0,1,1,0,0|2,0,0]=4 6604 B11R1.172 C[C@@H](O)CNCC1OCCO1 34a_100000036311_100009817552 [0,0,1,1,0,0|2,0,0]=4 6605 B11R1.172 C[C@@H](O)CNC[C@@H]1CCCO1 2230a_100020590478_100009817552 [0,0,1,1,0,0|1,0,0]=3 6606 B11R1.172 C[C@@H](O)CNC[C@@H]1CCCO1 34a_100020590478_100009817552 [0,0,1,1,0,0|1,0,0]=3 6607 B11R1.172 C[C@@H](O)COCC1CCCC1 34a_100000742336_100009817552 [0,0,1,1,0,0|1,0,0]=3 6608 B11R1.172 C[C@@H](O)COCC1CCCC1 7a_100000742336_100009817552 [0,0,1,1,0,0|1,0,0]=3 6609 B11R1.172 C[C@@H](O)COCC1CCCO1 34a_100000210270_100009817552 [0,0,1,1,0,0|2,0,0]=4 6610 B11R1.172 C[C@@H](O)COCC1CCCO1 7a_100000210270_100009817552 [0,0,1,1,0,0|2,0,0]=4 6611 B11R1.172 C[C@@H](O)COCC1CCNC1 34a_100000748654_100009817552 [0,0,1,1,0,0|2,0,0]=4 6612 B11R1.172 C[C@@H](O)COCC1CCOC1 34a_100000740260_100009817552 [0,0,1,1,0,0|2,0,0]=4 6613 B11R1.172 C[C@@H](O)COC[C@H]1CCCN1 34a_100000745186_100009817552 [0,0,1,1,0,0|2,0,0]=4 6614 B11R1.172 C[C@@H](O)CSCC1CCCC1 62a_100000740388_100009817552 [0,0,1,1,0,0|1,0,0]=3 6615 B11R1.172 C[C@@H](O)CSCC1CCCC1 62a_100009817552_100000740388 [0,0,1,1,0,0|1,0,0]=3 6616 B11R1.172 C[C@@H](O)CSCC1CCCO1 62a_100000203698_100009817552 [0,0,1,1,0,0|2,0,0]=4 6617 B11R1.172 C[C@@H](O)CSCC1CCCO1 62a_100009817552_100000203698 [0,0,1,1,0,0|2,0,0]=4 6618 B11R1.172 C[C@@H](O)CSCC1CCOC1 62a_100000702531_100009817552 [0,0,1,1,0,0|2,0,0]=4 6619 B11R1.172 C[C@@H](O)CSCC1CCOC1 62a_100009817552_100000702531 [0,0,1,1,0,0|2,0,0]=4 6620 B11R1.172 FC(F)CNCC1CCCC1 2230a_100000737975_100011934356 [0,0,1,1,0,0|2,0,0]=4 6621 B11R1.172 FC(F)CNCC1CCCC1 34a_100000737975_100011934356 [0,0,1,1,0,0|2,0,0]=4 6622 B11R1.172 FC(F)CNCC1CCCC1 34a_100000765723_100000740388 [0,0,1,1,0,0|2,0,0]=4 6623 B11R1.172 O=C(O)CNCC1CCCC1 269956a_100016091260_100000740388 [0,0,1,1,0,0|1,0,1]=4 6624 B11R1.174 CC(O)CCCNC1CCC1 2230a_100000749019_200000718107 [0,0,1,1,0,0|2,0,0]=4 6625 B11R1.174 CC(O)CCCNC1CCC1 34a_100000749019_200000718107 [0,0,1,1,0,0|2,0,0]=4 6626 B11R1.174 CC(O)CCCOC1CCC1 34a_100000748187_200000718107 [0,0,1,1,0,0|2,0,0]=4 6627 B11R1.174 CC(O)CCCSC1CCC1 62a_200000718107_100000749161 [0,0,1,1,0,0|2,0,0]=4 6628 B11R1.174 CC(O)CCNCC1CCC1 2230a_100000738700_100012276601 [0,0,1,1,0,0|2,0,0]=4 6629 B11R1.174 CC(O)CCNCC1CCC1 2230a_200000755665_100000763275 [0,0,1,1,0,0|2,0,0]=4 6630 B11R1.174 CC(O)CCNCC1CCC1 269862a_200000755665_100000753134 [0,0,1,1,0,0|2,0,0]=4 6631 B11R1.174 CC(O)CCNCC1CCC1 34a_100000738700_100012276601 [0,0,1,1,0,0|2,0,0]=4 6632 B11R1.174 CC(O)CCOCC1CCC1 34a_100000760304_100012276601 [0,0,1,1,0,0|2,0,0]=4 6633 B11R1.174 CC(O)CCSCC1CCC1 62a_100000763275_100012276601 [0,0,1,1,0,0|2,0,0]=4 6634 B11R1.174 CC(O)CCSCC1CCC1 62a_100012276601_100000763275 [0,0,1,1,0,0|2,0,0]=4 6635 B11R1.174 CC(O)CNN=CC1CCC1 4a_200000730056_100000753134 [0,0,1,1,0,0|1,0,1]=4 6636 B11R1.174 CC(O)COCCC1COC1 34a_100009855314_100011218427 [0,0,1,1,0,0|2,0,0]=4 6637 B11R1.174 C[C@@H](O)COCCC1COC1 34a_100009855314_100009817552 [0,0,1,1,0,0|2,0,0]=4 6638 B11R1.176 CC(C)CNCCCC1CO1 2230a_100000210953_100000733510 [0,0,1,1,0,0|2,0,0]=4 6639 B11R1.176 CC(C)CNCCCC1CO1 34a_100000210953_100000733510 [0,0,1,1,0,0|2,0,0]=4 6640 B11R1.176 CC(C)CNCCOC1CC1 34a_100015185251_100000211595 [0,0,1,1,0,0|2,0,0]=4 6641 B11R1.176 CC(O)CCCNCC1CC1 2230a_100000735609_200000718107 [0,0,1,1,0,0|2,0,0]=4 6642 B11R1.176 CC(O)CCCNCC1CC1 34a_100000735609_200000718107 [0,0,1,1,0,0|2,0,0]=4 6643 B11R1.176 CC(O)CCCOCC1CC1 34a_100000211283_200000718107 [0,0,1,1,0,0|2,0,0]=4 6644 B11R1.176 CC(O)CCCSCC1CC1 62a_100000756562_200000718107 [0,0,1,1,0,0|2,0,0]=4 6645 B11R1.176 CC(O)CCCSCC1CC1 62a_200000718107_100000742324 [0,0,1,1,0,0|2,0,0]=4 6646 B11R1.176 CC(O)CCNCCC1CC1 2230a_200000755665_100000694398 [0,0,1,1,0,0|2,0,0]=4 6647 B11R1.176 CC(O)CCNCCC1CC1 34a_100000764129_100012276601 [0,0,1,1,0,0|2,0,0]=4 6648 B11R1.176 CC(O)CCOCCC1CC1 34a_100000754188_100012276601 [0,0,1,1,0,0|2,0,0]=4 6649 B11R1.176 CC(O)CCOCCC1CC1 7a_100000754188_100012276601 [0,0,1,1,0,0|2,0,0]=4 6650 B11R1.176 CC(O)CCSCCC1CC1 62a_100000764125_100012276601 [0,0,1,1,0,0|2,0,0]=4 6651 B11R1.176 CC(O)CCSCCC1CC1 62a_100012276601_100000764125 [0,0,1,1,0,0|2,0,0]=4 6652 B11R1.176 CC(O)CNCC#CC1CC1 2230a_100000210904_100009895102 [0,0,1,1,0,0|0,0,2]=4 6653 B11R1.176 CC(O)CNCC#CC1CC1 34a_100000210904_100009895102 [0,0,1,1,0,0|0,0,2]=4 6654 B11R1.176 CC(O)CNCCCC1CO1 2230a_100000210904_100000733510 [0,0,1,1,0,0|1,0,0]=3 6655 B11R1.176 CC(O)CNCCCC1CO1 34a_100000210904_100000733510 [0,0,1,1,0,0|1,0,0]=3 6656 B11R1.176 CC(O)COCCNC1CC1 34a_100000738766_100011218427 [0,0,1,1,0,0|2,0,0]=4 6657 B11R1.176 CC(O)CSCCCC1CO1 62a_100000733510_100011218427 [0,0,1,1,0,0|2,0,0]=4 6658 B11R1.176 CC(O)CSCCCC1CO1 62a_100011218427_100000733510 [0,0,1,1,0,0|2,0,0]=4 6659 B11R1.176 C[C@@H](O)COCCNC1CC1 34a_100000738766_100009817552 [0,0,1,1,0,0|2,0,0]=4 6660 B11R1.176 C[C@@H](O)CSCCCC1CO1 62a_100000733510_100009817552 [0,0,1,1,0,0|2,0,0]=4 6661 B11R1.176 C[C@@H](O)CSCCCC1CO1 62a_100009817552_100000733510 [0,0,1,1,0,0|2,0,0]=4 6662 B11R1.191 CCNC1CCNCC1(C)C 269862a_100015525214_100015191249 [0,0,1,1,0,0|2,0,0]=4 6663 B11R1.191 CCOC1CCNCC1(C)C 34a_100000709803_100000210202 [0,0,1,1,0,0|2,0,0]=4 6664 B11R1.233 CCCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100000210303 [0,0,1,1,0,0|2,0,0]=4 6665 B11R1.233 CCCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100000210303 [0,0,1,1,0,0|2,0,0]=4 6666 B11R1.38 CCN1CCN(CC1(C)C)C 2230a_100011886065_200000210301 [0,0,1,1,0,0|2,0,0]=4 6667 B11R1.38 CCN1CCN(CC1(C)C)C 2230a_200000695439_100000210202 [0,0,1,1,0,0|2,0,0]=4 6668 B11R1.38 CCN1CCN(CC1(C)C)C 269982a_100011886065_200000210301 [0,0,1,1,0,0|2,0,0]=4 6669 B11R1.38 CCN1CCN(CC1(C)C)C 269982a_200000695439_100000204670 [0,0,1,1,0,0|2,0,0]=4 6670 B11R1.38 CCN1CCN(CC1(C)C)[13CH3] 2230a_100011886065_200025704644 [0,0,1,1,0,0|2,0,0]=4 6671 B11R1.38 CCN1CCN(CC1(C)C)[13CH3] 269982a_100011886065_200025704644 [0,0,1,1,0,0|2,0,0]=4 6672 B11R1.38 COC1CCN(CC1(C)C)C 2230a_100015203941_200000210301 [0,0,1,1,0,0|2,0,0]=4 6673 B11R1.38 COC1CCN(CC1(C)C)C 269982a_100015203941_200000210301 [0,0,1,1,0,0|2,0,0]=4 6674 B11R1.38 COC1CCN(CC1(C)C)C 34a_100015203941_200000210301 [0,0,1,1,0,0|2,0,0]=4 6675 B11R1.38 COC1CCN(CC1(C)C)[13CH3] 2230a_100015203941_200025704644 [0,0,1,1,0,0|2,0,0]=4 6676 B11R1.38 COC1CCN(CC1(C)C)[13CH3] 269982a_100015203941_200025704644 [0,0,1,1,0,0|2,0,0]=4 6677 B11R1.38 COC1CCN(CC1(C)C)[13CH3] 34a_100015203941_200025704644 [0,0,1,1,0,0|2,0,0]=4 6678 B11R1.43 CC(C)CN1CCC(C1)CO 2230a_100000748654_100000210760 [0,0,1,1,0,0|2,0,0]=4 6679 B11R1.43 CC(C)CN1CCC(C1)CO 269982a_100000748654_100000210624 [0,0,1,1,0,0|2,0,0]=4 6680 B11R1.43 CC(C)CN1CCC(C1)CO 270004a_100000748654_100000210432 [0,0,1,1,0,0|2,0,0]=4 6681 B11R1.43 CC(C)CN1CCC(C1)CO 34a_100000748654_100000210624 [0,0,1,1,0,0|2,0,0]=4 6682 B11R1.43 CC(O)CN1CCC(C1)C#N 2230a_100016989334_100011218427 [0,0,1,1,0,0|1,0,1]=4 6683 B11R1.43 CC(O)CN1CCC(C1)CO 2230a_100000748654_100011218427 [0,0,1,1,0,0|1,0,0]=3 6684 B11R1.43 CC(O)CN1CCC(C1)CO 269982a_100000748654_100011218427 [0,0,1,1,0,0|1,0,0]=3 6685 B11R1.43 CC(O)CN1CCC(C1)CO 34a_100000748654_100011218427 [0,0,1,1,0,0|1,0,0]=3 6686 B11R1.43 CO[C@@H]1CCN(C1)CC(C)C 2230a_100000766984_100000210760 [0,0,1,1,0,0|2,0,0]=4 6687 B11R1.43 CO[C@@H]1CCN(C1)CC(C)C 269982a_100000766984_100000210624 [0,0,1,1,0,0|2,0,0]=4 6688 B11R1.43 CO[C@@H]1CCN(C1)CC(C)C 270004a_100000766984_100000210432 [0,0,1,1,0,0|2,0,0]=4 6689 B11R1.43 CO[C@@H]1CCN(C1)CC(C)O 2230a_100000766984_100011218427 [0,0,1,1,0,0|1,0,0]=3 6690 B11R1.43 CO[C@@H]1CCN(C1)CC(C)O 269982a_100000766984_100011218427 [0,0,1,1,0,0|1,0,0]=3 6691 B11R1.43 CO[C@@H]1CCN(C1)C[C@@H](C)O 2230a_100000766984_100009817552 [0,0,1,1,0,0|1,0,0]=3 6692 B11R1.43 CO[C@@H]1CCN(C1)C[C@@H](C)O 269982a_100000766984_100009817552 [0,0,1,1,0,0|1,0,0]=3 6693 B11R1.43 C[C@@H](O)CN1CCC(C1)C#N 2230a_100016989334_100009817552 [0,0,1,1,0,0|1,0,1]=4 6694 B11R1.43 C[C@@H](O)CN1CCC(C1)CO 2230a_100000748654_100009817552 [0,0,1,1,0,0|1,0,0]=3 6695 B11R1.43 C[C@@H](O)CN1CCC(C1)CO 269982a_100000748654_100009817552 [0,0,1,1,0,0|1,0,0]=3 6696 B11R1.43 C[C@@H](O)CN1CCC(C1)CO 34a_100000748654_100009817552 [0,0,1,1,0,0|1,0,0]=3 6697 B11R1.77 C=C(C)CN(C)C1CCCC1 2230a_100000207505_100000748629 [0,0,1,1,0,0|1,0,1]=4 6698 B11R1.77 C=C(C)CN(C)C1CCCC1 2230a_100000225649_100000179811 [0,0,1,1,0,0|1,0,1]=4 6699 B11R1.77 C=C(C)CN(C)C1CCCC1 269982a_100000207505_100000748629 [0,0,1,1,0,0|1,0,1]=4 6700 B11R1.77 C=C(C)CN(C)C1CCCC1 269982a_100000225649_100000179811 [0,0,1,1,0,0|1,0,1]=4 6701 B11R1.77 C=C(C)CN(C)C1CCCC1 270004a_100000225649_100000210133 [0,0,1,1,0,0|1,0,1]=4 6702 B11R1.77 C=C(C)CN(C)C1CCCC1 34a_100000207505_100000748629 [0,0,1,1,0,0|1,0,1]=4 6703 B11R1.77 CC(=O)CN(C)C1CCCC1 1458a_100073796569_200000210301 [0,0,1,1,0,0|0,0,2]=4 6704 B11R1.77 CC(C)CN(C)C1CCCC1 2230a_100000207505_100000210760 [0,0,1,1,0,0|1,0,0]=3 6705 B11R1.77 CC(C)CN(C)C1CCCC1 2230a_100000747067_100000179811 [0,0,1,1,0,0|1,0,0]=3 6706 B11R1.77 CC(C)CN(C)C1CCCC1 269982a_100000207505_100000210624 [0,0,1,1,0,0|1,0,0]=3 6707 B11R1.77 CC(C)CN(C)C1CCCC1 269982a_100000747067_100000179811 [0,0,1,1,0,0|1,0,0]=3 6708 B11R1.77 CC(C)CN(C)C1CCCC1 270004a_100000207505_100000210432 [0,0,1,1,0,0|1,0,0]=3 6709 B11R1.77 CC(C)CN(C)C1CCCC1 270004a_100000747067_100000210133 [0,0,1,1,0,0|1,0,0]=3 6710 B11R1.77 CC(C)CN(C)C1CCCC1 34a_100000207505_100000210624 [0,0,1,1,0,0|1,0,0]=3 6711 B11R1.77 CC(C)CN(C)C1CCOC1 2230a_100000747067_100000731011 [0,0,1,1,0,0|2,0,0]=4 6712 B11R1.77 CC(C)CN(C)C1CCOC1 2230a_100016988252_100000210760 [0,0,1,1,0,0|2,0,0]=4 6713 B11R1.77 CC(C)CN(C)C1CCOC1 269982a_100000747067_100000731011 [0,0,1,1,0,0|2,0,0]=4 6714 B11R1.77 CC(C)CN(C)C1CCOC1 269982a_100016988252_100000210624 [0,0,1,1,0,0|2,0,0]=4 6715 B11R1.77 CC(C)CN(C)C1CCOC1 270004a_100000747067_100000752484 [0,0,1,1,0,0|2,0,0]=4 6716 B11R1.77 CC(C)CN(C)C1CCOC1 270004a_100016988252_100000210432 [0,0,1,1,0,0|2,0,0]=4 6717 B11R1.77 CC(C)CN(C)C1CCOC1 34a_100016988252_100000210624 [0,0,1,1,0,0|2,0,0]=4 6718 B11R1.77 CC(C)CN(C)C1CCSC1 270004a_100000747067_100000212027 [0,0,1,1,0,0|2,0,0]=4 6719 B11R1.77 CC(O)CC(=O)C1CCCC1 1458a_100000210718_100011218427 [0,0,1,1,0,0|2,0,0]=4 6720 B11R1.77 CC(O)CN(C)C1CCCC1 2230a_100000207505_100011218427 [0,0,1,1,0,0|0,0,0]=2 6721 B11R1.77 CC(O)CN(C)C1CCCC1 2230a_100000227577_100000179811 [0,0,1,1,0,0|0,0,0]=2 6722 B11R1.77 CC(O)CN(C)C1CCCC1 269982a_100000207505_100011218427 [0,0,1,1,0,0|0,0,0]=2 6723 B11R1.77 CC(O)CN(C)C1CCCC1 269982a_100000227577_100000179811 [0,0,1,1,0,0|0,0,0]=2 6724 B11R1.77 CC(O)CN(C)C1CCCC1 270004a_100000227577_100000210133 [0,0,1,1,0,0|0,0,0]=2 6725 B11R1.77 CC(O)CN(C)C1CCCC1 34a_100000207505_100011218427 [0,0,1,1,0,0|0,0,0]=2 6726 B11R1.77 CC(O)CN(C)C1CCOC1 2230a_100000227577_100000731011 [0,0,1,1,0,0|1,0,0]=3 6727 B11R1.77 CC(O)CN(C)C1CCOC1 2230a_100016988252_100011218427 [0,0,1,1,0,0|1,0,0]=3 6728 B11R1.77 CC(O)CN(C)C1CCOC1 269982a_100000227577_100000731011 [0,0,1,1,0,0|1,0,0]=3 6729 B11R1.77 CC(O)CN(C)C1CCOC1 269982a_100016988252_100011218427 [0,0,1,1,0,0|1,0,0]=3 6730 B11R1.77 CC(O)CN(C)C1CCOC1 270004a_100000227577_100000752484 [0,0,1,1,0,0|1,0,0]=3 6731 B11R1.77 CC(O)CN(C)C1CCOC1 34a_100016988252_100011218427 [0,0,1,1,0,0|1,0,0]=3 6732 B11R1.77 CC(O)CN(C)C1CCSC1 270004a_100000227577_100000212027 [0,0,1,1,0,0|1,0,0]=3 6733 B11R1.77 CN(CC(=O)O)C1CCCC1 269956a_100000746989_100000179811 [0,0,1,1,0,0|1,0,1]=4 6734 B11R1.77 CN(CC(=O)[13CH3])C1CCCC1 1458a_100073796569_200025704644 [0,0,1,1,0,0|0,0,2]=4 6735 B11R1.77 CN(CC(F)F)C1CCCC1 2230a_100000207505_100011934356 [0,0,1,1,0,0|2,0,0]=4 6736 B11R1.77 CN(CC(F)F)C1CCCC1 269982a_100000207505_100011934356 [0,0,1,1,0,0|2,0,0]=4 6737 B11R1.77 CN(CC(F)F)C1CCCC1 34a_100000207505_100011934356 [0,0,1,1,0,0|2,0,0]=4 6738 B11R1.77 C[C@@H](O)CC(=O)C1CCCC1 1458a_100011933948_100000179811 [0,0,1,1,0,0|2,0,0]=4 6739 B11R1.77 C[C@@H](O)CN(C)C1CCCC1 2230a_100000207505_100009817552 [0,0,1,1,0,0|0,0,0]=2 6740 B11R1.77 C[C@@H](O)CN(C)C1CCCC1 269982a_100000207505_100009817552 [0,0,1,1,0,0|0,0,0]=2 6741 B11R1.77 C[C@@H](O)CN(C)C1CCCC1 34a_100000207505_100009817552 [0,0,1,1,0,0|0,0,0]=2 6742 B11R1.77 C[C@@H](O)CN(C)C1CCOC1 2230a_100016988252_100009817552 [0,0,1,1,0,0|1,0,0]=3 6743 B11R1.77 C[C@@H](O)CN(C)C1CCOC1 269982a_100016988252_100009817552 [0,0,1,1,0,0|1,0,0]=3 6744 B11R1.77 C[C@@H](O)CN(C)C1CCOC1 34a_100016988252_100009817552 [0,0,1,1,0,0|1,0,0]=3 6745 B11R1.120 CC(O)CN1CC(C1)CC#N 269982a_206645079572_100011218427 [0,0,1,1,0,0|1,0,1]=4 6746 B11R1.120 CCOC1CN(C1)CC(C)C 269982a_100000732654_100000210624 [0,0,1,1,0,0|2,0,0]=4 6747 B11R1.120 CCOC1CN(C1)CC(C)C 270004a_100000732654_100000210432 [0,0,1,1,0,0|2,0,0]=4 6748 B11R1.120 CCOC1CN(C1)CC(C)C 34a_100000732654_100000210624 [0,0,1,1,0,0|2,0,0]=4 6749 B11R1.120 CCOC1CN(C1)CC(C)O 269982a_100000732654_100011218427 [0,0,1,1,0,0|1,0,0]=3 6750 B11R1.120 CCOC1CN(C1)CC(C)O 34a_100000732654_100011218427 [0,0,1,1,0,0|1,0,0]=3 6751 B11R1.120 CCOC1CN(C1)C[C@@H](C)O 269982a_100000732654_100009817552 [0,0,1,1,0,0|1,0,0]=3 6752 B11R1.120 CCOC1CN(C1)C[C@@H](C)O 34a_100000732654_100009817552 [0,0,1,1,0,0|1,0,0]=3 6753 B11R1.120 COCC1CN(C1)CC(C)C 2230a_100016993750_100000210760 [0,0,1,1,0,0|2,0,0]=4 6754 B11R1.120 COCC1CN(C1)CC(C)C 269982a_100016993750_100000210624 [0,0,1,1,0,0|2,0,0]=4 6755 B11R1.120 COCC1CN(C1)CC(C)C 270004a_100016993750_100000210432 [0,0,1,1,0,0|2,0,0]=4 6756 B11R1.120 COCC1CN(C1)CC(C)C 34a_100016993750_100000210624 [0,0,1,1,0,0|2,0,0]=4 6757 B11R1.120 COCC1CN(C1)CC(C)O 2230a_100016993750_100011218427 [0,0,1,1,0,0|1,0,0]=3 6758 B11R1.120 COCC1CN(C1)CC(C)O 269982a_100016993750_100011218427 [0,0,1,1,0,0|1,0,0]=3 6759 B11R1.120 COCC1CN(C1)CC(C)O 34a_100016993750_100011218427 [0,0,1,1,0,0|1,0,0]=3 6760 B11R1.120 COCC1CN(C1)C[C@@H](C)O 2230a_100016993750_100009817552 [0,0,1,1,0,0|1,0,0]=3 6761 B11R1.120 COCC1CN(C1)C[C@@H](C)O 269982a_100016993750_100009817552 [0,0,1,1,0,0|1,0,0]=3 6762 B11R1.120 COCC1CN(C1)C[C@@H](C)O 34a_100016993750_100009817552 [0,0,1,1,0,0|1,0,0]=3 6763 B11R1.120 C[C@@H](O)CN1CC(C1)CC#N 269982a_206645079572_100009817552 [0,0,1,1,0,0|1,0,1]=4 6764 B11R1.141 CC(O)CN(C)C1CCC1=O 269982a_100000227577_100009892977 [0,0,1,1,0,0|1,0,1]=4 6765 B11R1.257 CCC1CC1C(=O)CC(C)O 1458a_200011661523_100011218427 [0,0,1,1,0,0|2,0,0]=4 6766 B11R1.301 CCCCCC(=O)CC1CO1 1458a_100000212188_100011216344 [0,0,1,1,0,0|2,0,0]=4 6767 B11R1.301 CCCCCC(=O)C[C@@H]1CO1 1458a_100000212188_100000745022 [0,0,1,1,0,0|2,0,0]=4 6768 B11R1.301 CCCCCN(C)CC1CC1 2230a_100000223495_100000742324 [0,0,1,1,0,0|1,0,0]=3 6769 B11R1.301 CCCCCN(C)CC1CC1 2230a_100000741881_100000210326 [0,0,1,1,0,0|1,0,0]=3 6770 B11R1.301 CCCCCN(C)CC1CC1 269982a_100000223495_100000756562 [0,0,1,1,0,0|1,0,0]=3 6771 B11R1.301 CCCCCN(C)CC1CC1 269982a_100000741881_100000210215 [0,0,1,1,0,0|1,0,0]=3 6772 B11R1.301 CCCCCN(C)CC1CO1 2230a_100000223495_100011216344 [0,0,1,1,0,0|0,0,0]=2 6773 B11R1.301 CCCCCN(C)CC1CO1 269982a_100000223495_102125554688 [0,0,1,1,0,0|0,0,0]=2 6774 B11R1.301 CCCCCN(C)CC1CS1 269982a_100000223495_100000031435 [0,0,1,1,0,0|0,1,0]=3 6775 B11R1.301 CCCCCN(C)C[C@@H]1CO1 269982a_100000223495_100000745022 [0,0,1,1,0,0|0,0,0]=2 6776 B11R1.301 CCOCCN(C)CC1CC1 2230a_100000741881_100011215890 [0,0,1,1,0,0|2,0,0]=4 6777 B11R1.301 CCOCCN(C)CC1CC1 269982a_100000741881_100011215890 [0,0,1,1,0,0|2,0,0]=4 6778 B11R1.301 CCSCCN(C)CC1CC1 2230a_100000741881_100000757381 [0,0,1,1,0,0|2,0,0]=4 6779 B11R1.301 CCSCCN(C)CC1CC1 269982a_100000741881_100000757381 [0,0,1,1,0,0|2,0,0]=4 6780 B11R1.301 CN(CCCCF)CC1CC1 2230a_100000741881_100000729493 [0,0,1,1,0,0|2,0,0]=4 6781 B11R1.301 CN(CCCCF)CC1CC1 269982a_100000741881_100000729493 [0,0,1,1,0,0|2,0,0]=4 6782 B11R1.301 CN(CCCCO)CC1CC1 2230a_100000717598_100000742324 [0,0,1,1,0,0|2,0,0]=4 6783 B11R1.301 CN(CCCCO)CC1CC1 2230a_100000741881_100000210776 [0,0,1,1,0,0|2,0,0]=4 6784 B11R1.301 CN(CCCCO)CC1CC1 269982a_100000717598_100000756562 [0,0,1,1,0,0|2,0,0]=4 6785 B11R1.301 CN(CCCCO)CC1CC1 269982a_100000741881_100000210776 [0,0,1,1,0,0|2,0,0]=4 6786 B11R1.301 CN(CCCCO)CC1CO1 2230a_100000717598_100011216344 [0,0,1,1,0,0|1,0,0]=3 6787 B11R1.301 CN(CCCCO)CC1CO1 269982a_100000717598_102125554688 [0,0,1,1,0,0|1,0,0]=3 6788 B11R1.301 CN(CCCCO)CC1CS1 269982a_100000717598_100000031435 [0,0,1,1,0,0|1,1,0]=4 6789 B11R1.301 CN(CCCCO)C[C@@H]1CO1 269982a_100000717598_100000745022 [0,0,1,1,0,0|1,0,0]=3 6790 B11R1.301 COCCCN(C)CC1CC1 2230a_100000224831_100000742324 [0,0,1,1,0,0|2,0,0]=4 6791 B11R1.301 COCCCN(C)CC1CC1 2230a_100000741881_100000740836 [0,0,1,1,0,0|2,0,0]=4 6792 B11R1.301 COCCCN(C)CC1CC1 269982a_100000224831_100000756562 [0,0,1,1,0,0|2,0,0]=4 6793 B11R1.301 COCCCN(C)CC1CC1 269982a_100000741881_100000740836 [0,0,1,1,0,0|2,0,0]=4 6794 B11R1.301 COCCCN(C)CC1CO1 2230a_100000224831_100011216344 [0,0,1,1,0,0|1,0,0]=3 6795 B11R1.301 COCCCN(C)CC1CO1 269982a_100000224831_102125554688 [0,0,1,1,0,0|1,0,0]=3 6796 B11R1.301 COCCCN(C)CC1CS1 269982a_100000224831_100000031435 [0,0,1,1,0,0|1,1,0]=4 6797 B11R1.301 COCCCN(C)C[C@@H]1CO1 269982a_100000224831_100000745022 [0,0,1,1,0,0|1,0,0]=3 6798 B11R1.484 C=C(C)CN(C)CC1CCC1 2230a_100000225649_100000763275 [0,0,1,1,0,0|1,0,1]=4 6799 B11R1.484 C=C(C)CN(C)CC1CCC1 2230a_200000750244_100000748629 [0,0,1,1,0,0|1,0,1]=4 6800 B11R1.484 C=C(C)CN(C)CC1CCC1 269982a_100000225649_100000763275 [0,0,1,1,0,0|1,0,1]=4 6801 B11R1.484 C=C(C)CN(C)CC1CCC1 269982a_200000750244_100000748629 [0,0,1,1,0,0|1,0,1]=4 6802 B11R1.484 C=C(C)CN(C)CC1CCC1 34a_200000750244_100000748629 [0,0,1,1,0,0|1,0,1]=4 6803 B11R1.484 CC(C)CN(C)CC1CCC1 2230a_100000747067_100000763275 [0,0,1,1,0,0|1,0,0]=3 6804 B11R1.484 CC(C)CN(C)CC1CCC1 2230a_200000750244_100000210760 [0,0,1,1,0,0|1,0,0]=3 6805 B11R1.484 CC(C)CN(C)CC1CCC1 269982a_100000747067_100000763275 [0,0,1,1,0,0|1,0,0]=3 6806 B11R1.484 CC(C)CN(C)CC1CCC1 269982a_200000750244_100000210624 [0,0,1,1,0,0|1,0,0]=3 6807 B11R1.484 CC(C)CN(C)CC1CCC1 270004a_200000750244_100000210432 [0,0,1,1,0,0|1,0,0]=3 6808 B11R1.484 CC(C)CN(C)CC1CCC1 34a_200000750244_100000210624 [0,0,1,1,0,0|1,0,0]=3 6809 B11R1.484 CC(C)CN(C)CC1CCO1 2230a_100000747067_100000103362 [0,0,1,1,0,0|2,0,0]=4 6810 B11R1.484 CC(C)CN(C)CC1CCO1 269982a_100000747067_100000103362 [0,0,1,1,0,0|2,0,0]=4 6811 B11R1.484 CC(C)CN(C)CC1COC1 2230a_100000747067_100010264016 [0,0,1,1,0,0|2,0,0]=4 6812 B11R1.484 CC(C)CN(C)CC1COC1 269982a_100000747067_100010264016 [0,0,1,1,0,0|2,0,0]=4 6813 B11R1.484 CC(O)CC(=O)CC1CCC1 1458a_100000763092_100011218427 [0,0,1,1,0,0|2,0,0]=4 6814 B11R1.484 CC(O)CN(C)CC1CCC1 2230a_100000227577_100000763275 [0,0,1,1,0,0|0,0,0]=2 6815 B11R1.484 CC(O)CN(C)CC1CCC1 2230a_200000750244_100011218427 [0,0,1,1,0,0|0,0,0]=2 6816 B11R1.484 CC(O)CN(C)CC1CCC1 269982a_100000227577_100000763275 [0,0,1,1,0,0|0,0,0]=2 6817 B11R1.484 CC(O)CN(C)CC1CCC1 269982a_200000750244_100011218427 [0,0,1,1,0,0|0,0,0]=2 6818 B11R1.484 CC(O)CN(C)CC1CCC1 34a_200000750244_100011218427 [0,0,1,1,0,0|0,0,0]=2 6819 B11R1.484 CC(O)CN(C)CC1CCO1 2230a_100000227577_100000103362 [0,0,1,1,0,0|1,0,0]=3 6820 B11R1.484 CC(O)CN(C)CC1CCO1 269982a_100000227577_100000103362 [0,0,1,1,0,0|1,0,0]=3 6821 B11R1.484 CC(O)CN(C)CC1COC1 2230a_100000227577_100010264016 [0,0,1,1,0,0|1,0,0]=3 6822 B11R1.484 CC(O)CN(C)CC1COC1 269982a_100000227577_100010264016 [0,0,1,1,0,0|1,0,0]=3 6823 B11R1.484 CN(CC(=O)O)CC1CCC1 269956a_100000746989_100000763275 [0,0,1,1,0,0|1,0,1]=4 6824 B11R1.484 CN(CC(F)F)CC1CCC1 2230a_200000750244_100011934356 [0,0,1,1,0,0|2,0,0]=4 6825 B11R1.484 CN(CC(F)F)CC1CCC1 269982a_200000750244_100011934356 [0,0,1,1,0,0|2,0,0]=4 6826 B11R1.484 CN(CC(F)F)CC1CCC1 34a_200000750244_100011934356 [0,0,1,1,0,0|2,0,0]=4 6827 B11R1.484 C[C@@H](O)CC(=O)CC1CCC1 1458a_100011933948_100000763275 [0,0,1,1,0,0|2,0,0]=4 6828 B11R1.484 C[C@@H](O)CN(C)CC1CCC1 2230a_200000750244_100009817552 [0,0,1,1,0,0|0,0,0]=2 6829 B11R1.484 C[C@@H](O)CN(C)CC1CCC1 269982a_200000750244_100009817552 [0,0,1,1,0,0|0,0,0]=2 6830 B11R1.484 C[C@@H](O)CN(C)CC1CCC1 34a_200000750244_100009817552 [0,0,1,1,0,0|0,0,0]=2 6831 B11R1.485 C=C(C)CN(C)CCC1CC1 2230a_100000225649_100000694398 [0,0,1,1,0,0|1,0,1]=4 6832 B11R1.485 C=C(C)CN(C)CCC1CC1 269982a_100000225649_100000694398 [0,0,1,1,0,0|1,0,1]=4 6833 B11R1.485 CC(C)CN(C)CCC1CC1 2230a_100000747067_100000694398 [0,0,1,1,0,0|1,0,0]=3 6834 B11R1.485 CC(C)CN(C)CCC1CC1 269982a_100000747067_100000694398 [0,0,1,1,0,0|1,0,0]=3 6835 B11R1.485 CC(C)CN(C)CCC1CO1 2230a_100000747067_100000732470 [0,0,1,1,0,0|2,0,0]=4 6836 B11R1.485 CC(C)CN(C)CCC1CO1 269982a_100000747067_100000732470 [0,0,1,1,0,0|2,0,0]=4 6837 B11R1.485 CC(O)CC(=O)CCC1CC1 1458a_100000756386_100011218427 [0,0,1,1,0,0|2,0,0]=4 6838 B11R1.485 CC(O)CN(C)CCC1CC1 2230a_100000227577_100000694398 [0,0,1,1,0,0|0,0,0]=2 6839 B11R1.485 CC(O)CN(C)CCC1CC1 269982a_100000227577_100000694398 [0,0,1,1,0,0|0,0,0]=2 6840 B11R1.485 CC(O)CN(C)CCC1CO1 2230a_100000227577_100000732470 [0,0,1,1,0,0|1,0,0]=3 6841 B11R1.485 CC(O)CN(C)CCC1CO1 269982a_100000227577_100000732470 [0,0,1,1,0,0|1,0,0]=3 6842 B11R1.485 CN(CCC1CC1)CC(=O)O 269956a_100000746989_100000694398 [0,0,1,1,0,0|1,0,1]=4 6843 B11R1.485 C[C@@H](O)CC(=O)CCC1CC1 1458a_100011933948_100000694398 [0,0,1,1,0,0|2,0,0]=4 6844 B11R1.758 C#CCCCN1CC(C1)(C)O 2230a_100000718560_100000731252 [0,0,1,1,0,0|0,0,2]=4 6845 B11R1.758 C#CCCCN1CC(C1)(C)O 269982a_100000718560_100011215417 [0,0,1,1,0,0|0,0,2]=4 6846 B11R1.758 C=CCCCN1CC(C1)(C)O 2230a_100000718560_100011713584 [0,0,1,1,0,0|0,0,2]=4 6847 B11R1.758 C=CCCCN1CC(C1)(C)O 269982a_100000718560_100000757094 [0,0,1,1,0,0|0,0,2]=4 6848 B11R1.758 CC/C=C\CN1CC(C1)(C)O 2230a_100000718560_100103147603 [0,0,1,1,0,0|0,0,2]=4 6849 B11R1.758 CC/C=C\CN1CC(C1)(C)O 269982a_100000718560_100103147603 [0,0,1,1,0,0|0,0,2]=4 6850 B11R1.758 CC1(CN(C1)CCCC#N)O 2230a_100000718560_100000687738 [0,0,1,1,0,0|1,0,1]=4 6851 B11R1.758 CC1(CN(C1)CCCC#N)O 269982a_100000718560_100000687738 [0,0,1,1,0,0|1,0,1]=4 6852 B11R1.758 CC1(CN(C1)CCCC=O)O 2230a_100000718560_200011292268 [0,0,1,1,0,0|1,0,1]=4 6853 B11R1.758 CC1(CN(C1)CCCC=O)O 269982a_100000718560_200011292268 [0,0,1,1,0,0|1,0,1]=4 6854 B11R1.758 CC1(CN(C1)CCCCF)C 2230a_100000753659_100000729493 [0,0,1,1,0,0|2,0,0]=4 6855 B11R1.758 CC1(CN(C1)CCCCF)C 269982a_100000753659_100000729493 [0,0,1,1,0,0|2,0,0]=4 6856 B11R1.758 CC1(CN(C1)CCCCF)F 2230a_100000696199_100000729493 [0,0,1,1,0,0|2,0,0]=4 6857 B11R1.758 CC1(CN(C1)CCCCF)F 269982a_100000696199_100000729493 [0,0,1,1,0,0|2,0,0]=4 6858 B11R1.758 CC1(CN(C1)CCCCF)O 2230a_100000718560_100000729493 [0,0,1,1,0,0|1,0,0]=3 6859 B11R1.758 CC1(CN(C1)CCCCF)O 269982a_100000718560_100000729493 [0,0,1,1,0,0|1,0,0]=3 6860 B11R1.758 CC1(CN(C1)CCCCO)C 2230a_100000753659_100000210776 [0,0,1,1,0,0|2,0,0]=4 6861 B11R1.758 CC1(CN(C1)CCCCO)C 269982a_100000753659_100000210776 [0,0,1,1,0,0|2,0,0]=4 6862 B11R1.758 CC1(CN(C1)CCCCO)F 2230a_100000696199_100000210776 [0,0,1,1,0,0|2,0,0]=4 6863 B11R1.758 CC1(CN(C1)CCCCO)F 269982a_100000696199_100000210776 [0,0,1,1,0,0|2,0,0]=4 6864 B11R1.758 CC1(CN(C1)CCCCO)O 2230a_100000718560_100000210776 [0,0,1,1,0,0|1,0,0]=3 6865 B11R1.758 CC1(CN(C1)CCCCO)O 269982a_100000718560_100000210776 [0,0,1,1,0,0|1,0,0]=3 6866 B11R1.758 CCC#CCN1CC(C1)(C)O 2230a_100000718560_100009813939 [0,0,1,1,0,0|0,0,2]=4 6867 B11R1.758 CCCCCN1CC(C1)(C)C 2230a_100000753659_100000210326 [0,0,1,1,0,0|1,0,0]=3 6868 B11R1.758 CCCCCN1CC(C1)(C)C 269982a_100000753659_100000210215 [0,0,1,1,0,0|1,0,0]=3 6869 B11R1.758 CCCCCN1CC(C1)(C)F 2230a_100000696199_100000210326 [0,0,1,1,0,0|1,0,0]=3 6870 B11R1.758 CCCCCN1CC(C1)(C)F 269982a_100000696199_100000210215 [0,0,1,1,0,0|1,0,0]=3 6871 B11R1.758 CCCCCN1CC(C1)(C)O 2230a_100000718560_100000210326 [0,0,1,1,0,0|0,0,0]=2 6872 B11R1.758 CCCCCN1CC(C1)(C)O 269982a_100000718560_100000210215 [0,0,1,1,0,0|0,0,0]=2 6873 B11R1.758 CCCCCN1CC(C1)(F)F 2230a_100000684464_100000210326 [0,0,1,1,0,0|2,0,0]=4 6874 B11R1.758 CCCCCN1CC(C1)(F)F 269982a_100000684464_100000210215 [0,0,1,1,0,0|2,0,0]=4 6875 B11R1.758 CCCCN[C@H]1C[C@@](C1)(C)O 2230a_100121572536_100000210211 [0,0,1,1,0,0|2,0,0]=4 6876 B11R1.758 CCCNC[C@H]1C[C@@](C1)(C)O 2230a_100015257651_100000210303 [0,0,1,1,0,0|2,0,0]=4 6877 B11R1.758 CCOCCN1CC(C1)(C)C 2230a_100000753659_100011215890 [0,0,1,1,0,0|2,0,0]=4 6878 B11R1.758 CCOCCN1CC(C1)(C)C 269982a_100000753659_100011215890 [0,0,1,1,0,0|2,0,0]=4 6879 B11R1.758 CCOCCN1CC(C1)(C)F 2230a_100000696199_100011215890 [0,0,1,1,0,0|2,0,0]=4 6880 B11R1.758 CCOCCN1CC(C1)(C)F 269982a_100000696199_100011215890 [0,0,1,1,0,0|2,0,0]=4 6881 B11R1.758 CCOCCN1CC(C1)(C)O 2230a_100000718560_100011215890 [0,0,1,1,0,0|1,0,0]=3 6882 B11R1.758 CCOCCN1CC(C1)(C)O 269982a_100000718560_100011215890 [0,0,1,1,0,0|1,0,0]=3 6883 B11R1.758 CCSCCN1CC(C1)(C)C 2230a_100000753659_100000757381 [0,0,1,1,0,0|2,0,0]=4 6884 B11R1.758 CCSCCN1CC(C1)(C)C 269982a_100000753659_100000757381 [0,0,1,1,0,0|2,0,0]=4 6885 B11R1.758 CCSCCN1CC(C1)(C)F 2230a_100000696199_100000757381 [0,0,1,1,0,0|2,0,0]=4 6886 B11R1.758 CCSCCN1CC(C1)(C)F 269982a_100000696199_100000757381 [0,0,1,1,0,0|2,0,0]=4 6887 B11R1.758 CCSCCN1CC(C1)(C)O 2230a_100000718560_100000757381 [0,0,1,1,0,0|1,0,0]=3 6888 B11R1.758 CCSCCN1CC(C1)(C)O 269982a_100000718560_100000757381 [0,0,1,1,0,0|1,0,0]=3 6889 B11R1.758 COCCCN1CC(C1)(C)C 2230a_100000753659_100000740836 [0,0,1,1,0,0|2,0,0]=4 6890 B11R1.758 COCCCN1CC(C1)(C)C 269982a_100000753659_100000740836 [0,0,1,1,0,0|2,0,0]=4 6891 B11R1.758 COCCCN1CC(C1)(C)F 2230a_100000696199_100000740836 [0,0,1,1,0,0|2,0,0]=4 6892 B11R1.758 COCCCN1CC(C1)(C)F 269982a_100000696199_100000740836 [0,0,1,1,0,0|2,0,0]=4 6893 B11R1.758 COCCCN1CC(C1)(C)O 2230a_100000718560_100000740836 [0,0,1,1,0,0|1,0,0]=3 6894 B11R1.758 COCCCN1CC(C1)(C)O 269982a_100000718560_100000740836 [0,0,1,1,0,0|1,0,0]=3 6895 B11R1.80 CC(C)CN1C[C@H]([C@H](C1)O)C 2230a_200015306588_100000210760 [0,0,1,1,0,0|2,0,0]=4 6896 B11R1.80 CC(C)CN1C[C@H]([C@H](C1)O)C 269982a_200015306588_100000210624 [0,0,1,1,0,0|2,0,0]=4 6897 B11R1.80 CC(C)CN1C[C@H]([C@H](C1)O)C 270004a_200015306588_100000210432 [0,0,1,1,0,0|2,0,0]=4 6898 B11R1.80 CC(O)CN1C[C@@H]([C@H](C1)F)O 2230a_100020590056_100011218427 [0,0,1,1,0,0|2,0,0]=4 6899 B11R1.80 CC(O)CN1C[C@@H]([C@H](C1)F)O 269982a_100020590056_100011218427 [0,0,1,1,0,0|2,0,0]=4 6900 B11R1.80 CC(O)CN1C[C@H]([C@H](C1)F)F 269982a_100103146936_100011218427 [0,0,1,1,0,0|2,0,0]=4 6901 B11R1.80 CC(O)CN1C[C@H]([C@H](C1)F)F 34a_100103146936_100011218427 [0,0,1,1,0,0|2,0,0]=4 6902 B11R1.80 CC(O)CN1C[C@H]([C@H](C1)O)C 2230a_200015306588_100011218427 [0,0,1,1,0,0|1,0,0]=3 6903 B11R1.80 CC(O)CN1C[C@H]([C@H](C1)O)C 269982a_200015306588_100011218427 [0,0,1,1,0,0|1,0,0]=3 6904 B11R1.80 CC(O)CN1C[C@H]([C@H](C1)O)O 2230a_100015207562_100011218427 [0,0,1,1,0,0|2,0,0]=4 6905 B11R1.80 CC(O)CN1C[C@H]([C@H](C1)O)O 269982a_100015207562_100011218427 [0,0,1,1,0,0|2,0,0]=4 6906 B11R1.80 C[C@@H](O)CN1C[C@@H]([C@H](C1)F)O 2230a_100020590056_100009817552 [0,0,1,1,0,0|2,0,0]=4 6907 B11R1.80 C[C@@H](O)CN1C[C@@H]([C@H](C1)F)O 269982a_100020590056_100009817552 [0,0,1,1,0,0|2,0,0]=4 6908 B11R1.80 C[C@@H](O)CN1C[C@H]([C@H](C1)F)F 269982a_100103146936_100009817552 [0,0,1,1,0,0|2,0,0]=4 6909 B11R1.80 C[C@@H](O)CN1C[C@H]([C@H](C1)F)F 34a_100103146936_100009817552 [0,0,1,1,0,0|2,0,0]=4 6910 B11R1.80 C[C@@H](O)CN1C[C@H]([C@H](C1)O)O 2230a_100015207562_100009817552 [0,0,1,1,0,0|2,0,0]=4 6911 B11R1.80 C[C@@H](O)CN1C[C@H]([C@H](C1)O)O 269982a_100015207562_100009817552 [0,0,1,1,0,0|2,0,0]=4 6912 B11R1.80 C[C@@H]1CN(C[C@@H]1O)C[C@@H](C)O 2230a_200015306588_100009817552 [0,0,1,1,0,0|1,0,0]=3 6913 B11R1.80 C[C@@H]1CN(C[C@@H]1O)C[C@@H](C)O 269982a_200015306588_100009817552 [0,0,1,1,0,0|1,0,0]=3 6914 B11R1.183 CCCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100000210303 [0,0,1,1,0,0|1,0,0]=3 6915 B11R1.183 CCCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100000210303 [0,0,1,1,0,0|1,0,0]=3 6916 B11R1.183 CCCN1C[C@H](C[C@H]1CO)F 2230a_100015204000_100000210303 [0,0,1,1,0,0|2,0,0]=4 6917 B11R1.183 CCCN1C[C@H](C[C@H]1CO)F 269982a_100015204000_100000210303 [0,0,1,1,0,0|2,0,0]=4 6918 B11R1.183 CCCN1C[C@H](C[C@H]1CO)F 34a_100015204000_100000210303 [0,0,1,1,0,0|2,0,0]=4 6919 B11R1.183 COCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100000766300 [0,0,1,1,0,0|2,0,0]=4 6920 B11R1.183 COCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100000766300 [0,0,1,1,0,0|2,0,0]=4 6921 B11R1.183 CSCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100011218213 [0,0,1,1,0,0|2,0,0]=4 6922 B11R1.183 CSCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100011218213 [0,0,1,1,0,0|2,0,0]=4 6923 B11R1.183 OCCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100000211926 [0,0,1,1,0,0|2,0,0]=4 6924 B11R1.183 OCCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100000211926 [0,0,1,1,0,0|2,0,0]=4 6925 B11R1.183 OC[C@@H]1C[C@H](CN1CCF)O 2230a_100000707816_100011217306 [0,0,1,1,0,0|2,0,0]=4 6926 B11R1.183 OC[C@@H]1C[C@H](CN1CCF)O 269982a_100000707816_100011217306 [0,0,1,1,0,0|2,0,0]=4 6927 B11R1.342 C#CCN1CCCC(C1)(C)O 2230a_100000695535_100000038162 [0,0,1,1,0,0|0,0,2]=4 6928 B11R1.342 C=CCN1CCCC(C1)(C)O 2230a_100000695535_100000210623 [0,0,1,1,0,0|0,0,2]=4 6929 B11R1.342 C=CCN1CCCC(C1)(C)O 269982a_100000695535_100000210623 [0,0,1,1,0,0|0,0,2]=4 6930 B11R1.342 CC1(CCCN(C1)CC#N)O 2230a_100000695535_100011215382 [0,0,1,1,0,0|1,0,1]=4 6931 B11R1.342 CC1(CCCN(C1)CC#N)O 269982a_100000695535_100011214920 [0,0,1,1,0,0|1,0,1]=4 6932 B11R1.342 CC1(CCCN(C1)CC=O)O 2230a_100000695535_200015260668 [0,0,1,1,0,0|1,0,1]=4 6933 B11R1.342 CC1(CCCN(C1)CC=O)O 269982a_100000695535_200015260668 [0,0,1,1,0,0|1,0,1]=4 6934 B11R1.342 CC1(CCCN(C1)CCF)C 2230a_100000716857_100011217306 [0,0,1,1,0,0|2,0,0]=4 6935 B11R1.342 CC1(CCCN(C1)CCF)C 269982a_100000716857_100011217306 [0,0,1,1,0,0|2,0,0]=4 6936 B11R1.342 CC1(CCCN(C1)CCF)C 34a_100000716857_100011217306 [0,0,1,1,0,0|2,0,0]=4 6937 B11R1.342 CC1(CCCN(C1)CCF)O 2230a_100000695535_100011217306 [0,0,1,1,0,0|1,0,0]=3 6938 B11R1.342 CC1(CCCN(C1)CCF)O 269982a_100000695535_100011217306 [0,0,1,1,0,0|1,0,0]=3 6939 B11R1.342 CC1(CCCN(C1)CCO)C 2230a_100000716857_100000211926 [0,0,1,1,0,0|2,0,0]=4 6940 B11R1.342 CC1(CCCN(C1)CCO)C 269982a_100000716857_100000211926 [0,0,1,1,0,0|2,0,0]=4 6941 B11R1.342 CC1(CCCN(C1)CCO)C 34a_100000716857_100000211926 [0,0,1,1,0,0|2,0,0]=4 6942 B11R1.342 CC1(CCCN(C1)CCO)O 2230a_100000695535_100000211926 [0,0,1,1,0,0|1,0,0]=3 6943 B11R1.342 CC1(CCCN(C1)CCO)O 269982a_100000695535_100000211926 [0,0,1,1,0,0|1,0,0]=3 6944 B11R1.342 CCCN1CCCC(C1)(C)C 2230a_100000716857_100000210303 [0,0,1,1,0,0|1,0,0]=3 6945 B11R1.342 CCCN1CCCC(C1)(C)C 269982a_100000716857_100000210303 [0,0,1,1,0,0|1,0,0]=3 6946 B11R1.342 CCCN1CCCC(C1)(C)C 34a_100000716857_100000210303 [0,0,1,1,0,0|1,0,0]=3 6947 B11R1.342 CCCN1CCCC(C1)(C)O 2230a_100000695535_100000210303 [0,0,1,1,0,0|0,0,0]=2 6948 B11R1.342 CCCN1CCCC(C1)(C)O 269982a_100000695535_100000210303 [0,0,1,1,0,0|0,0,0]=2 6949 B11R1.342 CCCN1CCCC(C1)(F)F 2230a_100000732682_100000210303 [0,0,1,1,0,0|2,0,0]=4 6950 B11R1.342 CCCN1CCCC(C1)(F)F 269982a_100000732682_100000210303 [0,0,1,1,0,0|2,0,0]=4 6951 B11R1.342 CCCN1CCCC(C1)(F)F 34a_100000732682_100000210303 [0,0,1,1,0,0|2,0,0]=4 6952 B11R1.342 CCCN1CCOC(C1)(C)C 2230a_100000738910_100000210303 [0,0,1,1,0,0|2,0,0]=4 6953 B11R1.342 CCCN1CCOC(C1)(C)C 269982a_100000738910_100000210303 [0,0,1,1,0,0|2,0,0]=4 6954 B11R1.342 CCCN1CCOC(C1)(C)C 34a_100000738910_100000210303 [0,0,1,1,0,0|2,0,0]=4 6955 B11R1.342 COCN1CCCC(C1)(C)C 2230a_100000716857_100000766300 [0,0,1,1,0,0|2,0,0]=4 6956 B11R1.342 COCN1CCCC(C1)(C)C 269982a_100000716857_100000766300 [0,0,1,1,0,0|2,0,0]=4 6957 B11R1.342 COCN1CCCC(C1)(C)O 2230a_100000695535_100000766300 [0,0,1,1,0,0|1,0,0]=3 6958 B11R1.342 COCN1CCCC(C1)(C)O 269982a_100000695535_100000766300 [0,0,1,1,0,0|1,0,0]=3 6959 B11R1.342 CSCN1CCCC(C1)(C)C 2230a_100000716857_100011218213 [0,0,1,1,0,0|2,0,0]=4 6960 B11R1.342 CSCN1CCCC(C1)(C)C 269982a_100000716857_100011218213 [0,0,1,1,0,0|2,0,0]=4 6961 B11R1.342 CSCN1CCCC(C1)(C)C 34a_100000716857_100011218213 [0,0,1,1,0,0|2,0,0]=4 6962 B11R1.342 CSCN1CCCC(C1)(C)O 2230a_100000695535_100011218213 [0,0,1,1,0,0|1,0,0]=3 6963 B11R1.342 CSCN1CCCC(C1)(C)O 269982a_100000695535_100011218213 [0,0,1,1,0,0|1,0,0]=3 6964 B11R1.799 CCCN(CCC)CC1CC1 2230a_100000210455_100000742324 [0,0,1,1,0,0|1,0,0]=3 6965 B11R1.799 CCCN(CCC)CC1CC1 2230a_100000210729_100000210303 [0,0,1,1,0,0|1,0,0]=3 6966 B11R1.799 CCCN(CCC)CC1CC1 269982a_100000210455_100000756562 [0,0,1,1,0,0|1,0,0]=3 6967 B11R1.799 CCCN(CCC)CC1CC1 269982a_100000210729_100000210303 [0,0,1,1,0,0|1,0,0]=3 6968 B11R1.799 CCCN(CCC)CC1CC1 34a_100000210729_100000210303 [0,0,1,1,0,0|1,0,0]=3 6969 B11R1.799 CCCN(CCC)CC1CO1 2230a_100000210455_100011216344 [0,0,1,1,0,0|0,0,0]=2 6970 B11R1.799 CCCN(CCC)CC1CO1 269982a_100000210455_102125554688 [0,0,1,1,0,0|0,0,0]=2 6971 B11R1.799 CCCN(CCC)CC1CS1 269982a_100000210455_100000031435 [0,0,1,1,0,0|0,1,0]=3 6972 B11R1.799 CCCN(CCC)C[C@@H]1CO1 269982a_100000210455_100000745022 [0,0,1,1,0,0|0,0,0]=2 6973 B11R1.799 CCCN(CCF)CC1CC1 2230a_100000210729_100011217306 [0,0,1,1,0,0|2,0,0]=4 6974 B11R1.799 CCCN(CCF)CC1CC1 269982a_100000210729_100011217306 [0,0,1,1,0,0|2,0,0]=4 6975 B11R1.799 CCCN(CCF)CC1CC1 34a_100000210729_100011217306 [0,0,1,1,0,0|2,0,0]=4 6976 B11R1.799 CCCN(CCO)CC1CC1 2230a_100000210729_100000211926 [0,0,1,1,0,0|2,0,0]=4 6977 B11R1.799 CCCN(CCO)CC1CC1 2230a_100000211420_100000742324 [0,0,1,1,0,0|2,0,0]=4 6978 B11R1.799 CCCN(CCO)CC1CC1 269982a_100000210729_100000211926 [0,0,1,1,0,0|2,0,0]=4 6979 B11R1.799 CCCN(CCO)CC1CC1 269982a_100000211420_100000756562 [0,0,1,1,0,0|2,0,0]=4 6980 B11R1.799 CCCN(CCO)CC1CC1 34a_100000210729_100000211926 [0,0,1,1,0,0|2,0,0]=4 6981 B11R1.799 CCCN(CCO)CC1CO1 2230a_100000211420_100011216344 [0,0,1,1,0,0|1,0,0]=3 6982 B11R1.799 CCCN(CCO)CC1CO1 269982a_100000211420_102125554688 [0,0,1,1,0,0|1,0,0]=3 6983 B11R1.799 CCCN(CCO)CC1CS1 269982a_100000211420_100000031435 [0,0,1,1,0,0|1,1,0]=4 6984 B11R1.799 CCCN(CCO)C[C@@H]1CO1 269982a_100000211420_100000745022 [0,0,1,1,0,0|1,0,0]=3 6985 B11R1.799 CCCN(COC)CC1CC1 2230a_100000210729_100000766300 [0,0,1,1,0,0|2,0,0]=4 6986 B11R1.799 CCCN(COC)CC1CC1 269982a_100000210729_100000766300 [0,0,1,1,0,0|2,0,0]=4 6987 B11R1.799 CCCN(CSC)CC1CC1 2230a_100000210729_100011218213 [0,0,1,1,0,0|2,0,0]=4 6988 B11R1.799 CCCN(CSC)CC1CC1 269982a_100000210729_100011218213 [0,0,1,1,0,0|2,0,0]=4 6989 B11R1.799 CCCN(CSC)CC1CC1 34a_100000210729_100011218213 [0,0,1,1,0,0|2,0,0]=4 6990 B11R1.799 OCCN(CCO)CC1CO1 2230a_100000210587_100011216344 [0,0,1,1,0,0|2,0,0]=4 6991 B11R1.799 OCCN(CCO)CC1CO1 269982a_100000210587_102125554688 [0,0,1,1,0,0|2,0,0]=4 6992 B11R1.799 OCCN(CCO)C[C@@H]1CO1 269982a_100000210587_100000745022 [0,0,1,1,0,0|2,0,0]=4 6993 B11R1.804 C=C(C)CN(CCC)C1CC1 2230a_100000765834_100000748629 [0,0,1,1,0,0|1,0,1]=4 6994 B11R1.804 C=C(C)CN(CCC)C1CC1 269982a_100000765834_100000748629 [0,0,1,1,0,0|1,0,1]=4 6995 B11R1.804 CC(C)CN(CCF)C1CC1 2230a_100000737031_100011217306 [0,0,1,1,0,0|2,0,0]=4 6996 B11R1.804 CC(C)CN(CCF)C1CC1 269982a_100000737031_100011217306 [0,0,1,1,0,0|2,0,0]=4 6997 B11R1.804 CC(C)CN(CCF)C1CC1 34a_100000737031_100011217306 [0,0,1,1,0,0|2,0,0]=4 6998 B11R1.804 CC(C)CN(CCO)C1CC1 2230a_100000737031_100000211926 [0,0,1,1,0,0|2,0,0]=4 6999 B11R1.804 CC(C)CN(CCO)C1CC1 2230a_100000738766_100000210760 [0,0,1,1,0,0|2,0,0]=4 7000 B11R1.804 CC(C)CN(CCO)C1CC1 269982a_100000737031_100000211926 [0,0,1,1,0,0|2,0,0]=4 7001 B11R1.804 CC(C)CN(CCO)C1CC1 269982a_100000738766_100000210624 [0,0,1,1,0,0|2,0,0]=4 7002 B11R1.804 CC(C)CN(CCO)C1CC1 269982a_100015185251_100000211595 [0,0,1,1,0,0|2,0,0]=4 7003 B11R1.804 CC(C)CN(CCO)C1CC1 270004a_100000738766_100000210432 [0,0,1,1,0,0|2,0,0]=4 7004 B11R1.804 CC(C)CN(CCO)C1CC1 34a_100000737031_100000211926 [0,0,1,1,0,0|2,0,0]=4 7005 B11R1.804 CC(C)CN(CCO)C1CC1 34a_100000738766_100000210624 [0,0,1,1,0,0|2,0,0]=4 7006 B11R1.804 CC(O)CN(CCO)C1CC1 2230a_100000738766_100011218427 [0,0,1,1,0,0|1,0,0]=3 7007 B11R1.804 CC(O)CN(CCO)C1CC1 269982a_100000731851_100000211595 [0,0,1,1,0,0|1,0,0]=3 7008 B11R1.804 CC(O)CN(CCO)C1CC1 269982a_100000738766_100011218427 [0,0,1,1,0,0|1,0,0]=3 7009 B11R1.804 CC(O)CN(CCO)C1CC1 34a_100000738766_100011218427 [0,0,1,1,0,0|1,0,0]=3 7010 B11R1.804 CCCN(CC(C)C)C1CC1 2230a_100000737031_100000210303 [0,0,1,1,0,0|1,0,0]=3 7011 B11R1.804 CCCN(CC(C)C)C1CC1 2230a_100000765834_100000210760 [0,0,1,1,0,0|1,0,0]=3 7012 B11R1.804 CCCN(CC(C)C)C1CC1 269982a_100000737031_100000210303 [0,0,1,1,0,0|1,0,0]=3 7013 B11R1.804 CCCN(CC(C)C)C1CC1 269982a_100000765834_100000210624 [0,0,1,1,0,0|1,0,0]=3 7014 B11R1.804 CCCN(CC(C)C)C1CC1 270004a_100000765834_100000210432 [0,0,1,1,0,0|1,0,0]=3 7015 B11R1.804 CCCN(CC(C)C)C1CC1 34a_100000737031_100000210303 [0,0,1,1,0,0|1,0,0]=3 7016 B11R1.804 CCCN(CC(C)O)C1CC1 2230a_100000765834_100011218427 [0,0,1,1,0,0|0,0,0]=2 7017 B11R1.804 CCCN(CC(C)O)C1CC1 269982a_100000765834_100011218427 [0,0,1,1,0,0|0,0,0]=2 7018 B11R1.804 CCCN(CC(F)F)C1CC1 2230a_100000765834_100011934356 [0,0,1,1,0,0|2,0,0]=4 7019 B11R1.804 CCCN(CC(F)F)C1CC1 269982a_100000765834_100011934356 [0,0,1,1,0,0|2,0,0]=4 7020 B11R1.804 CCCN(C[C@@H](C)O)C1CC1 2230a_100000765834_100009817552 [0,0,1,1,0,0|0,0,0]=2 7021 B11R1.804 CCCN(C[C@@H](C)O)C1CC1 269982a_100000765834_100009817552 [0,0,1,1,0,0|0,0,0]=2 7022 B11R1.804 COCN(CC(C)C)C1CC1 2230a_100000737031_100000766300 [0,0,1,1,0,0|2,0,0]=4 7023 B11R1.804 COCN(CC(C)C)C1CC1 269982a_100000737031_100000766300 [0,0,1,1,0,0|2,0,0]=4 7024 B11R1.804 CSCN(CC(C)C)C1CC1 2230a_100000737031_100011218213 [0,0,1,1,0,0|2,0,0]=4 7025 B11R1.804 CSCN(CC(C)C)C1CC1 269982a_100000737031_100011218213 [0,0,1,1,0,0|2,0,0]=4 7026 B11R1.804 CSCN(CC(C)C)C1CC1 34a_100000737031_100011218213 [0,0,1,1,0,0|2,0,0]=4 7027 B11R1.804 C[C@@H](O)CN(CCO)C1CC1 2230a_100000738766_100009817552 [0,0,1,1,0,0|1,0,0]=3 7028 B11R1.804 C[C@@H](O)CN(CCO)C1CC1 269982a_100000738766_100009817552 [0,0,1,1,0,0|1,0,0]=3 7029 B11R1.804 C[C@@H](O)CN(CCO)C1CC1 34a_100000738766_100009817552 [0,0,1,1,0,0|1,0,0]=3 7030 B11R1.9 CCN1CC(CC(C1)CO)C 2230a_200012821172_100000210202 [0,0,1,1,0,0|2,0,0]=4 7031 B11R1.9 CCN1CC(CC(C1)CO)C 269982a_200012821172_100000204670 [0,0,1,1,0,0|2,0,0]=4 7032 B11R1.9 CCN1CC(CC(C1)CO)C 34a_200012821172_100000210202 [0,0,1,1,0,0|2,0,0]=4 7033 B11R1.213 C#CCCN1CCC(C1)(C)O 2230a_100000718628_100000688953 [0,0,1,1,0,0|0,0,2]=4 7034 B11R1.213 C#CCCN1CCC(C1)(C)O 269982a_100000718628_100000730999 [0,0,1,1,0,0|0,0,2]=4 7035 B11R1.213 C/C=C/CN1CCC(C1)(C)O 269982a_100000718628_100102629194 [0,0,1,1,0,0|0,0,2]=4 7036 B11R1.213 C=CCCN1CCC(C1)(C)O 2230a_100000718628_100000754431 [0,0,1,1,0,0|0,0,2]=4 7037 B11R1.213 C=CCCN1CCC(C1)(C)O 269982a_100000718628_100000754431 [0,0,1,1,0,0|0,0,2]=4 7038 B11R1.213 CC#CCN1CCC(C1)(C)O 2230a_100000718628_100000748600 [0,0,1,1,0,0|0,0,2]=4 7039 B11R1.213 CC1(CCN(C1)CCC#N)O 2230a_100000718628_100011215226 [0,0,1,1,0,0|1,0,1]=4 7040 B11R1.213 CC1(CCN(C1)CCC#N)O 269982a_100000718628_100011215226 [0,0,1,1,0,0|1,0,1]=4 7041 B11R1.213 CC1(CCN(C1)CCCF)C 2230a_100000764714_100011934791 [0,0,1,1,0,0|2,0,0]=4 7042 B11R1.213 CC1(CCN(C1)CCCF)C 269982a_100000764714_100011934791 [0,0,1,1,0,0|2,0,0]=4 7043 B11R1.213 CC1(CCN(C1)CCCF)O 2230a_100000718628_100011934791 [0,0,1,1,0,0|1,0,0]=3 7044 B11R1.213 CC1(CCN(C1)CCCF)O 269982a_100000718628_100011934791 [0,0,1,1,0,0|1,0,0]=3 7045 B11R1.213 CC1(CCN(C1)CCCO)C 2230a_100000764714_100000230001 [0,0,1,1,0,0|2,0,0]=4 7046 B11R1.213 CC1(CCN(C1)CCCO)C 269982a_100000764714_100011215043 [0,0,1,1,0,0|2,0,0]=4 7047 B11R1.213 CC1(CCN(C1)CCCO)O 2230a_100000718628_100000230001 [0,0,1,1,0,0|1,0,0]=3 7048 B11R1.213 CC1(CCN(C1)CCCO)O 269982a_100000718628_100011215043 [0,0,1,1,0,0|1,0,0]=3 7049 B11R1.213 CC=CCN1CCC(C1)(C)O 2230a_100000718628_100000070051 [0,0,1,1,0,0|0,0,2]=4 7050 B11R1.213 CCCCN1CCC(C1)(C)C 2230a_100000764714_100000210211 [0,0,1,1,0,0|1,0,0]=3 7051 B11R1.213 CCCCN1CCC(C1)(C)C 269982a_100000764714_100000210211 [0,0,1,1,0,0|1,0,0]=3 7052 B11R1.213 CCCCN1CCC(C1)(C)O 2230a_100000718628_100000210211 [0,0,1,1,0,0|0,0,0]=2 7053 B11R1.213 CCCCN1CCC(C1)(C)O 269982a_100000718628_100000210211 [0,0,1,1,0,0|0,0,0]=2 7054 B11R1.213 CCCCN1CCC(C1)(F)F 2230a_100000697292_100000210211 [0,0,1,1,0,0|2,0,0]=4 7055 B11R1.213 CCCCN1CCC(C1)(F)F 269982a_100000697292_100000210211 [0,0,1,1,0,0|2,0,0]=4 7056 B11R1.213 CCCCN1CCC(C1)(F)F 34a_100000697292_100000210210 [0,0,1,1,0,0|2,0,0]=4 7057 B11R1.213 CCOCN1CCC(C1)(C)C 269982a_100000764714_100000739092 [0,0,1,1,0,0|2,0,0]=4 7058 B11R1.213 CCOCN1CCC(C1)(C)O 269982a_100000718628_100000739092 [0,0,1,1,0,0|1,0,0]=3 7059 B11R1.213 COCCN1CCC(C1)(C)C 2230a_100000764714_100011201679 [0,0,1,1,0,0|2,0,0]=4 7060 B11R1.213 COCCN1CCC(C1)(C)C 269982a_100000764714_100000233755 [0,0,1,1,0,0|2,0,0]=4 7061 B11R1.213 COCCN1CCC(C1)(C)O 2230a_100000718628_100011201679 [0,0,1,1,0,0|1,0,0]=3 7062 B11R1.213 COCCN1CCC(C1)(C)O 269982a_100000718628_100000233755 [0,0,1,1,0,0|1,0,0]=3 7063 B11R1.213 CSCCN1CCC(C1)(C)C 2230a_100000764714_100000751147 [0,0,1,1,0,0|2,0,0]=4 7064 B11R1.213 CSCCN1CCC(C1)(C)C 269982a_100000764714_100000212216 [0,0,1,1,0,0|2,0,0]=4 7065 B11R1.213 CSCCN1CCC(C1)(C)O 2230a_100000718628_100000751147 [0,0,1,1,0,0|1,0,0]=3 7066 B11R1.213 CSCCN1CCC(C1)(C)O 269982a_100000718628_100000212216 [0,0,1,1,0,0|1,0,0]=3 7067 B11R1.281 CCN1CCC(C(C1)(C)C)O 2230a_100000709803_100000210202 [0,0,1,1,0,0|2,0,0]=4 7068 B11R1.281 CCN1CCC(C(C1)(C)C)O 269982a_100000709803_100000204670 [0,0,1,1,0,0|2,0,0]=4 7069 B11R1.281 CCN1CCC(C(C1)(C)C)O 34a_100000709803_100000210202 [0,0,1,1,0,0|2,0,0]=4 7070 B11R1.319 CCCCN(CC)CC1CC1 2230a_100000207695_100000742324 [0,0,1,1,0,0|1,0,0]=3 7071 B11R1.319 CCCCN(CC)CC1CC1 269982a_100000207695_100000756562 [0,0,1,1,0,0|1,0,0]=3 7072 B11R1.319 CCCCN(CC)CC1CO1 2230a_100000207695_100011216344 [0,0,1,1,0,0|0,0,0]=2 7073 B11R1.319 CCCCN(CC)CC1CO1 269982a_100000207695_102125554688 [0,0,1,1,0,0|0,0,0]=2 7074 B11R1.319 CCCCN(CC)CC1CS1 269982a_100000207695_100000031435 [0,0,1,1,0,0|0,1,0]=3 7075 B11R1.319 CCCCN(CC)C[C@@H]1CO1 269982a_100000207695_100000745022 [0,0,1,1,0,0|0,0,0]=2 7076 B11R1.319 CCN(CCC#N)CC1CO1 2230a_100000226048_100011216344 [0,0,1,1,0,0|1,0,1]=4 7077 B11R1.319 CCN(CCOC)CC1CC1 2230a_100000731262_100000742324 [0,0,1,1,0,0|2,0,0]=4 7078 B11R1.319 CCN(CCOC)CC1CC1 2230a_100011232889_100000210202 [0,0,1,1,0,0|2,0,0]=4 7079 B11R1.319 CCN(CCOC)CC1CC1 269982a_100000731262_100000756562 [0,0,1,1,0,0|2,0,0]=4 7080 B11R1.319 CCN(CCOC)CC1CC1 269982a_100011232889_100000204670 [0,0,1,1,0,0|2,0,0]=4 7081 B11R1.319 CCN(CCOC)CC1CC1 34a_100011232889_100000210202 [0,0,1,1,0,0|2,0,0]=4 7082 B11R1.319 CCN(CCOC)CC1CO1 2230a_100000731262_100011216344 [0,0,1,1,0,0|1,0,0]=3 7083 B11R1.319 CCN(CCOC)CC1CO1 269982a_100000731262_102125554688 [0,0,1,1,0,0|1,0,0]=3 7084 B11R1.319 CCN(CCOC)CC1CS1 269982a_100000731262_100000031435 [0,0,1,1,0,0|1,1,0]=4 7085 B11R1.319 CCN(CCOC)C[C@@H]1CO1 269982a_100000731262_100000745022 [0,0,1,1,0,0|1,0,0]=3 7086 B11R1.382 CC1(COCCN(C1)CF)O 269982a_100011091861_100015361967 [0,0,1,1,0,0|2,0,0]=4 7087 B11R1.382 CCN1CCOCC(C1)(C)O 2230a_100011091861_100000210202 [0,0,1,1,0,0|1,0,0]=3 7088 B11R1.382 CCN1CCOCC(C1)(C)O 269982a_100011091861_100000204670 [0,0,1,1,0,0|1,0,0]=3 7089 B11R1.751 C=C(C)CN(CC)C1CCC1 2230a_100000758130_100000748629 [0,0,1,1,0,0|1,0,1]=4 7090 B11R1.751 C=C(C)CN(CC)C1CCC1 269982a_100000211296_100000749161 [0,0,1,1,0,0|1,0,1]=4 7091 B11R1.751 C=C(C)CN(CC)C1CCC1 269982a_100000758130_100000748629 [0,0,1,1,0,0|1,0,1]=4 7092 B11R1.751 C=C(C)CN(CC)C1CCC1 270004a_100000211296_100000241760 [0,0,1,1,0,0|1,0,1]=4 7093 B11R1.751 CCN(CC(=O)O)C1CCC1 269956a_100000746405_100000749161 [0,0,1,1,0,0|1,0,1]=4 7094 B11R1.751 CCN(CC(C)C)C1CCC1 2230a_100000758130_100000210760 [0,0,1,1,0,0|1,0,0]=3 7095 B11R1.751 CCN(CC(C)C)C1CCC1 269982a_100000738554_100000749161 [0,0,1,1,0,0|1,0,0]=3 7096 B11R1.751 CCN(CC(C)C)C1CCC1 269982a_100000758130_100000210624 [0,0,1,1,0,0|1,0,0]=3 7097 B11R1.751 CCN(CC(C)C)C1CCC1 270004a_100000738554_100000241760 [0,0,1,1,0,0|1,0,0]=3 7098 B11R1.751 CCN(CC(C)C)C1CCC1 270004a_100000758130_100000210432 [0,0,1,1,0,0|1,0,0]=3 7099 B11R1.751 CCN(CC(C)C)C1COC1 2230a_200015199590_100000210760 [0,0,1,1,0,0|2,0,0]=4 7100 B11R1.751 CCN(CC(C)C)C1COC1 269982a_100000738554_100000687716 [0,0,1,1,0,0|2,0,0]=4 7101 B11R1.751 CCN(CC(C)C)C1COC1 269982a_200015199590_100000210624 [0,0,1,1,0,0|2,0,0]=4 7102 B11R1.751 CCN(CC(C)C)C1COC1 270004a_200015199590_100000210432 [0,0,1,1,0,0|2,0,0]=4 7103 B11R1.751 CCN(CC(C)O)C1CCC1 2230a_100000758130_100011218427 [0,0,1,1,0,0|0,0,0]=2 7104 B11R1.751 CCN(CC(C)O)C1CCC1 269982a_100000758130_100011218427 [0,0,1,1,0,0|0,0,0]=2 7105 B11R1.751 CCN(CC(C)O)C1COC1 2230a_200015199590_100011218427 [0,0,1,1,0,0|1,0,0]=3 7106 B11R1.751 CCN(CC(C)O)C1COC1 269982a_200015199590_100011218427 [0,0,1,1,0,0|1,0,0]=3 7107 B11R1.751 CCN(CC(F)F)C1CCC1 2230a_100000758130_100011934356 [0,0,1,1,0,0|2,0,0]=4 7108 B11R1.751 CCN(CC(F)F)C1CCC1 269982a_100000758130_100011934356 [0,0,1,1,0,0|2,0,0]=4 7109 B11R1.751 CCN(C[C@@H](C)O)C1CCC1 2230a_100000758130_100009817552 [0,0,1,1,0,0|0,0,0]=2 7110 B11R1.751 CCN(C[C@@H](C)O)C1CCC1 269982a_100000758130_100009817552 [0,0,1,1,0,0|0,0,0]=2 7111 B11R1.751 CCN(C[C@@H](C)O)C1COC1 2230a_200015199590_100009817552 [0,0,1,1,0,0|1,0,0]=3 7112 B11R1.751 CCN(C[C@@H](C)O)C1COC1 269982a_200015199590_100009817552 [0,0,1,1,0,0|1,0,0]=3 7113 B11R1.751 CCN(C[C@H](C)O)C1CCC1 269982a_100000729506_100000749161 [0,0,1,1,0,0|0,0,0]=2 7114 B11R1.751 CCN(C[C@H](C)O)C1CCC1 270004a_100000729506_100000241760 [0,0,1,1,0,0|0,0,0]=2 7115 B11R1.751 CCN(C[C@H](C)O)C1COC1 269982a_100000729506_100000687716 [0,0,1,1,0,0|1,0,0]=3 7116 B11R1.1032 C=C(C)CN(CC)CC1CC1 2230a_100000211296_100000742324 [0,0,1,1,0,0|1,0,1]=4 7117 B11R1.1032 C=C(C)CN(CC)CC1CC1 269982a_100000211296_100000756562 [0,0,1,1,0,0|1,0,1]=4 7118 B11R1.1032 CCN(CC(=O)O)CC1CC1 269956a_100000746405_100000742324 [0,0,1,1,0,0|1,0,1]=4 7119 B11R1.1032 CCN(CC(C)C)CC1CC1 2230a_100000738554_100000742324 [0,0,1,1,0,0|1,0,0]=3 7120 B11R1.1032 CCN(CC(C)C)CC1CC1 269982a_100000738554_100000756562 [0,0,1,1,0,0|1,0,0]=3 7121 B11R1.1032 CCN(CC(C)C)CC1CO1 2230a_100000738554_100011216344 [0,0,1,1,0,0|2,0,0]=4 7122 B11R1.1032 CCN(CC(C)C)CC1CO1 269982a_100000738554_102125554688 [0,0,1,1,0,0|2,0,0]=4 7123 B11R1.1032 CCN(CC(C)C)CC1CS1 269982a_100000738554_100000031435 [0,0,1,1,0,0|2,0,0]=4 7124 B11R1.1032 CCN(CC(C)C)C[C@@H]1CO1 269982a_100000738554_100000745022 [0,0,1,1,0,0|2,0,0]=4 7125 B11R1.1032 CCN(CC1CC1)C[C@H](C)O 2230a_100000729506_100000742324 [0,0,1,1,0,0|0,0,0]=2 7126 B11R1.1032 CCN(CC1CC1)C[C@H](C)O 269982a_100000729506_100000756562 [0,0,1,1,0,0|0,0,0]=2 7127 B11R1.1032 CCN(CC1CO1)C[C@H](C)O 2230a_100000729506_100011216344 [0,0,1,1,0,0|1,0,0]=3 7128 B11R1.1032 CCN(CC1CO1)C[C@H](C)O 269982a_100000729506_102125554688 [0,0,1,1,0,0|1,0,0]=3 7129 B11R1.1032 CCN(CC1CS1)C[C@H](C)O 269982a_100000729506_100000031435 [0,0,1,1,0,0|1,0,0]=3 7130 B11R1.1032 CCN(C[C@@H]1CO1)C[C@H](C)O 269982a_100000729506_100000745022 [0,0,1,1,0,0|1,0,0]=3 7131 B11R2.641 CCNC1CCCC2C1C2 269862a_100015525214_100000697651 [1,0,0,1,0,0|2,0,0]=4 7132 B11R2.1036 C1CCCN(CC1)C2CC2 269982a_100000185865_100000211595 [1,0,0,1,0,0|0,0,0]=2 7133 B11R2.1036 C1CCCN(CC1)C2CC2 34a_100000185865_100000211595 [1,0,0,1,0,0|0,0,0]=2 7134 B11R2.1036 C1COCCN(C1)C2CC2 269982a_100000685342_100000211595 [1,0,0,1,0,0|1,0,0]=3 7135 B11R2.1036 C1COCCN(C1)C2CC2 34a_100000685342_100000211595 [1,0,0,1,0,0|1,0,0]=3 7136 B11R2.238 C1=CCN(CC1)CC2CO2 2230a_100000698166_100011216344 [0,0,0,1,1,0|0,0,2]=4 7137 B11R2.238 C1=CCN(CC1)CC2CO2 269982a_100000698166_102125554688 [0,0,0,1,1,0|0,0,2]=4 7138 B11R2.238 C1=CCN(CC1)CC2CO2 34a_100000698166_102125554688 [0,0,0,1,1,0|0,0,2]=4 7139 B11R2.238 C1=CCN(CC1)C[C@@H]2CO2 269982a_100000698166_100000745022 [0,0,0,1,1,0|0,0,2]=4 7140 B11R2.238 C1CN(CCO1)CC2CC2 2230a_100015191051_100000742324 [0,0,0,1,1,0|2,0,0]=4 7141 B11R2.238 C1CN(CCO1)CC2CC2 269982a_100015191051_100000756562 [0,0,0,1,1,0|2,0,0]=4 7142 B11R2.238 C1CN(CCO1)CC2CC2 34a_100015191051_100000742324 [0,0,0,1,1,0|2,0,0]=4 7143 B11R2.238 C1CN(CCO1)CC2CO2 2230a_100015191051_100011216344 [0,0,0,1,1,0|1,0,0]=3 7144 B11R2.238 C1CN(CCO1)CC2CO2 269982a_100015191051_102125554688 [0,0,0,1,1,0|1,0,0]=3 7145 B11R2.238 C1CN(CCO1)CC2CO2 34a_100015191051_102125554688 [0,0,0,1,1,0|1,0,0]=3 7146 B11R2.238 C1CN(CCO1)CC2CS2 269982a_100015191051_100000031435 [0,0,0,1,1,0|1,1,0]=4 7147 B11R2.238 C1CN(CCO1)C[C@@H]2CO2 269982a_100015191051_100000745022 [0,0,0,1,1,0|1,0,0]=3 7148 B11R2.238 C1CN(CCS1)CC2CC2 2230a_100000737611_100000742324 [0,0,0,1,1,0|2,0,0]=4 7149 B11R2.238 C1CN(CCS1)CC2CC2 269982a_100000737611_100000756562 [0,0,0,1,1,0|2,0,0]=4 7150 B11R2.238 C1CN(CCS1)CC2CO2 2230a_100000737611_100011216344 [0,0,0,1,1,0|1,0,0]=3 7151 B11R2.238 C1CN(CCS1)CC2CO2 269982a_100000737611_102125554688 [0,0,0,1,1,0|1,0,0]=3 7152 B11R2.238 C1CN(CCS1)CC2CS2 269982a_100000737611_100000031435 [0,0,0,1,1,0|1,1,0]=4 7153 B11R2.238 C1CN(CCS1)C[C@@H]2CO2 269982a_100000737611_100000745022 [0,0,0,1,1,0|1,0,0]=3 7154 B11R2.238 C1COCN(C1)CC2CC2 2230a_100000131196_100000742324 [0,0,0,1,1,0|2,0,0]=4 7155 B11R2.238 C1COCN(C1)CC2CC2 269982a_100000131196_100000756562 [0,0,0,1,1,0|2,0,0]=4 7156 B11R2.238 C1COCN(C1)CC2CC2 34a_100000131196_100000742324 [0,0,0,1,1,0|2,0,0]=4 7157 B11R2.238 C1COCN(C1)CC2CO2 2230a_100000131196_100011216344 [0,0,0,1,1,0|1,0,0]=3 7158 B11R2.238 C1COCN(C1)CC2CO2 269982a_100000131196_102125554688 [0,0,0,1,1,0|1,0,0]=3 7159 B11R2.238 C1COCN(C1)CC2CO2 34a_100000131196_102125554688 [0,0,0,1,1,0|1,0,0]=3 7160 B11R2.238 C1COCN(C1)CC2CS2 269982a_100000131196_100000031435 [0,0,0,1,1,0|1,1,0]=4 7161 B11R2.238 C1COCN(C1)C[C@@H]2CO2 269982a_100000131196_100000745022 [0,0,0,1,1,0|1,0,0]=3 7162 B11R2.934 C=C(C)CN1CC2CC2C1 2230a_100000741873_100000748629 [0,0,0,1,1,0|1,0,1]=4 7163 B11R2.934 C=C(C)CN1CC2CC2C1 269982a_100000741873_100000748629 [0,0,0,1,1,0|1,0,1]=4 7164 B11R2.934 C=C(C)CN1CC2CC2C1 34a_100000741873_100000748629 [0,0,0,1,1,0|1,0,1]=4 7165 B11R2.934 CC(C)CN1CC2CC2C1 2230a_100000741873_100000210760 [0,0,0,1,1,0|1,0,0]=3 7166 B11R2.934 CC(C)CN1CC2CC2C1 269982a_100000741873_100000210624 [0,0,0,1,1,0|1,0,0]=3 7167 B11R2.934 CC(C)CN1CC2CC2C1 270004a_100000741873_100000210432 [0,0,0,1,1,0|1,0,0]=3 7168 B11R2.934 CC(C)CN1CC2CC2C1 34a_100000741873_100000210624 [0,0,0,1,1,0|1,0,0]=3 7169 B11R2.934 CC(O)CN1CC2CC2C1 2230a_100000741873_100011218427 [0,0,0,1,1,0|0,0,0]=2 7170 B11R2.934 CC(O)CN1CC2CC2C1 269982a_100000741873_100011218427 [0,0,0,1,1,0|0,0,0]=2 7171 B11R2.934 CC(O)CN1CC2CC2C1 34a_100000741873_100011218427 [0,0,0,1,1,0|0,0,0]=2 7172 B11R2.934 C[C@@H](O)CN1CC2CC2C1 2230a_100000741873_100009817552 [0,0,0,1,1,0|0,0,0]=2 7173 B11R2.934 C[C@@H](O)CN1CC2CC2C1 269982a_100000741873_100009817552 [0,0,0,1,1,0|0,0,0]=2 7174 B11R2.934 C[C@@H](O)CN1CC2CC2C1 34a_100000741873_100009817552 [0,0,0,1,1,0|0,0,0]=2 7175 B11R2.934 FC(F)CN1CC2CC2C1 2230a_100000741873_100011934356 [0,0,0,1,1,0|2,0,0]=4 7176 B11R2.934 FC(F)CN1CC2CC2C1 269982a_100000741873_100011934356 [0,0,0,1,1,0|2,0,0]=4 7177 B11R2.934 FC(F)CN1CC2CC2C1 34a_100000741873_100011934356 [0,0,0,1,1,0|2,0,0]=4 7178 B13R2.689 CC(O)CN1C2CCC1COC2 2230a_100015205251_100011218427 [0,0,0,1,0,1|2,0,0]=4 7179 B13R2.689 CC(O)CN1C2CCC1COC2 269982a_100015205251_100011218427 [0,0,0,1,0,1|2,0,0]=4 7180 B13R2.689 CC(O)CN1C2CCC1COC2 34a_100015205251_100011218427 [0,0,0,1,0,1|2,0,0]=4 7181 B13R2.689 C[C@@H](O)CN1C2CCC1COC2 2230a_100015205251_100009817552 [0,0,0,1,0,1|2,0,0]=4 7182 B13R2.689 C[C@@H](O)CN1C2CCC1COC2 269982a_100015205251_100009817552 [0,0,0,1,0,1|2,0,0]=4 7183 B13R2.689 C[C@@H](O)CN1C2CCC1COC2 34a_100015205251_100009817552 [0,0,0,1,0,1|2,0,0]=4 7184 B13R2.3443 F[C@@H]1C[C@H]1NC2CCCCCC2 34a_100025746932_100011217769 [0,0,0,1,0,1|2,0,0]=4 7185 B13R2.5283 CC1CN(C1)C2CCCCCC2 269982a_100000702820_100011217769 [0,0,0,1,0,1|2,0,0]=4 7186 B13R2.5283 CC1CN(C1)C2CCCCCC2 270004a_100000702820_100000210131 [0,0,0,1,0,1|2,0,0]=4 7187 B13R2.5283 CC1CN(C1)C2CCCCCC2 34a_100000702820_100011217769 [0,0,0,1,0,1|2,0,0]=4 7188 B13R2.5283 FC1CN(C1)C2CCCCCC2 269982a_100000690557_100011217769 [0,0,0,1,0,1|2,0,0]=4 7189 B13R2.5283 FC1CN(C1)C2CCCCCC2 270004a_100000690557_100000210131 [0,0,0,1,0,1|2,0,0]=4 7190 B13R2.5283 FC1CN(C1)C2CCCCCC2 34a_100000690557_100011217769 [0,0,0,1,0,1|2,0,0]=4 7191 B13R2.5283 O=C1CC(C1)N2CCCCCC2 269982a_100000185865_100009894365 [0,0,0,1,0,1|0,0,2]=4 7192 B13R2.5283 OC1CN(C1)C2CCCCCC2 269982a_100000749847_100011217769 [0,0,0,1,0,1|1,0,0]=3 7193 B13R2.6841 C1CCCC(CC1)CNC2CC2 34a_100000212008_200000696569 [0,0,0,1,0,1|2,0,0]=4 7194 B13R2.6841 C1CCCC(CC1)CNC2CC2 34a_100015204231_100000211595 [0,0,0,1,0,1|2,0,0]=4 7195 B13R2.6841 C1CCCC(CC1)COC2CC2 34a_100000699130_100000211595 [0,0,0,1,0,1|2,0,0]=4 7196 B13R2.6841 C1CCCC(CC1)CSC2CC2 62a_200000696569_100000211595 [0,0,0,1,0,1|2,0,0]=4 7197 B13R2.6841 C1CCCC(CC1)NCC2CC2 2230a_100000210984_100000742324 [0,0,0,1,0,1|2,0,0]=4 7198 B13R2.6841 C1CCCC(CC1)NCC2CC2 269862a_100000210984_100000741477 [0,0,0,1,0,1|2,0,0]=4 7199 B13R2.6841 C1CCCC(CC1)NCC2CC2 270004a_100000735609_100000210131 [0,0,0,1,0,1|2,0,0]=4 7200 B13R2.6841 C1CCCC(CC1)NCC2CC2 34a_100000210984_100000742324 [0,0,0,1,0,1|2,0,0]=4 7201 B13R2.6841 C1CCCC(CC1)NCC2CC2 34a_100000735609_100011217769 [0,0,0,1,0,1|2,0,0]=4 7202 B13R2.6841 C1CCCC(CC1)NCC2CO2 2230a_100000210984_100011216344 [0,0,0,1,0,1|1,0,0]=3 7203 B13R2.6841 C1CCCC(CC1)NCC2CO2 34a_100000210984_102125554688 [0,0,0,1,0,1|1,0,0]=3 7204 B13R2.6841 C1CCCC(CC1)OCC2CC2 34a_100000210887_100000742324 [0,0,0,1,0,1|2,0,0]=4 7205 B13R2.6841 C1CCCC(CC1)OCC2CC2 34a_100000211283_100011217769 [0,0,0,1,0,1|2,0,0]=4 7206 B13R2.6841 C1CCCC(CC1)OCC2CC2 7a_100000210887_100000742324 [0,0,0,1,0,1|2,0,0]=4 7207 B13R2.6841 C1CCCC(CC1)OCC2CO2 34a_100000210887_102125554688 [0,0,0,1,0,1|1,0,0]=3 7208 B13R2.6841 C1CCCC(CC1)OCC2CO2 7a_100000210887_102125554688 [0,0,0,1,0,1|1,0,0]=3 7209 B13R2.6841 C1CCCC(CC1)OCC2CS2 7a_100000210887_100000031435 [0,0,0,1,0,1|1,1,0]=4 7210 B13R2.6841 C1CCCC(CC1)OC[C@@H]2CO2 34a_100000757423_100011217769 [0,0,0,1,0,1|1,0,0]=3 7211 B13R2.6841 C1CCCC(CC1)OC[C@@H]2CO2 7a_100000210887_100000745022 [0,0,0,1,0,1|1,0,0]=3 7212 B13R2.6841 C1CCCC(CC1)SCC2CC2 62a_100000756562_100011217769 [0,0,0,1,0,1|2,0,0]=4 7213 B13R2.6841 C1CCCC(CC1)SCC2CC2 62a_100011217769_100000742324 [0,0,0,1,0,1|2,0,0]=4 7214 B13R2.6841 C1CCCC(CC1)SCC2CO2 62a_100011217769_102125554688 [0,0,0,1,0,1|1,0,0]=3 7215 B13R2.6841 C1CCCC(CC1)SCC2CO2 62a_102125554688_100011217769 [0,0,0,1,0,1|1,0,0]=3 7216 B13R2.6841 C1CCCC(CC1)SCC2CS2 62a_100000031435_100011217769 [0,0,0,1,0,1|1,1,0]=4 7217 B13R2.6841 C1CCCC(CC1)SCC2CS2 62a_100011217769_100000031435 [0,0,0,1,0,1|1,1,0]=4 7218 B13R2.6841 C1CCCC(CC1)SC[C@@H]2CO2 62a_100000745022_100011217769 [0,0,0,1,0,1|1,0,0]=3 7219 B13R2.6841 C1CCCC(CC1)SC[C@@H]2CO2 62a_100011217769_100000745022 [0,0,0,1,0,1|1,0,0]=3 7220 B13R2.6841 C1CCCN(CC1)CCC2CC2 2230a_100000185865_100000694398 [0,0,0,1,0,1|1,0,0]=3 7221 B13R2.6841 C1CCCN(CC1)CCC2CC2 269982a_100000185865_100000694398 [0,0,0,1,0,1|1,0,0]=3 7222 B13R2.6841 C1CCCN(CC1)CCC2CC2 34a_100000185865_100000694398 [0,0,0,1,0,1|1,0,0]=3 7223 B13R2.6841 C1CCCN(CC1)CCC2CO2 2230a_100000185865_100000732470 [0,0,0,1,0,1|0,0,0]=2 7224 B13R2.6841 C1CCCN(CC1)CCC2CO2 269982a_100000185865_100000732470 [0,0,0,1,0,1|0,0,0]=2 7225 B13R2.6841 C1CCCN(CC1)CCC2CO2 34a_100000185865_100000732470 [0,0,0,1,0,1|0,0,0]=2 7226 B13R2.6841 C1COCCN(C1)CCC2CC2 2230a_100000685342_100000694398 [0,0,0,1,0,1|2,0,0]=4 7227 B13R2.6841 C1COCCN(C1)CCC2CC2 269982a_100000685342_100000694398 [0,0,0,1,0,1|2,0,0]=4 7228 B13R2.6841 C1COCCN(C1)CCC2CC2 34a_100000685342_100000694398 [0,0,0,1,0,1|2,0,0]=4 7229 B13R2.6841 C1COCCN(C1)CCC2CO2 2230a_100000685342_100000732470 [0,0,0,1,0,1|1,0,0]=3 7230 B13R2.6841 C1COCCN(C1)CCC2CO2 269982a_100000685342_100000732470 [0,0,0,1,0,1|1,0,0]=3 7231 B13R2.6841 C1COCCN(C1)CCC2CO2 34a_100000685342_100000732470 [0,0,0,1,0,1|1,0,0]=3 7232 B13R2.13856 CC(C)CNC1CCCC2C1C2 269862a_100000210953_100000697651 [0,0,0,1,0,1|2,0,0]=4 7233 B13R2.13856 CC(O)CNC1CCCC2C1C2 269862a_100000210904_100000697651 [0,0,0,1,0,1|1,0,0]=3 7234 B13R2.543 C=C(C)CN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100000748629 [0,0,0,1,0,1|1,0,1]=4 7235 B13R2.543 C=C(C)CN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100000748629 [0,0,0,1,0,1|1,0,1]=4 7236 B13R2.543 C=C(C)CN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100000748629 [0,0,0,1,0,1|1,0,1]=4 7237 B13R2.543 C=C(C)CN1C[C@H]2COC[C@H]2C1 2230a_100000700037_100000748629 [0,0,0,1,0,1|1,0,1]=4 7238 B13R2.543 C=C(C)CN1C[C@H]2COC[C@H]2C1 269982a_100000700037_100000748629 [0,0,0,1,0,1|1,0,1]=4 7239 B13R2.543 C=C(C)CN1C[C@H]2COC[C@H]2C1 34a_100000700037_100000748629 [0,0,0,1,0,1|1,0,1]=4 7240 B13R2.543 CC(C)CN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100000210760 [0,0,0,1,0,1|1,0,0]=3 7241 B13R2.543 CC(C)CN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100000210624 [0,0,0,1,0,1|1,0,0]=3 7242 B13R2.543 CC(C)CN1C[C@H]2CCC[C@H]2C1 270004a_100102946302_100000210432 [0,0,0,1,0,1|1,0,0]=3 7243 B13R2.543 CC(C)CN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100000210624 [0,0,0,1,0,1|1,0,0]=3 7244 B13R2.543 CC(C)CN1C[C@H]2COC[C@H]2C1 2230a_100000700037_100000210760 [0,0,0,1,0,1|1,0,0]=3 7245 B13R2.543 CC(C)CN1C[C@H]2COC[C@H]2C1 269982a_100000700037_100000210624 [0,0,0,1,0,1|1,0,0]=3 7246 B13R2.543 CC(C)CN1C[C@H]2COC[C@H]2C1 270004a_100000700037_100000210432 [0,0,0,1,0,1|1,0,0]=3 7247 B13R2.543 CC(C)CN1C[C@H]2COC[C@H]2C1 34a_100000700037_100000210624 [0,0,0,1,0,1|1,0,0]=3 7248 B13R2.543 CC(O)CN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100011218427 [0,0,0,1,0,1|0,0,0]=2 7249 B13R2.543 CC(O)CN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100011218427 [0,0,0,1,0,1|0,0,0]=2 7250 B13R2.543 CC(O)CN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100011218427 [0,0,0,1,0,1|0,0,0]=2 7251 B13R2.543 CC(O)CN1C[C@H]2COC[C@H]2C1 2230a_100000700037_100011218427 [0,0,0,1,0,1|0,0,0]=2 7252 B13R2.543 CC(O)CN1C[C@H]2COC[C@H]2C1 269982a_100000700037_100011218427 [0,0,0,1,0,1|0,0,0]=2 7253 B13R2.543 CC(O)CN1C[C@H]2COC[C@H]2C1 34a_100000700037_100011218427 [0,0,0,1,0,1|0,0,0]=2 7254 B13R2.543 C[C@@H](O)CN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100009817552 [0,0,0,1,0,1|0,0,0]=2 7255 B13R2.543 C[C@@H](O)CN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100009817552 [0,0,0,1,0,1|0,0,0]=2 7256 B13R2.543 C[C@@H](O)CN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100009817552 [0,0,0,1,0,1|0,0,0]=2 7257 B13R2.543 C[C@@H](O)CN1C[C@H]2COC[C@H]2C1 2230a_100000700037_100009817552 [0,0,0,1,0,1|0,0,0]=2 7258 B13R2.543 C[C@@H](O)CN1C[C@H]2COC[C@H]2C1 269982a_100000700037_100009817552 [0,0,0,1,0,1|0,0,0]=2 7259 B13R2.543 C[C@@H](O)CN1C[C@H]2COC[C@H]2C1 34a_100000700037_100009817552 [0,0,0,1,0,1|0,0,0]=2 7260 B13R2.543 FC(F)CN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100011934356 [0,0,0,1,0,1|2,0,0]=4 7261 B13R2.543 FC(F)CN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100011934356 [0,0,0,1,0,1|2,0,0]=4 7262 B13R2.543 FC(F)CN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100011934356 [0,0,0,1,0,1|2,0,0]=4 7263 B13R2.543 FC(F)CN1C[C@H]2COC[C@H]2C1 2230a_100000700037_100011934356 [0,0,0,1,0,1|2,0,0]=4 7264 B13R2.543 FC(F)CN1C[C@H]2COC[C@H]2C1 269982a_100000700037_100011934356 [0,0,0,1,0,1|2,0,0]=4 7265 B13R2.543 FC(F)CN1C[C@H]2COC[C@H]2C1 34a_100000700037_100011934356 [0,0,0,1,0,1|2,0,0]=4 7266 B13R2.6839 C1CCCN(CCC1)CC2CC2 2230a_100000211400_100000742324 [0,0,0,1,0,1|1,0,0]=3 7267 B13R2.6839 C1CCCN(CCC1)CC2CC2 269982a_100000211400_100000756562 [0,0,0,1,0,1|1,0,0]=3 7268 B13R2.6839 C1CCCN(CCC1)CC2CC2 34a_100000211400_100000742324 [0,0,0,1,0,1|1,0,0]=3 7269 B13R2.6839 C1CCCN(CCC1)CC2CO2 2230a_100000211400_100011216344 [0,0,0,1,0,1|0,0,0]=2 7270 B13R2.6839 C1CCCN(CCC1)CC2CO2 269982a_100000211400_102125554688 [0,0,0,1,0,1|0,0,0]=2 7271 B13R2.6839 C1CCCN(CCC1)CC2CO2 34a_100000211400_102125554688 [0,0,0,1,0,1|0,0,0]=2 7272 B13R2.6839 C1CCCN(CCC1)CC2CS2 269982a_100000211400_100000031435 [0,0,0,1,0,1|0,1,0]=3 7273 B13R2.6839 C1CCCN(CCC1)C[C@@H]2CO2 269982a_100000211400_100000745022 [0,0,0,1,0,1|0,0,0]=2 7274 B13R2.544 C=C(C)CN1CC2CCC(C1)O2 2230a_100015188616_100000748629 [0,1,0,1,0,0|1,0,1]=4 7275 B13R2.544 C=C(C)CN1CC2CCC(C1)O2 269982a_100015188616_100000748629 [0,1,0,1,0,0|1,0,1]=4 7276 B13R2.544 C=C(C)CN1CC2CCC(C1)O2 34a_100015188616_100000748629 [0,1,0,1,0,0|1,0,1]=4 7277 B13R2.544 CC(C)CN1CC2CCC(C1)O2 2230a_100015188616_100000210760 [0,1,0,1,0,0|1,0,0]=3 7278 B13R2.544 CC(C)CN1CC2CCC(C1)O2 269982a_100015188616_100000210624 [0,1,0,1,0,0|1,0,0]=3 7279 B13R2.544 CC(C)CN1CC2CCC(C1)O2 270004a_100015188616_100000210432 [0,1,0,1,0,0|1,0,0]=3 7280 B13R2.544 CC(C)CN1CC2CCC(C1)O2 34a_100015188616_100000210624 [0,1,0,1,0,0|1,0,0]=3 7281 B13R2.544 CC(O)CN1CC2CCC(C1)O2 2230a_100015188616_100011218427 [0,1,0,1,0,0|0,0,0]=2 7282 B13R2.544 CC(O)CN1CC2CCC(C1)O2 269982a_100015188616_100011218427 [0,1,0,1,0,0|0,0,0]=2 7283 B13R2.544 CC(O)CN1CC2CCC(C1)O2 34a_100015188616_100011218427 [0,1,0,1,0,0|0,0,0]=2 7284 B13R2.544 C[C@@H](O)CN1CC2CCC(C1)O2 2230a_100015188616_100009817552 [0,1,0,1,0,0|0,0,0]=2 7285 B13R2.544 C[C@@H](O)CN1CC2CCC(C1)O2 269982a_100015188616_100009817552 [0,1,0,1,0,0|0,0,0]=2 7286 B13R2.544 C[C@@H](O)CN1CC2CCC(C1)O2 34a_100015188616_100009817552 [0,1,0,1,0,0|0,0,0]=2 7287 B13R2.544 FC(F)CN1CC2CCC(C1)O2 2230a_100015188616_100011934356 [0,1,0,1,0,0|2,0,0]=4 7288 B13R2.544 FC(F)CN1CC2CCC(C1)O2 269982a_100015188616_100011934356 [0,1,0,1,0,0|2,0,0]=4 7289 B13R2.544 FC(F)CN1CC2CCC(C1)O2 34a_100015188616_100011934356 [0,1,0,1,0,0|2,0,0]=4 7290 B13R2.10288 O=C1CN(CCCN1)CC2CO2 2230a_100015190381_100011216344 [0,1,0,1,0,0|1,0,1]=4 7291 B13R2.10288 OC1CCCCN(C1)CC2CC2 2230a_100025706797_100000742324 [0,1,0,1,0,0|1,0,0]=3 7292 B13R2.10288 OC1CCCCN(C1)CC2CC2 269982a_100025706797_100000756562 [0,1,0,1,0,0|1,0,0]=3 7293 B13R2.10288 OC1CCCCN(C1)CC2CO2 2230a_100025706797_100011216344 [0,1,0,1,0,0|0,0,0]=2 7294 B13R2.10288 OC1CCCCN(C1)CC2CO2 269982a_100025706797_102125554688 [0,1,0,1,0,0|0,0,0]=2 7295 B13R2.10288 OC1CCCCN(C1)CC2CS2 269982a_100025706797_100000031435 [0,1,0,1,0,0|0,1,0]=3 7296 B13R2.10288 OC1CCCCN(C1)C[C@@H]2CO2 269982a_100025706797_100000745022 [0,1,0,1,0,0|0,0,0]=2 7297 B13R2.10288 O[C@H]1COCCN(C1)CC2CC2 2230a_100016073750_100000742324 [0,1,0,1,0,0|2,0,0]=4 7298 B13R2.10288 O[C@H]1COCCN(C1)CC2CC2 269982a_100016073750_100000756562 [0,1,0,1,0,0|2,0,0]=4 7299 B13R2.10288 O[C@H]1COCCN(C1)CC2CO2 2230a_100016073750_100011216344 [0,1,0,1,0,0|1,0,0]=3 7300 B13R2.10288 O[C@H]1COCCN(C1)CC2CO2 269982a_100016073750_102125554688 [0,1,0,1,0,0|1,0,0]=3 7301 B13R2.10288 O[C@H]1COCCN(C1)CC2CS2 269982a_100016073750_100000031435 [0,1,0,1,0,0|1,1,0]=4 7302 B13R2.10288 O[C@H]1COCCN(C1)C[C@@H]2CO2 269982a_100016073750_100000745022 [0,1,0,1,0,0|1,0,0]=3 7303 B13R2.11178 CC1CCCN(CC1)CC2CC2 2230a_100025706717_100000742324 [0,1,0,1,0,0|1,0,0]=3 7304 B13R2.11178 CC1CCCN(CC1)CC2CC2 269982a_100025706717_100000756562 [0,1,0,1,0,0|1,0,0]=3 7305 B13R2.11178 CC1CCCN(CC1)CC2CC2 34a_100025706717_100000742324 [0,1,0,1,0,0|1,0,0]=3 7306 B13R2.11178 CC1CCCN(CC1)CC2CO2 2230a_100025706717_100011216344 [0,1,0,1,0,0|0,0,0]=2 7307 B13R2.11178 CC1CCCN(CC1)CC2CO2 269982a_100025706717_102125554688 [0,1,0,1,0,0|0,0,0]=2 7308 B13R2.11178 CC1CCCN(CC1)CC2CO2 34a_100025706717_102125554688 [0,1,0,1,0,0|0,0,0]=2 7309 B13R2.11178 CC1CCCN(CC1)CC2CS2 269982a_100025706717_100000031435 [0,1,0,1,0,0|0,1,0]=3 7310 B13R2.11178 CC1CCCN(CC1)C[C@@H]2CO2 269982a_100025706717_100000745022 [0,1,0,1,0,0|0,0,0]=2 7311 B13R2.11178 CN1CCCN(CC1)CC2CC2 2230a_100000211313_100000742324 [0,1,0,1,0,0|2,0,0]=4 7312 B13R2.11178 CN1CCCN(CC1)CC2CC2 269982a_100000211313_100000756562 [0,1,0,1,0,0|2,0,0]=4 7313 B13R2.11178 CN1CCCN(CC1)CC2CO2 2230a_100000211313_100011216344 [0,1,0,1,0,0|1,0,0]=3 7314 B13R2.11178 CN1CCCN(CC1)CC2CO2 269982a_100000211313_102125554688 [0,1,0,1,0,0|1,0,0]=3 7315 B13R2.11178 CN1CCCN(CC1)CC2CS2 269982a_100000211313_100000031435 [0,1,0,1,0,0|1,1,0]=4 7316 B13R2.11178 CN1CCCN(CC1)C[C@@H]2CO2 269982a_100000211313_100000745022 [0,1,0,1,0,0|1,0,0]=3 7317 B13R2.11178 O=C1CCN(CCN1)CC2CO2 2230a_100000698595_100011216344 [0,1,0,1,0,0|1,0,1]=4 7318 B13R2.11178 O=C1CCN(CCN1)CC2CO2 269982a_100000698595_102125554688 [0,1,0,1,0,0|1,0,1]=4 7319 B13R2.11178 O=C1CCN(CCN1)C[C@@H]2CO2 269982a_100000698595_100000745022 [0,1,0,1,0,0|1,0,1]=4 7320 B13R2.11178 OC1CCCN(CC1)CC2CC2 2230a_100015186869_100000742324 [0,1,0,1,0,0|1,0,0]=3 7321 B13R2.11178 OC1CCCN(CC1)CC2CC2 269982a_100015186869_100000756562 [0,1,0,1,0,0|1,0,0]=3 7322 B13R2.11178 OC1CCCN(CC1)CC2CO2 2230a_100015186869_100011216344 [0,1,0,1,0,0|0,0,0]=2 7323 B13R2.11178 OC1CCCN(CC1)CC2CO2 269982a_100015186869_102125554688 [0,1,0,1,0,0|0,0,0]=2 7324 B13R2.11178 OC1CCCN(CC1)CC2CS2 269982a_100015186869_100000031435 [0,1,0,1,0,0|0,1,0]=3 7325 B13R2.11178 OC1CCCN(CC1)C[C@@H]2CO2 269982a_100015186869_100000745022 [0,1,0,1,0,0|0,0,0]=2 7326 B13R2.4880 O=C1CCC1N2CCCCCC2 269982a_100000185865_100009892977 [0,1,0,1,0,0|0,0,2]=4 7327 B13R2.4880 O=C1CCC1N2CCCCCC2 34a_100000185865_100009892977 [0,1,0,1,0,0|0,0,2]=4 7328 B13R2.5685 C[C@H](CO)NC1CCCC2C1C2 269862a_100000737577_100000697651 [0,1,0,1,0,0|2,0,0]=4 7329 B13R2.6840 C1CC(C1)CN2CCCOCC2 2230a_100000685342_100000763275 [0,1,0,1,0,0|2,0,0]=4 7330 B13R2.6840 C1CC(C1)CN2CCCOCC2 269982a_100000685342_100000763275 [0,1,0,1,0,0|2,0,0]=4 7331 B13R2.6840 C1CC(C1)CN2CCCOCC2 34a_100000685342_100000763275 [0,1,0,1,0,0|2,0,0]=4 7332 B13R2.6840 C1CCCC(CC1)NC2COC2 270004a_100016991112_100000210131 [0,1,0,1,0,0|2,0,0]=4 7333 B13R2.6840 C1CCCC(CC1)NC2COC2 34a_100000210984_100009818527 [0,1,0,1,0,0|2,0,0]=4 7334 B13R2.6840 C1CCCC(CC1)OC2COC2 34a_100000210887_100009818527 [0,1,0,1,0,0|2,0,0]=4 7335 B13R2.6840 C1CCCC(CC1)OC2COC2 7a_100000210887_100009818527 [0,1,0,1,0,0|2,0,0]=4 7336 B13R2.6840 C1CCCC(CC1)SC2COC2 62a_100011217769_100009818527 [0,1,0,1,0,0|2,0,0]=4 7337 B13R2.6840 C1CCCN(CC1)CC2CCC2 2230a_100000185865_100000763275 [0,1,0,1,0,0|1,0,0]=3 7338 B13R2.6840 C1CCCN(CC1)CC2CCC2 269982a_100000185865_100000763275 [0,1,0,1,0,0|1,0,0]=3 7339 B13R2.6840 C1CCCN(CC1)CC2CCC2 34a_100000185865_100000763275 [0,1,0,1,0,0|1,0,0]=3 7340 B13R2.6840 C1CCCN(CC1)CC2CCO2 2230a_100000185865_100000103362 [0,1,0,1,0,0|0,0,0]=2 7341 B13R2.6840 C1CCCN(CC1)CC2CCO2 269982a_100000185865_100000103362 [0,1,0,1,0,0|0,0,0]=2 7342 B13R2.6840 C1CCCN(CC1)CC2CCO2 34a_100000185865_100000103362 [0,1,0,1,0,0|0,0,0]=2 7343 B13R2.6840 C1CCCN(CC1)CC2COC2 2230a_100000185865_100010264016 [0,1,0,1,0,0|0,0,0]=2 7344 B13R2.6840 C1CCCN(CC1)CC2COC2 269982a_100000185865_100010264016 [0,1,0,1,0,0|0,0,0]=2 7345 B13R2.6840 C1CCCN(CC1)CC2COC2 34a_100000185865_100010264016 [0,1,0,1,0,0|0,0,0]=2 7346 B13R2.6840 C1COCCN(C1)CC2CCO2 2230a_100000685342_100000103362 [0,1,0,1,0,0|1,0,0]=3 7347 B13R2.6840 C1COCCN(C1)CC2CCO2 269982a_100000685342_100000103362 [0,1,0,1,0,0|1,0,0]=3 7348 B13R2.6840 C1COCCN(C1)CC2CCO2 34a_100000685342_100000103362 [0,1,0,1,0,0|1,0,0]=3 7349 B13R2.6840 C1COCCN(C1)CC2COC2 2230a_100000685342_100010264016 [0,1,0,1,0,0|1,0,0]=3 7350 B13R2.6840 C1COCCN(C1)CC2COC2 269982a_100000685342_100010264016 [0,1,0,1,0,0|1,0,0]=3 7351 B13R2.6840 C1COCCN(C1)CC2COC2 34a_100000685342_100010264016 [0,1,0,1,0,0|1,0,0]=3 7352 B13R2.10493 CC1(CO1)CN2CCCCCC2 269982a_100000185865_100000760498 [0,1,0,1,0,0|0,0,0]=2 7353 B13R2.10493 CC1(CO1)CN2CCCCCC2 34a_100000185865_100000760498 [0,1,0,1,0,0|0,0,0]=2 7354 B13R2.10493 CC1(CO1)CN2CCCOCC2 269982a_100000685342_100000760498 [0,1,0,1,0,0|1,0,0]=3 7355 B13R2.10493 CC1(CO1)CN2CCCOCC2 34a_100000685342_100000760498 [0,1,0,1,0,0|1,0,0]=3 7356 B13R2.2283 CC(C1CO1)N2CCCCCC2 270004a_100000185865_100000031964 [0,1,0,1,0,0|0,0,0]=2 7357 B13R2.2283 CC(C1CO1)N2CCCOCC2 270004a_100000685342_100000031964 [0,1,0,1,0,0|1,0,0]=3 7358 B13R2.2283 O=C(C1CC1)N2CCCCCC2 11a_100000185865_100000210395 [0,1,0,1,0,0|1,0,1]=4 7359 B13R2.2283 O=C(C1CC1)N2CCCCCC2 1626a_100000185865_100000210395 [0,1,0,1,0,0|1,0,1]=4 7360 B13R2.2283 O=C(C1CC1)N2CCCCCC2 240690a_100000185865_100000210395 [0,1,0,1,0,0|1,0,1]=4 7361 B13R2.2283 O=C(C1CC1)N2CCCCCC2 527a_100000185865_100000210395 [0,1,0,1,0,0|1,0,1]=4 7362 B13R2.2283 O=C(C1CCCCCC1)C2CO2 1458a_100000701028_100011217769 [0,1,0,1,0,0|1,0,1]=4 7363 B13R2.2283 O=C(C1CO1)N2CCCCCC2 11a_100000185865_100000701028 [0,1,0,1,0,0|0,0,1]=3 7364 B13R2.2283 O=C(C1CO1)N2CCCCCC2 1626a_100000185865_100000701028 [0,1,0,1,0,0|0,0,1]=3 7365 B13R2.2283 O=C(C1CO1)N2CCCCCC2 240690a_100000185865_100000701028 [0,1,0,1,0,0|0,0,1]=3 7366 B13R2.2283 O=C(C1CO1)N2CCCCCC2 527a_100000185865_100000701028 [0,1,0,1,0,0|0,0,1]=3 7367 B13R2.2283 O=C(C1CO1)N2CCCOCC2 11a_100000685342_100000701028 [0,1,0,1,0,0|1,0,1]=4 7368 B13R2.2283 O=C(C1CO1)N2CCCOCC2 1626a_100000685342_100000701028 [0,1,0,1,0,0|1,0,1]=4 7369 B13R2.2283 O=C(C1CO1)N2CCCOCC2 240690a_100000685342_100000701028 [0,1,0,1,0,0|1,0,1]=4 7370 B13R2.2283 O=C(C1CO1)N2CCCOCC2 527a_100000685342_100000701028 [0,1,0,1,0,0|1,0,1]=4 7371 B9R0.47 CC(C)N(C)CCCCF 269982a_200000211004_100000729493 [0,0,1,0,1,0|2,0,0]=4 7372 B9R0.47 CC(C)N(C)CCCCO 2230a_100000717598_100000210206 [0,0,1,0,1,0|2,0,0]=4 7373 B9R0.47 CC(C)N(C)CCCCO 2230a_100011521146_200000210301 [0,0,1,0,1,0|2,0,0]=4 7374 B9R0.47 CC(C)N(C)CCCCO 269982a_100000717598_100000210206 [0,0,1,0,1,0|2,0,0]=4 7375 B9R0.47 CC(C)N(C)CCCCO 269982a_100011521146_200000210301 [0,0,1,0,1,0|2,0,0]=4 7376 B9R0.47 CC(C)N(C)CCCCO 269982a_200000211004_100000210776 [0,0,1,0,1,0|2,0,0]=4 7377 B9R0.47 CC(C)N([13CH3])CCCCO 2230a_100011521146_200025704644 [0,0,1,0,1,0|2,0,0]=4 7378 B9R0.47 CC(C)N([13CH3])CCCCO 269982a_100011521146_200025704644 [0,0,1,0,1,0|2,0,0]=4 7379 B9R0.47 CCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210326 [0,0,1,0,1,0|2,0,0]=4 7380 B9R0.47 CCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210326 [0,0,1,0,1,0|2,0,0]=4 7381 B9R0.47 CCCCCN(C)C(=O)C 11a_100000223495_100015343762 [0,0,1,0,1,0|0,0,2]=4 7382 B9R0.47 CCCCCN(C)C(=O)C 1626a_100000223495_100015343762 [0,0,1,0,1,0|0,0,2]=4 7383 B9R0.47 CCCCCN(C)C(=O)C 240690a_100000223495_100015343762 [0,0,1,0,1,0|0,0,2]=4 7384 B9R0.47 CCCCCN(C)C(=O)C 527a_100000223495_100103153847 [0,0,1,0,1,0|0,0,2]=4 7385 B9R0.47 CCCCCN(C)C(C)C 2230a_100000223495_100000210206 [0,0,1,0,1,0|1,0,0]=3 7386 B9R0.47 CCCCCN(C)C(C)C 2230a_100000223497_200000210301 [0,0,1,0,1,0|1,0,0]=3 7387 B9R0.47 CCCCCN(C)C(C)C 269982a_100000223495_100000210206 [0,0,1,0,1,0|1,0,0]=3 7388 B9R0.47 CCCCCN(C)C(C)C 269982a_100000223497_200000210301 [0,0,1,0,1,0|1,0,0]=3 7389 B9R0.47 CCCCCN(C)C(C)C 269982a_200000211004_100000210215 [0,0,1,0,1,0|1,0,0]=3 7390 B9R0.47 CCCCCN([13CH3])C(C)C 2230a_100000223497_200025704644 [0,0,1,0,1,0|1,0,0]=3 7391 B9R0.47 CCCCCN([13CH3])C(C)C 269982a_100000223497_200025704644 [0,0,1,0,1,0|1,0,0]=3 7392 B9R0.47 CCOCCN(C)C(C)C 269982a_200000211004_100011215890 [0,0,1,0,1,0|2,0,0]=4 7393 B9R0.47 CCSCCN(C)C(C)C 269982a_200000211004_100000757381 [0,0,1,0,1,0|2,0,0]=4 7394 B9R0.47 COCCCN(C)C(C)C 2230a_100000224831_100000210206 [0,0,1,0,1,0|2,0,0]=4 7395 B9R0.47 COCCCN(C)C(C)C 269982a_100000224831_100000210206 [0,0,1,0,1,0|2,0,0]=4 7396 B9R0.47 COCCCN(C)C(C)C 269982a_200000211004_100000740836 [0,0,1,0,1,0|2,0,0]=4 7397 B9R0.15 CCCN(CCC)C(=O)C 11a_100000210455_100015343762 [0,0,1,0,1,0|0,0,2]=4 7398 B9R0.15 CCCN(CCC)C(=O)C 1626a_100000210455_100015343762 [0,0,1,0,1,0|0,0,2]=4 7399 B9R0.15 CCCN(CCC)C(=O)C 240690a_100000210455_100015343762 [0,0,1,0,1,0|0,0,2]=4 7400 B9R0.15 CCCN(CCC)C(=O)C 527a_100000210455_100103153847 [0,0,1,0,1,0|0,0,2]=4 7401 B9R0.15 CCCN(CCC)C(C)C 2230a_100000210455_100000210206 [0,0,1,0,1,0|1,0,0]=3 7402 B9R0.15 CCCN(CCC)C(C)C 2230a_106256033942_100000210303 [0,0,1,0,1,0|1,0,0]=3 7403 B9R0.15 CCCN(CCC)C(C)C 269982a_100000210455_100000210206 [0,0,1,0,1,0|1,0,0]=3 7404 B9R0.15 CCCN(CCC)C(C)C 269982a_106256033942_100000210303 [0,0,1,0,1,0|1,0,0]=3 7405 B9R0.15 CCCN(CCF)C(C)C 2230a_106256033942_100011217306 [0,0,1,0,1,0|2,0,0]=4 7406 B9R0.15 CCCN(CCF)C(C)C 269982a_106256033942_100011217306 [0,0,1,0,1,0|2,0,0]=4 7407 B9R0.15 CCCN(CCO)C(C)C 2230a_100000211420_100000210206 [0,0,1,0,1,0|2,0,0]=4 7408 B9R0.15 CCCN(CCO)C(C)C 2230a_100000224655_100000210303 [0,0,1,0,1,0|2,0,0]=4 7409 B9R0.15 CCCN(CCO)C(C)C 2230a_106256033942_100000211926 [0,0,1,0,1,0|2,0,0]=4 7410 B9R0.15 CCCN(CCO)C(C)C 269982a_100000211420_100000210206 [0,0,1,0,1,0|2,0,0]=4 7411 B9R0.15 CCCN(CCO)C(C)C 269982a_100000224655_100000210303 [0,0,1,0,1,0|2,0,0]=4 7412 B9R0.15 CCCN(CCO)C(C)C 269982a_106256033942_100000211926 [0,0,1,0,1,0|2,0,0]=4 7413 B9R0.15 CCCN(COC)C(C)C 2230a_106256033942_100000766300 [0,0,1,0,1,0|2,0,0]=4 7414 B9R0.15 CCCN(COC)C(C)C 269982a_106256033942_100000766300 [0,0,1,0,1,0|2,0,0]=4 7415 B9R0.15 CCCN(CSC)C(C)C 2230a_106256033942_100011218213 [0,0,1,0,1,0|2,0,0]=4 7416 B9R0.15 CCCN(CSC)C(C)C 269982a_106256033942_100011218213 [0,0,1,0,1,0|2,0,0]=4 7417 B9R0.13 CCCCN(CC)C(=O)C 11a_100000207695_100015343762 [0,0,1,0,1,0|0,0,2]=4 7418 B9R0.13 CCCCN(CC)C(=O)C 1626a_100000207695_100015343762 [0,0,1,0,1,0|0,0,2]=4 7419 B9R0.13 CCCCN(CC)C(=O)C 240690a_100000207695_100015343762 [0,0,1,0,1,0|0,0,2]=4 7420 B9R0.13 CCCCN(CC)C(=O)C 527a_100000207695_100103153847 [0,0,1,0,1,0|0,0,2]=4 7421 B9R0.13 CCCCN(CC)C(C)C 2230a_100000207398_100000210202 [0,0,1,0,1,0|1,0,0]=3 7422 B9R0.13 CCCCN(CC)C(C)C 2230a_100000207695_100000210206 [0,0,1,0,1,0|1,0,0]=3 7423 B9R0.13 CCCCN(CC)C(C)C 2230a_100000223864_100000210211 [0,0,1,0,1,0|1,0,0]=3 7424 B9R0.13 CCCCN(CC)C(C)C 269982a_100000207398_100000204670 [0,0,1,0,1,0|1,0,0]=3 7425 B9R0.13 CCCCN(CC)C(C)C 269982a_100000207695_100000210206 [0,0,1,0,1,0|1,0,0]=3 7426 B9R0.13 CCCCN(CC)C(C)C 269982a_100000223864_100000210211 [0,0,1,0,1,0|1,0,0]=3 7427 B9R0.13 CCCCN(CF)C(C)C 269982a_100000207398_100015361967 [0,0,1,0,1,0|2,0,0]=4 7428 B9R0.13 CCCN[C@@H](CC)[C@@H](C)O 2230a_100161114882_100000210303 [0,0,1,0,1,0|2,0,0]=4 7429 B9R0.13 CCCN[C@@H](CC)[C@@H](C)O 34a_100161114882_100000210303 [0,0,1,0,1,0|2,0,0]=4 7430 B9R0.13 CCN(CCCF)C(C)C 2230a_100000223864_100011934791 [0,0,1,0,1,0|2,0,0]=4 7431 B9R0.13 CCN(CCCF)C(C)C 269982a_100000223864_100011934791 [0,0,1,0,1,0|2,0,0]=4 7432 B9R0.13 CCN(CCCO)C(C)C 2230a_100000182298_100000210202 [0,0,1,0,1,0|2,0,0]=4 7433 B9R0.13 CCN(CCCO)C(C)C 2230a_100000223864_100000230001 [0,0,1,0,1,0|2,0,0]=4 7434 B9R0.13 CCN(CCCO)C(C)C 269982a_100000182298_100000204670 [0,0,1,0,1,0|2,0,0]=4 7435 B9R0.13 CCN(CCCO)C(C)C 269982a_100000223864_100011215043 [0,0,1,0,1,0|2,0,0]=4 7436 B9R0.13 CCN(CCOC)C(C)C 2230a_100000223864_100011201679 [0,0,1,0,1,0|2,0,0]=4 7437 B9R0.13 CCN(CCOC)C(C)C 2230a_100000731262_100000210206 [0,0,1,0,1,0|2,0,0]=4 7438 B9R0.13 CCN(CCOC)C(C)C 2230a_200000223778_100000210202 [0,0,1,0,1,0|2,0,0]=4 7439 B9R0.13 CCN(CCOC)C(C)C 269982a_100000223864_100000233755 [0,0,1,0,1,0|2,0,0]=4 7440 B9R0.13 CCN(CCOC)C(C)C 269982a_100000731262_100000210206 [0,0,1,0,1,0|2,0,0]=4 7441 B9R0.13 CCN(CCOC)C(C)C 269982a_200000223778_100000204670 [0,0,1,0,1,0|2,0,0]=4 7442 B9R0.13 CCN(CCSC)C(C)C 2230a_100000223864_100000751147 [0,0,1,0,1,0|2,0,0]=4 7443 B9R0.13 CCN(CCSC)C(C)C 269982a_100000223864_100000212216 [0,0,1,0,1,0|2,0,0]=4 7444 B9R0.13 CCOCN(CC)C(C)C 269982a_100000223864_100000739092 [0,0,1,0,1,0|2,0,0]=4 7445 B9R1.8 CCCN1CC=CCC1 2230a_100000698166_100000210303 [1,0,0,0,1,0|0,0,2]=4 7446 B9R1.8 CCCN1CC=CCC1 269982a_100000698166_100000210303 [1,0,0,0,1,0|0,0,2]=4 7447 B9R1.8 CCCN1CC=CCC1 34a_100000698166_100000210303 [1,0,0,0,1,0|0,0,2]=4 7448 B9R1.8 CCCN1CCCOC1 2230a_100000131196_100000210303 [1,0,0,0,1,0|1,0,0]=3 7449 B9R1.8 CCCN1CCCOC1 269982a_100000131196_100000210303 [1,0,0,0,1,0|1,0,0]=3 7450 B9R1.8 CCCN1CCCOC1 34a_100000131196_100000210303 [1,0,0,0,1,0|1,0,0]=3 7451 B9R1.8 CCCN1CCOCC1 2230a_100015191051_100000210303 [1,0,0,0,1,0|1,0,0]=3 7452 B9R1.8 CCCN1CCOCC1 269982a_100015191051_100000210303 [1,0,0,0,1,0|1,0,0]=3 7453 B9R1.8 CCCN1CCOCC1 34a_100015191051_100000210303 [1,0,0,0,1,0|1,0,0]=3 7454 B9R1.8 CCCN1CCSCC1 2230a_100000737611_100000210303 [1,0,0,0,1,0|1,0,0]=3 7455 B9R1.8 CCCN1CCSCC1 269982a_100000737611_100000210303 [1,0,0,0,1,0|1,0,0]=3 7456 B9R1.8 CCNC1CCCCC1 2230a_100000182618_100000210202 [1,0,0,0,1,0|2,0,0]=4 7457 B9R1.8 CCNC1CCCCC1 270004a_100015525214_100000210434 [1,0,0,0,1,0|2,0,0]=4 7458 B9R1.8 CCNC1CCCCC1 34a_100000182618_100000210202 [1,0,0,0,1,0|2,0,0]=4 7459 B9R1.8 CCOC1CCCCC1 34a_100000210231_100000210202 [1,0,0,0,1,0|2,0,0]=4 7460 B9R1.8 CCOC1CCCCC1 34a_100121572206_100000210327 [1,0,0,0,1,0|2,0,0]=4 7461 B9R1.8 CCOC1CCCCC1 7a_100000210231_100000210202 [1,0,0,0,1,0|2,0,0]=4 7462 B9R1.8 CCSC1CCCCC1 62a_100000210202_100000210327 [1,0,0,0,1,0|2,0,0]=4 7463 B9R1.8 CCSC1CCCCC1 62a_100000210327_100000210202 [1,0,0,0,1,0|2,0,0]=4 7464 B9R1.8 CNCC1CCCCC1 2230a_100000210473_200000210301 [1,0,0,0,1,0|2,0,0]=4 7465 B9R1.8 CNCC1CCCCC1 2230a_106832991635_100000211423 [1,0,0,0,1,0|2,0,0]=4 7466 B9R1.8 CNCC1CCCCC1 269862a_106832991636_100000211278 [1,0,0,0,1,0|2,0,0]=4 7467 B9R1.8 CNCC1CCCCC1 34a_100000210473_200000210301 [1,0,0,0,1,0|2,0,0]=4 7468 B9R1.8 CNCC1CCCCC1 34a_100102657272_100000211423 [1,0,0,0,1,0|2,0,0]=4 7469 B9R1.8 CNCC1CCCCC1 7a_106832991635_100000211423 [1,0,0,0,1,0|2,0,0]=4 7470 B9R1.8 COCC1CCCCC1 34a_100000212181_200000210301 [1,0,0,0,1,0|2,0,0]=4 7471 B9R1.8 COCC1CCCCC1 34a_100138415774_100000211423 [1,0,0,0,1,0|2,0,0]=4 7472 B9R1.8 COCC1CCCCC1 7a_100000212181_200000210301 [1,0,0,0,1,0|2,0,0]=4 7473 B9R1.8 COCN1CCCOC1 2230a_100000131196_100000766300 [1,0,0,0,1,0|2,0,0]=4 7474 B9R1.8 COCN1CCCOC1 269982a_100000131196_100000766300 [1,0,0,0,1,0|2,0,0]=4 7475 B9R1.8 COCN1CCOCC1 2230a_100015191051_100000766300 [1,0,0,0,1,0|2,0,0]=4 7476 B9R1.8 COCN1CCOCC1 269982a_100015191051_100000766300 [1,0,0,0,1,0|2,0,0]=4 7477 B9R1.8 COCN1CCSCC1 2230a_100000737611_100000766300 [1,0,0,0,1,0|2,0,0]=4 7478 B9R1.8 COCN1CCSCC1 269982a_100000737611_100000766300 [1,0,0,0,1,0|2,0,0]=4 7479 B9R1.8 CSCC1CCCCC1 62a_100000211423_200000210301 [1,0,0,0,1,0|2,0,0]=4 7480 B9R1.8 CSCC1CCCCC1 62a_200000210301_100000211423 [1,0,0,0,1,0|2,0,0]=4 7481 B9R1.8 CSCN1CCCOC1 2230a_100000131196_100011218213 [1,0,0,0,1,0|2,0,0]=4 7482 B9R1.8 CSCN1CCCOC1 269982a_100000131196_100011218213 [1,0,0,0,1,0|2,0,0]=4 7483 B9R1.8 CSCN1CCCOC1 34a_100000131196_100011218213 [1,0,0,0,1,0|2,0,0]=4 7484 B9R1.8 CSCN1CCOCC1 2230a_100015191051_100011218213 [1,0,0,0,1,0|2,0,0]=4 7485 B9R1.8 CSCN1CCOCC1 269982a_100015191051_100011218213 [1,0,0,0,1,0|2,0,0]=4 7486 B9R1.8 CSCN1CCOCC1 34a_100015191051_100011218213 [1,0,0,0,1,0|2,0,0]=4 7487 B9R1.8 CSCN1CCSCC1 2230a_100000737611_100011218213 [1,0,0,0,1,0|2,0,0]=4 7488 B9R1.8 CSCN1CCSCC1 269982a_100000737611_100011218213 [1,0,0,0,1,0|2,0,0]=4 7489 B9R1.8 FCCN1CCCOC1 2230a_100000131196_100011217306 [1,0,0,0,1,0|2,0,0]=4 7490 B9R1.8 FCCN1CCCOC1 269982a_100000131196_100011217306 [1,0,0,0,1,0|2,0,0]=4 7491 B9R1.8 FCCN1CCCOC1 34a_100000131196_100011217306 [1,0,0,0,1,0|2,0,0]=4 7492 B9R1.8 FCCN1CCOCC1 2230a_100015191051_100011217306 [1,0,0,0,1,0|2,0,0]=4 7493 B9R1.8 FCCN1CCOCC1 269982a_100015191051_100011217306 [1,0,0,0,1,0|2,0,0]=4 7494 B9R1.8 FCCN1CCOCC1 34a_100015191051_100011217306 [1,0,0,0,1,0|2,0,0]=4 7495 B9R1.8 FCCN1CCSCC1 2230a_100000737611_100011217306 [1,0,0,0,1,0|2,0,0]=4 7496 B9R1.8 FCCN1CCSCC1 269982a_100000737611_100011217306 [1,0,0,0,1,0|2,0,0]=4 7497 B9R1.8 OCCN1CC=CCC1 2230a_100000698166_100000211926 [1,0,0,0,1,0|0,0,2]=4 7498 B9R1.8 OCCN1CC=CCC1 269982a_100000698166_100000211926 [1,0,0,0,1,0|0,0,2]=4 7499 B9R1.8 OCCN1CC=CCC1 34a_100000698166_100000211926 [1,0,0,0,1,0|0,0,2]=4 7500 B9R1.8 OCCN1CCCOC1 2230a_100000131196_100000211926 [1,0,0,0,1,0|1,0,0]=3 7501 B9R1.8 OCCN1CCCOC1 269982a_100000131196_100000211926 [1,0,0,0,1,0|1,0,0]=3 7502 B9R1.8 OCCN1CCCOC1 34a_100000131196_100000211926 [1,0,0,0,1,0|1,0,0]=3 7503 B9R1.8 OCCN1CCOCC1 2230a_100015191051_100000211926 [1,0,0,0,1,0|1,0,0]=3 7504 B9R1.8 OCCN1CCOCC1 269982a_100015191051_100000211926 [1,0,0,0,1,0|1,0,0]=3 7505 B9R1.8 OCCN1CCOCC1 34a_100015191051_100000211926 [1,0,0,0,1,0|1,0,0]=3 7506 B9R1.8 OCCN1CCSCC1 2230a_100000737611_100000211926 [1,0,0,0,1,0|1,0,0]=3 7507 B9R1.8 OCCN1CCSCC1 269982a_100000737611_100000211926 [1,0,0,0,1,0|1,0,0]=3 7508 B9R1.8 [13CH3]NCC1CCCCC1 2230a_100000210473_200025704644 [1,0,0,0,1,0|2,0,0]=4 7509 B9R1.8 [13CH3]NCC1CCCCC1 34a_100000210473_200025704644 [1,0,0,0,1,0|2,0,0]=4 7510 B9R1.8 [13CH3]OCC1CCCCC1 34a_100000212181_200025704644 [1,0,0,0,1,0|2,0,0]=4 7511 B9R1.8 [13CH3]OCC1CCCCC1 7a_100000212181_200025704644 [1,0,0,0,1,0|2,0,0]=4 7512 B9R1.8 [13CH3]SCC1CCCCC1 62a_100000211423_200025704644 [1,0,0,0,1,0|2,0,0]=4 7513 B9R1.8 [13CH3]SCC1CCCCC1 62a_200025704644_100000211423 [1,0,0,0,1,0|2,0,0]=4 7514 B9R1.6 CC(C)N1CCCOC1 2230a_100000131196_100000210206 [0,0,0,0,2,0|2,0,0]=4 7515 B9R1.6 CC(C)N1CCCOC1 269982a_100000131196_100000210206 [0,0,0,0,2,0|2,0,0]=4 7516 B9R1.6 CC(C)N1CCCOC1 34a_100000131196_100000210206 [0,0,0,0,2,0|2,0,0]=4 7517 B9R1.6 CC(C)N1CCOCC1 2230a_100015191051_100000210206 [0,0,0,0,2,0|2,0,0]=4 7518 B9R1.6 CC(C)N1CCOCC1 269982a_100015191051_100000210206 [0,0,0,0,2,0|2,0,0]=4 7519 B9R1.6 CC(C)N1CCOCC1 34a_100015191051_100000210206 [0,0,0,0,2,0|2,0,0]=4 7520 B9R1.6 CC(C)N1CCSCC1 2230a_100000737611_100000210206 [0,0,0,0,2,0|2,0,0]=4 7521 B9R1.6 CC(C)N1CCSCC1 269982a_100000737611_100000210206 [0,0,0,0,2,0|2,0,0]=4 7522 B9R1.13 C=C(C)CN1CCCC1 2230a_100000188435_100000748629 [0,0,0,0,2,0|1,0,1]=4 7523 B9R1.13 C=C(C)CN1CCCC1 269982a_100000188435_100000748629 [0,0,0,0,2,0|1,0,1]=4 7524 B9R1.13 CC(=O)CN1CCCC1 1458a_100000740243_200000210301 [0,0,0,0,2,0|0,0,2]=4 7525 B9R1.13 CC(C)CN1CCCC1 2230a_100000188435_100000210760 [0,0,0,0,2,0|1,0,0]=3 7526 B9R1.13 CC(C)CN1CCCC1 269982a_100000188435_100000210624 [0,0,0,0,2,0|1,0,0]=3 7527 B9R1.13 CC(C)CN1CCCC1 270004a_100000188435_100000210432 [0,0,0,0,2,0|1,0,0]=3 7528 B9R1.13 CC(C)CN1CCSC1 2230a_100011215254_100000210760 [0,0,0,0,2,0|2,0,0]=4 7529 B9R1.13 CC(C)CN1CCSC1 269982a_100011215254_100000210624 [0,0,0,0,2,0|2,0,0]=4 7530 B9R1.13 CC(C)CN1CCSC1 270004a_100011215254_100000210432 [0,0,0,0,2,0|2,0,0]=4 7531 B9R1.13 CC(O)CN1CC=CC1 269982a_100015195280_100011218427 [0,0,0,0,2,0|0,0,2]=4 7532 B9R1.13 CC(O)CN1CCCC1 2230a_100000188435_100011218427 [0,0,0,0,2,0|0,0,0]=2 7533 B9R1.13 CC(O)CN1CCCC1 269982a_100000188435_100011218427 [0,0,0,0,2,0|0,0,0]=2 7534 B9R1.13 CC(O)CN1CCSC1 2230a_100011215254_100011218427 [0,0,0,0,2,0|1,0,0]=3 7535 B9R1.13 CC(O)CN1CCSC1 269982a_100011215254_100011218427 [0,0,0,0,2,0|1,0,0]=3 7536 B9R1.13 C[C@@H](O)CN1CC=CC1 269982a_100015195280_100009817552 [0,0,0,0,2,0|0,0,2]=4 7537 B9R1.13 C[C@@H](O)CN1CCCC1 2230a_100000188435_100009817552 [0,0,0,0,2,0|0,0,0]=2 7538 B9R1.13 C[C@@H](O)CN1CCCC1 269982a_100000188435_100009817552 [0,0,0,0,2,0|0,0,0]=2 7539 B9R1.13 C[C@@H](O)CN1CCSC1 2230a_100011215254_100009817552 [0,0,0,0,2,0|1,0,0]=3 7540 B9R1.13 C[C@@H](O)CN1CCSC1 269982a_100011215254_100009817552 [0,0,0,0,2,0|1,0,0]=3 7541 B9R1.13 FC(F)CN1CCCC1 2230a_100000188435_100011934356 [0,0,0,0,2,0|2,0,0]=4 7542 B9R1.13 FC(F)CN1CCCC1 269982a_100000188435_100011934356 [0,0,0,0,2,0|2,0,0]=4 7543 B9R1.13 [13CH3]C(=O)CN1CCCC1 1458a_100000740243_200025704644 [0,0,0,0,2,0|0,0,2]=4 7544 B11R0.280 C=C(C)CCN(CCC)CCC 2230a_100000210455_100000730704 [0,0,1,0,0,1|1,0,1]=4 7545 B11R0.280 C=C(C)CCN(CCC)CCC 269982a_100000210455_100000730704 [0,0,1,0,0,1|1,0,1]=4 7546 B11R0.280 CC(O)CCN(CCO)CCO 2230a_100000210587_100012276601 [0,0,1,0,0,1|2,0,0]=4 7547 B11R0.280 CC(O)CCN(CCO)CCO 269982a_100000210587_100012276601 [0,0,1,0,0,1|2,0,0]=4 7548 B11R0.280 CCCC(CCC)COC(C)C 34a_200011215456_100000210206 [0,0,1,0,0,1|2,0,0]=4 7549 B11R0.280 CCCC(CCC)COC(C)C 7a_200011215456_100000210206 [0,0,1,0,0,1|2,0,0]=4 7550 B11R0.280 CCCC(CCC)NCC(C)C 2230a_100011207992_100000210760 [0,0,1,0,0,1|2,0,0]=4 7551 B11R0.280 CCCC(CCC)NCC(C)C 270004a_100000210953_100000210088 [0,0,1,0,0,1|2,0,0]=4 7552 B11R0.280 CCCC(CCC)NCC(C)C 270004a_100011207992_100000210432 [0,0,1,0,0,1|2,0,0]=4 7553 B11R0.280 CCCC(CCC)NCC(C)C 34a_100000210953_200011218217 [0,0,1,0,0,1|2,0,0]=4 7554 B11R0.280 CCCC(CCC)NCC(C)C 34a_100011207992_100000210624 [0,0,1,0,0,1|2,0,0]=4 7555 B11R0.280 CCCC(CCC)NCC(C)O 2230a_100011207992_100011218427 [0,0,1,0,0,1|1,0,0]=3 7556 B11R0.280 CCCC(CCC)NCC(C)O 270004a_100000210904_100000210088 [0,0,1,0,0,1|1,0,0]=3 7557 B11R0.280 CCCC(CCC)NCC(C)O 34a_100000210904_200011218217 [0,0,1,0,0,1|1,0,0]=3 7558 B11R0.280 CCCC(CCC)NCC(C)O 34a_100011207992_100011218427 [0,0,1,0,0,1|1,0,0]=3 7559 B11R0.280 CCCC(CCC)NC[C@@H](C)O 2230a_100011207992_100009817552 [0,0,1,0,0,1|1,0,0]=3 7560 B11R0.280 CCCC(CCC)NC[C@@H](C)O 34a_100011207992_100009817552 [0,0,1,0,0,1|1,0,0]=3 7561 B11R0.280 CCCC(CCC)OCC(C)Br 34a_100012180447_200011218217 [0,0,1,0,0,1|2,0,0]=4 7562 B11R0.280 CCCC(CCC)OCC(C)C 34a_100000210257_200011218217 [0,0,1,0,0,1|2,0,0]=4 7563 B11R0.280 CCCC(CCC)OCC(C)C 34a_200011218534_100000210624 [0,0,1,0,0,1|2,0,0]=4 7564 B11R0.280 CCCC(CCC)OCC(C)C 7a_200011218534_100000210760 [0,0,1,0,0,1|2,0,0]=4 7565 B11R0.280 CCCC(CCC)OCC(C)F 34a_100015925927_200011218217 [0,0,1,0,0,1|2,0,0]=4 7566 B11R0.280 CCCC(CCC)OCC(C)O 34a_200011218534_100011218427 [0,0,1,0,0,1|1,0,0]=3 7567 B11R0.280 CCCC(CCC)OCC(C)O 7a_200011218534_100011218427 [0,0,1,0,0,1|1,0,0]=3 7568 B11R0.280 CCCC(CCC)OC[C@@H](C)Cl 34a_100016084084_200011218217 [0,0,1,0,0,1|2,0,0]=4 7569 B11R0.280 CCCC(CCC)OC[C@@H](C)N 34a_100000737577_200011218217 [0,0,1,0,0,1|2,0,0]=4 7570 B11R0.280 CCCC(CCC)OC[C@@H](C)O 34a_200011218534_100009817552 [0,0,1,0,0,1|1,0,0]=3 7571 B11R0.280 CCCC(CCC)OC[C@@H](C)O 7a_200011218534_100009817552 [0,0,1,0,0,1|1,0,0]=3 7572 B11R0.280 CCCC(CCC)SCC(C)C 62a_100000210624_200011218217 [0,0,1,0,0,1|2,0,0]=4 7573 B11R0.280 CCCC(CCC)SCC(C)C 62a_200011218217_100000210760 [0,0,1,0,0,1|2,0,0]=4 7574 B11R0.280 CCCC(CCC)SCC(C)O 62a_100011218427_200011218217 [0,0,1,0,0,1|1,0,0]=3 7575 B11R0.280 CCCC(CCC)SCC(C)O 62a_200011218217_100011218427 [0,0,1,0,0,1|1,0,0]=3 7576 B11R0.280 CCCC(CCC)SC[C@@H](C)O 62a_100009817552_200011218217 [0,0,1,0,0,1|1,0,0]=3 7577 B11R0.280 CCCC(CCC)SC[C@@H](C)O 62a_200011218217_100009817552 [0,0,1,0,0,1|1,0,0]=3 7578 B11R0.280 CCCN(CC=C(C)C)CCC 2230a_100000210455_100000761012 [0,0,1,0,0,1|1,0,1]=4 7579 B11R0.280 CCCN(CC=C(C)C)CCC 269982a_100000210455_100000761012 [0,0,1,0,0,1|1,0,1]=4 7580 B11R0.280 CCCN(CCC)CCC(=O)C 269982a_100000210455_100000053229 [0,0,1,0,0,1|0,0,2]=4 7581 B11R0.280 CCCN(CCC)CCC(C)C 2230a_100000210455_100000210312 [0,0,1,0,0,1|1,0,0]=3 7582 B11R0.280 CCCN(CCC)CCC(C)C 269982a_100000210455_100000210312 [0,0,1,0,0,1|1,0,0]=3 7583 B11R0.280 CCCN(CCC)CCC(C)O 2230a_100000210455_100012276601 [0,0,1,0,0,1|0,0,0]=2 7584 B11R0.280 CCCN(CCC)CCC(C)O 269982a_100000210455_100012276601 [0,0,1,0,0,1|0,0,0]=2 7585 B11R0.280 CCCN(CCC)CCN(C)C 2230a_100000226821_100000210303 [0,0,1,0,0,1|2,0,0]=4 7586 B11R0.280 CCCN(CCC)CCN(C)C 269982a_100000210455_100000755713 [0,0,1,0,0,1|2,0,0]=4 7587 B11R0.280 CCCN(CCC)CCN(C)C 269982a_100000226821_100000210303 [0,0,1,0,0,1|2,0,0]=4 7588 B11R0.280 CCCN(CCC)COC(=O)C 269982a_100000210455_100000076356 [0,0,1,0,0,1|0,0,2]=4 7589 B11R0.280 CCCN(CCC)COC(C)C 2230a_100000210455_100000709892 [0,0,1,0,0,1|1,0,0]=3 7590 B11R0.280 CCCN(CCC)COC(C)C 269982a_100000210455_100000709892 [0,0,1,0,0,1|1,0,0]=3 7591 B11R0.280 CCCN(CCO)CCC(C)C 2230a_100000211420_100000210312 [0,0,1,0,0,1|2,0,0]=4 7592 B11R0.280 CCCN(CCO)CCC(C)C 269982a_100000211420_100000210312 [0,0,1,0,0,1|2,0,0]=4 7593 B11R0.280 CCCN(CCO)CCC(C)O 2230a_100000211420_100012276601 [0,0,1,0,0,1|1,0,0]=3 7594 B11R0.280 CCCN(CCO)CCC(C)O 269982a_100000211420_100012276601 [0,0,1,0,0,1|1,0,0]=3 7595 B11R0.280 CCCN(CCO)COC(C)C 2230a_100000211420_100000709892 [0,0,1,0,0,1|2,0,0]=4 7596 B11R0.280 CCCN(CCO)COC(C)C 269982a_100000211420_100000709892 [0,0,1,0,0,1|2,0,0]=4 7597 B11R0.280 CCC[C@@H](CCO)NCC(C)O 2230a_100015193777_100011218427 [0,0,1,0,0,1|2,0,0]=4 7598 B11R0.280 CCC[C@@H](CCO)NCC(C)O 34a_100015193777_100011218427 [0,0,1,0,0,1|2,0,0]=4 7599 B11R0.280 CCC[C@@H](CCO)NC[C@@H](C)O 2230a_100015193777_100009817552 [0,0,1,0,0,1|2,0,0]=4 7600 B11R0.280 CCC[C@@H](CCO)NC[C@@H](C)O 34a_100015193777_100009817552 [0,0,1,0,0,1|2,0,0]=4 7601 B11R0.164 C=C(C)CCN(CC)CCCC 2230a_100000207695_100000730704 [0,0,1,0,0,1|1,0,1]=4 7602 B11R0.164 C=C(C)CCN(CC)CCCC 269982a_100000207695_100000730704 [0,0,1,0,0,1|1,0,1]=4 7603 B11R0.164 CCCCC(CC)CNC(C)C 2230a_100000209976_100000210206 [0,0,1,0,0,1|2,0,0]=4 7604 B11R0.164 CCCCC(CC)CNC(C)C 2230a_100138425928_100000211942 [0,0,1,0,0,1|2,0,0]=4 7605 B11R0.164 CCCCC(CC)CNC(C)C 34a_100138425928_100000211942 [0,0,1,0,0,1|2,0,0]=4 7606 B11R0.164 CCCCC(CC)COC(C)C 34a_100000210273_100000210206 [0,0,1,0,0,1|2,0,0]=4 7607 B11R0.164 CCCCC(CC)COC(C)C 34a_100000212225_100000211942 [0,0,1,0,0,1|2,0,0]=4 7608 B11R0.164 CCCCC(CC)COC(C)C 7a_100000210273_100000210206 [0,0,1,0,0,1|2,0,0]=4 7609 B11R0.164 CCCCC(CC)CSC(C)C 62a_100000210206_100000211942 [0,0,1,0,0,1|2,0,0]=4 7610 B11R0.164 CCCCC(CC)CSC(C)C 62a_100000211942_100000210206 [0,0,1,0,0,1|2,0,0]=4 7611 B11R0.164 CCCCC(CC)NCC(C)C 270004a_100000210953_100000753412 [0,0,1,0,0,1|2,0,0]=4 7612 B11R0.164 CCCCC(CC)NCC(C)C 34a_100000210953_200011216223 [0,0,1,0,0,1|2,0,0]=4 7613 B11R0.164 CCCCC(CC)NCC(C)O 270004a_100000210904_100000753412 [0,0,1,0,0,1|1,0,0]=3 7614 B11R0.164 CCCCC(CC)NCC(C)O 34a_100000210904_200011216223 [0,0,1,0,0,1|1,0,0]=3 7615 B11R0.164 CCCCC(CC)OCC(C)Br 34a_100012180447_200011216223 [0,0,1,0,0,1|2,0,0]=4 7616 B11R0.164 CCCCC(CC)OCC(C)C 34a_100000210257_200011216223 [0,0,1,0,0,1|2,0,0]=4 7617 B11R0.164 CCCCC(CC)OCC(C)C 34a_100011215227_100000210624 [0,0,1,0,0,1|2,0,0]=4 7618 B11R0.164 CCCCC(CC)OCC(C)C 7a_100011215227_100000210760 [0,0,1,0,0,1|2,0,0]=4 7619 B11R0.164 CCCCC(CC)OCC(C)F 34a_100015925927_200011216223 [0,0,1,0,0,1|2,0,0]=4 7620 B11R0.164 CCCCC(CC)OCC(C)O 34a_100011215227_100011218427 [0,0,1,0,0,1|1,0,0]=3 7621 B11R0.164 CCCCC(CC)OCC(C)O 7a_100011215227_100011218427 [0,0,1,0,0,1|1,0,0]=3 7622 B11R0.164 CCCCC(CC)OC[C@@H](C)Cl 34a_100016084084_200011216223 [0,0,1,0,0,1|2,0,0]=4 7623 B11R0.164 CCCCC(CC)OC[C@@H](C)N 34a_100000737577_200011216223 [0,0,1,0,0,1|2,0,0]=4 7624 B11R0.164 CCCCC(CC)OC[C@@H](C)O 34a_100011215227_100009817552 [0,0,1,0,0,1|1,0,0]=3 7625 B11R0.164 CCCCC(CC)OC[C@@H](C)O 7a_100011215227_100009817552 [0,0,1,0,0,1|1,0,0]=3 7626 B11R0.164 CCCCC(CC)SCC(C)C 62a_100000210624_200011216223 [0,0,1,0,0,1|2,0,0]=4 7627 B11R0.164 CCCCC(CC)SCC(C)C 62a_200011216223_100000210760 [0,0,1,0,0,1|2,0,0]=4 7628 B11R0.164 CCCCC(CC)SCC(C)O 62a_100011218427_200011216223 [0,0,1,0,0,1|1,0,0]=3 7629 B11R0.164 CCCCC(CC)SCC(C)O 62a_200011216223_100011218427 [0,0,1,0,0,1|1,0,0]=3 7630 B11R0.164 CCCCC(CC)SC[C@@H](C)O 62a_100009817552_200011216223 [0,0,1,0,0,1|1,0,0]=3 7631 B11R0.164 CCCCC(CC)SC[C@@H](C)O 62a_200011216223_100009817552 [0,0,1,0,0,1|1,0,0]=3 7632 B11R0.164 CCCCN(CC)CC=C(C)C 2230a_100000207695_100000761012 [0,0,1,0,0,1|1,0,1]=4 7633 B11R0.164 CCCCN(CC)CC=C(C)C 269982a_100000207695_100000761012 [0,0,1,0,0,1|1,0,1]=4 7634 B11R0.164 CCCCN(CC)CCC(=O)C 269982a_100000207695_100000053229 [0,0,1,0,0,1|0,0,2]=4 7635 B11R0.164 CCCCN(CC)CCC(C)C 2230a_100000207693_100000210211 [0,0,1,0,0,1|1,0,0]=3 7636 B11R0.164 CCCCN(CC)CCC(C)C 2230a_100000207695_100000210312 [0,0,1,0,0,1|1,0,0]=3 7637 B11R0.164 CCCCN(CC)CCC(C)C 269982a_100000207693_100000210211 [0,0,1,0,0,1|1,0,0]=3 7638 B11R0.164 CCCCN(CC)CCC(C)C 269982a_100000207695_100000210312 [0,0,1,0,0,1|1,0,0]=3 7639 B11R0.164 CCCCN(CC)CCC(C)O 2230a_100000207695_100012276601 [0,0,1,0,0,1|0,0,0]=2 7640 B11R0.164 CCCCN(CC)CCC(C)O 269982a_100000207695_100012276601 [0,0,1,0,0,1|0,0,0]=2 7641 B11R0.164 CCCCN(CC)CCN(C)C 269982a_100000207695_100000755713 [0,0,1,0,0,1|2,0,0]=4 7642 B11R0.164 CCCCN(CC)CCN(C)C 269982a_100000225870_100000210211 [0,0,1,0,0,1|2,0,0]=4 7643 B11R0.164 CCCCN(CC)COC(=O)C 269982a_100000207695_100000076356 [0,0,1,0,0,1|0,0,2]=4 7644 B11R0.164 CCCCN(CC)COC(C)C 2230a_100000207695_100000709892 [0,0,1,0,0,1|1,0,0]=3 7645 B11R0.164 CCCCN(CC)COC(C)C 269982a_100000207695_100000709892 [0,0,1,0,0,1|1,0,0]=3 7646 B11R0.164 CCCC[C@@H](CO)NCC(C)O 2230a_100011934283_100011218427 [0,0,1,0,0,1|2,0,0]=4 7647 B11R0.164 CCCC[C@@H](CO)NCC(C)O 34a_100011934283_100011218427 [0,0,1,0,0,1|2,0,0]=4 7648 B11R0.164 CCCC[C@@H](CO)NC[C@@H](C)O 2230a_100011934283_100009817552 [0,0,1,0,0,1|2,0,0]=4 7649 B11R0.164 CCCC[C@@H](CO)NC[C@@H](C)O 34a_100011934283_100009817552 [0,0,1,0,0,1|2,0,0]=4 7650 B11R0.164 CCN(CCC#N)CCC(C)O 2230a_100000226048_100012276601 [0,0,1,0,0,1|1,0,1]=4 7651 B11R0.164 CCN(CCCF)CCC(C)C 2230a_100000207693_100011934791 [0,0,1,0,0,1|2,0,0]=4 7652 B11R0.164 CCN(CCCF)CCC(C)C 269982a_100000207693_100011934791 [0,0,1,0,0,1|2,0,0]=4 7653 B11R0.164 CCN(CCCO)CCC(C)C 2230a_100000207693_100000230001 [0,0,1,0,0,1|2,0,0]=4 7654 B11R0.164 CCN(CCCO)CCC(C)C 269982a_100000207693_100011215043 [0,0,1,0,0,1|2,0,0]=4 7655 B11R0.164 CCN(CCOC)CCC(C)C 2230a_100000207693_100011201679 [0,0,1,0,0,1|2,0,0]=4 7656 B11R0.164 CCN(CCOC)CCC(C)C 2230a_100000731262_100000210312 [0,0,1,0,0,1|2,0,0]=4 7657 B11R0.164 CCN(CCOC)CCC(C)C 269982a_100000207693_100000233755 [0,0,1,0,0,1|2,0,0]=4 7658 B11R0.164 CCN(CCOC)CCC(C)C 269982a_100000731262_100000210312 [0,0,1,0,0,1|2,0,0]=4 7659 B11R0.164 CCN(CCOC)CCC(C)O 2230a_100000731262_100012276601 [0,0,1,0,0,1|1,0,0]=3 7660 B11R0.164 CCN(CCOC)CCC(C)O 269982a_100000731262_100012276601 [0,0,1,0,0,1|1,0,0]=3 7661 B11R0.164 CCN(CCOC)COC(C)C 2230a_100000731262_100000709892 [0,0,1,0,0,1|2,0,0]=4 7662 B11R0.164 CCN(CCOC)COC(C)C 269982a_100000731262_100000709892 [0,0,1,0,0,1|2,0,0]=4 7663 B11R0.164 CCN(CCSC)CCC(C)C 2230a_100000207693_100000751147 [0,0,1,0,0,1|2,0,0]=4 7664 B11R0.164 CCN(CCSC)CCC(C)C 269982a_100000207693_100000212216 [0,0,1,0,0,1|2,0,0]=4 7665 B11R0.164 CCOCN(CC)CCC(C)C 269982a_100000207693_100000739092 [0,0,1,0,0,1|2,0,0]=4 7666 B11R1.117 C#CCN1CCCCCCC1 2230a_100000211400_100000038162 [1,0,0,0,0,1|0,0,2]=4 7667 B11R1.117 C#CCN1CCCCCCC1 34a_100000211400_100000184674 [1,0,0,0,0,1|0,0,2]=4 7668 B11R1.117 C=CCN1CCCCCCC1 2230a_100000211400_100000210623 [1,0,0,0,0,1|0,0,2]=4 7669 B11R1.117 C=CCN1CCCCCCC1 269982a_100000211400_100000210623 [1,0,0,0,0,1|0,0,2]=4 7670 B11R1.117 C=CCN1CCCCCCC1 34a_100000211400_100015514636 [1,0,0,0,0,1|0,0,2]=4 7671 B11R1.117 CCCN1CCCCCCC1 2230a_100000211400_100000210303 [1,0,0,0,0,1|0,0,0]=2 7672 B11R1.117 CCCN1CCCCCCC1 269982a_100000211400_100000210303 [1,0,0,0,0,1|0,0,0]=2 7673 B11R1.117 CCCN1CCCCCCC1 34a_100000211400_100000210303 [1,0,0,0,0,1|0,0,0]=2 7674 B11R1.117 CCNC1CCCCCCC1 2230a_100000211152_100000210202 [1,0,0,0,0,1|2,0,0]=4 7675 B11R1.117 CCNC1CCCCCCC1 270004a_100015525214_100000210524 [1,0,0,0,0,1|2,0,0]=4 7676 B11R1.117 CCNC1CCCCCCC1 34a_100000211152_100000210202 [1,0,0,0,0,1|2,0,0]=4 7677 B11R1.117 CCOC1CCCCCCC1 34a_100000210054_100000210202 [1,0,0,0,0,1|2,0,0]=4 7678 B11R1.117 CCOC1CCCCCCC1 7a_100000210054_100000210202 [1,0,0,0,0,1|2,0,0]=4 7679 B11R1.117 COCC1CCCCCCC1 34a_100011216312_200000210301 [1,0,0,0,0,1|2,0,0]=4 7680 B11R1.117 COCC1CCCCCCC1 7a_100011216312_200000210301 [1,0,0,0,0,1|2,0,0]=4 7681 B11R1.117 COCN1CCCCCCC1 2230a_100000211400_100000766300 [1,0,0,0,0,1|1,0,0]=3 7682 B11R1.117 COCN1CCCCCCC1 269982a_100000211400_100000766300 [1,0,0,0,0,1|1,0,0]=3 7683 B11R1.117 CSCN1CCCCCCC1 2230a_100000211400_100011218213 [1,0,0,0,0,1|1,0,0]=3 7684 B11R1.117 CSCN1CCCCCCC1 269982a_100000211400_100011218213 [1,0,0,0,0,1|1,0,0]=3 7685 B11R1.117 CSCN1CCCCCCC1 34a_100000211400_100011218213 [1,0,0,0,0,1|1,0,0]=3 7686 B11R1.117 FCCN1CCCCCCC1 2230a_100000211400_100011217306 [1,0,0,0,0,1|1,0,0]=3 7687 B11R1.117 FCCN1CCCCCCC1 269982a_100000211400_100011217306 [1,0,0,0,0,1|1,0,0]=3 7688 B11R1.117 FCCN1CCCCCCC1 34a_100000211400_100011217306 [1,0,0,0,0,1|1,0,0]=3 7689 B11R1.117 N#CCN1CCCCCCC1 2230a_100000211400_100011215382 [1,0,0,0,0,1|1,0,1]=4 7690 B11R1.117 N#CCN1CCCCCCC1 269982a_100000211400_100011214920 [1,0,0,0,0,1|1,0,1]=4 7691 B11R1.117 O=CCN1CCCCCCC1 2230a_100000211400_200015260668 [1,0,0,0,0,1|0,0,2]=4 7692 B11R1.117 O=CCN1CCCCCCC1 269982a_100000211400_200015260668 [1,0,0,0,0,1|0,0,2]=4 7693 B11R1.117 O=CCN1CCCCCCC1 34a_100000211400_200009817547 [1,0,0,0,0,1|0,0,2]=4 7694 B11R1.117 OCCN1CCCCCCC1 2230a_100000211400_100000211926 [1,0,0,0,0,1|0,0,0]=2 7695 B11R1.117 OCCN1CCCCCCC1 269982a_100000211400_100000211926 [1,0,0,0,0,1|0,0,0]=2 7696 B11R1.117 OCCN1CCCCCCC1 34a_100000211400_100000211926 [1,0,0,0,0,1|0,0,0]=2 7697 B11R1.117 [13CH3]OCC1CCCCCCC1 34a_100011216312_200025704644 [1,0,0,0,0,1|2,0,0]=4 7698 B11R1.117 [13CH3]OCC1CCCCCCC1 7a_100011216312_200025704644 [1,0,0,0,0,1|2,0,0]=4 7699 B13R1.1022 C=C(C)CCN1CCCCCCC1 2230a_100000211400_100000730704 [0,0,0,0,0,2|1,0,1]=4 7700 B13R1.1022 C=C(C)CCN1CCCCCCC1 269982a_100000211400_100000730704 [0,0,0,0,0,2|1,0,1]=4 7701 B13R1.1022 C=C(C)CCN1CCCCCCC1 34a_100000211400_100000730704 [0,0,0,0,0,2|1,0,1]=4 7702 B13R1.1022 CC(=CCN1CCCCCCC1)C 2230a_100000211400_100000761012 [0,0,0,0,0,2|1,0,1]=4 7703 B13R1.1022 CC(=CCN1CCCCCCC1)C 269982a_100000211400_100000761012 [0,0,0,0,0,2|1,0,1]=4 7704 B13R1.1022 CC(=CCN1CCCCCCC1)C 34a_100000211400_100000761012 [0,0,0,0,0,2|1,0,1]=4 7705 B13R1.1022 CC(=O)CCN1CCCCCCC1 1458a_200015187237_200000210301 [0,0,0,0,0,2|0,0,2]=4 7706 B13R1.1022 CC(=O)CCN1CCCCCCC1 269982a_100000211400_100000053229 [0,0,0,0,0,2|0,0,2]=4 7707 B13R1.1022 CC(=O)OCN1CCCCCCC1 269982a_100000211400_100000076356 [0,0,0,0,0,2|0,0,2]=4 7708 B13R1.1022 CC(=O)OCN1CCCCCCC1 34a_100000211400_100009813279 [0,0,0,0,0,2|0,0,2]=4 7709 B13R1.1022 CC(C)CCN1CCCCCCC1 2230a_100000211400_100000210312 [0,0,0,0,0,2|1,0,0]=3 7710 B13R1.1022 CC(C)CCN1CCCCCCC1 269982a_100000211400_100000210312 [0,0,0,0,0,2|1,0,0]=3 7711 B13R1.1022 CC(C)CCN1CCCCCCC1 34a_100000211400_100000210312 [0,0,0,0,0,2|1,0,0]=3 7712 B13R1.1022 CC(C)CNC1CCCCCCC1 2230a_100000211152_100000210760 [0,0,0,0,0,2|2,0,0]=4 7713 B13R1.1022 CC(C)CNC1CCCCCCC1 270004a_100000210953_100000210524 [0,0,0,0,0,2|2,0,0]=4 7714 B13R1.1022 CC(C)CNC1CCCCCCC1 270004a_100000211152_100000210432 [0,0,0,0,0,2|2,0,0]=4 7715 B13R1.1022 CC(C)CNC1CCCCCCC1 34a_100000211152_100000210624 [0,0,0,0,0,2|2,0,0]=4 7716 B13R1.1022 CC(C)COC1CCCCCCC1 34a_100000210054_100000210624 [0,0,0,0,0,2|2,0,0]=4 7717 B13R1.1022 CC(C)COC1CCCCCCC1 7a_100000210054_100000210760 [0,0,0,0,0,2|2,0,0]=4 7718 B13R1.1022 CC(C)OCC1CCCCCCC1 34a_100011216312_100000210206 [0,0,0,0,0,2|2,0,0]=4 7719 B13R1.1022 CC(C)OCC1CCCCCCC1 7a_100011216312_100000210206 [0,0,0,0,0,2|2,0,0]=4 7720 B13R1.1022 CC(C)OCN1CCCCCCC1 2230a_100000211400_100000709892 [0,0,0,0,0,2|1,0,0]=3 7721 B13R1.1022 CC(C)OCN1CCCCCCC1 269982a_100000211400_100000709892 [0,0,0,0,0,2|1,0,0]=3 7722 B13R1.1022 CC(C)OCN1CCCCCCC1 34a_100000211400_100000709892 [0,0,0,0,0,2|1,0,0]=3 7723 B13R1.1022 CC(O)CCN1CCCCCCC1 2230a_100000211400_100012276601 [0,0,0,0,0,2|0,0,0]=2 7724 B13R1.1022 CC(O)CCN1CCCCCCC1 269982a_100000211400_100012276601 [0,0,0,0,0,2|0,0,0]=2 7725 B13R1.1022 CC(O)CCN1CCCCCCC1 34a_100000211400_100012276601 [0,0,0,0,0,2|0,0,0]=2 7726 B13R1.1022 CC(O)CNC1CC/C=C\CCC1 34a_100000210904_100021000466 [0,0,0,0,0,2|1,0,1]=4 7727 B13R1.1022 CC(O)CNC1CCCCCCC1 2230a_100000211152_100011218427 [0,0,0,0,0,2|1,0,0]=3 7728 B13R1.1022 CC(O)CNC1CCCCCCC1 270004a_100000210904_100000210524 [0,0,0,0,0,2|1,0,0]=3 7729 B13R1.1022 CC(O)CNC1CCCCCCC1 34a_100000211152_100011218427 [0,0,0,0,0,2|1,0,0]=3 7730 B13R1.1022 CC(O)COC1C=CCCCCC1 34a_100000688657_100011218427 [0,0,0,0,0,2|1,0,1]=4 7731 B13R1.1022 CC(O)COC1CC/C=C\CCC1 34a_100016989180_100011218427 [0,0,0,0,0,2|1,0,1]=4 7732 B13R1.1022 CC(O)COC1CCCCCCC1 34a_100000210054_100011218427 [0,0,0,0,0,2|1,0,0]=3 7733 B13R1.1022 CC(O)COC1CCCCCCC1 7a_100000210054_100011218427 [0,0,0,0,0,2|1,0,0]=3 7734 B13R1.1022 CC(O)CSC1CC/C=C\CCC1 62a_100011218427_100021000466 [0,0,0,0,0,2|1,0,1]=4 7735 B13R1.1022 CC(O)CSC1CC/C=C\CCC1 62a_100021000466_100011218427 [0,0,0,0,0,2|1,0,1]=4 7736 B13R1.1022 CN(C)CCN1CCCCCCC1 269982a_100000211400_100000755713 [0,0,0,0,0,2|2,0,0]=4 7737 B13R1.1022 C[C@@H](O)CNC1CCCCCCC1 2230a_100000211152_100009817552 [0,0,0,0,0,2|1,0,0]=3 7738 B13R1.1022 C[C@@H](O)CNC1CCCCCCC1 34a_100000211152_100009817552 [0,0,0,0,0,2|1,0,0]=3 7739 B13R1.1022 C[C@@H](O)COC1C=CCCCCC1 34a_100000688657_100009817552 [0,0,0,0,0,2|1,0,1]=4 7740 B13R1.1022 C[C@@H](O)COC1CC/C=C\CCC1 34a_100016989180_100009817552 [0,0,0,0,0,2|1,0,1]=4 7741 B13R1.1022 C[C@@H](O)COC1CCCCCCC1 34a_100000210054_100009817552 [0,0,0,0,0,2|1,0,0]=3 7742 B13R1.1022 C[C@@H](O)COC1CCCCCCC1 7a_100000210054_100009817552 [0,0,0,0,0,2|1,0,0]=3 7743 B13R1.1022 C[C@@H](O)CSC1CC/C=C\CCC1 62a_100009817552_100021000466 [0,0,0,0,0,2|1,0,1]=4 7744 B13R1.1022 C[C@@H](O)CSC1CC/C=C\CCC1 62a_100021000466_100009817552 [0,0,0,0,0,2|1,0,1]=4 7745 B13R1.1022 [13CH3]C(=O)CCN1CCCCCCC1 1458a_200015187237_200025704644 [0,0,0,0,0,2|0,0,2]=4 7746 B13R1.1988 CC(=CCCN1CCCCCC1)C 2230a_100000185865_100011217483 [0,0,0,0,0,2|1,0,1]=4 7747 B13R1.1988 CC(=CCCN1CCCCCC1)C 269982a_100000185865_100011217483 [0,0,0,0,0,2|1,0,1]=4 7748 B13R1.1988 CC(=CCCN1CCCCCC1)C 34a_100000185865_100011217483 [0,0,0,0,0,2|1,0,1]=4 7749 B13R1.1988 CC(=O)CCCN1CCCCCC1 269982a_100000185865_100011215641 [0,0,0,0,0,2|0,0,2]=4 7750 B13R1.1988 CC(=O)CCCN1CCCCCC1 34a_100000185865_100000685027 [0,0,0,0,0,2|0,0,2]=4 7751 B13R1.1988 CC(=O)NCCN1CCCCCC1 11a_100000738142_100015343762 [0,0,0,0,0,2|0,0,2]=4 7752 B13R1.1988 CC(=O)NCCN1CCCCCC1 2230a_100000185865_100000189650 [0,0,0,0,0,2|0,0,2]=4 7753 B13R1.1988 CC(=O)NCCN1CCCCCC1 240690a_100000738142_100015343762 [0,0,0,0,0,2|0,0,2]=4 7754 B13R1.1988 CC(=O)NCCN1CCCCCC1 269982a_100000185865_100000189650 [0,0,0,0,0,2|0,0,2]=4 7755 B13R1.1988 CC(=O)NCCN1CCCCCC1 527a_100000738142_100103153847 [0,0,0,0,0,2|0,0,2]=4 7756 B13R1.1988 CC(=O)OCCN1CCCCCC1 269982a_100000185865_100009814007 [0,0,0,0,0,2|0,0,2]=4 7757 B13R1.1988 CC(=O)OCCN1CCCCCC1 34a_100000185865_100009814007 [0,0,0,0,0,2|0,0,2]=4 7758 B13R1.1988 CC(Br)CCOC1CCCCCC1 34a_100009893172_100011217769 [0,0,0,0,0,2|2,0,0]=4 7759 B13R1.1988 CC(Br)COCC1CCCCCC1 34a_100012180447_200000696569 [0,0,0,0,0,2|2,0,0]=4 7760 B13R1.1988 CC(C)CCCN1CCCCCC1 2230a_100000185865_100011214892 [0,0,0,0,0,2|1,0,0]=3 7761 B13R1.1988 CC(C)CCCN1CCCCCC1 269982a_100000185865_100011214892 [0,0,0,0,0,2|1,0,0]=3 7762 B13R1.1988 CC(C)CCCN1CCCCCC1 34a_100000185865_100011214892 [0,0,0,0,0,2|1,0,0]=3 7763 B13R1.1988 CC(C)CCCN1CCCOCC1 2230a_100000685342_100011214892 [0,0,0,0,0,2|2,0,0]=4 7764 B13R1.1988 CC(C)CCCN1CCCOCC1 269982a_100000685342_100011214892 [0,0,0,0,0,2|2,0,0]=4 7765 B13R1.1988 CC(C)CCCN1CCCOCC1 34a_100000685342_100011214892 [0,0,0,0,0,2|2,0,0]=4 7766 B13R1.1988 CC(C)CCNC1CCCCCC1 2230a_100000210984_100000210312 [0,0,0,0,0,2|2,0,0]=4 7767 B13R1.1988 CC(C)CCNC1CCCCCC1 269862a_100000210984_100000185833 [0,0,0,0,0,2|2,0,0]=4 7768 B13R1.1988 CC(C)CCNC1CCCCCC1 270004a_100000210545_100000210131 [0,0,0,0,0,2|2,0,0]=4 7769 B13R1.1988 CC(C)CCNC1CCCCCC1 34a_100000210984_100000210312 [0,0,0,0,0,2|2,0,0]=4 7770 B13R1.1988 CC(C)CCOC1CCCCCC1 34a_100000210254_100011217769 [0,0,0,0,0,2|2,0,0]=4 7771 B13R1.1988 CC(C)CCOC1CCCCCC1 34a_100000210887_100000210312 [0,0,0,0,0,2|2,0,0]=4 7772 B13R1.1988 CC(C)CCOC1CCCCCC1 7a_100000210887_100000210626 [0,0,0,0,0,2|2,0,0]=4 7773 B13R1.1988 CC(C)CCSC1CCCCCC1 62a_100000210312_100011217769 [0,0,0,0,0,2|2,0,0]=4 7774 B13R1.1988 CC(C)CCSC1CCCCCC1 62a_100011217769_100000210312 [0,0,0,0,0,2|2,0,0]=4 7775 B13R1.1988 CC(C)CNCC1CCCCCC1 2230a_100000210953_200000696569 [0,0,0,0,0,2|2,0,0]=4 7776 B13R1.1988 CC(C)CNCC1CCCCCC1 2230a_100015204231_100000210760 [0,0,0,0,0,2|2,0,0]=4 7777 B13R1.1988 CC(C)CNCC1CCCCCC1 269862a_100000210953_200000763224 [0,0,0,0,0,2|2,0,0]=4 7778 B13R1.1988 CC(C)CNCC1CCCCCC1 270004a_100015204231_100000210432 [0,0,0,0,0,2|2,0,0]=4 7779 B13R1.1988 CC(C)CNCC1CCCCCC1 34a_100000210953_200000696569 [0,0,0,0,0,2|2,0,0]=4 7780 B13R1.1988 CC(C)CNCC1CCCCCC1 34a_100015204231_100000210624 [0,0,0,0,0,2|2,0,0]=4 7781 B13R1.1988 CC(C)COCC1CCCCCC1 34a_100000210257_200000696569 [0,0,0,0,0,2|2,0,0]=4 7782 B13R1.1988 CC(C)COCC1CCCCCC1 34a_100000699130_100000210624 [0,0,0,0,0,2|2,0,0]=4 7783 B13R1.1988 CC(C)COCC1CCCCCC1 7a_100000699130_100000210760 [0,0,0,0,0,2|2,0,0]=4 7784 B13R1.1988 CC(C)CSCC1CCCCCC1 62a_100000210624_200000696569 [0,0,0,0,0,2|2,0,0]=4 7785 B13R1.1988 CC(C)CSCC1CCCCCC1 62a_200000696569_100000210760 [0,0,0,0,0,2|2,0,0]=4 7786 B13R1.1988 CC(C)NCCC1CCCCCC1 2230a_100011532351_100000210206 [0,0,0,0,0,2|2,0,0]=4 7787 B13R1.1988 CC(C)NCCC1CCCCCC1 34a_100011532351_100000210206 [0,0,0,0,0,2|2,0,0]=4 7788 B13R1.1988 CC(C)OCCN1CCCCCC1 2230a_100000185865_100000211751 [0,0,0,0,0,2|1,0,0]=3 7789 B13R1.1988 CC(C)OCCN1CCCCCC1 269982a_100000185865_100000211751 [0,0,0,0,0,2|1,0,0]=3 7790 B13R1.1988 CC(C)OCCN1CCCCCC1 34a_100000185865_100000211751 [0,0,0,0,0,2|1,0,0]=3 7791 B13R1.1988 CC(C)OCCN1CCCCCC1 34a_100000238007_100000210206 [0,0,0,0,0,2|1,0,0]=3 7792 B13R1.1988 CC(C)OCCN1CCCOCC1 2230a_100000685342_100000211751 [0,0,0,0,0,2|2,0,0]=4 7793 B13R1.1988 CC(C)OCCN1CCCOCC1 269982a_100000685342_100000211751 [0,0,0,0,0,2|2,0,0]=4 7794 B13R1.1988 CC(C)OCCN1CCCOCC1 34a_100000685342_100000211751 [0,0,0,0,0,2|2,0,0]=4 7795 B13R1.1988 CC(C)OCNC1CCCCCC1 2230a_100000210984_100000709892 [0,0,0,0,0,2|2,0,0]=4 7796 B13R1.1988 CC(C)OCNC1CCCCCC1 34a_100000210984_100000709892 [0,0,0,0,0,2|2,0,0]=4 7797 B13R1.1988 CC(C)OCOC1CCCCCC1 34a_100000210887_100000709892 [0,0,0,0,0,2|2,0,0]=4 7798 B13R1.1988 CC(C)OCSC1CCCCCC1 62a_100000709892_100011217769 [0,0,0,0,0,2|2,0,0]=4 7799 B13R1.1988 CC(C)OCSC1CCCCCC1 62a_100011217769_100000709892 [0,0,0,0,0,2|2,0,0]=4 7800 B13R1.1988 CC(C)SCCN1CCCCCC1 2230a_100000185865_100000730970 [0,0,0,0,0,2|1,0,0]=3 7801 B13R1.1988 CC(C)SCCN1CCCCCC1 269982a_100000185865_100000730970 [0,0,0,0,0,2|1,0,0]=3 7802 B13R1.1988 CC(C)SCCN1CCCCCC1 34a_100000185865_100000730970 [0,0,0,0,0,2|1,0,0]=3 7803 B13R1.1988 CC(C)SCCN1CCCCCC1 62a_100000210206_100000722644 [0,0,0,0,0,2|1,0,0]=3 7804 B13R1.1988 CC(C)SCCN1CCCCCC1 62a_100000722644_100000210206 [0,0,0,0,0,2|1,0,0]=3 7805 B13R1.1988 CC(C)SCCN1CCCOCC1 2230a_100000685342_100000730970 [0,0,0,0,0,2|2,0,0]=4 7806 B13R1.1988 CC(C)SCCN1CCCOCC1 269982a_100000685342_100000730970 [0,0,0,0,0,2|2,0,0]=4 7807 B13R1.1988 CC(C)SCCN1CCCOCC1 34a_100000685342_100000730970 [0,0,0,0,0,2|2,0,0]=4 7808 B13R1.1988 CC(F)COCC1CCCCCC1 34a_100015925927_200000696569 [0,0,0,0,0,2|2,0,0]=4 7809 B13R1.1988 CC(O)CCCN1CCCCCC1 2230a_100000185865_200000718107 [0,0,0,0,0,2|0,0,0]=2 7810 B13R1.1988 CC(O)CCCN1CCCCCC1 269982a_100000185865_200000718107 [0,0,0,0,0,2|0,0,0]=2 7811 B13R1.1988 CC(O)CCCN1CCCCCC1 34a_100000185865_200000718107 [0,0,0,0,0,2|0,0,0]=2 7812 B13R1.1988 CC(O)CCCN1CCCOCC1 2230a_100000685342_200000718107 [0,0,0,0,0,2|1,0,0]=3 7813 B13R1.1988 CC(O)CCCN1CCCOCC1 269982a_100000685342_200000718107 [0,0,0,0,0,2|1,0,0]=3 7814 B13R1.1988 CC(O)CCCN1CCCOCC1 34a_100000685342_200000718107 [0,0,0,0,0,2|1,0,0]=3 7815 B13R1.1988 CC(O)CCNC1CCCCCC1 2230a_100000210984_100012276601 [0,0,0,0,0,2|1,0,0]=3 7816 B13R1.1988 CC(O)CCNC1CCCCCC1 270004a_200000755665_100000210131 [0,0,0,0,0,2|1,0,0]=3 7817 B13R1.1988 CC(O)CCNC1CCCCCC1 34a_100000210984_100012276601 [0,0,0,0,0,2|1,0,0]=3 7818 B13R1.1988 CC(O)CCNC1CCCNCC1 270004a_200000755665_100015187895 [0,0,0,0,0,2|2,0,0]=4 7819 B13R1.1988 CC(O)CCOC1CCCCCC1 34a_100000210887_100012276601 [0,0,0,0,0,2|1,0,0]=3 7820 B13R1.1988 CC(O)CCOC1CCCCCC1 7a_100000210887_100012276601 [0,0,0,0,0,2|1,0,0]=3 7821 B13R1.1988 CC(O)CCSC1CCCCCC1 62a_100011217769_100012276601 [0,0,0,0,0,2|1,0,0]=3 7822 B13R1.1988 CC(O)CCSC1CCCCCC1 62a_100012276601_100011217769 [0,0,0,0,0,2|1,0,0]=3 7823 B13R1.1988 CC(O)CNCC1CCCCCC1 2230a_100000210904_200000696569 [0,0,0,0,0,2|1,0,0]=3 7824 B13R1.1988 CC(O)CNCC1CCCCCC1 2230a_100015204231_100011218427 [0,0,0,0,0,2|1,0,0]=3 7825 B13R1.1988 CC(O)CNCC1CCCCCC1 269862a_100000210904_200000763224 [0,0,0,0,0,2|1,0,0]=3 7826 B13R1.1988 CC(O)CNCC1CCCCCC1 34a_100000210904_200000696569 [0,0,0,0,0,2|1,0,0]=3 7827 B13R1.1988 CC(O)CNCC1CCCCCC1 34a_100015204231_100011218427 [0,0,0,0,0,2|1,0,0]=3 7828 B13R1.1988 CC(O)CNN=C1CCCCCC1 4a_200000730056_100000210131 [0,0,0,0,0,2|1,0,0]=3 7829 B13R1.1988 CC(O)COCC1CCCCCC1 34a_100000699130_100011218427 [0,0,0,0,0,2|1,0,0]=3 7830 B13R1.1988 CC(O)COCC1CCCCCC1 7a_100000699130_100011218427 [0,0,0,0,0,2|1,0,0]=3 7831 B13R1.1988 CC(O)CSCC1CCCCCC1 62a_100011218427_200000696569 [0,0,0,0,0,2|1,0,0]=3 7832 B13R1.1988 CC(O)CSCC1CCCCCC1 62a_200000696569_100011218427 [0,0,0,0,0,2|1,0,0]=3 7833 B13R1.1988 CN(C)CCCN1CCCCCC1 269982a_100000185865_100000757444 [0,0,0,0,0,2|2,0,0]=4 7834 B13R1.1988 CN(C)CCCN1CCCCCC1 269982a_200000231118_200000210301 [0,0,0,0,0,2|2,0,0]=4 7835 B13R1.1988 CN([13CH3])CCCN1CCCCCC1 269982a_200000231118_200025704644 [0,0,0,0,0,2|2,0,0]=4 7836 B13R1.1988 C[C@@H](Cl)COCC1CCCCCC1 34a_100016084084_200000696569 [0,0,0,0,0,2|2,0,0]=4 7837 B13R1.1988 C[C@@H](N)CCOC1CCCCCC1 34a_100000706166_100011217769 [0,0,0,0,0,2|2,0,0]=4 7838 B13R1.1988 C[C@@H](N)COCC1CCCCCC1 34a_100000737577_200000696569 [0,0,0,0,0,2|2,0,0]=4 7839 B13R1.1988 C[C@@H](O)CNCC1CCCCCC1 2230a_100015204231_100009817552 [0,0,0,0,0,2|1,0,0]=3 7840 B13R1.1988 C[C@@H](O)CNCC1CCCCCC1 34a_100015204231_100009817552 [0,0,0,0,0,2|1,0,0]=3 7841 B13R1.1988 C[C@@H](O)COCC1CCCCCC1 34a_100000699130_100009817552 [0,0,0,0,0,2|1,0,0]=3 7842 B13R1.1988 C[C@@H](O)COCC1CCCCCC1 7a_100000699130_100009817552 [0,0,0,0,0,2|1,0,0]=3 7843 B13R1.1988 C[C@@H](O)CSCC1CCCCCC1 62a_100009817552_200000696569 [0,0,0,0,0,2|1,0,0]=3 7844 B13R1.1988 C[C@@H](O)CSCC1CCCCCC1 62a_200000696569_100009817552 [0,0,0,0,0,2|1,0,0]=3 7845 B13R1.1988 OB(O)/C=C/CN1CCCCCC1 2230a_100000185865_100016262062 [0,0,0,0,0,2|2,0,0]=4 7846 B13R1.1988 OB(O)/C=C/CN1CCCCCC1 269982a_100000185865_100016262062 [0,0,0,0,0,2|2,0,0]=4 7847 B13R1.1988 OB(O)/C=C/CN1CCCCCC1 34a_100000185865_100016262062 [0,0,0,0,0,2|2,0,0]=4 7848 B13R1.1107 C=C(C)CN1CCCCCCCC1 2230a_100000039187_100000748629 [0,0,0,0,0,2|1,0,1]=4 7849 B13R1.1107 C=C(C)CN1CCCCCCCC1 269982a_100000039187_100000748629 [0,0,0,0,0,2|1,0,1]=4 7850 B13R1.1107 C=C(C)CN1CCCCCCCC1 34a_100000039187_100000748629 [0,0,0,0,0,2|1,0,1]=4 7851 B13R1.1107 CC(C)CN1CCCCCCCC1 2230a_100000039187_100000210760 [0,0,0,0,0,2|1,0,0]=3 7852 B13R1.1107 CC(C)CN1CCCCCCCC1 269982a_100000039187_100000210624 [0,0,0,0,0,2|1,0,0]=3 7853 B13R1.1107 CC(C)CN1CCCCCCCC1 270004a_100000039187_100000210432 [0,0,0,0,0,2|1,0,0]=3 7854 B13R1.1107 CC(C)CN1CCCCCCCC1 34a_100000039187_100000210624 [0,0,0,0,0,2|1,0,0]=3 7855 B13R1.1107 CC(O)CN1CCCCCCCC1 2230a_100000039187_100011218427 [0,0,0,0,0,2|0,0,0]=2 7856 B13R1.1107 CC(O)CN1CCCCCCCC1 269982a_100000039187_100011218427 [0,0,0,0,0,2|0,0,0]=2 7857 B13R1.1107 CC(O)CN1CCCCCCCC1 34a_100000039187_100011218427 [0,0,0,0,0,2|0,0,0]=2 7858 B13R1.1107 C[C@@H](O)CN1CCCCCCCC1 2230a_100000039187_100009817552 [0,0,0,0,0,2|0,0,0]=2 7859 B13R1.1107 C[C@@H](O)CN1CCCCCCCC1 269982a_100000039187_100009817552 [0,0,0,0,0,2|0,0,0]=2 7860 B13R1.1107 C[C@@H](O)CN1CCCCCCCC1 34a_100000039187_100009817552 [0,0,0,0,0,2|0,0,0]=2 7861 B13R1.1107 FC(F)CN1CCCCCCCC1 2230a_100000039187_100011934356 [0,0,0,0,0,2|2,0,0]=4 7862 B13R1.1107 FC(F)CN1CCCCCCCC1 269982a_100000039187_100011934356 [0,0,0,0,0,2|2,0,0]=4 7863 B13R1.1107 FC(F)CN1CCCCCCCC1 34a_100000039187_100011934356 [0,0,0,0,0,2|2,0,0]=4