0 B5R0.1 BrCC=C(C)C PI-12725 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.1 C(C#N)C(=O)[O-] PI-50587 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.1 C(CBr)C(=O)Cl PI-47061 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.1 C(CCl)C(=O)Cl PI-48842 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.1 CC#CC(=O)O PI-12861 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.1 CC(=C)CCBr PI-40493 [0,0,0,0,0,0|3,0,1]=4 6 B5R0.1 CC(=O)NCO PI-29791 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.1 CC=CC(=O)C PI-45740 [0,0,0,0,0,0|1,0,1]=2 8 B5R0.1 CCCC(=O)N PI-32787 [0,0,0,0,0,0|2,0,2]=4 9 B5R0.1 CCOC(=O)C PI-13192 [0,0,0,0,0,0|0,0,2]=2 10 B5R0.1 CCOC(=S)[S-] PI-47063 [0,0,0,0,0,0|1,1,2]=4 11 B5R0.1 CCO[Si](C)C PI-50089 [0,0,0,0,0,0|1,1,2]=4 12 B5R0.1 CCSC(=O)C PI-48509 [0,0,0,0,0,0|0,1,2]=3 13 B5R0.1 CCSC(=O)Cl PI-38596 [0,0,0,0,0,0|1,1,2]=4 14 B5R0.1 CNCC(=O)O PI-45053 [0,0,0,0,0,0|3,0,1]=4 15 B5R0.1 CSCC(=O)N PI-36555 [0,0,0,0,0,0|3,0,1]=4 16 B5R0.1 C\C=C\C(=O)N PI-50568 [0,0,0,0,0,0|2,0,1]=3 17 B5R0.1 C\C=C\C(=O)O PI-48966 [0,0,0,0,0,0|2,0,1]=3 18 B5R0.1 NCCC(=O)O PI-14317 [0,0,0,0,0,0|3,0,1]=4 19 B5R0.1 O=C(O)CCS PI-40342 [0,0,0,0,0,0|3,0,1]=4 20 B5R0.1 O=S(CSC)C PI-39632 [0,0,0,0,0,0|3,0,1]=4 21 B5R0.1 OC(CON)=O PI-37190 [0,0,0,0,0,0|4,0,0]=4 22 B5R0.1 OCCC(=O)O PI-20855 [0,0,0,0,0,0|3,0,1]=4 23 B4R0.1 C#CC(=O)N PI-48352 [1,0,0,0,0,0|1,0,2]=4 24 B4R0.1 C(=C(F)Cl)Cl PI-21037 [1,0,0,0,0,0|3,0,0]=4 25 B4R0.1 C(=C(F)Cl)F PI-20042 [1,0,0,0,0,0|3,0,0]=4 26 B4R0.1 C(=O)(N)NO PI-15345 [1,0,0,0,0,0|3,0,0]=4 27 B4R0.1 C(C(=O)Cl)Br PI-46514 [1,0,0,0,0,0|2,0,1]=4 28 B4R0.1 C(C(=O)N)I PI-47045 [1,0,0,0,0,0|2,0,1]=4 29 B4R0.1 C(C(=O)N)N PI-14271 [1,0,0,0,0,0|2,0,1]=4 30 B4R0.1 C(C(=O)[O-])Cl PI-44622 [1,0,0,0,0,0|2,0,1]=4 31 B4R0.1 CC(=C)CBr PI-46510 [1,0,0,0,0,0|2,0,1]=4 32 B4R0.1 CC(=CBr)C PI-46509 [1,0,0,0,0,0|2,0,0]=3 33 B4R0.1 CC(=O)C#C PI-15653 [1,0,0,0,0,0|0,0,2]=3 34 B4R0.1 CC(=O)CBr PI-38994 [1,0,0,0,0,0|1,0,1]=3 35 B4R0.1 CC(=O)NBr PI-47108 [1,0,0,0,0,0|2,0,0]=3 36 B4R0.1 CC(O)=NO PI-10772 [1,0,0,0,0,0|2,0,1]=4 37 B4R0.1 COC(=N)N PI-30686 [1,0,0,0,0,0|2,0,1]=4 38 B4R0.1 NC(=O)CBr PI-10963 [1,0,0,0,0,0|2,0,1]=4 39 B4R0.2 C(=O)[N-]C=O PI-42986 [1,0,0,0,0,0|2,0,0]=3 40 B4R0.2 C=CCCBr PI-20589 [1,0,0,0,0,0|2,0,1]=4 41 B4R0.2 C=CCON PI-47075 [1,0,0,0,0,0|3,0,0]=4 42 B4R0.2 CC=CCO PI-41583 [1,0,0,0,0,0|2,0,1]=4 43 B4R0.2 CCOC=C PI-12733 [1,0,0,0,0,0|0,0,1]=2 44 B4R0.2 CNCC=C PI-41121 [1,0,0,0,0,0|2,0,0]=3 45 B6R0.1 C(C(=O)NCO)Cl PI-29429 [0,1,0,0,0,0|2,0,1]=4 46 B6R0.1 CC#CC(=O)OC PI-48956 [0,1,0,0,0,0|1,0,2]=4 47 B6R0.1 CCCC(=O)SC PI-48512 [0,1,0,0,0,0|1,0,2]=4 48 B6R0.1 CCOC(=O)C#C PI-35147 [0,1,0,0,0,0|0,0,3]=4 49 B6R0.1 CCOC(=O)CBr PI-15815 [0,1,0,0,0,0|0,0,2]=3 50 B6R0.1 CCOC(=O)NC PI-50343 [0,1,0,0,0,0|0,0,2]=3 51 B6R0.1 CNCC(=O)OC PI-45586 [0,1,0,0,0,0|2,0,1]=4 52 B6R0.1 COC(=O)CCN PI-31148 [0,1,0,0,0,0|2,0,1]=4 53 B6R0.1 C\C(=N/O)\OCC PI-38013 [0,1,0,0,0,0|0,0,3]=4 54 B6R0.1 NNC(OCC)=O PI-28515 [0,1,0,0,0,0|1,0,2]=4 55 B6R0.1 O=C(OC)CCO PI-41038 [0,1,0,0,0,0|2,0,1]=4 56 B6R0.2 CC(=CC(=O)C)O PI-39500 [0,1,0,0,0,0|1,0,1]=3 57 B6R0.2 CC(=CC(=O)Cl)C PI-13707 [0,1,0,0,0,0|2,0,1]=4 58 B6R0.2 CC(=CC(=O)O)C PI-42632 [0,1,0,0,0,0|2,0,1]=4 59 B6R0.2 CC(=O)O[Si](C)C PI-23366 [0,1,0,0,0,0|0,1,1]=3 60 B6R0.2 CC(Br)OC(=O)C PI-36668 [0,1,0,0,0,0|0,0,2]=3 61 B6R0.2 CC(C)OC(=S)[S-] PI-47168 [0,1,0,0,0,0|2,0,1]=4 62 B6R0.2 CC(OC(=O)C)Cl PI-36669 [0,1,0,0,0,0|0,0,2]=3 63 B6R0.2 CC(OC(=O)Cl)Cl PI-22740 [0,1,0,0,0,0|1,0,2]=4 64 B6R0.2 C\C(=C/C(=O)C)\N PI-38617 [0,1,0,0,0,0|1,0,1]=3 65 B6R0.3 CC=C(C)C(=O)O PI-40492 [0,1,0,0,0,0|2,0,1]=4 66 B6R0.3 CCC(C(=O)C)S PI-48501 [0,1,0,0,0,0|1,0,2]=4 67 B6R0.4 BrC\C=C\C(=O)O PI-36796 [0,1,0,0,0,0|2,0,1]=4 68 B6R0.4 C(C(=O)O)NC=O PI-33231 [0,1,0,0,0,0|3,0,0]=4 69 B6R0.4 CC(NCCS)=O PI-37034 [0,1,0,0,0,0|1,0,2]=4 70 B6R0.4 CC=CCC(=O)O PI-47130 [0,1,0,0,0,0|2,0,0]=3 71 B6R0.4 CC=NNC(=O)N PI-26775 [0,1,0,0,0,0|2,0,1]=4 72 B6R0.4 ClCCCC(=O)C PI-39487 [0,1,0,0,0,0|1,0,2]=4 73 B6R0.4 O=C\C=C/N(C)C PI-12739 [0,1,0,0,0,0|3,0,0]=4 74 B6R0.4 OCCCC(=O)C PI-13555 [0,1,0,0,0,0|1,0,2]=4 75 B6R0.5 C=CC[Si](C)(C)C PI-35320 [0,1,0,0,0,0|2,1,0]=4 76 B6R0.5 C[Si](C)(C)OC=C PI-45112 [0,1,0,0,0,0|1,1,0]=3 77 B6R1.2 Brc1ccco1 PI-14449 [0,0,0,1,0,0|1,0,1]=3 78 B6R1.2 Brc1cccs1 PI-11144 [0,0,0,1,0,0|1,1,1]=4 79 B6R1.2 Brc1ncc[nH]1 PI-39207 [0,0,0,1,0,0|3,0,0]=4 80 B6R1.2 C1=C(ON=C1)N PI-34865 [0,0,0,1,0,0|2,0,1]=4 81 B6R1.2 C1=CN=C(N1)N PI-11170 [0,0,0,1,0,0|3,0,0]=4 82 B6R1.2 C1=CN=C(N1)N PI-45241 [0,0,0,1,0,0|3,0,0]=4 83 B6R1.2 C1=CN=C(N1)N PI-45281 [0,0,0,1,0,0|3,0,0]=4 84 B6R1.2 C1=CSC(=N1)Br PI-11814 [0,0,0,1,0,0|2,1,0]=4 85 B6R1.2 C1C=CCC1N PI-35476 [0,0,0,1,0,0|2,0,1]=4 86 B6R1.2 C1COC(=O)N1 PI-10783 [0,0,0,1,0,0|1,0,2]=4 87 B6R1.2 C1CSCC1=O PI-11167 [0,0,0,1,0,0|2,0,1]=4 88 B6R1.2 C1OC(=O)C=C1 PI-37270 [0,0,0,1,0,0|0,0,2]=3 89 B6R1.2 CC1=CC=CS1 PI-11146 [0,0,0,1,0,0|1,1,0]=3 90 B6R1.2 CC1=CN=CN1 PI-44758 [0,0,0,1,0,0|3,0,0]=4 91 B6R1.2 CC1=COC=C1 PI-41011 [0,0,0,1,0,0|3,0,0]=4 92 B6R1.2 Cc1cc[nH]n1 PI-31344 [0,0,0,1,0,0|3,0,0]=4 93 B6R1.2 Cc1cncs1 PI-33497 [0,0,0,1,0,0|2,1,0]=4 94 B6R1.2 Cc1nc[nH]n1 PI-40309 [0,0,0,1,0,0|3,0,0]=4 95 B6R1.2 Cc1nccs1 PI-11132 [0,0,0,1,0,0|1,1,0]=3 96 B6R1.2 Clc1ncc[nH]1 PI-20136 [0,0,0,1,0,0|3,0,0]=4 97 B6R1.2 Clc1nccs1 PI-39297 [0,0,0,1,0,0|2,1,0]=4 98 B6R1.2 Cn1cccn1 PI-37584 [0,0,0,1,0,0|3,0,0]=4 99 B6R1.2 Ic1cccs1 PI-11145 [0,0,0,1,0,0|1,1,1]=4 100 B6R1.2 NC1=NC=CO1 PI-40002 [0,0,0,1,0,0|2,0,0]=3 101 B6R1.2 O=C1CC=CC1 PI-38266 [0,0,0,1,0,0|1,0,0]=2 102 B6R1.2 O=C1CCOC1 PI-42678 [0,0,0,1,0,0|2,0,1]=4 103 B6R1.2 O=C1NCNC1 PI-35001 [0,0,0,1,0,0|2,0,1]=4 104 B6R1.2 O=c1occo1 PI-15331 [0,0,0,1,0,0|1,0,0]=2 105 B6R1.2 OC1CC=CC1 PI-38265 [0,0,0,1,0,0|1,0,2]=4 106 B6R1.2 Sc1cccs1 PI-27908 [0,0,0,1,0,0|0,2,1]=4 107 B6R1.2 Sc1nccs1 PI-11130 [0,0,0,1,0,0|1,2,0]=4 108 B6R1.5 C1C(CC1=O)N PI-48953 [0,0,0,1,0,0|2,0,1]=4 109 B6R1.11 CC(=O)C1CC1 PI-12875 [0,0,0,1,0,0|1,0,2]=4 110 B3R0.1 C(=CBr)Br PI-47053 [2,0,0,0,0,0|2,0,0]=4 111 B3R0.1 C(=CCl)F PI-20089 [2,0,0,0,0,0|2,0,0]=4 112 B3R0.1 CCC=O PI-28552 [2,0,0,0,0,0|0,0,2]=4 113 B3R0.1 COCBr PI-22152 [2,0,0,0,0,0|1,0,1]=4 114 B3R0.1 CONC PI-16632 [2,0,0,0,0,0|1,0,1]=4 115 B3R0.1 C\C=N\O PI-37002 [2,0,0,0,0,0|2,0,0]=4 116 B3R0.1 NNC=O PI-38803 [2,0,0,0,0,0|2,0,0]=4 117 B3R0.2 C=C(F)Br PI-14442 [2,0,0,0,0,0|2,0,0]=4 118 B3R0.2 CB(O)O PI-24088 [2,0,0,0,0,0|1,0,1]=4 119 B3R0.2 CC(=O)O PI-11632 [2,0,0,0,0,0|0,0,0]=2 120 B3R0.2 CC(=O)O PI-38547 [2,0,0,0,0,0|0,0,0]=2 121 B3R0.2 CC(=O)[O-] PI-20290 [2,0,0,0,0,0|0,0,1]=3 122 B3R0.2 CC(=S)N PI-16528 [2,0,0,0,0,0|1,1,0]=4 123 B3R0.2 CC([O-])=S PI-36444 [2,0,0,0,0,0|0,1,1]=4 124 B3R0.2 [O-]C(=O)C PI-37083 [2,0,0,0,0,0|0,0,1]=3 125 B3R0.2 [O-]C(=O)C PI-41421 [2,0,0,0,0,0|0,0,1]=3 126 B5R0.3 C(C(=O)NN)O PI-50333 [1,1,0,0,0,0|2,0,0]=4 127 B5R0.3 C(C(=O)NN)S PI-50542 [1,1,0,0,0,0|2,0,0]=4 128 B5R0.3 C=C[C@H](CO)N PI-48191 [1,1,0,0,0,0|1,0,1]=4 129 B5R0.3 CCC(=C)C=O PI-44654 [1,1,0,0,0,0|2,0,0]=4 130 B5R0.3 CCC(=O)CBr PI-20588 [1,1,0,0,0,0|0,0,2]=4 131 B5R0.3 CCC(=O)NN PI-50290 [1,1,0,0,0,0|2,0,0]=4 132 B5R0.3 CNC(=O)CCl PI-39443 [1,1,0,0,0,0|1,0,1]=4 133 B5R0.3 COC(=O)C#C PI-35828 [1,1,0,0,0,0|0,0,2]=4 134 B5R0.3 N[C@H](CO)C=C PI-36414 [1,1,0,0,0,0|1,0,1]=4 135 B5R0.4 C=C[Si](C)(C)C PI-35331 [1,1,0,0,0,0|1,1,0]=4 136 B5R0.4 C[Si](C)(C=C)Cl PI-45014 [1,1,0,0,0,0|1,1,0]=4 137 B5R0.5 CC(=C)C(=O)C PI-41913 [1,1,0,0,0,0|0,0,0]=2 138 B5R0.5 CC(=O)C(=O)[O-] PI-15478 [1,1,0,0,0,0|1,0,0]=3 139 B5R0.5 CC(=O)C(=O)[O-] PI-15479 [1,1,0,0,0,0|1,0,0]=3 140 B5R0.5 CC(=O)C(=O)[O-] PI-15480 [1,1,0,0,0,0|1,0,0]=3 141 B5R0.5 CC(=O)C(=O)[O-] PI-15481 [1,1,0,0,0,0|1,0,0]=3 142 B5R0.5 CC(C(=O)C)Br PI-35002 [1,1,0,0,0,0|0,0,2]=4 143 B5R0.5 CC(C(=O)C)S PI-48502 [1,1,0,0,0,0|0,0,2]=4 144 B5R0.5 OC(=O)C(=O)C PI-15477 [1,1,0,0,0,0|1,0,0]=3 145 B5R0.2 BrCCCC=C PI-39146 [1,1,0,0,0,0|1,0,1]=4 146 B5R0.2 C(=O)NNC=O PI-50265 [1,1,0,0,0,0|2,0,0]=4 147 B5R0.2 C=COCCO PI-12735 [1,1,0,0,0,0|0,0,1]=3 148 B5R0.2 CCO\C=C\C PI-12734 [1,1,0,0,0,0|0,0,1]=3 149 B5R0.2 O=CCCC=O PI-14232 [1,1,0,0,0,0|1,0,1]=4 150 B5R0.2 OCCCC=C PI-13243 [1,1,0,0,0,0|1,0,1]=4 151 B7R0.2 CC(=CC(=O)OC)C PI-13263 [0,2,0,0,0,0|1,0,1]=4 152 B7R0.2 CC(=CC(=O)OC)N PI-13659 [0,2,0,0,0,0|1,0,1]=4 153 B7R0.2 CC(=O)OC(=C)C#N PI-26544 [0,2,0,0,0,0|0,0,0]=2 154 B7R0.2 CC(C)OC(=O)CO PI-35449 [0,2,0,0,0,0|0,0,2]=4 155 B7R0.2 CC(OC(=O)OC)Cl PI-49210 [0,2,0,0,0,0|0,0,2]=4 156 B7R0.2 O=C(OC(C)C)CN PI-46621 [0,2,0,0,0,0|0,0,2]=4 157 B7R0.2 O=C([O-])CC(OC)=O PI-18514 [0,2,0,0,0,0|2,0,0]=4 158 B7R0.3 C=CCNC(=O)CCl PI-15657 [0,2,0,0,0,0|1,0,0]=3 159 B7R0.3 COC(=O)CCC=O PI-48276 [0,2,0,0,0,0|1,0,1]=4 160 B7R0.3 COC(=O)CNC=O PI-33232 [0,2,0,0,0,0|2,0,0]=4 161 B7R0.3 COC(=O)\C=C\CBr PI-10946 [0,2,0,0,0,0|1,0,1]=4 162 B7R0.3 CO\C=C\C(=O)OC PI-37579 [0,2,0,0,0,0|1,0,1]=4 163 B7R0.5 C=CCC(C(=O)O)N PI-43236 [0,2,0,0,0,0|2,0,0]=4 164 B7R0.5 C=CCC(C(=O)O)N PI-43396 [0,2,0,0,0,0|2,0,0]=4 165 B7R0.5 CCOC(=O)C(Br)F PI-13394 [0,2,0,0,0,0|0,0,2]=4 166 B7R0.5 CCOC(=O)C(C)Br PI-44612 [0,2,0,0,0,0|0,0,2]=4 167 B7R0.5 CCOC(=O)C(C)Cl PI-21896 [0,2,0,0,0,0|0,0,2]=4 168 B7R0.5 CCOC(=O)C(C)F PI-12305 [0,2,0,0,0,0|0,0,2]=4 169 B7R0.5 CCOC(=O)C(F)Cl PI-49444 [0,2,0,0,0,0|0,0,2]=4 170 B7R0.5 CCOC(=O)C(F)F PI-24421 [0,2,0,0,0,0|0,0,2]=4 171 B7R0.5 CCOC(=O)C(F)I PI-49445 [0,2,0,0,0,0|0,0,2]=4 172 B7R0.5 CCOC(=O)C(N)C PI-10064 [0,2,0,0,0,0|0,0,2]=4 173 B7R0.5 CCOC(=O)[C@@H](N)C PI-31019 [0,2,0,0,0,0|0,0,2]=4 174 B7R0.5 NC(CC=C)C(O)=O PI-29913 [0,2,0,0,0,0|2,0,0]=4 175 B7R0.7 CC=CC(=O)OC=C PI-13581 [0,2,0,0,0,0|0,0,0]=2 176 B7R0.7 CCCC(=O)OCCl PI-36667 [0,2,0,0,0,0|1,0,1]=4 177 B7R0.7 CCOC(=O)C#CC PI-22064 [0,2,0,0,0,0|0,0,2]=4 178 B7R0.7 CCOC(=O)COC PI-50353 [0,2,0,0,0,0|0,0,2]=4 179 B7R0.7 CCOC(=O)CSC PI-39857 [0,2,0,0,0,0|0,0,2]=4 180 B7R0.7 CCOC(=O)C[N+]#[C-] PI-50608 [0,2,0,0,0,0|0,0,2]=4 181 B7R0.7 CNCC(=O)OCC PI-30682 [0,2,0,0,0,0|0,0,2]=4 182 B7R0.7 NCCC(=O)OCC PI-33213 [0,2,0,0,0,0|0,0,2]=4 183 B7R0.7 OCCC(=O)OCC PI-39562 [0,2,0,0,0,0|0,0,2]=4 184 B7R0.11 CC(C)(CC=C)C=O PI-34825 [0,2,0,0,0,0|1,0,1]=4 185 B7R0.9 CC(=C)O[Si](C)(C)C PI-38837 [0,2,0,0,0,0|1,1,0]=4 186 B7R0.9 CC(=O)OC(C)(C)C PI-32776 [0,2,0,0,0,0|0,0,2]=4 187 B7R0.9 CC(=O)O[Si](C)(C)C PI-35315 [0,2,0,0,0,0|0,1,1]=4 188 B7R0.4 CC=CC=CC(=O)[O-] PI-15818 [0,2,0,0,0,0|2,0,0]=4 189 B7R0.4 COCCOC(=O)C PI-12910 [0,2,0,0,0,0|0,0,2]=4 190 B7R0.4 O=C(O)CNCC=C PI-37297 [0,2,0,0,0,0|2,0,0]=4 191 B7R0.6 CC(=C)COC(=O)C PI-47091 [0,2,0,0,0,0|0,0,0]=2 192 B7R0.6 CC(=O)C=CC(=O)O PI-29616 [0,2,0,0,0,0|1,0,0]=3 193 B7R0.6 CC(=O)CCC(=O)C PI-48500 [0,2,0,0,0,0|1,0,1]=4 194 B7R0.6 CC(=O)NCC(=O)C PI-36400 [0,2,0,0,0,0|1,0,1]=4 195 B7R0.6 CC(=O)NCC(=O)O PI-33247 [0,2,0,0,0,0|1,0,1]=4 196 B7R0.6 CC(=O)NNC(=O)C PI-30465 [0,2,0,0,0,0|1,0,1]=4 197 B7R0.6 CC(=O)NNC(=S)N PI-30346 [0,2,0,0,0,0|2,0,0]=4 198 B7R0.6 CC(=O)OCC(=O)Cl PI-13657 [0,2,0,0,0,0|0,0,1]=3 199 B7R0.6 CC(=O)OCC(=O)O PI-26120 [0,2,0,0,0,0|0,0,1]=3 200 B7R0.6 CC(=O)OCC(F)F PI-21167 [0,2,0,0,0,0|0,0,2]=4 201 B7R0.8 C[Si](C)(C)OCC=C PI-50087 [0,2,0,0,0,0|1,1,0]=4 202 B5R1.2 C1C(=O)CN1 PI-48919 [1,0,0,1,0,0|1,0,1]=4 203 B5R1.2 O=C1CCC1 PI-36783 [1,0,0,1,0,0|0,0,2]=4 204 B5R1.2 O=C1COC1 PI-38969 [1,0,0,1,0,0|1,0,1]=4 205 B5R1.1 C1=CSC=C1 PI-45119 [1,0,0,1,0,0|0,1,1]=4 206 B5R1.1 C1=CSC=N1 PI-45012 [1,0,0,1,0,0|1,1,0]=4 207 B5R1.1 C1C=CCN1 PI-36315 [1,0,0,1,0,0|2,0,0]=4 208 B5R1.1 C1C=CCN1 PI-40188 [1,0,0,1,0,0|2,0,0]=4 209 B5R1.1 C1COC=C1 PI-45414 [1,0,0,1,0,0|0,0,1]=3 210 B5R1.1 O1C=NC=C1 PI-37188 [1,0,0,1,0,0|1,0,0]=3 211 B5R1.1 O1N=CC=C1 PI-37186 [1,0,0,1,0,0|1,0,1]=4 212 B7R1.1 C1=COC(=C1)CS PI-48474 [0,1,0,1,0,0|1,0,0]=3 213 B7R1.1 C1=CSC(=C1)C=O PI-44709 [0,1,0,1,0,0|0,1,1]=4 214 B7R1.1 C1=CSC(=C1)CCl PI-50490 [0,1,0,1,0,0|1,1,0]=4 215 B7R1.1 C1=CSC(=C1)CO PI-11151 [0,1,0,1,0,0|1,1,0]=4 216 B7R1.1 C1=CSC(=N1)CN PI-45385 [0,1,0,1,0,0|1,1,0]=4 217 B7R1.1 CCC1=CC=CS1 PI-10993 [0,1,0,1,0,0|1,1,0]=4 218 B7R1.1 CCc1ncc[nH]1 PI-31817 [0,1,0,1,0,0|2,0,0]=4 219 B7R1.1 COC1=NC=CS1 PI-11131 [0,1,0,1,0,0|1,1,0]=4 220 B7R1.1 COc1cccs1 PI-33573 [0,1,0,1,0,0|1,1,0]=4 221 B7R1.1 NCc1cccs1 PI-11152 [0,1,0,1,0,0|1,1,0]=4 222 B7R1.1 O=CC1=NC=CO1 PI-39572 [0,1,0,1,0,0|1,0,0]=3 223 B7R1.1 O=Cc1ccc[nH]1 PI-16523 [0,1,0,1,0,0|1,0,1]=4 224 B7R1.1 O=Cc1cnco1 PI-38922 [0,1,0,1,0,0|1,0,1]=4 225 B7R1.1 O=Cc1ncc[nH]1 PI-24015 [0,1,0,1,0,0|2,0,0]=4 226 B7R1.1 O=Cc1nccs1 PI-11133 [0,1,0,1,0,0|1,1,0]=4 227 B7R1.1 OCC1=NC=CN1 PI-36879 [0,1,0,1,0,0|2,0,0]=4 228 B7R1.1 OCc1cnco1 PI-38536 [0,1,0,1,0,0|2,0,0]=4 229 B7R1.1 OCc1nccs1 PI-38807 [0,1,0,1,0,0|1,1,0]=4 230 B7R1.2 Brc1c[nH]c(n1)C PI-14475 [0,1,0,1,0,0|2,0,0]=4 231 B7R1.2 Brc1ccc(Br)o1 PI-17239 [0,1,0,1,0,0|1,0,1]=4 232 B7R1.2 C1C(=O)COC1=O PI-17979 [0,1,0,1,0,0|0,0,1]=3 233 B7R1.2 C1C(=O)NC(=O)S1 PI-10988 [0,1,0,1,0,0|2,0,0]=4 234 B7R1.2 C1C(=O)NC(=S)N1 PI-25614 [0,1,0,1,0,0|2,0,0]=4 235 B7R1.2 C1C(=O)NC(=S)S1 PI-10884 [0,1,0,1,0,0|2,0,0]=4 236 B7R1.2 C1C(C=CC1=O)O PI-48068 [0,1,0,1,0,0|1,0,1]=4 237 B7R1.2 C1C(COC1=O)O PI-28663 [0,1,0,1,0,0|0,0,2]=4 238 B7R1.2 CC1=CC(=CS1)Br PI-22178 [0,1,0,1,0,0|1,1,0]=4 239 B7R1.2 CC1=CC(=NO1)C PI-11253 [0,1,0,1,0,0|1,0,1]=4 240 B7R1.2 CC1=CC=C(O1)C PI-44542 [0,1,0,1,0,0|1,0,0]=3 241 B7R1.2 CC1=CC=C(S1)Br PI-11164 [0,1,0,1,0,0|1,1,0]=4 242 B7R1.2 CC1=CC=C(S1)C PI-11158 [0,1,0,1,0,0|1,1,0]=4 243 B7R1.2 CC1=CN=C(S1)C PI-11134 [0,1,0,1,0,0|1,1,0]=4 244 B7R1.2 CC1=CNC(=O)N1 PI-31820 [0,1,0,1,0,0|2,0,0]=4 245 B7R1.2 CC1=CSC(=N1)C PI-11115 [0,1,0,1,0,0|1,1,0]=4 246 B7R1.2 CC1=NC=C(N1)I PI-45234 [0,1,0,1,0,0|2,0,0]=4 247 B7R1.2 CC1=NC=C(S1)Br PI-44984 [0,1,0,1,0,0|1,1,0]=4 248 B7R1.2 CC1=NN=C(Br)O1 PI-39669 [0,1,0,1,0,0|2,0,0]=4 249 B7R1.2 C[C@@H]1CCC(=O)O1 PI-27751 [0,1,0,1,0,0|0,0,2]=4 250 B7R1.2 C[C@@H]1COC(=O)O1 PI-12235 [0,1,0,1,0,0|0,0,2]=4 251 B7R1.2 C[C@H]1COC(=O)O1 PI-12953 [0,1,0,1,0,0|0,0,2]=4 252 B7R1.2 Cc1[nH]cc(c1)C PI-10987 [0,1,0,1,0,0|2,0,0]=4 253 B7R1.2 Cc1[nH]cc(n1)C PI-31821 [0,1,0,1,0,0|2,0,0]=4 254 B7R1.2 Cc1ccc(s1)Cl PI-29205 [0,1,0,1,0,0|1,1,0]=4 255 B7R1.2 Cc1nnc(o1)N PI-38338 [0,1,0,1,0,0|2,0,0]=4 256 B7R1.2 Cc1noc(c1)N PI-30153 [0,1,0,1,0,0|2,0,0]=4 257 B7R1.2 Cc1scc(c1)C PI-29816 [0,1,0,1,0,0|1,1,0]=4 258 B7R1.2 Nc1noc(c1)C PI-33190 [0,1,0,1,0,0|2,0,0]=4 259 B7R1.2 O=C1C=CC(=O)N1 PI-29681 [0,1,0,1,0,0|1,0,1]=4 260 B7R1.2 O=C1CSC(=N1)N PI-25673 [0,1,0,1,0,0|2,0,0]=4 261 B7R1.2 O=C1NCC(=O)O1 PI-37627 [0,1,0,1,0,0|1,0,0]=3 262 B7R1.2 O=C1OC=C(Br)O1 PI-38607 [0,1,0,1,0,0|1,0,0]=3 263 B7R1.2 O=C1OC=C(Cl)O1 PI-38606 [0,1,0,1,0,0|1,0,0]=3 264 B7R1.2 O=C1OCC(O)C1 PI-12958 [0,1,0,1,0,0|0,0,2]=4 265 B7R1.2 O[C@H]1CC(=O)OC1 PI-28789 [0,1,0,1,0,0|0,0,2]=4 266 B7R1.3 C1=CC(=O)NC=C1 PI-13304 [0,1,0,1,0,0|1,0,1]=4 267 B7R1.3 C1=CC(=O)NC=C1 PI-49120 [0,1,0,1,0,0|1,0,1]=4 268 B7R1.3 C1=CC(=O)OC=C1 PI-46989 [0,1,0,1,0,0|0,0,1]=3 269 B7R1.3 C1=CN=CNC1=O PI-21341 [0,1,0,1,0,0|1,0,1]=4 270 B7R1.3 C1=CN=CNC1=O PI-45002 [0,1,0,1,0,0|1,0,1]=4 271 B7R1.3 C1=CNC(=O)N=C1 PI-32626 [0,1,0,1,0,0|1,0,1]=4 272 B7R1.3 C1=CNC(=O)N=C1 PI-33107 [0,1,0,1,0,0|1,0,1]=4 273 B7R1.3 C1=COC=CC1=O PI-43972 [0,1,0,1,0,0|1,0,1]=4 274 B7R1.3 C1CC(=O)COC1 PI-39263 [0,1,0,1,0,0|0,0,2]=4 275 B7R1.3 C1COC(=O)C=C1 PI-47083 [0,1,0,1,0,0|0,0,2]=4 276 B7R1.3 CC1=CC=CC=N1 PI-38534 [0,1,0,1,0,0|2,0,0]=4 277 B7R1.3 CC1=NC=CN=C1 PI-48495 [0,1,0,1,0,0|2,0,0]=4 278 B7R1.3 Cc1ncccn1 PI-35192 [0,1,0,1,0,0|2,0,0]=4 279 B7R1.3 O=C1C=CC=NN1 PI-40006 [0,1,0,1,0,0|1,0,1]=4 280 B7R1.3 O=C1C=CNC=C1 PI-33984 [0,1,0,1,0,0|1,0,1]=4 281 B7R1.3 O=C1CCCCO1 PI-37295 [0,1,0,1,0,0|0,0,2]=4 282 B7R1.3 O=C1COCCO1 PI-44056 [0,1,0,1,0,0|0,0,2]=4 283 B7R1.4 BrC1CCOC1=O PI-37275 [0,1,0,1,0,0|0,0,2]=4 284 B7R1.4 C1=COC(=C1Br)Br PI-17204 [0,1,0,1,0,0|1,0,1]=4 285 B7R1.4 C1COC(=O)C1N PI-45116 [0,1,0,1,0,0|0,0,2]=4 286 B7R1.4 CC1=C(OC=N1)C PI-35004 [0,1,0,1,0,0|2,0,0]=4 287 B7R1.4 CC1=C(SC=C1)Cl PI-10992 [0,1,0,1,0,0|1,1,0]=4 288 B7R1.4 CC1=CCOC1=O PI-46986 [0,1,0,1,0,0|0,0,1]=3 289 B7R1.4 CC1=NC=CN1C PI-31811 [0,1,0,1,0,0|2,0,0]=4 290 B7R1.4 CN1C=CN=C1Cl PI-20160 [0,1,0,1,0,0|2,0,0]=4 291 B7R1.4 CN1C=CNC1=S PI-18739 [0,1,0,1,0,0|1,1,0]=4 292 B7R1.4 Cc1ccsc1Br PI-10990 [0,1,0,1,0,0|1,1,0]=4 293 B7R1.4 Cn1ccnc1Br PI-14474 [0,1,0,1,0,0|2,0,0]=4 294 B7R1.4 Cn1sccc1=O PI-11861 [0,1,0,1,0,0|1,1,0]=4 295 B7R1.4 O=C1OCC[C@@H]1O PI-38131 [0,1,0,1,0,0|0,0,2]=4 296 B7R1.4 O=C1OCC[C@H]1N PI-39306 [0,1,0,1,0,0|0,0,2]=4 297 B7R1.4 SC1=C(C)OC=C1 PI-14227 [0,1,0,1,0,0|0,1,0]=3