0 B8R0.28 CC(C)C\C=C\C(=O)O SC-96534 [0,0,0,0,0,0|1,0,2]=3 1 B8R0.28 CN(C)C\C=C\C(=O)O SC-20214 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.28 CN(C)C\C=C\C(=O)O SC-82699 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.28 CN(C)\C=C\C=[N+](C)C SC-91287 [0,0,0,0,0,0|3,0,0]=3 4 B8R0.28 O=C(O)\C=C\CC(=O)O SC-37894 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.4 CCC\C=C\C(C)=O SC-49007 [1,0,0,0,0,0|0,0,2]=3 6 B7R0.4 CCO\C=C\C(=O)Cl SC-50076 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.4 CCO\C=C\C(=O)O SC-89061 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.4 C\C=C\CCC(=O)O SC-21245 [1,0,0,0,0,0|1,0,2]=4 9 B9R0.1 C=C\C(C)=C\CC=C(C)C SC-20483 [0,1,0,0,0,0|1,0,1]=3 10 B9R0.1 CC(C)=CCCC(C)C=O SC-79180 [0,1,0,0,0,0|0,0,3]=4 11 B9R0.7 CC(C)=CCC(N)C(=O)O SC-22867 [0,1,0,0,0,0|1,0,2]=4 12 B9R0.53 CC(=O)CC(=O)OC(C)C SC-18510 [0,1,0,0,0,0|1,0,2]=4 13 B9R0.53 CC(C)=CC(=O)C=C(C)C SC-83781 [0,1,0,0,0,0|1,0,0]=2 14 B9R0.53 CN(C)\C=C(/Cl)C=[N+](C)C SC-69242 [0,1,0,0,0,0|3,0,0]=4 15 B9R0.53 CN(C)\C=C(/Cl)C=[N+](C)C SC-90289 [0,1,0,0,0,0|3,0,0]=4 16 B9R1.35 CC(=O)C1=CC(Br)=CS1 SC-49457 [0,0,0,1,0,0|2,0,1]=4 17 B9R1.35 CC(=O)C1=CC(Cl)=CS1 SC-67650 [0,0,0,1,0,0|2,0,1]=4 18 B9R1.35 CC(=O)C1=CC=C(C)S1 SC-03600 [0,0,0,1,0,0|1,0,0]=2 19 B9R1.35 CC(=O)C1=CC=C(Cl)S1 SC-44218 [0,0,0,1,0,0|2,0,0]=3 20 B9R1.35 CC(=O)C1=CN(C)C=C1 SC-96099 [0,0,0,1,0,0|1,0,1]=3 21 B9R1.35 CC(=O)C1=CN(C)C=N1 SC-89121 [0,0,0,1,0,0|2,0,1]=4 22 B9R1.35 CC(=O)C1=CN(C)N=C1 SC-20768 [0,0,0,1,0,0|2,0,1]=4 23 B9R1.35 CC(=O)C1=NOC(C)=C1 SC-33251 [0,0,0,1,0,0|2,0,1]=4 24 B9R1.35 CC1=CC=C(C(=O)O)N1 SC-94836 [0,0,0,1,0,0|2,0,0]=3 25 B9R1.35 CC1=CC=C(C(=O)O)O1 SC-20513 [0,0,0,1,0,0|2,0,0]=3 26 B9R1.35 CC1=CN=C(C(=O)[O-])S1 SC-34621 [0,0,0,1,0,0|3,0,0]=4 27 B9R1.35 CC1=CNC(C(=O)O)=C1 SC-36204 [0,0,0,1,0,0|2,0,1]=4 28 B9R1.35 CC1=CSC(C(=O)O)=C1 SC-01072 [0,0,0,1,0,0|2,0,1]=4 29 B9R1.35 CC1=NC(C(=O)O)=CN1 SC-48423 [0,0,0,1,0,0|3,0,0]=4 30 B9R1.35 CC1=NC(C(=O)O)=CO1 SC-30359 [0,0,0,1,0,0|3,0,0]=4 31 B9R1.35 CC1=NC(C(=O)O)=CO1 SC-66016 [0,0,0,1,0,0|3,0,0]=4 32 B9R1.35 CC1=NC(C(=O)O)=CS1 SC-27449 [0,0,0,1,0,0|3,0,0]=4 33 B9R1.35 CC1=NC(C(N)=O)=CS1 SC-91185 [0,0,0,1,0,0|3,0,0]=4 34 B9R1.35 CC1=NC=C(C(=O)O)O1 SC-43630 [0,0,0,1,0,0|3,0,0]=4 35 B9R1.35 CC1=NC=C(C(=O)O)S1 SC-31817 [0,0,0,1,0,0|3,0,0]=4 36 B9R1.35 CN1C=CC(C(=O)O)=N1 SC-48405 [0,0,0,1,0,0|3,0,0]=4 37 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 SC-23954 [0,0,0,1,0,0|3,0,0]=4 38 B9R1.35 O=C(O)C1=CC=C(Br)O1 SC-17440 [0,0,0,1,0,0|3,0,0]=4 39 B9R1.35 O=C(O)C1=CC=C(Br)S1 SC-06548 [0,0,0,1,0,0|3,0,0]=4 40 B9R1.35 O=C(O)C1=CC=C(Cl)O1 SC-53519 [0,0,0,1,0,0|3,0,0]=4 41 B9R1.35 O=C(O)C1=CC=C(Cl)S1 SC-02789 [0,0,0,1,0,0|3,0,0]=4 42 B9R1.35 O=C(O)C1=CC=C(F)S1 SC-52616 [0,0,0,1,0,0|3,0,0]=4 43 B7R0.6 CC(=O)OCC(C)C SC-25600 [0,0,0,0,1,0|1,0,2]=4 44 B7R0.6 CC(=O)\C=C\C(=O)O SC-94119 [0,0,0,0,1,0|2,0,0]=3 45 B7R0.6 CC(=O)\C=C\N(C)C SC-92543 [0,0,0,0,1,0|1,0,0]=2 46 B7R0.6 CN(C)\C=C\[N+](=O)[O-] SC-16745 [0,0,0,0,1,0|3,0,0]=4 47 B6R0.4 CC\C=C\C(=O)O SC-92876 [2,0,0,0,0,0|1,0,1]=4 48 B6R0.4 CO\C=C\C(C)=O SC-71024 [2,0,0,0,0,0|1,0,0]=3 49 B6R0.6 CCC\C=C\C=O SC-25240 [2,0,0,0,0,0|0,0,2]=4 50 B8R0.8 C\C=C\C=C(/C)C(=O)[O-] SC-10258 [1,1,0,0,0,0|1,0,0]=3 51 B8R0.9 COC(=O)\C=C\C(=O)[O-] SC-65689 [1,1,0,0,0,0|2,0,0]=4 52 B8R0.23 C=C(CC(C)C)C(C)=O SC-A2921 [0,1,0,0,1,0|0,0,2]=4 53 B8R1.1 CC1=CC=C(C=O)N1 SC-97579 [1,0,0,1,0,0|1,0,0]=3 54 B8R1.1 CC1=CC=C(C=O)S1 SC-00934 [1,0,0,1,0,0|1,0,0]=3 55 B8R1.1 CC1=CNC(C=O)=N1 SC-52739 [1,0,0,1,0,0|2,0,0]=4 56 B8R1.1 CC1=CSC(C=O)=C1 SC-51189 [1,0,0,1,0,0|1,0,1]=4 57 B8R1.1 CC1=CSC(C=O)=N1 SC-21023 [1,0,0,1,0,0|2,0,0]=4 58 B8R1.1 CC1=NC(C=O)=CN1 SC-25211 [1,0,0,1,0,0|2,0,0]=4 59 B8R1.1 CC1=NC(C=O)=CO1 SC-30620 [1,0,0,1,0,0|2,0,0]=4 60 B8R1.1 CC1=NC(C=O)=CS1 SC-30898 [1,0,0,1,0,0|2,0,0]=4 61 B8R1.1 CC1=NC=C(C=O)O1 SC-14501 [1,0,0,1,0,0|2,0,0]=4 62 B8R1.1 CC1=NC=C(C=O)O1 SC-65844 [1,0,0,1,0,0|2,0,0]=4 63 B8R1.1 CC1=NC=C(C=O)S1 SC-48442 [1,0,0,1,0,0|2,0,0]=4 64 B8R1.1 CN1C=CC(C=O)=N1 SC-49404 [1,0,0,1,0,0|2,0,0]=4 65 B8R1.1 O=CC1=CC=C(Br)O1 SC-16551 [1,0,0,1,0,0|2,0,0]=4 66 B8R1.1 O=CC1=CC=C(Br)S1 SC-23891 [1,0,0,1,0,0|2,0,0]=4 67 B8R1.1 O=CC1=CC=C(Cl)O1 SC-66690 [1,0,0,1,0,0|2,0,0]=4 68 B8R1.1 O=CC1=CC=C(Cl)S1 SC-06542 [1,0,0,1,0,0|2,0,0]=4 69 B8R1.4 CC1=CC(C)=NC=C1 SC-25798 [1,0,0,1,0,0|1,0,1]=4 70 B8R1.4 CC1=CC([Mg+])=CC=C1 SC-92161 [1,0,0,1,0,0|1,0,1]=4 71 B8R1.4 CC1=CC=CC(Br)=N1 SC-05100 [1,0,0,1,0,0|2,0,0]=4 72 B8R1.4 CC1=CC=CC(Cl)=N1 SC-01935 [1,0,0,1,0,0|2,0,0]=4 73 B8R1.4 CC1=CC=CC(F)=C1 SC-27107 [1,0,0,1,0,0|1,0,1]=4 74 B8R1.4 CC1=CC=CC(F)=N1 SC-04337 [1,0,0,1,0,0|2,0,0]=4 75 B8R1.4 CC1=CC=CC(I)=C1 SC-22886 [1,0,0,1,0,0|1,0,1]=4 76 B8R1.4 CC1=CC=CC(O)=N1 SC-03498 [1,0,0,1,0,0|1,0,1]=4 77 B8R1.4 CC1=CC=CC(S)=N1 SC-20607 [1,0,0,1,0,0|1,1,0]=4 78 B8R1.7 CC(=O)C1=CC=CO1 SC-00529 [1,0,0,1,0,0|1,0,0]=3 79 B8R1.7 CC(=O)C1=CN=CN1 SC-21155 [1,0,0,1,0,0|2,0,0]=4 80 B8R1.7 CC(=O)C1=CN=CS1 SC-20615 [1,0,0,1,0,0|2,0,0]=4 81 B8R1.7 CC(=O)C1=CNC=C1 SC-68845 [1,0,0,1,0,0|1,0,1]=4 82 B8R1.7 CC(=O)C1=CSC=N1 SC-66041 [1,0,0,1,0,0|2,0,0]=4 83 B8R1.7 CC(=O)C1=NC=CS1 SC-02806 [1,0,0,1,0,0|2,0,0]=4 84 B8R1.7 O=C(Cl)C1=CC=CS1 SC-77247 [1,0,0,1,0,0|2,0,0]=4 85 B8R1.7 O=C(O)C1=CC=CN1 SC-54396 [1,0,0,1,0,0|2,0,0]=4 86 B8R1.7 O=C(O)C1=CC=CS1 SC-05067 [1,0,0,1,0,0|2,0,0]=4 87 B8R1.19 CC1(C)OC=CC1=O SC-97893 [1,0,0,1,0,0|1,0,1]=4 88 B8R1.22 O=C1C=CCCCC1 SC-99582 [1,0,0,1,0,0|0,0,2]=4 89 B8R1.3 CC1=CCC(=O)CC1 SC-25236 [0,0,0,1,1,0|0,0,1]=3 90 B8R1.3 CC1=CCC(=O)CC1 SC-83877 [0,0,0,1,1,0|0,0,1]=3 91 B8R1.3 CC1=NNC(=O)CC1 SC-73679 [0,0,0,1,1,0|2,0,0]=4 92 B8R1.51 CC1(C)C=CC(=O)C1 SC-91103 [0,0,0,1,1,0|0,0,1]=3 93 B10R1.54 CC(=O)NC1=NC(C)=CS1 SC-92903 [0,0,0,1,0,1|2,0,0]=4 94 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 SC-24215 [0,0,0,1,0,1|1,0,1]=4 95 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 SC-28947 [0,0,0,1,0,1|1,0,1]=4 96 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 SC-35528 [0,0,0,1,0,1|1,0,1]=4 97 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 SC-33044 [0,0,0,1,0,1|1,0,1]=4 98 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 SC-20123 [0,0,0,1,0,1|1,0,1]=4 99 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 SC-02450 [0,0,0,1,0,1|1,0,1]=4 100 B10R1.113 CC(=O)C1=CC=CC(F)=C1 SC-45965 [0,0,0,1,0,1|1,0,1]=4 101 B10R1.113 CC(=O)C1=CC=CC(N)=C1 SC-46716 [0,0,0,1,0,1|1,0,1]=4 102 B10R1.113 CC(=O)C1=CC=CC(O)=C1 SC-00606 [0,0,0,1,0,1|1,0,1]=4 103 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 SC-27044 [0,0,0,1,0,1|2,0,0]=4 104 B10R1.113 CC(=O)C1=NC(Cl)=CC=C1 SC-39891 [0,0,0,1,0,1|2,0,0]=4 105 B10R1.113 CC(=O)C1=NC(F)=CC=C1 SC-14253 [0,0,0,1,0,1|2,0,0]=4 106 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 SC-91180 [0,0,0,1,0,1|1,0,1]=4 107 B10R1.113 CC(=O)C1=NC=CC(C)=C1 SC-40245 [0,0,0,1,0,1|0,0,1]=3 108 B10R1.113 CC1=CC(C(=O)O)=CN=C1 SC-19769 [0,0,0,1,0,1|1,0,1]=4 109 B10R1.113 CC1=CC(C(=O)O)=NC=C1 SC-43275 [0,0,0,1,0,1|1,0,1]=4 110 B10R1.113 CC1=CC=CC(C(=O)O)=C1 SC-26660 [0,0,0,1,0,1|1,0,1]=4 111 B10R1.113 CC1=CC=CC(C(=O)O)=N1 SC-23757 [0,0,0,1,0,1|2,0,0]=4 112 B10R1.113 CC1=CN=CC(C(=O)Cl)=C1 SC-50797 [0,0,0,1,0,1|1,0,1]=4 113 B10R1.113 CC1=CN=CC(C(=O)O)=N1 SC-14460 [0,0,0,1,0,1|2,0,0]=4 114 B10R1.113 CC1=NC(C(=O)O)=CC=N1 SC-22528 [0,0,0,1,0,1|2,0,0]=4 115 B10R1.113 CC1=NC=CC(C(=O)O)=C1 SC-26501 [0,0,0,1,0,1|1,0,1]=4 116 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 SC-00991 [0,1,0,1,0,0|1,0,1]=4 117 B10R1.13 CC(=O)C1=CC=C(C)C=C1 SC-00611 [0,1,0,1,0,0|0,0,1]=3 118 B10R1.13 CC(=O)C1=CC=C(F)C=C1 SC-24410 [0,1,0,1,0,0|1,0,1]=4 119 B10R1.13 CC(=O)C1=CC=C(F)N=C1 SC-34866 [0,1,0,1,0,0|1,0,1]=4 120 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SC-00833 [0,1,0,1,0,0|1,0,1]=4 121 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SC-07565 [0,1,0,1,0,0|1,0,1]=4 122 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SC-07567 [0,1,0,1,0,0|1,0,1]=4 123 B10R1.13 CC(=O)C1=CC=C(O)N=C1 SC-68934 [0,1,0,1,0,0|1,0,1]=4 124 B10R1.13 CC(=O)C1=CN=C(C)C=C1 SC-22000 [0,1,0,1,0,0|0,0,1]=3 125 B10R1.13 CC(=O)C1=CN=C(N)C=C1 SC-44437 [0,1,0,1,0,0|1,0,1]=4 126 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 SC-13139 [0,1,0,1,0,0|1,0,1]=4 127 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 SC-29346 [0,1,0,1,0,0|1,0,1]=4 128 B10R1.13 CC(=O)C1=NC=C(F)C=C1 SC-48996 [0,1,0,1,0,0|1,0,1]=4 129 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 SC-B8505 [0,1,0,1,0,0|2,0,0]=4 130 B10R1.13 CC1=CC=C(C(=O)O)C=C1 SC-94826 [0,1,0,1,0,0|1,0,1]=4 131 B10R1.13 CC1=CC=C(C(=O)O)N=C1 SC-28824 [0,1,0,1,0,0|1,0,1]=4 132 B10R1.13 CC1=CC=C(N(C)C)C=C1 SC-25990 [0,1,0,1,0,0|2,0,0]=4 133 B10R1.14 CNC(=O)C1=COC(C)=N1 SC-94136 [0,1,0,1,0,0|2,0,0]=4 134 B10R1.14 COC(=O)C1=CC=C(Br)N1 SC-48714 [0,1,0,1,0,0|2,0,0]=4 135 B10R1.14 COC(=O)C1=CC=C(Br)O1 SC-15025 [0,1,0,1,0,0|2,0,0]=4 136 B10R1.14 COC(=O)C1=CC=C(Br)S1 SC-52012 [0,1,0,1,0,0|2,0,0]=4 137 B10R1.14 COC(=O)C1=CC=C(Cl)O1 SC-68644 [0,1,0,1,0,0|2,0,0]=4 138 B10R1.14 COC(=O)C1=NC(C)=CS1 SC-33575 [0,1,0,1,0,0|2,0,0]=4 139 B10R1.14 O=C(CBr)C1=CC=C(Cl)S1 SC-94993 [0,1,0,1,0,0|2,0,0]=4 140 B10R1.31 O=C(O)C1=CC=C(CO)O1 SC-95631 [0,1,0,1,0,0|2,0,0]=4 141 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 SC-99885 [0,1,0,1,0,0|2,0,0]=4 142 B10R1.59 CC(=O)C1=C(Br)C=C(Br)S1 SC-48309 [0,1,0,1,0,0|2,0,0]=4 143 B6R0.2 CC(=O)CC(C)=O SC-77723 [0,0,0,0,2,0|1,0,1]=4 144 B6R0.2 CC(=O)NC(C)C SC-A3057 [0,0,0,0,2,0|1,0,1]=4 145 B6R0.2 CC(=O)OC(C)C SC-25616 [0,0,0,0,2,0|1,0,1]=4 146 B6R0.2 CC(=O)\C=C(\C)N SC-89382 [0,0,0,0,2,0|1,0,0]=3 147 B6R0.2 CC(=O)\C=C(\C)O SC-20333 [0,0,0,0,2,0|1,0,0]=3 148 B6R0.2 CC(=O)\C=C(\C)O SC-67757 [0,0,0,0,2,0|1,0,0]=3 149 B6R0.2 CC(=O)\C=C(\C)[O-] SC-19412 [0,0,0,0,2,0|1,0,0]=3 150 B6R0.2 CC(C)=CC(=O)Cl SC-17934 [0,0,0,0,2,0|1,0,0]=3 151 B6R0.2 CC(C)=CC(=O)O SC-16257 [0,0,0,0,2,0|1,0,0]=3