0 B7R1.3 BrC1=CC=CN=C1 SC-05888 [0,0,0,0,0,0|2,0,2]=4 1 B7R1.3 BrC1=CC=NC=C1 SC-02129 [0,0,0,0,0,0|2,0,2]=4 2 B7R1.3 BrC1=CC=NC=C1 SC-20313 [0,0,0,0,0,0|2,0,2]=4 3 B7R1.3 BrC1=CC=NN=C1 SC-43669 [0,0,0,0,0,0|3,0,1]=4 4 B7R1.3 BrC1=CC=NN=C1 SC-82176 [0,0,0,0,0,0|3,0,1]=4 5 B7R1.3 BrC1=CC=NN=C1 SC-89220 [0,0,0,0,0,0|3,0,1]=4 6 B7R1.3 BrC1=CCCCC1 SC-69986 [0,0,0,0,0,0|1,0,1]=2 7 B7R1.3 BrC1=NC=CC=C1 SC-00317 [0,0,0,0,0,0|2,0,2]=4 8 B7R1.3 BrC1=NC=NC=C1 SC-19730 [0,0,0,0,0,0|3,0,1]=4 9 B7R1.3 BrC1=NC=NC=C1 SC-82272 [0,0,0,0,0,0|3,0,1]=4 10 B7R1.3 BrC1=NN=CC=C1 SC-21836 [0,0,0,0,0,0|3,0,1]=4 11 B7R1.3 BrC1CCCOC1 SC-43426 [0,0,0,0,0,0|2,0,2]=4 12 B7R1.3 C=C1CCNCC1 SC-88353 [0,0,0,0,0,0|2,0,2]=4 13 B7R1.3 CC1=CC=NC=N1 SC-21623 [0,0,0,0,0,0|3,0,1]=4 14 B7R1.3 CC1=CCCCC1 SC-99243 [0,0,0,0,0,0|1,0,1]=2 15 B7R1.3 CC1=CCCNC1 SC-82898 [0,0,0,0,0,0|2,0,1]=3 16 B7R1.3 CC1=CCNCC1 SC-B8899 [0,0,0,0,0,0|2,0,1]=3 17 B7R1.3 CC1=NC=CC=C1 SC-83123 [0,0,0,0,0,0|2,0,2]=4 18 B7R1.3 CC1=NN=CC=C1 SC-50470 [0,0,0,0,0,0|3,0,1]=4 19 B7R1.3 CC1CCCCC1 SC-79075 [0,0,0,0,0,0|1,0,3]=4 20 B7R1.3 CC1CCCNC1 SC-46299 [0,0,0,0,0,0|2,0,2]=4 21 B7R1.3 C[C@H]1CCCNC1 SC-99949 [0,0,0,0,0,0|2,0,2]=4 22 B7R1.3 C[SiH]1CCCCO1 SC-91060 [0,0,0,0,0,0|2,1,1]=4 23 B7R1.3 ClC1=CC=CN=C1 SC-05891 [0,0,0,0,0,0|2,0,2]=4 24 B7R1.3 ClC1=CC=NC=C1 SC-06575 [0,0,0,0,0,0|2,0,2]=4 25 B7R1.3 ClC1=CC=NN=C1 SC-48191 [0,0,0,0,0,0|3,0,1]=4 26 B7R1.3 ClC1=NC=NC=C1 SC-19731 [0,0,0,0,0,0|3,0,1]=4 27 B7R1.3 ClC1=NC=NC=C1 SC-52559 [0,0,0,0,0,0|3,0,1]=4 28 B7R1.3 ClC1=NN=CC=C1 SC-B6866 [0,0,0,0,0,0|3,0,1]=4 29 B7R1.3 ClC1CCCCO1 SC-85266 [0,0,0,0,0,0|2,0,2]=4 30 B7R1.3 FC1=CC=CN=C1 SC-03948 [0,0,0,0,0,0|2,0,2]=4 31 B7R1.3 FC1=CC=NC=C1 SC-04101 [0,0,0,0,0,0|2,0,2]=4 32 B7R1.3 FC1=CC=NC=C1 SC-13797 [0,0,0,0,0,0|2,0,2]=4 33 B7R1.3 FC1=NC=CC=C1 SC-03949 [0,0,0,0,0,0|2,0,2]=4 34 B7R1.3 FC1CCCCC1 SC-09547 [0,0,0,0,0,0|1,0,3]=4 35 B7R1.3 FC1CCCNC1 SC-21265 [0,0,0,0,0,0|2,0,2]=4 36 B7R1.3 IC1=CC=CC=C1 SC-05582 [0,0,0,0,0,0|1,0,3]=4 37 B7R1.3 IC1=CC=CN=C1 SC-00365 [0,0,0,0,0,0|2,0,2]=4 38 B7R1.3 IC1=CC=NC=C1 SC-01411 [0,0,0,0,0,0|2,0,2]=4 39 B7R1.3 IC1=NC=CC=C1 SC-48572 [0,0,0,0,0,0|2,0,2]=4 40 B7R1.3 IC1=NN=CC=C1 SC-48200 [0,0,0,0,0,0|3,0,1]=4 41 B7R1.3 NC1=CC=CN=C1 SC-04710 [0,0,0,0,0,0|2,0,2]=4 42 B7R1.3 NC1=CC=NN=C1 SC-14948 [0,0,0,0,0,0|3,0,1]=4 43 B7R1.3 NC1=NC=NC=C1 SC-26466 [0,0,0,0,0,0|3,0,1]=4 44 B7R1.3 NC1=NN=CC=C1 SC-14947 [0,0,0,0,0,0|3,0,1]=4 45 B7R1.3 NC1CCCNC1 SC-54118 [0,0,0,0,0,0|2,0,2]=4 46 B7R1.3 NC1CCCNC1 SC-77469 [0,0,0,0,0,0|2,0,2]=4 47 B7R1.3 NC1CCCOC1 SC-35742 [0,0,0,0,0,0|2,0,2]=4 48 B7R1.3 NC1CCCOC1 SC-49332 [0,0,0,0,0,0|2,0,2]=4 49 B7R1.3 NN1CCCCC1 SC-18780 [0,0,0,0,0,0|2,0,2]=4 50 B7R1.3 N[C@@H]1CCCNC1 SC-03568 [0,0,0,0,0,0|2,0,2]=4 51 B7R1.3 N[C@@H]1CCCOC1 SC-71639 [0,0,0,0,0,0|2,0,2]=4 52 B7R1.3 N[C@@H]1CCCOC1 SC-96408 [0,0,0,0,0,0|2,0,2]=4 53 B7R1.3 N[C@H]1CCCNC1 SC-25042 [0,0,0,0,0,0|2,0,2]=4 54 B7R1.3 N[C@H]1CCCOC1 SC-94110 [0,0,0,0,0,0|2,0,2]=4 55 B7R1.3 O=C1C=CC=NN1 SC-04871 [0,0,0,0,0,0|2,0,1]=3 56 B7R1.3 O=C1C=CCCN1 SC-25185 [0,0,0,0,0,0|1,0,0]=1 57 B7R1.3 O=C1C=CCCO1 SC-50374 [0,0,0,0,0,0|1,0,0]=1 58 B7R1.3 O=C1CCCCN1 SC-16274 [0,0,0,0,0,0|1,0,1]=2 59 B7R1.3 O=C1CCCCO1 SC-65111 [0,0,0,0,0,0|1,0,1]=2 60 B7R1.3 O=C1CCCNC1 SC-29391 [0,0,0,0,0,0|1,0,1]=2 61 B7R1.3 O=C1CCCNC1 SC-48015 [0,0,0,0,0,0|1,0,1]=2 62 B7R1.3 O=C1CCCOC1 SC-14944 [0,0,0,0,0,0|1,0,1]=2 63 B7R1.3 O=C1CCNCC1 SC-04236 [0,0,0,0,0,0|1,0,2]=3 64 B7R1.3 O=C1CCNCC1 SC-04379 [0,0,0,0,0,0|1,0,2]=3 65 B7R1.3 O=C1CCNCC1 SC-19352 [0,0,0,0,0,0|1,0,2]=3 66 B7R1.3 O=C1CCOCC1 SC-03251 [0,0,0,0,0,0|1,0,2]=3 67 B7R1.3 O=C1CCSCC1 SC-19697 [0,0,0,0,0,0|1,0,2]=3 68 B7R1.3 O=C1CNCCN1 SC-05365 [0,0,0,0,0,0|2,0,1]=3 69 B7R1.3 O=C1CNCCO1 SC-84883 [0,0,0,0,0,0|2,0,1]=3 70 B7R1.3 O=C1COCCN1 SC-24222 [0,0,0,0,0,0|2,0,1]=3 71 B7R1.3 O=C1CSCCN1 SC-28581 [0,0,0,0,0,0|2,0,1]=3 72 B7R1.3 O=C1N=CC=CN1 SC-14287 [0,0,0,0,0,0|2,0,2]=4 73 B7R1.3 OC1=CC=CN=C1 SC-00314 [0,0,0,0,0,0|1,0,3]=4 74 B7R1.3 OC1=CC=NC=C1 SC-05892 [0,0,0,0,0,0|1,0,3]=4 75 B7R1.3 OC1=CC=NN=C1 SC-43569 [0,0,0,0,0,0|2,0,2]=4 76 B7R1.3 OC1=CC=NN=C1 SC-92872 [0,0,0,0,0,0|2,0,2]=4 77 B7R1.3 OC1=CN=NCC1 SC-89630 [0,0,0,0,0,0|2,0,1]=3 78 B7R1.3 OC1=NC=CC=C1 SC-01052 [0,0,0,0,0,0|1,0,3]=4 79 B7R1.3 OC1=NC=CC=C1 SC-81688 [0,0,0,0,0,0|1,0,3]=4 80 B7R1.3 OC1=NC=NC=C1 SC-19385 [0,0,0,0,0,0|2,0,2]=4 81 B7R1.3 OC1=NC=NC=C1 SC-47322 [0,0,0,0,0,0|2,0,2]=4 82 B7R1.3 OC1CC=CCC1 SC-87372 [0,0,0,0,0,0|0,0,4]=4 83 B7R1.3 OC1CCCCO1 SC-84303 [0,0,0,0,0,0|1,0,3]=4 84 B7R1.3 OC1CCCNC1 SC-06262 [0,0,0,0,0,0|1,0,3]=4 85 B7R1.3 OC1CCCNC1 SC-47771 [0,0,0,0,0,0|1,0,3]=4 86 B7R1.3 OC1CCCOC1 SC-19794 [0,0,0,0,0,0|1,0,3]=4 87 B7R1.3 OC1CCCOC1 SC-35801 [0,0,0,0,0,0|1,0,3]=4 88 B7R1.3 ON1CCCCC1 SC-13334 [0,0,0,0,0,0|1,0,3]=4 89 B7R1.3 O[C@@H]1CCCNC1 SC-12564 [0,0,0,0,0,0|1,0,3]=4 90 B7R1.3 O[C@H]1CCCNC1 SC-19802 [0,0,0,0,0,0|1,0,3]=4 91 B7R1.3 S=C1C=CNC=N1 SC-A2193 [0,0,0,0,0,0|2,1,1]=4 92 B7R1.3 SC1=CC=NC=C1 SC-04665 [0,0,0,0,0,0|1,1,2]=4 93 B7R1.3 [O-]C1=CC=CC=C1 SC-72823 [0,0,0,0,0,0|0,0,4]=4 94 B7R1.3 [SiH3]C1=CC=CC=C1 SC-15903 [0,0,0,0,0,0|1,0,3]=4 95 B6R1.1 C1=CC=NC=C1 SC-15293 [1,0,0,0,0,0|1,0,2]=4 96 B6R1.1 C1=CC=NC=C1 SC-26943 [1,0,0,0,0,0|1,0,2]=4 97 B6R1.1 C1=CC=NC=C1 SC-90173 [1,0,0,0,0,0|1,0,2]=4 98 B6R1.1 C1=CC=NN=C1 SC-20940 [1,0,0,0,0,0|2,0,1]=4 99 B6R1.1 C1=CC=[NH+]C=C1 SC-16400 [1,0,0,0,0,0|1,0,2]=4 100 B6R1.1 C1=CCCC=C1 SC-50457 [1,0,0,0,0,0|0,0,1]=2 101 B6R1.1 C1=CCNCC1 SC-83515 [1,0,0,0,0,0|1,0,1]=3 102 B6R1.1 C1=COCCC1 SC-00342 [1,0,0,0,0,0|1,0,0]=2 103 B6R1.1 C1CCNCC1 SC-05687 [1,0,0,0,0,0|1,0,2]=4 104 B6R1.1 C1CCNNC1 SC-84334 [1,0,0,0,0,0|2,0,1]=4 105 B6R1.1 C1CCONC1 SC-82296 [1,0,0,0,0,0|2,0,1]=4 106 B6R1.1 C1CC[NH2+]CC1 SC-48018 [1,0,0,0,0,0|1,0,2]=4 107 B6R1.1 C1CNCNC1 SC-72269 [1,0,0,0,0,0|2,0,1]=4 108 B6R1.1 C1CSCSC1 SC-46192 [1,0,0,0,0,0|2,0,1]=4 109 B8R1.2 COC1=CCCCC1 SC-28269 [0,1,0,0,0,0|0,0,2]=3 110 B8R1.2 O=CC1=CC=CN=N1 SC-47572 [0,1,0,0,0,0|2,0,1]=4 111 B8R1.2 O=CC1=CC=NC=C1 SC-17461 [0,1,0,0,0,0|1,0,2]=4 112 B8R1.2 O=CC1=COCCC1 SC-46524 [0,1,0,0,0,0|1,0,0]=2 113 B8R1.2 O=CC1=NC=CC=C1 SC-17970 [0,1,0,0,0,0|1,0,2]=4 114 B8R1.2 O=CC1CCCCC1 SC-02305 [0,1,0,0,0,0|0,0,3]=4 115 B8R1.2 O=CC1CCCCN1 SC-29120 [0,1,0,0,0,0|1,0,2]=4 116 B8R1.2 O=CC1CCCOC1 SC-45114 [0,1,0,0,0,0|1,0,2]=4 117 B8R1.2 O=CN1CCCCC1 SC-02942 [0,1,0,0,0,0|1,0,2]=4 118 B8R1.2 O=NC1=CC=CC=C1 SC-82101 [0,1,0,0,0,0|0,0,3]=4 119 B8R1.3 CC1=CCC(=O)CC1 SC-25236 [0,1,0,0,0,0|0,0,2]=3 120 B8R1.3 CC1=CCC(=O)CC1 SC-83877 [0,1,0,0,0,0|0,0,2]=3 121 B8R1.3 CC1=NNC(=O)CC1 SC-73679 [0,1,0,0,0,0|2,0,1]=4 122 B8R1.3 CN1CCC(=O)CC1 SC-01124 [0,1,0,0,0,0|1,0,2]=4 123 B8R1.3 CN1CCC(=O)CC1 SC-90211 [0,1,0,0,0,0|1,0,2]=4 124 B8R1.3 NC1CCC(=O)CC1 SC-51421 [0,1,0,0,0,0|0,0,2]=3 125 B8R1.3 NC1CCC(=O)CC1 SC-94303 [0,1,0,0,0,0|0,0,2]=3 126 B8R1.3 N[C@H]1CCC(=O)NC1 SC-A3084 [0,1,0,0,0,0|1,0,1]=3 127 B8R1.3 O=C1C=CC(Br)=NN1 SC-89401 [0,1,0,0,0,0|2,0,1]=4 128 B8R1.3 O=C1C=CC(Cl)=NN1 SC-04477 [0,1,0,0,0,0|2,0,1]=4 129 B8R1.3 O=C1C=CC(I)=CN1 SC-96951 [0,1,0,0,0,0|1,0,2]=4 130 B8R1.3 O=C1CCC(=O)CC1 SC-15336 [0,1,0,0,0,0|0,0,3]=4 131 B8R1.3 O=C1CCC(=O)NC1 SC-35404 [0,1,0,0,0,0|1,0,2]=4 132 B8R1.3 O=C1CCC(O)CC1 SC-22101 [0,1,0,0,0,0|0,0,2]=3 133 B8R1.3 O=C1CCC(O)CN1 SC-14920 [0,1,0,0,0,0|1,0,1]=3 134 B8R1.4 CC1=CC(=O)NN=C1 SC-35661 [0,1,0,0,0,0|2,0,1]=4 135 B8R1.4 CC1CC(=O)CCN1 SC-14913 [0,1,0,0,0,0|1,0,2]=4 136 B8R1.4 CC1CC(=O)CCN1 SC-26346 [0,1,0,0,0,0|1,0,2]=4 137 B8R1.4 CC1CC(=O)CCO1 SC-43658 [0,1,0,0,0,0|1,0,2]=4 138 B8R1.4 CC1CCCC(=O)N1 SC-90092 [0,1,0,0,0,0|1,0,1]=3 139 B8R1.4 CC1CCNC(=O)C1 SC-65553 [0,1,0,0,0,0|1,0,1]=3 140 B8R1.4 CC1CNCC(=O)N1 SC-68745 [0,1,0,0,0,0|2,0,1]=4 141 B8R1.4 CN1CCCC(=O)C1 SC-88063 [0,1,0,0,0,0|1,0,1]=3 142 B8R1.4 CN1CCNC(=O)C1 SC-43594 [0,1,0,0,0,0|2,0,1]=4 143 B8R1.4 C[C@H]1COCC(=O)N1 SC-82343 [0,1,0,0,0,0|2,0,1]=4 144 B8R1.4 NC1=CC(=O)CCC1 SC-18537 [0,1,0,0,0,0|0,0,0]=1 145 B8R1.4 NC1=CC(=O)NC=C1 SC-86850 [0,1,0,0,0,0|1,0,2]=4 146 B8R1.4 O=C1C=C(Cl)C=NN1 SC-48403 [0,1,0,0,0,0|2,0,1]=4 147 B8R1.4 O=C1C=CNC(=O)N1 SC-09054 [0,1,0,0,0,0|2,0,1]=4 148 B8R1.4 O=C1C=CNC(=S)N1 SC-46212 [0,1,0,0,0,0|2,0,1]=4 149 B8R1.4 O=C1CC(O)CCN1 SC-14921 [0,1,0,0,0,0|1,0,1]=3 150 B8R1.4 O=C1CC(O)CCN1 SC-26449 [0,1,0,0,0,0|1,0,1]=3 151 B8R1.4 O=C1CCCC(=O)C1 SC-16085 [0,1,0,0,0,0|0,0,1]=2 152 B8R1.4 O=C1CCCC(=O)N1 SC-65454 [0,1,0,0,0,0|1,0,0]=2 153 B8R1.4 O=C1CCCC(=O)O1 SC-43876 [0,1,0,0,0,0|1,0,0]=2 154 B8R1.4 O=C1CCCC(O)C1 SC-52929 [0,1,0,0,0,0|0,0,2]=3 155 B8R1.4 O=C1COCC(=O)O1 SC-26890 [0,1,0,0,0,0|2,0,0]=3 156 B8R1.4 O=C1CSCC(=O)C1 SC-21904 [0,1,0,0,0,0|1,0,1]=3 157 B8R1.5 CC1=CC=CNC1=O SC-17920 [0,1,0,0,0,0|1,0,2]=4 158 B8R1.5 CC1CCCCC1=O SC-20428 [0,1,0,0,0,0|0,0,2]=3 159 B8R1.5 C[C@H]1NCCNC1=O SC-05130 [0,1,0,0,0,0|2,0,1]=4 160 B8R1.5 NC1CCCCC1=O SC-22252 [0,1,0,0,0,0|0,0,2]=3 161 B8R1.5 NC1CCCCC1=O SC-84826 [0,1,0,0,0,0|0,0,2]=3 162 B8R1.5 NC1CCCNC1=O SC-14514 [0,1,0,0,0,0|1,0,1]=3 163 B8R1.5 N[C@@H]1CCCNC1=O SC-48796 [0,1,0,0,0,0|1,0,1]=3 164 B8R1.5 N[C@H]1CCCNC1=O SC-27263 [0,1,0,0,0,0|1,0,1]=3 165 B8R1.5 O=C1C=CNC=C1F SC-28390 [0,1,0,0,0,0|1,0,2]=4 166 B8R1.5 O=C1C=COC=C1O SC-65649 [0,1,0,0,0,0|1,0,2]=4 167 B8R1.5 O=C1CCCCC1=O SC-46435 [0,1,0,0,0,0|0,0,1]=2 168 B8R1.5 O=C1CCCCC1Br SC-86496 [0,1,0,0,0,0|0,0,2]=3 169 B8R1.5 O=C1CCCCC1Cl SC-20977 [0,1,0,0,0,0|0,0,2]=3 170 B8R1.5 O=C1CCCCC1O SC-49144 [0,1,0,0,0,0|0,0,2]=3 171 B8R1.5 O=C1CCNCC1Br SC-94331 [0,1,0,0,0,0|1,0,2]=4 172 B8R1.5 O=C1CCOCC1Br SC-33711 [0,1,0,0,0,0|1,0,2]=4 173 B8R1.5 O=C1N=CNC=C1I SC-89876 [0,1,0,0,0,0|2,0,1]=4 174 B8R1.5 O=C1NCCCC1O SC-14922 [0,1,0,0,0,0|1,0,1]=3 175 B8R1.5 O=C1NN=CC=C1Cl SC-53678 [0,1,0,0,0,0|2,0,1]=4 176 B8R1.5 O=C1OC=CC=C1O SC-24535 [0,1,0,0,0,0|1,0,2]=4 177 B8R1.72 O=S1(=O)CCCCN1 SC-48177 [0,1,0,0,0,0|2,0,1]=4 178 B8R1.72 O=S1(=O)CCCCO1 SC-15335 [0,1,0,0,0,0|2,0,1]=4 179 B6R0.1 C#CC(=O)OCC SC-05846 [0,0,1,0,0,0|1,0,2]=4 180 B6R0.1 C=CC(=O)NCO SC-75438 [0,0,1,0,0,0|2,0,0]=3 181 B6R0.1 C=CCC(=O)OC SC-48829 [0,0,1,0,0,0|1,0,2]=4 182 B6R0.1 CC#CC(=O)OC SC-48510 [0,0,1,0,0,0|1,0,2]=4 183 B6R0.1 CCOC(=O)C#N SC-20120 [0,0,1,0,0,0|2,0,1]=4 184 B6R0.1 CCOC(=O)CBr SC-17870 [0,0,1,0,0,0|2,0,1]=4 185 B6R0.1 CCOC(=O)CCl SC-79310 [0,0,1,0,0,0|2,0,1]=4 186 B6R0.1 CCOC(=O)CN SC-09569 [0,0,1,0,0,0|2,0,1]=4 187 B6R0.1 CCOC(=O)CN SC-48652 [0,0,1,0,0,0|2,0,1]=4 188 B6R0.1 CCOC(=O)CO SC-50412 [0,0,1,0,0,0|2,0,1]=4 189 B6R0.1 CCOC(=O)CS SC-18381 [0,0,1,0,0,0|2,0,1]=4 190 B6R0.1 CCOC(=O)NN SC-50147 [0,0,1,0,0,0|3,0,0]=4 191 B6R0.1 CNCC(=O)OC SC-10432 [0,0,1,0,0,0|2,0,1]=4 192 B6R0.1 COC(=O)CC=O SC-53143 [0,0,1,0,0,0|2,0,1]=4 193 B6R0.1 COC(=O)CCBr SC-18677 [0,0,1,0,0,0|2,0,1]=4 194 B6R0.1 COC(=O)CCN SC-21486 [0,0,1,0,0,0|2,0,1]=4 195 B6R0.1 COC(=O)CCO SC-21690 [0,0,1,0,0,0|2,0,1]=4 196 B6R0.1 COC(=O)CSC SC-20536 [0,0,1,0,0,0|2,0,1]=4 197 B6R0.1 COCC(=O)NN SC-54001 [0,0,1,0,0,0|3,0,0]=4 198 B6R0.1 COCC(=O)OC SC-62202 [0,0,1,0,0,0|2,0,1]=4 199 B6R0.1 C\C=C\C(=O)OC SC-22589 [0,0,1,0,0,0|1,0,0]=2 200 B6R0.4 C=C(C)CNCC SC-47240 [0,0,1,0,0,0|2,0,1]=4 201 B6R0.4 C=CCCC(=O)O SC-25836 [0,0,1,0,0,0|1,0,1]=3 202 B6R0.4 C=CCOC(=O)Cl SC-18715 [0,0,1,0,0,0|2,0,1]=4 203 B6R0.4 C=CNCC(=O)O SC-20808 [0,0,1,0,0,0|2,0,1]=4 204 B6R0.4 CC(=O)CCCBr SC-91341 [0,0,1,0,0,0|1,0,1]=3 205 B6R0.4 CC(=O)NCCN SC-19651 [0,0,1,0,0,0|2,0,1]=4 206 B6R0.4 CCCCC(=O)Cl SC-46867 [0,0,1,0,0,0|1,0,1]=3 207 B6R0.4 CC\C=C\C(=O)O SC-92876 [0,0,1,0,0,0|1,0,0]=2 208 B6R0.4 CNCCC(=O)O SC-27492 [0,0,1,0,0,0|2,0,1]=4 209 B6R0.4 CNCCC(=O)O SC-52914 [0,0,1,0,0,0|2,0,1]=4 210 B6R0.4 COCCC(=O)O SC-50255 [0,0,1,0,0,0|2,0,1]=4 211 B6R0.4 CO\C=C\C(C)=O SC-71024 [0,0,1,0,0,0|1,0,0]=2 212 B6R0.4 CSCCC(=O)O SC-96567 [0,0,1,0,0,0|2,0,1]=4 213 B6R0.4 NCCCC(=O)O SC-10045 [0,0,1,0,0,0|2,0,0]=3 214 B6R0.4 O=C(Cl)CCCBr SC-70369 [0,0,1,0,0,0|2,0,0]=3 215 B6R0.4 O=C(O)CCCCl SC-89723 [0,0,1,0,0,0|2,0,0]=3 216 B6R0.4 O=C(O)\C=C\CBr SC-53654 [0,0,1,0,0,0|2,0,0]=3 217 B6R0.6 C=CCCCCBr SC-27023 [0,0,1,0,0,0|1,0,1]=3 218 B6R0.6 C=COCCON SC-93636 [0,0,1,0,0,0|3,0,0]=4 219 B6R0.6 CCCCON=O SC-70750 [0,0,1,0,0,0|2,0,1]=4 220 B6R0.6 CCC\C=C\C=O SC-25240 [0,0,1,0,0,0|0,0,0]=1 221 B6R0.6 C\C=C\CCCO SC-48265 [0,0,1,0,0,0|2,0,1]=4 222 B6R0.6 O=CCCCCCl SC-A3300 [0,0,1,0,0,0|1,0,1]=3 223 B8R2.34 C1=CC2CCC1C2 SC-49283 [0,0,0,1,0,0|1,0,1]=3 224 B6R1.2 BrC1=CC=CO1 SC-46529 [0,0,0,0,1,0|2,0,1]=4 225 B6R1.2 BrC1=COC=C1 SC-02537 [0,0,0,0,1,0|2,0,1]=4 226 B6R1.2 BrC1=CSC=C1 SC-07078 [0,0,0,0,1,0|2,0,1]=4 227 B6R1.2 BrC1=NNC=C1 SC-25384 [0,0,0,0,1,0|3,0,0]=4 228 B6R1.2 BrC1=NSC=C1 SC-53924 [0,0,0,0,1,0|3,0,0]=4 229 B6R1.2 CC1=CC=CN1 SC-88412 [0,0,0,0,1,0|2,0,1]=4 230 B6R1.2 CC1=CC=NO1 SC-47380 [0,0,0,0,1,0|3,0,0]=4 231 B6R1.2 CC1=CCCC1 SC-46849 [0,0,0,0,1,0|1,0,0]=2 232 B6R1.2 CC1=CCCO1 SC-69814 [0,0,0,0,1,0|2,0,0]=3 233 B6R1.2 CC1=NCCC1 SC-07079 [0,0,0,0,1,0|2,0,0]=3 234 B6R1.2 CC1=NSC=C1 SC-89582 [0,0,0,0,1,0|3,0,0]=4 235 B6R1.2 CC1CCCN1 SC-89376 [0,0,0,0,1,0|2,0,1]=4 236 B6R1.2 CC1CCCN1 SC-A3822 [0,0,0,0,1,0|2,0,1]=4 237 B6R1.2 CN1CCCC1 SC-19022 [0,0,0,0,1,0|2,0,1]=4 238 B6R1.2 C[C@H]1CCCN1 SC-95860 [0,0,0,0,1,0|2,0,1]=4 239 B6R1.2 ClC1=CC=NN1 SC-48488 [0,0,0,0,1,0|3,0,0]=4 240 B6R1.2 ClC1=CSC=C1 SC-45954 [0,0,0,0,1,0|2,0,1]=4 241 B6R1.2 FC1CCCC1 SC-09548 [0,0,0,0,1,0|1,0,2]=4 242 B6R1.2 IC1=CC=CO1 SC-99803 [0,0,0,0,1,0|2,0,1]=4 243 B6R1.2 IC1=CC=CS1 SC-46627 [0,0,0,0,1,0|2,0,1]=4 244 B6R1.2 NC1=CC=CN1 SC-20942 [0,0,0,0,1,0|2,0,1]=4 245 B6R1.2 NC1=CC=CO1 SC-21679 [0,0,0,0,1,0|2,0,1]=4 246 B6R1.2 NC1=CC=CS1 SC-21886 [0,0,0,0,1,0|2,0,1]=4 247 B6R1.2 NC1=CC=NN1 SC-69238 [0,0,0,0,1,0|3,0,0]=4 248 B6R1.2 NC1=CC=NO1 SC-66242 [0,0,0,0,1,0|3,0,0]=4 249 B6R1.2 NC1=CC=NS1 SC-15519 [0,0,0,0,1,0|3,0,0]=4 250 B6R1.2 NC1=CC=NS1 SC-A3255 [0,0,0,0,1,0|3,0,0]=4 251 B6R1.2 NC1=COC=C1 SC-21680 [0,0,0,0,1,0|2,0,1]=4 252 B6R1.2 NC1=CSC=C1 SC-21719 [0,0,0,0,1,0|2,0,1]=4 253 B6R1.2 NC1=CSC=C1 SC-21738 [0,0,0,0,1,0|2,0,1]=4 254 B6R1.2 NC1=CSC=C1 SC-95491 [0,0,0,0,1,0|2,0,1]=4 255 B6R1.2 NC1=NCCC1 SC-68430 [0,0,0,0,1,0|2,0,0]=3 256 B6R1.2 NC1=NCCO1 SC-89542 [0,0,0,0,1,0|3,0,0]=4 257 B6R1.2 NC1=NNC=C1 SC-17957 [0,0,0,0,1,0|3,0,0]=4 258 B6R1.2 NC1=NOC=C1 SC-01736 [0,0,0,0,1,0|3,0,0]=4 259 B6R1.2 NC1CCCC1 SC-84758 [0,0,0,0,1,0|1,0,2]=4 260 B6R1.2 NN1CCCC1 SC-01559 [0,0,0,0,1,0|2,0,1]=4 261 B6R1.2 NN1CCCC1 SC-65336 [0,0,0,0,1,0|2,0,1]=4 262 B6R1.2 O=C1C=CCC1 SC-07348 [0,0,0,0,1,0|0,0,0]=1 263 B6R1.2 O=C1C=CCN1 SC-67116 [0,0,0,0,1,0|1,0,0]=2 264 B6R1.2 O=C1C=CCO1 SC-50260 [0,0,0,0,1,0|1,0,0]=2 265 B6R1.2 O=C1C=CSN1 SC-14961 [0,0,0,0,1,0|2,0,0]=3 266 B6R1.2 O=C1CC=NN1 SC-89969 [0,0,0,0,1,0|2,0,1]=4 267 B6R1.2 O=C1CCCN1 SC-85210 [0,0,0,0,1,0|1,0,0]=2 268 B6R1.2 O=C1CCNC1 SC-24328 [0,0,0,0,1,0|1,0,1]=3 269 B6R1.2 O=C1CCNC1 SC-50749 [0,0,0,0,1,0|1,0,1]=3 270 B6R1.2 O=C1CCNN1 SC-21405 [0,0,0,0,1,0|2,0,0]=3 271 B6R1.2 O=C1CCOC1 SC-21867 [0,0,0,0,1,0|1,0,1]=3 272 B6R1.2 O=C1N=CNN1 SC-15326 [0,0,0,0,1,0|3,0,0]=4 273 B6R1.2 O=C1NCCO1 SC-04833 [0,0,0,0,1,0|2,0,0]=3 274 B6R1.2 O=C1NCCS1 SC-27050 [0,0,0,0,1,0|2,0,0]=3 275 B6R1.2 O=C1OC=CO1 SC-15988 [0,0,0,0,1,0|2,0,1]=4 276 B6R1.2 O=S1OCCO1 SC-15793 [0,0,0,0,1,0|3,0,0]=4 277 B6R1.2 OC1=CC=NN1 SC-88403 [0,0,0,0,1,0|2,0,1]=4 278 B6R1.2 OC1=NNCC1 SC-23225 [0,0,0,0,1,0|2,0,1]=4 279 B6R1.2 OC1CCCN1 SC-21341 [0,0,0,0,1,0|1,0,2]=4 280 B6R1.2 SC1=CC=CS1 SC-06762 [0,0,0,0,1,0|1,1,1]=4 281 B6R1.2 SC1=CSC=C1 SC-48067 [0,0,0,0,1,0|1,1,1]=4 282 B6R1.2 [C@@H]1(C)CCCN1 SC-48604 [0,0,0,0,1,0|2,0,1]=4 283 B8R1.22 O=C1C=CCCCC1 SC-99582 [0,0,0,0,0,1|0,0,0]=1 284 B8R1.22 O=C1CCCNCC1 SC-20974 [0,0,0,0,0,1|0,0,2]=3 285 B8R1.22 O=C1CCCNCC1 SC-20993 [0,0,0,0,0,1|0,0,2]=3 286 B8R1.22 O=C1CCNCCN1 SC-05951 [0,0,0,0,0,1|1,0,1]=3 287 B8R1.22 O=C1CNCCCN1 SC-21981 [0,0,0,0,0,1|1,0,1]=3 288 B5R0.1 C=C(C)CCBr SC-26305 [1,0,1,0,0,0|2,0,0]=4 289 B5R0.1 C=C(C)OCC SC-18086 [1,0,1,0,0,0|2,0,0]=4 290 B5R0.1 C=CCC(=O)O SC-49093 [1,0,1,0,0,0|1,0,1]=4 291 B5R0.1 C=COC(C)=O SC-79059 [1,0,1,0,0,0|1,0,1]=4 292 B5R0.1 CC(=O)CCCl SC-21586 [1,0,1,0,0,0|1,0,1]=4 293 B5R0.1 CC(=O)CCO SC-65678 [1,0,1,0,0,0|1,0,1]=4 294 B5R0.1 CC(=O)OCBr SC-44237 [1,0,1,0,0,0|2,0,0]=4 295 B5R0.1 CC(=O)\C=N/O SC-89466 [1,0,1,0,0,0|2,0,0]=4 296 B5R0.1 CC(=O)\C=N\O SC-68143 [1,0,1,0,0,0|2,0,0]=4 297 B5R0.1 CC(C)=CC=O SC-00290 [1,0,1,0,0,0|2,0,0]=4 298 B5R0.1 CC(C)=CCBr SC-13678 [1,0,1,0,0,0|2,0,0]=4 299 B5R0.1 CC(C)=CCN SC-51952 [1,0,1,0,0,0|2,0,0]=4 300 B5R0.1 CC(C)=CCO SC-77150 [1,0,1,0,0,0|2,0,0]=4 301 B5R0.1 CCCC(=N)N SC-19347 [1,0,1,0,0,0|2,0,0]=4 302 B5R0.1 CCCC(=O)Cl SC-18924 [1,0,1,0,0,0|1,0,0]=3 303 B5R0.1 CCCC(=O)[O-] SC-15718 [1,0,1,0,0,0|1,0,0]=3 304 B5R0.1 CCCC(N)=O SC-46377 [1,0,1,0,0,0|1,0,0]=3 305 B5R0.1 CCOC(C)=N SC-02547 [1,0,1,0,0,0|2,0,0]=4 306 B5R0.1 CCOC(C)=N SC-A3540 [1,0,1,0,0,0|2,0,0]=4 307 B5R0.1 CCOC(N)=O SC-16133 [1,0,1,0,0,0|2,0,0]=4 308 B5R0.1 CNCC(=O)O SC-10425 [1,0,1,0,0,0|2,0,0]=4 309 B5R0.1 CNCC(N)=O SC-10429 [1,0,1,0,0,0|2,0,0]=4 310 B5R0.1 COCC(=O)Cl SC-27381 [1,0,1,0,0,0|2,0,0]=4 311 B5R0.1 CSNC(C)=O SC-28667 [1,0,1,0,0,0|2,0,0]=4 312 B5R0.1 C\C=C/C(=O)O SC-25924 [1,0,1,0,0,0|1,0,0]=3 313 B5R0.1 C\C=C/C(C)=O SC-48085 [1,0,1,0,0,0|0,0,0]=2 314 B5R0.1 C\C=C\C(=O)Cl SC-16256 [1,0,1,0,0,0|1,0,0]=3 315 B5R0.1 NCCC(=O)O SC-10014 [1,0,1,0,0,0|2,0,0]=4 316 B5R0.1 NCCC(N)=O SC-48688 [1,0,1,0,0,0|2,0,0]=4 317 B5R0.1 NCCC(N)=O SC-84499 [1,0,1,0,0,0|2,0,0]=4 318 B5R0.1 O=C(Cl)CCCl SC-16310 [1,0,1,0,0,0|2,0,0]=4 319 B5R0.1 O=C(O)CCBr SC-18441 [1,0,1,0,0,0|2,0,0]=4 320 B5R0.1 O=C(O)CCS SC-22642 [1,0,1,0,0,0|2,0,0]=4 321 B5R0.2 C=CCCCBr SC-47340 [1,0,1,0,0,0|1,0,0]=3 322 B5R0.2 C=CCCCN SC-28944 [1,0,1,0,0,0|1,0,0]=3 323 B5R0.2 C=CCCCO SC-78424 [1,0,1,0,0,0|0,0,1]=3 324 B5R0.2 C=CCN=C=O SC-43729 [1,0,1,0,0,0|1,0,1]=4 325 B5R0.2 C=COCCO SC-22660 [1,0,1,0,0,0|1,0,1]=4 326 B5R0.2 COCCC=O SC-85357 [1,0,1,0,0,0|1,0,1]=4 327 B5R0.2 C\C=C\OCC SC-89361 [1,0,1,0,0,0|1,0,0]=3 328 B5R0.2 O=CCCC=O SC-13455 [1,0,1,0,0,0|1,0,0]=3 329 B5R0.2 O=CCCCBr SC-69595 [1,0,1,0,0,0|1,0,0]=3 330 B5R0.3 C=CC(O)CC SC-93539 [1,0,1,0,0,0|0,0,2]=4 331 B5R0.3 CCC(=O)NN SC-25039 [1,0,1,0,0,0|2,0,0]=4 332 B5R0.3 CC[PH](=O)CC SC-96905 [1,0,1,0,0,0|1,0,1]=4 333 B5R0.3 CNC(=O)CBr SC-27946 [1,0,1,0,0,0|2,0,0]=4 334 B5R0.3 CNC(=O)CN SC-47802 [1,0,1,0,0,0|2,0,0]=4 335 B5R0.3 CNC(=O)OC SC-97890 [1,0,1,0,0,0|2,0,0]=4 336 B5R0.3 COC(=O)CBr SC-15855 [1,0,1,0,0,0|2,0,0]=4 337 B5R0.3 COC(=O)CN SC-09571 [1,0,1,0,0,0|2,0,0]=4 338 B5R0.3 COC(=O)CN SC-49390 [1,0,1,0,0,0|2,0,0]=4 339 B5R0.3 COC(=O)CO SC-28291 [1,0,1,0,0,0|2,0,0]=4 340 B5R0.3 COC(=O)CS SC-54102 [1,0,1,0,0,0|2,0,0]=4 341 B7R0.2 C=CC(=O)NC(C)C SC-47047 [0,1,1,0,0,0|1,0,0]=3 342 B7R0.2 COC(=O)CC(C)Br SC-67097 [0,1,1,0,0,0|1,0,1]=4 343 B7R0.2 COC(=O)C[C@@H](C)N SC-88822 [0,1,1,0,0,0|1,0,1]=4 344 B7R0.2 COC(=O)C[C@@H](C)N SC-A1096 [0,1,1,0,0,0|1,0,1]=4 345 B7R0.3 C=CCOC(=O)C=C SC-19356 [0,1,1,0,0,0|0,0,2]=4 346 B7R0.3 COC(=O)CCCCl SC-15079 [0,1,1,0,0,0|1,0,1]=4 347 B7R0.3 COC(=O)\C=C\CBr SC-17676 [0,1,1,0,0,0|1,0,0]=3 348 B7R0.3 COC(=O)\C=C\CBr SC-49570 [0,1,1,0,0,0|1,0,0]=3 349 B7R0.3 COCCC(=O)OC SC-46379 [0,1,1,0,0,0|1,0,1]=4 350 B7R0.3 CO\C=C\C(=O)OC SC-90792 [0,1,1,0,0,0|1,0,0]=3 351 B7R0.5 CCNC(=O)[C@H](C)O SC-12514 [0,1,1,0,0,0|1,0,1]=4 352 B7R0.5 CCOC(=O)C(=N)N SC-32236 [0,1,1,0,0,0|2,0,0]=4 353 B7R0.5 CCOC(=O)C(=O)Cl SC-26882 [0,1,1,0,0,0|2,0,0]=4 354 B7R0.5 CCOC(=O)C(=O)O SC-26569 [0,1,1,0,0,0|2,0,0]=4 355 B7R0.5 CCOC(=O)C(=O)[O-] SC-73549 [0,1,1,0,0,0|2,0,0]=4 356 B7R0.5 CCOC(=O)C(C)=O SC-15232 [0,1,1,0,0,0|1,0,1]=4 357 B7R0.5 CCOC(=O)C(C)Br SC-27136 [0,1,1,0,0,0|1,0,1]=4 358 B7R0.5 CCOC(=O)C(C)Cl SC-13657 [0,1,1,0,0,0|1,0,1]=4 359 B7R0.5 CCOC(=O)C(C)F SC-75945 [0,1,1,0,0,0|1,0,1]=4 360 B7R0.5 CCOC(=O)C(C)N SC-09294 [0,1,1,0,0,0|1,0,1]=4 361 B7R0.5 CCOC(=O)C(C)N SC-13100 [0,1,1,0,0,0|1,0,1]=4 362 B7R0.5 CCOC(=O)C(C)N SC-15274 [0,1,1,0,0,0|1,0,1]=4 363 B7R0.5 CCOC(=O)C(N)=S SC-23134 [0,1,1,0,0,0|2,0,0]=4 364 B7R0.5 CCOC(=O)[C@@H](C)O SC-15791 [0,1,1,0,0,0|1,0,1]=4 365 B7R0.7 CC#CC(=O)OCC SC-54369 [0,1,1,0,0,0|0,0,2]=4 366 B7R0.7 CCOC(=O)C=[N+]=[N-] SC-25567 [0,1,1,0,0,0|2,0,0]=4 367 B7R0.7 CCOC(=O)CC=O SC-14726 [0,1,1,0,0,0|1,0,1]=4 368 B7R0.7 CCOC(=O)CCI SC-02730 [0,1,1,0,0,0|1,0,1]=4 369 B7R0.7 CCOC(=O)CCN SC-83852 [0,1,1,0,0,0|1,0,1]=4 370 B7R0.7 CCOC(=O)CCO SC-43709 [0,1,1,0,0,0|1,0,1]=4 371 B7R0.7 CCOC(=O)CCS SC-44443 [0,1,1,0,0,0|1,0,1]=4 372 B7R0.7 CCOC(=O)OCC SC-25934 [0,1,1,0,0,0|1,0,1]=4 373 B7R0.7 CCOC(=O)\C=C\[O-] SC-71247 [0,1,1,0,0,0|1,0,0]=3 374 B7R0.7 COCC(=O)COC SC-43684 [0,1,1,0,0,0|1,0,1]=4 375 B7R0.10 CC[C@@H](O)C(=O)OC SC-49455 [0,1,1,0,0,0|1,0,1]=4 376 B7R0.10 CC[C@H](N)C(=O)OC SC-33322 [0,1,1,0,0,0|1,0,1]=4 377 B7R0.10 CC[C@H](N)C(=O)OC SC-91370 [0,1,1,0,0,0|1,0,1]=4 378 B7R0.10 COC(=O)C(=O)CBr SC-15244 [0,1,1,0,0,0|2,0,0]=4 379 B7R0.10 C\C=C(/Br)C(=O)OC SC-89362 [0,1,1,0,0,0|1,0,0]=3 380 B7R0.4 C#CCCCC(=O)O SC-73017 [0,1,1,0,0,0|1,0,1]=4 381 B7R0.4 C=CCCC[N+](=O)[O-] SC-89901 [0,1,1,0,0,0|2,0,0]=4 382 B7R0.4 C=CCNCC(=O)O SC-74362 [0,1,1,0,0,0|1,0,1]=4 383 B7R0.4 C=CCOCC(=O)O SC-49027 [0,1,1,0,0,0|1,0,1]=4 384 B7R0.4 CCCNCC(=O)O SC-97541 [0,1,1,0,0,0|1,0,1]=4 385 B7R0.4 CCCSCC(=O)O SC-45283 [0,1,1,0,0,0|1,0,1]=4 386 B7R0.4 CCC\C=C\C(C)=O SC-49007 [0,1,1,0,0,0|0,0,0]=2 387 B7R0.4 CCO\C=C\C(=O)Cl SC-50076 [0,1,1,0,0,0|1,0,0]=3 388 B7R0.4 CCO\C=C\C(=O)O SC-89061 [0,1,1,0,0,0|1,0,0]=3 389 B7R0.4 CNCCCC(=O)O SC-49793 [0,1,1,0,0,0|1,0,1]=4 390 B7R0.4 CNCCCC(=O)O SC-A2900 [0,1,1,0,0,0|1,0,1]=4 391 B7R0.4 COCCCC(=O)O SC-51378 [0,1,1,0,0,0|1,0,1]=4 392 B7R0.4 C\C=C\CCC(=O)O SC-21245 [0,1,1,0,0,0|1,0,1]=4 393 B7R0.4 NC(=O)CCCCBr SC-98143 [0,1,1,0,0,0|1,0,1]=4 394 B7R0.4 NCCCCC(=O)O SC-10120 [0,1,1,0,0,0|1,0,1]=4 395 B7R0.4 NCCCCC(=O)O SC-92391 [0,1,1,0,0,0|1,0,1]=4 396 B7R0.4 NCCCCC(N)=O SC-94858 [0,1,1,0,0,0|1,0,1]=4 397 B7R0.4 NCCCCC(N)=O SC-A4262 [0,1,1,0,0,0|1,0,1]=4 398 B7R0.4 NCCNCC(=O)O SC-21750 [0,1,1,0,0,0|2,0,0]=4 399 B7R0.4 O=C(Cl)CCCCBr SC-13447 [0,1,1,0,0,0|1,0,1]=4 400 B7R0.4 O=C(Cl)CCCCCl SC-16009 [0,1,1,0,0,0|1,0,1]=4 401 B7R0.4 O=C(O)CCCCBr SC-02338 [0,1,1,0,0,0|1,0,1]=4 402 B7R0.4 O=C([O-])COCCO SC-A2671 [0,1,1,0,0,0|2,0,0]=4 403 B7R0.6 CC(=O)OCC(C)C SC-25600 [0,1,1,0,0,0|1,0,1]=4 404 B7R0.6 CC(=O)\C=C\C(=O)O SC-94119 [0,1,1,0,0,0|1,0,1]=4 405 B7R0.6 CC(=O)\C=C\N(C)C SC-92543 [0,1,1,0,0,0|1,0,0]=3 406 B7R0.6 CC(C)CCC(=O)O SC-57917 [0,1,1,0,0,0|1,0,1]=4 407 B7R0.6 CC(Cl)CCC(=O)Cl SC-74180 [0,1,1,0,0,0|1,0,1]=4 408 B7R0.1 C=CCCCCCBr SC-44229 [0,1,1,0,0,0|1,0,1]=4 409 B7R0.1 C=CCSSCC=C SC-77190 [0,1,1,0,0,0|2,0,0]=4 410 B7R0.1 COCCOCC=O SC-99722 [0,1,1,0,0,0|1,0,1]=4 411 B7R0.1 O=CCCCCCO SC-94633 [0,1,1,0,0,0|0,0,2]=4 412 B7R1.1 COC1=NCCC1 SC-72634 [0,1,0,0,1,0|1,0,1]=4 413 B7R1.1 O=CC1=CC=CN1 SC-00019 [0,1,0,0,1,0|1,0,1]=4 414 B7R1.1 O=CC1=CC=CN1 SC-29059 [0,1,0,0,1,0|1,0,1]=4 415 B7R1.1 O=CC1=CC=NN1 SC-21602 [0,1,0,0,1,0|2,0,0]=4 416 B7R1.1 O=CC1=CC=NN1 SC-87756 [0,1,0,0,1,0|2,0,0]=4 417 B7R1.1 O=CC1=CC=NO1 SC-26223 [0,1,0,0,1,0|2,0,0]=4 418 B7R1.1 O=CC1=CNC=C1 SC-12905 [0,1,0,0,1,0|1,0,1]=4 419 B7R1.1 O=CC1=COC=C1 SC-04839 [0,1,0,0,1,0|1,0,1]=4 420 B7R1.1 O=CC1=CSC=C1 SC-04841 [0,1,0,0,1,0|1,0,1]=4 421 B7R1.1 O=CC1=NOC=C1 SC-83871 [0,1,0,0,1,0|2,0,0]=4 422 B7R1.1 O=CC1CCCC1 SC-21778 [0,1,0,0,1,0|0,0,2]=4 423 B7R1.1 O=CC1CCCC1 SC-44728 [0,1,0,0,1,0|0,0,2]=4 424 B7R1.2 CC1=CC(=O)CC1 SC-18727 [0,1,0,0,1,0|0,0,0]=2 425 B7R1.2 CC1=CC(=O)OC1 SC-25541 [0,1,0,0,1,0|1,0,0]=3 426 B7R1.2 CC1CCC(=O)C1 SC-93748 [0,1,0,0,1,0|0,0,1]=3 427 B7R1.2 CC1CNC(=O)C1 SC-50248 [0,1,0,0,1,0|1,0,0]=3 428 B7R1.2 CC1COC(=O)C1 SC-60836 [0,1,0,0,1,0|1,0,0]=3 429 B7R1.2 CC1COC(=O)O1 SC-65189 [0,1,0,0,1,0|2,0,0]=4 430 B7R1.2 CN1C=CC(=O)N1 SC-98976 [0,1,0,0,1,0|2,0,0]=4 431 B7R1.2 C[C@H]1COC(=O)N1 SC-51056 [0,1,0,0,1,0|2,0,0]=4 432 B7R1.2 C[C@H]1COC(=O)O1 SC-04943 [0,1,0,0,1,0|2,0,0]=4 433 B7R1.2 N=C1NC(=O)CS1 SC-69631 [0,1,0,0,1,0|2,0,0]=4 434 B7R1.2 NC1CNC(=O)C1 SC-66063 [0,1,0,0,1,0|1,0,0]=3 435 B7R1.2 NC1COC(=O)C1 SC-34183 [0,1,0,0,1,0|1,0,0]=3 436 B7R1.2 N[C@@H]1CNC(=O)C1 SC-A4379 [0,1,0,0,1,0|1,0,0]=3 437 B7R1.2 N[C@@H]1COC(=O)C1 SC-71558 [0,1,0,0,1,0|1,0,0]=3 438 B7R1.2 O=C1C=C(O)CO1 SC-21646 [0,1,0,0,1,0|1,0,0]=3 439 B7R1.2 O=C1C=CC(=O)N1 SC-15117 [0,1,0,0,1,0|1,0,1]=4 440 B7R1.2 O=C1CC(O)CN1 SC-29049 [0,1,0,0,1,0|1,0,0]=3 441 B7R1.2 O=C1CCC(=O)C1 SC-15331 [0,1,0,0,1,0|0,0,1]=3 442 B7R1.2 O=C1CCC(=O)N1 SC-26697 [0,1,0,0,1,0|1,0,0]=3 443 B7R1.2 O=C1CNC(=O)C1 SC-88883 [0,1,0,0,1,0|1,0,1]=4 444 B7R1.2 O=C1CNC(=O)O1 SC-21301 [0,1,0,0,1,0|2,0,0]=4 445 B7R1.2 O=C1COC(=O)C1 SC-86968 [0,1,0,0,1,0|1,0,1]=4 446 B7R1.2 O=C1COC(=O)N1 SC-49693 [0,1,0,0,1,0|2,0,0]=4 447 B7R1.2 O=C1CSC(=O)N1 SC-17499 [0,1,0,0,1,0|2,0,0]=4 448 B7R1.2 O=C1C[C@@H](O)CN1 SC-02616 [0,1,0,0,1,0|1,0,0]=3 449 B7R1.2 O=C1C[C@H](O)CN1 SC-13587 [0,1,0,0,1,0|1,0,0]=3 450 B7R1.2 O=C1C[C@H](O)CO1 SC-06559 [0,1,0,0,1,0|1,0,0]=3 451 B7R1.4 C=C1CCOC1=O SC-19579 [0,1,0,0,1,0|1,0,0]=3 452 B7R1.4 CC1=CCCC1=O SC-15856 [0,1,0,0,1,0|0,0,0]=2 453 B7R1.4 CC1CCCC1=O SC-89605 [0,1,0,0,1,0|0,0,1]=3 454 B7R1.4 CC1CCNC1=O SC-21672 [0,1,0,0,1,0|1,0,0]=3 455 B7R1.4 CC1CCOC1=O SC-20996 [0,1,0,0,1,0|1,0,0]=3 456 B7R1.4 CN1CCNC1=O SC-89793 [0,1,0,0,1,0|2,0,0]=4 457 B7R1.4 NC1CCNC1=O SC-13910 [0,1,0,0,1,0|1,0,0]=3 458 B7R1.4 NC1CCNC1=O SC-53072 [0,1,0,0,1,0|1,0,0]=3 459 B7R1.4 N[C@@H]1CCNC1=O SC-65959 [0,1,0,0,1,0|1,0,0]=3 460 B7R1.4 N[C@@H]1CCNC1=O SC-A2225 [0,1,0,0,1,0|1,0,0]=3 461 B7R1.4 N[C@@H]1CCOC1=O SC-28003 [0,1,0,0,1,0|1,0,0]=3 462 B7R1.4 N[C@H]1CCNC1=O SC-96457 [0,1,0,0,1,0|1,0,0]=3 463 B7R1.4 N[C@H]1CCOC1=O SC-01385 [0,1,0,0,1,0|1,0,0]=3 464 B7R1.4 N[C@H]1CCOC1=O SC-28113 [0,1,0,0,1,0|1,0,0]=3 465 B7R1.4 O=C1CCCC1Cl SC-21538 [0,1,0,0,1,0|0,0,1]=3 466 B7R1.4 O=C1NCCC1O SC-26159 [0,1,0,0,1,0|1,0,0]=3 467 B7R1.4 O=C1NCC[C@H]1O SC-87526 [0,1,0,0,1,0|1,0,0]=3 468 B7R1.4 O=C1OCCC1Br SC-15437 [0,1,0,0,1,0|1,0,0]=3 469 B7R1.14 CP1(=O)C=CCO1 SC-93562 [0,1,0,0,1,0|2,0,0]=4 470 B7R1.14 O=S1(=O)C=CCO1 SC-86633 [0,1,0,0,1,0|2,0,0]=4 471 B7R1.14 O=S1(=O)CCCC1 SC-46369 [0,1,0,0,1,0|1,0,1]=4 472 B7R1.14 O=S1(=O)CCCN1 SC-82164 [0,1,0,0,1,0|2,0,0]=4 473 B7R1.14 O=S1(=O)CCCO1 SC-17901 [0,1,0,0,1,0|2,0,0]=4 474 B9R1.48 O=C1CCCCC(=O)C1 SC-14500 [0,1,0,0,0,1|0,0,1]=3 475 B9R1.48 O=C1CCCCC(=O)O1 SC-92931 [0,1,0,0,0,1|0,0,1]=3 476 B9R1.49 CN1CCCC(=O)CC1 SC-01972 [0,1,0,0,0,1|0,0,2]=4 477 B9R1.1 CNC1CCC(=O)CC1 SC-92932 [0,2,0,0,0,0|0,0,2]=4 478 B9R1.1 COC1CCC(=O)CC1 SC-51182 [0,2,0,0,0,0|0,0,2]=4 479 B9R1.1 N#CC1CCC(=O)CC1 SC-29485 [0,2,0,0,0,0|0,0,2]=4 480 B9R1.1 NCC1CCC(=O)NC1 SC-A2876 [0,2,0,0,0,0|1,0,1]=4 481 B9R1.1 O=C1CCC(CO)CC1 SC-66212 [0,2,0,0,0,0|0,0,2]=4 482 B9R1.2 O=C1CCCC(CO)N1 SC-21439 [0,2,0,0,0,0|1,0,1]=4 483 B9R1.6 O=C(O)C1=CCCNC1 SC-99979 [0,2,0,0,0,0|1,0,1]=4 484 B9R1.6 OB(O)C1=CCCCC1 SC-25437 [0,2,0,0,0,0|0,0,2]=4 485 B9R1.8 CCOC1=CCCCC1 SC-68423 [0,2,0,0,0,0|0,0,2]=4 486 B9R1.8 NCCC1=CCCCC1 SC-62304 [0,2,0,0,0,0|1,0,1]=4 487 B9R1.15 N#CC1CCCCC1=O SC-77521 [0,2,0,0,0,0|0,0,2]=4 488 B9R1.10 CC1(C)C=CC(=O)CC1 SC-25845 [0,2,0,0,0,0|0,0,0]=2 489 B9R1.10 CC1(C)CCC(=O)CC1 SC-20004 [0,2,0,0,0,0|0,0,2]=4 490 B9R1.10 O=C1CCC(F)(F)CC1 SC-14790 [0,2,0,0,0,0|0,0,2]=4 491 B9R1.69 CN1CCC(=O)CC1=O SC-A3321 [0,2,0,0,0,0|1,0,1]=4 492 B9R1.69 NC1CCC(=O)NC1=O SC-52533 [0,2,0,0,0,0|1,0,0]=3 493 B9R1.69 NC1CCC(=O)NC1=O SC-72018 [0,2,0,0,0,0|1,0,0]=3 494 B9R1.69 NC1CCC(=O)NC1=O SC-85613 [0,2,0,0,0,0|1,0,0]=3 495 B9R1.69 N[C@@H]1CCC(=O)NC1=O SC-A2238 [0,2,0,0,0,0|1,0,0]=3 496 B9R1.69 N[C@H]1CCC(=O)NC1=O SC-A2241 [0,2,0,0,0,0|1,0,0]=3 497 B9R1.69 O=C1CCC(Br)C(=O)N1 SC-A3664 [0,2,0,0,0,0|1,0,0]=3 498 B9R1.3 CC1C(=O)CCCC1=O SC-24698 [0,2,0,0,0,0|0,0,1]=3 499 B9R1.34 CC1CC(=O)CC(=O)C1 SC-26551 [0,2,0,0,0,0|0,0,1]=3 500 B9R1.34 CC1CC(=O)OC(=O)C1 SC-68133 [0,2,0,0,0,0|1,0,0]=3 501 B9R1.66 CC1(C)CCCC(=O)C1 SC-67598 [0,2,0,0,0,0|0,0,2]=4 502 B7R1.22 COC(=O)C1CC1 SC-16131 [0,0,1,1,0,0|1,0,1]=4 503 B7R1.22 NNC(=O)C1CC1 SC-B6986 [0,0,1,1,0,0|2,0,0]=4 504 B7R1.22 O=C(CBr)C1CC1 SC-20322 [0,0,1,1,0,0|1,0,1]=4 505 B7R1.7 CC\C=C\[C@H]1CO1 SC-A2838 [0,0,1,1,0,0|0,0,2]=4 506 B7R1.12 O=C(O)C1CC1F SC-85228 [0,0,1,1,0,0|2,0,0]=4 507 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F SC-83847 [0,0,1,1,0,0|2,0,0]=4 508 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F SC-A4679 [0,0,1,1,0,0|2,0,0]=4 509 B7R1.12 O=C(O)[C@H]1C[C@H]1F SC-72913 [0,0,1,1,0,0|2,0,0]=4 510 B7R1.18 CC(=O)C1CCC1 SC-74316 [0,0,1,1,0,0|0,0,2]=4 511 B7R1.18 NC(=O)[C@H]1CCN1 SC-42709 [0,0,1,1,0,0|2,0,0]=4 512 B7R1.18 O=C(Cl)C1CCC1 SC-46657 [0,0,1,1,0,0|1,0,1]=4 513 B7R1.18 O=C(O)C1CCC1 SC-17776 [0,0,1,1,0,0|1,0,1]=4 514 B7R1.18 O=C(O)C1CCO1 SC-22549 [0,0,1,1,0,0|2,0,0]=4 515 B7R1.18 O=C(O)[C@H]1CCN1 SC-24616 [0,0,1,1,0,0|2,0,0]=4 516 B7R1.20 CC(=O)CC1CC1 SC-21396 [0,0,1,1,0,0|0,0,2]=4 517 B7R1.20 O=C(O)CC1CC1 SC-13938 [0,0,1,1,0,0|1,0,1]=4 518 B9R2.7 O=C1CC2C=CCC12 SC-48173 [0,0,0,1,0,1|0,0,2]=4 519 B9R2.109 O=C1CCCC2OC12 SC-A3025 [0,0,0,1,0,1|0,0,2]=4 520 B9R2.25 O=C1OC(=O)C2CC12 SC-26129 [0,1,0,1,0,0|1,0,0]=3 521 B9R2.39 O=C1CC2CCC1C2 SC-50094 [0,1,0,1,0,0|0,0,2]=4 522 B9R2.39 [C@H]12CC[C@H](C1)C(=O)N2 SC-52249 [0,1,0,1,0,0|1,0,1]=4 523 B5R1.1 C1=CCC=C1 SC-76630 [1,0,0,0,1,0|0,0,1]=3 524 B5R1.1 C1=CCCC1 SC-18920 [1,0,0,0,1,0|0,0,0]=2 525 B5R1.1 C1=CCOC1 SC-47076 [1,0,0,0,1,0|1,0,0]=3 526 B5R1.1 C1=CNC=C1 SC-16214 [1,0,0,0,1,0|1,0,1]=4 527 B5R1.1 C1=CNCC1 SC-88946 [1,0,0,0,1,0|1,0,0]=3 528 B5R1.1 C1=CNN=C1 SC-15930 [1,0,0,0,1,0|2,0,0]=4 529 B5R1.1 C1=CON=C1 SC-03143 [1,0,0,0,1,0|2,0,0]=4 530 B5R1.1 C1=CSN=C1 SC-45492 [1,0,0,0,1,0|2,0,0]=4 531 B5R1.1 [C-]1=CC=CC1 SC-15776 [1,0,0,0,1,0|0,0,1]=3 532 B5R1.2 BrC1CCC1 SC-50402 [0,0,0,0,2,0|1,0,1]=4 533 B5R1.2 IC1CCC1 SC-92367 [0,0,0,0,2,0|1,0,1]=4 534 B5R1.2 NC1CCC1 SC-20422 [0,0,0,0,2,0|1,0,1]=4 535 B5R1.2 O=C1CCC1 SC-00523 [0,0,0,0,2,0|0,0,0]=2 536 B5R1.2 O=C1CCN1 SC-44172 [0,0,0,0,2,0|1,0,0]=3 537 B5R1.2 O=C1CNC1 SC-48283 [0,0,0,0,2,0|1,0,0]=3 538 B5R1.2 O=C1COC1 SC-21889 [0,0,0,0,2,0|1,0,0]=3 539 B9R1.50 O=C1CCCCCCC1 SC-19957 [0,0,0,0,0,2|0,0,2]=4 540 B9R1.50 O=C1CCCCCCN1 SC-84294 [0,0,0,0,0,2|0,0,2]=4