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53564dcd0445bc0803408d8e1ea5672d [0,0,0,0,0,0|3,0,1]=4 113 B12R1.372 CCSCCN[C@@H]1CCOC1=O 29d110aa0b3f02e546825d45fa4acf42 [0,0,0,0,0,0|3,0,1]=4 114 B12R1.372 CCSCCN[C@H]1CCNC1=O f41af3e189740ca83950bc97a5cd7186 [0,0,0,0,0,0|3,0,1]=4 115 B12R1.372 CCSCCN[C@H]1CCOC1=O 4e3f02f10d7ff9e893a272c5e1c5efbf [0,0,0,0,0,0|3,0,1]=4 116 B12R1.372 CCSCCOC1CCCC1=O 22337a27a9a12bba96ad7c59eb5b046f [0,0,0,0,0,0|2,0,1]=3 117 B12R1.372 CCSCCOC1CCNC1=O 64127845d0a618fd1c124c3efca9e383 [0,0,0,0,0,0|3,0,1]=4 118 B12R1.372 CCSCCO[C@@H]1CCNC1=O 12af486cc7a6e075a8e90b838458631d [0,0,0,0,0,0|3,0,1]=4 119 B12R1.372 CCSCCO[C@H]1CCNC1=O 1f8a92c0a38abe9084931d9a8e7a2661 [0,0,0,0,0,0|3,0,1]=4 120 B12R1.372 COCCCOC1CCCC1=O 34d0e8a582a1ed1d985e8a2d5f75f0fd [0,0,0,0,0,0|2,0,2]=4 121 B12R1.372 COCCOCC1CCCC1=O 3bf01d1567b29d97d5c85c76ead134e4 [0,0,0,0,0,0|2,0,2]=4 122 B12R1.372 COCNCCN1CCCC1=O 3c45bab28329468dc9d00ea128d0bf90 [0,0,0,0,0,0|3,0,1]=4 123 B12R1.372 COCOCCC1CCNC1=O a0da867922e63b4763a0d12c4e1fbec6 [0,0,0,0,0,0|3,0,1]=4 124 B12R1.372 COCOCCN1CCCC1=O 369f65603df36fd921f2665a60a8358a [0,0,0,0,0,0|3,0,1]=4 125 B12R1.372 CSCCCNC1CCCC1=O 92b433124fe138e460d03b0a7668ca7d [0,0,0,0,0,0|2,0,2]=4 126 B12R1.372 CSCCCOC1CCCC1=O 1ff07198924dce1ed7eea01d7ce2b64a [0,0,0,0,0,0|2,0,2]=4 127 B12R1.372 CSCCOCC1CCCC1=O f09eb6c11c761ed831ee3036ba66ec54 [0,0,0,0,0,0|2,0,2]=4 128 B12R1.372 CSCNCCN1CCCC1=O be59ba66e4828b9324d2f3cdef4969f6 [0,0,0,0,0,0|3,0,1]=4 129 B12R1.372 CSCOCCC1CCNC1=O 80a03ae48c2717004a99ac9617900bbf [0,0,0,0,0,0|3,0,1]=4 130 B12R1.372 CSCOCCN1CCCC1=O e2f0d65a89b48da0181f8d74c2e948a0 [0,0,0,0,0,0|3,0,1]=4 131 B12R1.372 N#CC=CCNC1CCNC1=O 8a5077b1b832958c9721141e794ad6ed [0,0,0,0,0,0|3,0,1]=4 132 B12R1.372 N#CC=CCNC1CCSC1=O 32ca8c46557ed6c967b347415267dda8 [0,0,0,0,0,0|3,0,1]=4 133 B12R1.372 N#CC=CCN[C@@H]1CCNC1=O ff2009bbfa72125a87c02108e5c0e566 [0,0,0,0,0,0|3,0,1]=4 134 B12R1.372 N#CC=CCN[C@@H]1CCOC1=O 49817a4615b6baa59c412ee4b578ea97 [0,0,0,0,0,0|3,0,1]=4 135 B12R1.372 N#CC=CCN[C@H]1CCNC1=O 52d4ccb221b1839739e98eca237537ca [0,0,0,0,0,0|3,0,1]=4 136 B12R1.372 N#CC=CCN[C@H]1CCOC1=O e72450e8875ffc4e6b40212460e71b7b [0,0,0,0,0,0|3,0,1]=4 137 B12R1.372 N#CC=CCOC1CCCC1=O aacb1a6ad6fb74fad30d5e6398882eda [0,0,0,0,0,0|2,0,1]=3 138 B12R1.372 N#CC=CCOC1CCNC1=O 57db58f5de6ac971fbb5db5bed07592e [0,0,0,0,0,0|3,0,1]=4 139 B12R1.372 N#CC=CCOC1CCOC1=O 3bd0e7780a3b212d138c9269e5e20f4b [0,0,0,0,0,0|3,0,1]=4 140 B12R1.372 N#CC=CCO[C@@H]1CCNC1=O e29b071eb5e4061a0b8d85f42a78f56e [0,0,0,0,0,0|3,0,1]=4 141 B12R1.372 N#CC=CCO[C@@H]1CCOC1=O 1191cd0f4d9cdeda262dbc0d3402cf31 [0,0,0,0,0,0|3,0,1]=4 142 B12R1.372 N#CC=CCO[C@H]1CCNC1=O c6b9788e449ba54eb2714b2dfbc85ba4 [0,0,0,0,0,0|3,0,1]=4 143 B12R1.372 N#CC=CCO[C@H]1CCOC1=O f485ccd5fd68b5db90a0ee25d5ea6b94 [0,0,0,0,0,0|3,0,1]=4 144 B12R1.372 O=C/C=C/COC1CCCC1=O b4cf98ad65688d163916146e92c7f674 [0,0,0,0,0,0|2,0,1]=3 145 B12R1.372 O=C/C=C/COC1CCNC1=O b979dc931c94511c692e3cd5f7f0bdc7 [0,0,0,0,0,0|3,0,1]=4 146 B12R1.372 O=C1CCCC1COC/C=C/Cl 88ac3182b68327e953f529d683f6236c [0,0,0,0,0,0|2,0,2]=4 147 B12R1.372 O=C1CCCC1COC/C=C\Cl 03a6702556a2d9ba46412555df7d9800 [0,0,0,0,0,0|2,0,2]=4 148 B12R1.372 O=C1CCCC1COCCCF 4dfe15b582532d815351c110d587afec [0,0,0,0,0,0|2,0,2]=4 149 B12R1.372 O=C1CCCC1COCCCS 68c99b9bdff22eb14860db41a4adc0b5 [0,0,0,0,0,0|2,0,2]=4 150 B12R1.372 O=C1CCCC1NCC#CCO 8f99fa19c81f2a409934d7dd4af30fe8 [0,0,0,0,0,0|2,0,2]=4 151 B12R1.372 O=C1CCCC1NCCCCCl afca07d6ff322d2a6ae1cd7a57ea6cea [0,0,0,0,0,0|2,0,2]=4 152 B12R1.372 O=C1CCCC1NCCCCO 122e0ed28f36539e4f892f5b8472123a [0,0,0,0,0,0|2,0,2]=4 153 B12R1.372 O=C1CCCC1NCCCCS a886ab336dcfe1a1334ae60eb1694fda [0,0,0,0,0,0|2,0,2]=4 154 B12R1.372 O=C1CCCC1OCCCCF 4f81d63044fc9c752ffcf2783f878862 [0,0,0,0,0,0|2,0,2]=4 155 B12R1.372 O=C1CCCC1OCCCCS 0fccd70f083bcb9daf5e1bee5f1e8dc0 [0,0,0,0,0,0|2,0,2]=4 156 B12R1.372 O=C1CCCN1CCCNCF bf1c2368faacb67c97655b33c4e49991 [0,0,0,0,0,0|3,0,1]=4 157 B12R1.372 O=C1CCCN1CCCNCO 451ee78ded5b4dc425973da97d9f471f [0,0,0,0,0,0|3,0,1]=4 158 B12R1.372 O=C1CCCN1CCCOCF 4e0eb7f432b60eb3db61a127e5fc1ede [0,0,0,0,0,0|3,0,1]=4 159 B12R1.372 O=C1CCCN1CCNCCBr b263451a37b92b462d2494aadf70aa44 [0,0,0,0,0,0|3,0,1]=4 160 B12R1.372 O=C1CCCN1CCNCCF fa6a00a8d3ac7cfc7f49c14070a59344 [0,0,0,0,0,0|3,0,1]=4 161 B12R1.372 O=C1CCCN1CCNCCI aef00bd89f75a34bb9b6639e1e48cf60 [0,0,0,0,0,0|3,0,1]=4 162 B12R1.372 O=C1CCCN1CCNCCO 0ea0712c1ed20e2c14647236a9d6e9ef [0,0,0,0,0,0|3,0,1]=4 163 B12R1.372 O=C1CCCN1CCNCCS 56bead2e4ee27093f7135878940daea6 [0,0,0,0,0,0|3,0,1]=4 164 B12R1.372 O=C1CCCN1CCOCCF 9eda54008e6a8caeb2c48c99cb5bc65c [0,0,0,0,0,0|3,0,1]=4 165 B12R1.372 O=C1CCCN1CCOCCS 0903b2b6bcc65e20eefc2a9fc68d8d2b [0,0,0,0,0,0|3,0,1]=4 166 B12R1.372 O=C1NCCC1CCNCCBr 094992c8e31983c555c37b24bd6fa368 [0,0,0,0,0,0|3,0,1]=4 167 B12R1.372 O=C1NCCC1CCNCCF 212445cdc3e937c0b9e1b5fc57ad4c5e [0,0,0,0,0,0|3,0,1]=4 168 B12R1.372 O=C1NCCC1CCNCCI a26e8ab4ac63e67e760ca446499af6db [0,0,0,0,0,0|3,0,1]=4 169 B12R1.372 O=C1NCCC1CCNCCO 5945837d67f7d9dc5ef6512de918aacf [0,0,0,0,0,0|3,0,1]=4 170 B12R1.372 O=C1NCCC1CCNCCS 0e41b5b7c9cc38487e0d83324f758cf9 [0,0,0,0,0,0|3,0,1]=4 171 B12R1.372 O=C1NCCC1CCOCCF 85e468f681cd51048ebcd2bb30d4e242 [0,0,0,0,0,0|3,0,1]=4 172 B12R1.372 O=C1NCCC1CCOCCS e24f3541477ed140e0cd1aab3e008dbd [0,0,0,0,0,0|3,0,1]=4 173 B11R1.4 CC/C=C/CNC1CCCC1 59de48df724d02ca8afb579334e260e1 [1,0,0,0,0,0|1,0,1]=3 174 B11R1.4 CC/C=C/CNC1CCOC1 d0a87a12cf384f677652d50f467aa9bb [1,0,0,0,0,0|2,0,1]=4 175 B11R1.4 CC/C=C/CNC1CCSC1 767aa9ba4942427014d8ed1e6aac2ebd [1,0,0,0,0,0|2,0,1]=4 176 B11R1.4 CC/C=C/CN[C@@H]1CCOC1 167ba030161a50cdecf270164fd37068 [1,0,0,0,0,0|2,0,1]=4 177 B11R1.4 CC/C=C/CN[C@H]1CCOC1 41834871fd76392fcfb063e443cc95d0 [1,0,0,0,0,0|2,0,1]=4 178 B11R1.4 CC/C=C/COC1C=CCC1 bd923ee1dbcc8e3cff0c716811536994 [1,0,0,0,0,0|1,0,1]=3 179 B11R1.4 CC/C=C/COC1CCCC1 22f1a97617cf69c83dda239e5f114c0f [1,0,0,0,0,0|1,0,1]=3 180 B11R1.4 CC/C=C/COC1CCCO1 fcb332c7f10d2c1e2c40d9dca815d1de [1,0,0,0,0,0|2,0,0]=3 181 B11R1.4 CC/C=C/COC1CCOC1 bff6e947c983fe750b917a08b8a47daa [1,0,0,0,0,0|2,0,1]=4 182 B11R1.4 CC/C=C/COC1CCSC1 1164d6aa7a83bda77dd0ad3770768f5b [1,0,0,0,0,0|2,0,1]=4 183 B11R1.4 CC/C=C/CO[C@@H]1CCOC1 ded8d3db61072fefa197f2b0e1e5f805 [1,0,0,0,0,0|2,0,1]=4 184 B11R1.4 CC/C=C/CO[C@@H]1CCSC1 0c36472fc65cec6c51a07a7cfd05b9ef [1,0,0,0,0,0|2,0,1]=4 185 B11R1.4 CC/C=C/CO[C@H]1CCOC1 8e4dd7788cafd7ce02ffab3796aa93f2 [1,0,0,0,0,0|2,0,1]=4 186 B11R1.4 CC/C=C/CO[C@H]1CCSC1 123a3225eb36c4686c12c6bd0f4fa58c [1,0,0,0,0,0|2,0,1]=4 187 B11R1.4 CC/C=C\CCN1CCSC1 5a7e83a4dd606f4d3b7eb10a27dceff4 [1,0,0,0,0,0|2,0,1]=4 188 B11R1.4 CC/C=C\COC1CCCC1 091a743790bd53272236b12a8a7729cc [1,0,0,0,0,0|1,0,1]=3 189 B11R1.4 CC/C=C\COC1CCOC1 d7c46bed5692e61bd15af8b9f063db5d [1,0,0,0,0,0|2,0,1]=4 190 B11R1.4 CC/C=C\CO[C@@H]1CCOC1 c8eff08f3085495a2101a1d31e03a6cb [1,0,0,0,0,0|2,0,1]=4 191 B11R1.4 CC/C=C\CO[C@H]1CCOC1 6dbaad82887a974f52d24aa6de3eec48 [1,0,0,0,0,0|2,0,1]=4 192 B11R1.4 CCCNCCC1CCCC1 d5270a9a9880d18f46e53116360a36aa [1,0,0,0,0,0|1,0,2]=4 193 B11R1.4 CCCNCCC1CCCO1 16ccc3766cb64abb779cf31870fdd1b1 [1,0,0,0,0,0|2,0,1]=4 194 B11R1.4 CCCOCCC1CCCC1 787081f1fdbda17248ae4c818980f2e7 [1,0,0,0,0,0|1,0,2]=4 195 B11R1.4 CCCOCCC1CCCO1 0bafcd2daa31466cb920a9ddb84cb9da [1,0,0,0,0,0|2,0,1]=4 196 B11R1.4 CCNCCCC1CCCC1 bb38b69d7bc0534c0a37772ecaaa96d9 [1,0,0,0,0,0|1,0,2]=4 197 B11R1.4 CCOCCCC1CCCC1 4c414e6d28e260b66dbefeb7947ff46e [1,0,0,0,0,0|1,0,2]=4 198 B11R1.180 C/C=C/CNC1CCCC1O 7a8f134d0f3738b13d1c931269c42c21 [1,0,0,0,0,0|1,0,2]=4 199 B11R1.180 C/C=C/CNC1CCNC1=O 39185184604fcb0a7e78af8cc08cb6ff [1,0,0,0,0,0|2,0,0]=3 200 B11R1.180 C/C=C/CNC1CCSC1=O b323ffe200e527f9049120149c83283b [1,0,0,0,0,0|2,0,0]=3 201 B11R1.180 C/C=C/CNC1CONC1=O 4a6577024e45d5658ef3d8ac9f2c0bc0 [1,0,0,0,0,0|3,0,0]=4 202 B11R1.180 C/C=C/CN[C@@H]1CCC[C@@H]1O 13cfd913d93c49af85888545e9cb6136 [1,0,0,0,0,0|1,0,2]=4 203 B11R1.180 C/C=C/CN[C@@H]1CCC[C@H]1O a05420e1efe991b330d4da507420bd43 [1,0,0,0,0,0|1,0,2]=4 204 B11R1.180 C/C=C/CN[C@@H]1CCNC1=O 21ad7a6d73d265d0c59453fa8ee65546 [1,0,0,0,0,0|2,0,0]=3 205 B11R1.180 C/C=C/CN[C@@H]1CCOC1=O 26dc0a704f44fd487c33cc7901791b88 [1,0,0,0,0,0|2,0,0]=3 206 B11R1.180 C/C=C/CN[C@@H]1CONC1=O a89c3c5ce7699ee68364d6c060996c19 [1,0,0,0,0,0|3,0,0]=4 207 B11R1.180 C/C=C/CN[C@H]1CCC[C@@H]1O 5b32ce8adf841cc3120552b1d970011e [1,0,0,0,0,0|1,0,2]=4 208 B11R1.180 C/C=C/CN[C@H]1CCC[C@H]1O d429644ad6c6e7539fe3acca3dc46a3e [1,0,0,0,0,0|1,0,2]=4 209 B11R1.180 C/C=C/CN[C@H]1CCNC1=O b887084bcf9521f8247dbabef55133a5 [1,0,0,0,0,0|2,0,0]=3 210 B11R1.180 C/C=C/CN[C@H]1CCOC1=O 6fc87686d7f47383675e6c471148a737 [1,0,0,0,0,0|2,0,0]=3 211 B11R1.180 C/C=C/CN[C@H]1CONC1=O 98a59204223431d1d6e80f00676de21a [1,0,0,0,0,0|3,0,0]=4 212 B11R1.180 C/C=C/COC1=CCCC1=O cdc8031d0c2d1043a731af735965cb4f [1,0,0,0,0,0|1,0,2]=4 213 B11R1.180 C/C=C/COC1CCC=C1Br f13f225a1dd7fa7d2cde812e558a7d60 [1,0,0,0,0,0|2,0,1]=4 214 B11R1.180 C/C=C/COC1CCCC1=O b05d4dd01c072fe5f2192ae3c470a21f [1,0,0,0,0,0|1,0,0]=2 215 B11R1.180 C/C=C/COC1CCCC1C f14b65d135467ebf75b2c5f0dde6438a [1,0,0,0,0,0|2,0,1]=4 216 B11R1.180 C/C=C/COC1CCNC1=O 89290e32b8f59b0f4f5b22c71ad5143a [1,0,0,0,0,0|2,0,0]=3 217 B11R1.180 C/C=C/COC1CCOC1=O 03bdf7467c99bb1566c74cfd8ce93af5 [1,0,0,0,0,0|2,0,0]=3 218 B11R1.180 C/C=C/CO[C@@H]1CCC[C@@H]1C 60a8408ce628f235ec450d67de8f40c5 [1,0,0,0,0,0|2,0,1]=4 219 B11R1.180 C/C=C/CO[C@@H]1CCC[C@H]1C 4958320dc4ad1b2b6033a91c8da5e2a2 [1,0,0,0,0,0|2,0,1]=4 220 B11R1.180 C/C=C/CO[C@@H]1CCC[C@H]1F f4f72e3620439cc52d140ef8787d0977 [1,0,0,0,0,0|2,0,1]=4 221 B11R1.180 C/C=C/CO[C@@H]1CCNC1=O d1d350dfc0c4fa24036e9363d9643471 [1,0,0,0,0,0|2,0,0]=3 222 B11R1.180 C/C=C/CO[C@@H]1CCOC1=O bb5f9420e6b6b590348aaaddab040d1a [1,0,0,0,0,0|2,0,0]=3 223 B11R1.180 C/C=C/CO[C@H]1CCC[C@@H]1C 5e0a93ff30af4a3e722f5f711d577401 [1,0,0,0,0,0|2,0,1]=4 224 B11R1.180 C/C=C/CO[C@H]1CCC[C@H]1C 3ff9d17212a951f29ee1f39caf8da739 [1,0,0,0,0,0|2,0,1]=4 225 B11R1.180 C/C=C/CO[C@H]1CCNC1=O 4c76d463aa108d2378ec907660803e17 [1,0,0,0,0,0|2,0,0]=3 226 B11R1.180 C/C=C/CO[C@H]1CCOC1=O 34f5fb8d96e0af0a300c2181eaff7f06 [1,0,0,0,0,0|2,0,0]=3 227 B11R1.180 C/C=C\CNC1CCCC1O ab33002276261bd896759c049727bd7f [1,0,0,0,0,0|1,0,2]=4 228 B11R1.180 C/C=C\CNC1CCNC1=O 4153f128cad53753687ab227d0783d54 [1,0,0,0,0,0|2,0,0]=3 229 B11R1.180 C/C=C\CNC1CCSC1=O d08e75d478202467ed9f77a59e655ec8 [1,0,0,0,0,0|2,0,0]=3 230 B11R1.180 C/C=C\CNC1CONC1=O 4392a2127a75c6f210c4ff3b5b5a79f9 [1,0,0,0,0,0|3,0,0]=4 231 B11R1.180 C/C=C\CN[C@@H]1CCC[C@@H]1O 697c83903b53876a68cfed6150a66227 [1,0,0,0,0,0|1,0,2]=4 232 B11R1.180 C/C=C\CN[C@@H]1CCC[C@H]1O 6f23b4c3533b9cb69313481d05d6eb8a [1,0,0,0,0,0|1,0,2]=4 233 B11R1.180 C/C=C\CN[C@@H]1CCNC1=O bd9c0c1cf64a550b2173a09d9f6fad25 [1,0,0,0,0,0|2,0,0]=3 234 B11R1.180 C/C=C\CN[C@@H]1CCOC1=O bcef9fd71d75632efe5a639cb1da0161 [1,0,0,0,0,0|2,0,0]=3 235 B11R1.180 C/C=C\CN[C@@H]1CONC1=O a5da2ba6646a4579f5aa8e9799a1230f [1,0,0,0,0,0|3,0,0]=4 236 B11R1.180 C/C=C\CN[C@H]1CCC[C@@H]1O 69640c8af2270719b42acd979896b868 [1,0,0,0,0,0|1,0,2]=4 237 B11R1.180 C/C=C\CN[C@H]1CCC[C@H]1O 5c8bbf43c995047f0f3186375379d834 [1,0,0,0,0,0|1,0,2]=4 238 B11R1.180 C/C=C\CN[C@H]1CCNC1=O b380f479fa0ba1d0232732604185bd18 [1,0,0,0,0,0|2,0,0]=3 239 B11R1.180 C/C=C\CN[C@H]1CCOC1=O 5ad1f74e737e67b9953256cf0514e93f [1,0,0,0,0,0|2,0,0]=3 240 B11R1.180 C/C=C\CN[C@H]1CONC1=O b136f6a57187244c8490d7949b8192d1 [1,0,0,0,0,0|3,0,0]=4 241 B11R1.180 C/C=C\COC1=CCCC1=O d774cec9a84630c0c53611acc181e296 [1,0,0,0,0,0|1,0,2]=4 242 B11R1.180 C/C=C\COC1CCC=C1Br 2196c812e8930f4ee3e7d051624bfe17 [1,0,0,0,0,0|2,0,1]=4 243 B11R1.180 C/C=C\COC1CCCC1=O 9bd0aa6a9ea22bf465415cd6785bd665 [1,0,0,0,0,0|1,0,0]=2 244 B11R1.180 C/C=C\COC1CCCC1C 0487d04407d11e9183986c61f80ebb70 [1,0,0,0,0,0|2,0,1]=4 245 B11R1.180 C/C=C\COC1CCNC1=O 3e28655a085e37a4f91fb3e9dd1232f0 [1,0,0,0,0,0|2,0,0]=3 246 B11R1.180 C/C=C\COC1CCOC1=O 54f074a95e0294a23e6bbf6a579a0839 [1,0,0,0,0,0|2,0,0]=3 247 B11R1.180 C/C=C\CO[C@@H]1CCC[C@@H]1C 06b8edf8e2813b026a3b9cbc8598f4d7 [1,0,0,0,0,0|2,0,1]=4 248 B11R1.180 C/C=C\CO[C@@H]1CCC[C@H]1C d831bcdd1fcc541f3350d00669274629 [1,0,0,0,0,0|2,0,1]=4 249 B11R1.180 C/C=C\CO[C@@H]1CCC[C@H]1F b816faa08ce395d0291dc0395ac22e34 [1,0,0,0,0,0|2,0,1]=4 250 B11R1.180 C/C=C\CO[C@@H]1CCNC1=O b9512106b07650290e2238c2fefba5c0 [1,0,0,0,0,0|2,0,0]=3 251 B11R1.180 C/C=C\CO[C@@H]1CCOC1=O b2e933d28df84255399899e35fe90d61 [1,0,0,0,0,0|2,0,0]=3 252 B11R1.180 C/C=C\CO[C@H]1CCC[C@@H]1C dd0cf210517d230bcab3f8d2208d4959 [1,0,0,0,0,0|2,0,1]=4 253 B11R1.180 C/C=C\CO[C@H]1CCC[C@H]1C 0acf76a0d0a82e7797697ac4415bcb62 [1,0,0,0,0,0|2,0,1]=4 254 B11R1.180 C/C=C\CO[C@H]1CCNC1=O a94c2ebd886783364895fb9dd7495d4c [1,0,0,0,0,0|2,0,0]=3 255 B11R1.180 C/C=C\CO[C@H]1CCOC1=O 6d088b3b048b4f29283b524f1f9af004 [1,0,0,0,0,0|2,0,0]=3 256 B11R1.180 C=CCCNC1CCCC1=O 1941a641c74e5a01fd3fe5e34dbe8768 [1,0,0,0,0,0|1,0,2]=4 257 B11R1.180 C=CCCOC1CCCC1=O 6fc2173a6fdaa1212365b5b3a6c9319e [1,0,0,0,0,0|1,0,2]=4 258 B11R1.180 C=CCOCC1CCCC1=O e39836eaadf0bbbab059db83af3ffbbc [1,0,0,0,0,0|1,0,2]=4 259 B11R1.180 CC/C=C/CN1CCCC1C 4c5b655e79e3f4fbdf4f420a3122049a [1,0,0,0,0,0|2,0,1]=4 260 B11R1.180 CC/C=C/CN1CCCC1O 9d31a7a51c745caa9fe46ecfbce33d33 [1,0,0,0,0,0|1,0,2]=4 261 B11R1.180 CC/C=C/CN1CCC[C@@H]1C ed4bb17962041fd6aa5ddbb2efcf7842 [1,0,0,0,0,0|2,0,1]=4 262 B11R1.180 CC/C=C/CN1CCC[C@H]1C 0ba68089ba3f37c679502c085af76bed [1,0,0,0,0,0|2,0,1]=4 263 B11R1.180 CC=CCNC1CCCC1=O 6347166fc51cc11632bea139b771e18e [1,0,0,0,0,0|1,0,0]=2 264 B11R1.180 CC=CCNC1CCCC1O 9f7301c1ceb0e20b0095d568bad68bf7 [1,0,0,0,0,0|1,0,2]=4 265 B11R1.180 CC=CCNC1CCNC1=O 6d14c36aee35898ffe154dc4b09f4be9 [1,0,0,0,0,0|2,0,0]=3 266 B11R1.180 CC=CCNC1CCOC1=O 0d888170e8bf0156ab68146198a7aab4 [1,0,0,0,0,0|2,0,0]=3 267 B11R1.180 CC=CCN[C@@H]1CCC[C@H]1O 2b0e1553cdbc21c8610c9152ab78f51f [1,0,0,0,0,0|1,0,2]=4 268 B11R1.180 CC=CCN[C@H]1CCC[C@@H]1O 12248c2b5cdcbf34d3c816c0283c5345 [1,0,0,0,0,0|1,0,2]=4 269 B11R1.180 CC=CCOC1CCCC1=O ab58de2a5311b318073fc2892a6900cd [1,0,0,0,0,0|1,0,0]=2 270 B11R1.180 CC=CCOC1CCNC1=O eb9c713ea95e94ea422950e1d039462c [1,0,0,0,0,0|2,0,0]=3 271 B11R1.180 CCCCNC1CCCC1=O 39f9ee5b59b883e97393975a970e10d4 [1,0,0,0,0,0|1,0,1]=3 272 B11R1.180 CCCCNC1CCNC1=O 186446e8bc07c208cf0e9b58e44f01e8 [1,0,0,0,0,0|2,0,1]=4 273 B11R1.180 CCCCNC1CCSC1=O 02e0fc8efcfe3b3711a069b87645d9fa [1,0,0,0,0,0|2,0,1]=4 274 B11R1.180 CCCCN[C@@H]1CCNC1=O 6e0f44241d58997cb1c6d0051eab8a32 [1,0,0,0,0,0|2,0,1]=4 275 B11R1.180 CCCCN[C@@H]1CCOC1=O ed0730bf918a90319664293109727836 [1,0,0,0,0,0|2,0,1]=4 276 B11R1.180 CCCCN[C@H]1CCNC1=O 66b10e76c34af5d0dab45f88e932d111 [1,0,0,0,0,0|2,0,1]=4 277 B11R1.180 CCCCN[C@H]1CCOC1=O bc1ff4fc4b1cbd2b8e734ea1a24a3145 [1,0,0,0,0,0|2,0,1]=4 278 B11R1.180 CCCCOC1CCCC1=O daa71a749c8ab0736df54ca1e1a12aa6 [1,0,0,0,0,0|1,0,1]=3 279 B11R1.180 CCCCOC1CCNC1=O 7b231c5ea57dcbc2aa7adddae086cda9 [1,0,0,0,0,0|2,0,1]=4 280 B11R1.180 CCCCOC1CCOC1=O 6b1a411a75446402594aca66d981812a [1,0,0,0,0,0|2,0,1]=4 281 B11R1.180 CCCCO[C@@H]1CCNC1=O cb2fa50a05ea794d6edb8e207c80ecd5 [1,0,0,0,0,0|2,0,1]=4 282 B11R1.180 CCCCO[C@@H]1CCOC1=O 7f089f9be002c56d4ed21d2753984a9f [1,0,0,0,0,0|2,0,1]=4 283 B11R1.180 CCCCO[C@H]1CCNC1=O 8cbf41402c4456eeb8d0823b203c93b8 [1,0,0,0,0,0|2,0,1]=4 284 B11R1.180 CCCCO[C@H]1CCOC1=O 3b100f447983d8c65cd8accc2947ac67 [1,0,0,0,0,0|2,0,1]=4 285 B11R1.180 CCCNCC1CCNC1=O 6f43743b2b4651249ecb698013e60338 [1,0,0,0,0,0|2,0,1]=4 286 B11R1.180 CCCNCN1CCCC1=O 91887f1bd955350d83fb5cbd80ecb1f5 [1,0,0,0,0,0|2,0,1]=4 287 B11R1.180 CCCOCC1CCCC1=O 38a6f11d54d34dd53e14f1182522173f [1,0,0,0,0,0|1,0,1]=3 288 B11R1.180 CCCOCC1CCNC1=O a7890dcd6183c9752ec22ee8c72e0b2a [1,0,0,0,0,0|2,0,1]=4 289 B11R1.180 CCCOCN1CCCC1=O f219657cc4d06050eaec73ad23ed676b [1,0,0,0,0,0|2,0,1]=4 290 B11R1.180 CCNCCC1CCCN1C 8dd87623ed8ce203aec3094aca5d8d00 [1,0,0,0,0,0|3,0,0]=4 291 B11R1.180 CCNCCN1CCCC1=O 36a7b721f69f8b18b7bc5858c5b90e81 [1,0,0,0,0,0|2,0,0]=3 292 B11R1.180 CCNCCN1CCNC1=O 48c0a96704ffc8cbadc09dd83f57f076 [1,0,0,0,0,0|3,0,0]=4 293 B11R1.180 CCNCC[C@@H]1CCCN1C c400f1373ed29c6a36e401acf31cf6f7 [1,0,0,0,0,0|3,0,0]=4 294 B11R1.180 CCNCC[C@H]1CCCN1C 4f78b80ca36916acb38782523b9d13d9 [1,0,0,0,0,0|3,0,0]=4 295 B11R1.180 CCOCCC1CCCN1C 2ce48a83ef6a23ca1f01db7eef6b80ad [1,0,0,0,0,0|3,0,0]=4 296 B11R1.180 CCOCCC1CCNC1=O 691ba5da473129ccf331160f91db89fc [1,0,0,0,0,0|2,0,0]=3 297 B11R1.180 CCOCCN1CCCC1=O eec83e50d5d1cf07c9841640aebd1ba4 [1,0,0,0,0,0|2,0,0]=3 298 B11R1.180 CCOCCN1CCNC1=O eb06045ce2e70e0a62149e599abeb3cc [1,0,0,0,0,0|3,0,0]=4 299 B11R1.180 CCOCC[C@@H]1CCCN1C 9c9a3b3a307be5c9f7e73141f3a945ac [1,0,0,0,0,0|3,0,0]=4 300 B11R1.180 CCOCC[C@H]1CCCN1C 34b7fadfc7a279e2ef84b7a8ef3f0a76 [1,0,0,0,0,0|3,0,0]=4 301 B11R1.180 CCOCNC1CCNC1=O 96d8e211be756b9f535180244ab0f34b [1,0,0,0,0,0|3,0,0]=4 302 B11R1.180 CCOCN[C@@H]1CCNC1=O 0377f37765f466477442c959974f82f1 [1,0,0,0,0,0|3,0,0]=4 303 B11R1.180 CCOCN[C@H]1CCNC1=O fec8c790b816398fe49eb1a3eb6f8f7a [1,0,0,0,0,0|3,0,0]=4 304 B11R1.180 COCCNC1CCCC1=O e3affe8a2fb4830ec43073ed366123f7 [1,0,0,0,0,0|2,0,1]=4 305 B11R1.180 COCCOC1CCCC1=O 64d6773d3f7f907b500ddffb29b8e5c9 [1,0,0,0,0,0|2,0,1]=4 306 B11R1.180 COCOCC1CCCC1=O 99747fc986fb155c7c97d45d40f3a523 [1,0,0,0,0,0|2,0,1]=4 307 B11R1.180 CSCCNC1CCCC1=O 1a918986e443973b93dcff5ab8488238 [1,0,0,0,0,0|2,0,1]=4 308 B11R1.180 CSCCOC1CCCC1=O 3cf11c06e2768f681e866c19a4bfc663 [1,0,0,0,0,0|2,0,1]=4 309 B11R1.180 CSCOCC1CCCC1=O 283bbcbffcad0dc5983c554947b2b571 [1,0,0,0,0,0|2,0,1]=4 310 B11R1.180 O=C1CCCC1COCCF 83d5df4865750a49009feacdd6fce70e [1,0,0,0,0,0|2,0,1]=4 311 B11R1.180 O=C1CCCC1COCCS ce0277165bc2576a887b2890f98c1bf3 [1,0,0,0,0,0|2,0,1]=4 312 B11R1.180 O=C1CCCC1NCCCCl 0d7b77a3647043b5308b9e03b03208f4 [1,0,0,0,0,0|2,0,1]=4 313 B11R1.180 O=C1CCCC1NCCCO 8deb1c83ab53c1e6f1beb704839da63c [1,0,0,0,0,0|2,0,1]=4 314 B11R1.180 O=C1CCCC1OC/C=C/Cl d92227449e9e2a08e77471461d6a49bb [1,0,0,0,0,0|2,0,0]=3 315 B11R1.180 O=C1CCCC1OC/C=C\Cl 1b71bca794c99c1dc74cd477c5593781 [1,0,0,0,0,0|2,0,0]=3 316 B11R1.180 O=C1CCCC1OCC=CCl ee8128f8bc9af9ef315308fdc5187782 [1,0,0,0,0,0|2,0,0]=3 317 B11R1.180 O=C1CCCC1OCCCF 0cb91a01e38d73789f9e0851f5649a66 [1,0,0,0,0,0|2,0,1]=4 318 B11R1.180 O=C1CCCC1OCCCS 5063541bc88a8e8fb7070e9c4a3cf1f4 [1,0,0,0,0,0|2,0,1]=4 319 B11R1.180 O=C1CCCN1CCNCF b1a3101e8fe931d8015ff6fdaa7f35b8 [1,0,0,0,0,0|3,0,0]=4 320 B11R1.180 O=C1CCCN1CCNCO b6e4ec7e13492967988e1dd60fe6ddca [1,0,0,0,0,0|3,0,0]=4 321 B11R1.180 O=C1CCCN1CCOCF a10081b916b9c24a9eba3625af868f26 [1,0,0,0,0,0|3,0,0]=4 322 B11R1.180 O=C1NCCC1CCOCF d398d5bb26633231279f03d2a44e1703 [1,0,0,0,0,0|3,0,0]=4 323 B11R1.180 O=C1NCCC1NC/C=C/Cl bab8eab6fee506edca06384301e6560b [1,0,0,0,0,0|3,0,0]=4 324 B11R1.180 O=C1NCCC1NC/C=C\Cl 9cb8dc9b81187c7f3c024af116bce663 [1,0,0,0,0,0|3,0,0]=4 325 B11R1.180 O=C1NCCC1NC/C=C\O 07c90e376a6241749232e5178864663f [1,0,0,0,0,0|3,0,0]=4 326 B11R1.180 O=C1NCCC1OC/C=C/Cl 48cf698c54d15ea460d901d1b1856575 [1,0,0,0,0,0|3,0,0]=4 327 B11R1.180 O=C1NCCC1OC/C=C\Cl c158a179b4f78af2c3088f9a1a41881f [1,0,0,0,0,0|3,0,0]=4 328 B11R1.180 O=C1NCCC1OCC=CCl 9f262d97824ffd1c9a394dfc80505303 [1,0,0,0,0,0|3,0,0]=4 329 B11R1.180 O=C1NCC[C@@H]1NC/C=C/Cl 22b92fae8b13e522789c369511be2beb [1,0,0,0,0,0|3,0,0]=4 330 B11R1.180 O=C1NCC[C@@H]1NC/C=C\Cl 5e61e2a0ee60611a7885df8c934bb5bd [1,0,0,0,0,0|3,0,0]=4 331 B11R1.180 O=C1NCC[C@@H]1NC/C=C\O d466c4f100e93764d1eb206b6c29bd36 [1,0,0,0,0,0|3,0,0]=4 332 B11R1.180 O=C1NCC[C@@H]1OC/C=C/Cl 48851c673e1165e14993f27e6a937484 [1,0,0,0,0,0|3,0,0]=4 333 B11R1.180 O=C1NCC[C@@H]1OC/C=C\Cl 50f01fd70fd1b25bd71840049f0f22f6 [1,0,0,0,0,0|3,0,0]=4 334 B11R1.180 O=C1NCC[C@H]1NC/C=C/Cl 245bec7e1120ecb964714661c2539606 [1,0,0,0,0,0|3,0,0]=4 335 B11R1.180 O=C1NCC[C@H]1NC/C=C\Cl 03faedcd663c93c74ae53234dffde741 [1,0,0,0,0,0|3,0,0]=4 336 B11R1.180 O=C1NCC[C@H]1NC/C=C\O b313ce93f538a02e2f6a4c1474befc86 [1,0,0,0,0,0|3,0,0]=4 337 B11R1.180 O=C1NCC[C@H]1OC/C=C/Cl f578f3f42b1490c97d4d0860554f1c45 [1,0,0,0,0,0|3,0,0]=4 338 B11R1.180 O=C1NCC[C@H]1OC/C=C\Cl a9c4be9c0b819e3180747884e6127916 [1,0,0,0,0,0|3,0,0]=4 339 B11R1.180 O=C1OCCC1OC/C=C/Cl 2ab34a07521bdb7a95f0157c31001543 [1,0,0,0,0,0|3,0,0]=4 340 B11R1.180 O=C1OCCC1OC/C=C\Cl bc3f67ab83fe275c62c15c5889057a89 [1,0,0,0,0,0|3,0,0]=4 341 B11R1.180 O=C1OCC[C@@H]1NC/C=C/Cl fa8698b31824f8906e0981c6ad6e62a5 [1,0,0,0,0,0|3,0,0]=4 342 B11R1.180 O=C1OCC[C@@H]1NC/C=C\Cl ba8119c67b1617358866725d0d15d9fe [1,0,0,0,0,0|3,0,0]=4 343 B11R1.180 O=C1OCC[C@@H]1NC/C=C\O 3d7312d750596935c9b5f6120abbe048 [1,0,0,0,0,0|3,0,0]=4 344 B11R1.180 O=C1OCC[C@@H]1OC/C=C/Cl 8846bb60002b95b479cd9e2fef3bb444 [1,0,0,0,0,0|3,0,0]=4 345 B11R1.180 O=C1OCC[C@@H]1OC/C=C\Cl 87efec54b98a067374470db1bc0fd910 [1,0,0,0,0,0|3,0,0]=4 346 B11R1.180 O=C1OCC[C@H]1NC/C=C/Cl 33ff5a32f0d29e40dbd2516ee5c99104 [1,0,0,0,0,0|3,0,0]=4 347 B11R1.180 O=C1OCC[C@H]1NC/C=C\Cl 934fc1f3a3385c2ba0131d602efff3ed [1,0,0,0,0,0|3,0,0]=4 348 B11R1.180 O=C1OCC[C@H]1NC/C=C\O 0cfcf1f68043bebb6682d7b17ba2540b [1,0,0,0,0,0|3,0,0]=4 349 B11R1.180 O=C1OCC[C@H]1OC/C=C/Cl 8f8da89a1b0d4187e4566f206008d0c8 [1,0,0,0,0,0|3,0,0]=4 350 B11R1.180 O=C1OCC[C@H]1OC/C=C\Cl de9dd2f1ceef35364c664ed64946d603 [1,0,0,0,0,0|3,0,0]=4 351 B11R1.180 O=C1SCCC1NC/C=C/Cl 8c44bea5878118c176a8f62693ace5db [1,0,0,0,0,0|3,0,0]=4 352 B11R1.180 O=C1SCCC1NC/C=C\Cl 4c711bad802869ab9b325e323f580ac2 [1,0,0,0,0,0|3,0,0]=4 353 B11R1.180 O=C1SCCC1NC/C=C\O 26922e70b367a59df45932789a7b1d05 [1,0,0,0,0,0|3,0,0]=4 354 B11R1.180 O=CCCOC1CCCC1=O d05eaf1ff263e50b5f3643f5c404cca5 [1,0,0,0,0,0|2,0,1]=4 355 B11R1.180 O=CCOCC1CCCC1=O c94134b18a5365cd43e6d1ecb76a89e5 [1,0,0,0,0,0|2,0,1]=4 356 B11R1.180 O=CNCCN1CCCC1=O 340c413054177c4f1cd9a1e521216d32 [1,0,0,0,0,0|3,0,0]=4 357 B13R1.137 C#CC1CCCC1OC/C=C/CC 5356a63ca53ac6cd48bd8d6a6077cbb3 [0,1,0,0,0,0|2,0,1]=4 358 B13R1.137 C#CC1CCCN1CC/C=C\CC 48ed7c11890e1003fe4132a1e8c3f1dc [0,1,0,0,0,0|2,0,1]=4 359 B13R1.137 CC/C=C/CNC1CCCC1OC d06a49f41a09254564765e6ad605f508 [0,1,0,0,0,0|1,0,2]=4 360 B13R1.137 CC/C=C/CN[C@@H]1CCC[C@H]1CC 17947637ee9c857a1fcc6f8c59b13fa2 [0,1,0,0,0,0|2,0,1]=4 361 B13R1.137 CC/C=C/CN[C@@H]1CCC[C@H]1OC 38347bd8755c4915ed0d8bcb91279537 [0,1,0,0,0,0|1,0,2]=4 362 B13R1.137 CC/C=C/CN[C@H]1CCC[C@@H]1OC 8b35ec3f873240ab7c4cc521954b20d2 [0,1,0,0,0,0|1,0,2]=4 363 B13R1.137 CC/C=C/CN[C@H]1CCC[C@H]1C#N 7ae07a45a3e9c6a24bbed5d35bddbcd9 [0,1,0,0,0,0|2,0,1]=4 364 B13R1.137 CC/C=C/CN[C@H]1CCC[C@H]1CO 1641437cdd7a7d3a18561fd26f9dbcbe [0,1,0,0,0,0|1,0,2]=4 365 B13R1.137 CC/C=C/CN[C@H]1CCC[C@H]1OC 6b04668040e5ea8b5fc5708fa8cdd854 [0,1,0,0,0,0|1,0,2]=4 366 B13R1.137 CC/C=C/COC1=C(CCC1)C#N 36597090e8b6dd84d6d0a7069b596514 [0,1,0,0,0,0|2,0,1]=4 367 B13R1.137 CC/C=C/COC1CCCC1C#N ae475f104ad77d2c2ad282898aa8498b [0,1,0,0,0,0|2,0,1]=4 368 B13R1.137 CC/C=C/CO[C@@H]1CCC[C@H]1C#N 045ffefebc26f937527ece0fe14d1780 [0,1,0,0,0,0|2,0,1]=4 369 B13R1.137 CC/C=C\CCN1CCCC1C#N d67300a241e75b74e5e6a465f217119e [0,1,0,0,0,0|2,0,1]=4 370 B13R1.137 CC/C=C\CCN1CCCC1CC 4ac41bc38c6de9bef9cf051f42c760ce [0,1,0,0,0,0|2,0,1]=4 371 B13R1.137 CC/C=C\CCN1CCCC1CO 5bfc1fda8ee3030b3897b53a302b6867 [0,1,0,0,0,0|1,0,2]=4 372 B13R1.137 CC/C=C\CCN1CCCC1OC ba1578324065649e8a24478cbaad357e [0,1,0,0,0,0|1,0,2]=4 373 B13R1.137 CC/C=C\CCN1CCC[C@@H]1CF f6c0b63c06744d0b671514ce740b6224 [0,1,0,0,0,0|2,0,1]=4 374 B13R1.137 CC/C=C\CCN1CCC[C@@H]1CO 6013ab40f06732d05a3ad17924dcf73b [0,1,0,0,0,0|1,0,2]=4 375 B13R1.137 CC/C=C\CCN1CCC[C@H]1C#N 1ca9c030c917d1399655c1ae3f4f042d [0,1,0,0,0,0|2,0,1]=4 376 B13R1.137 CC/C=C\CCN1CCC[C@H]1CC d42560260b5f77dee61b00720ac5aa9d [0,1,0,0,0,0|2,0,1]=4 377 B13R1.137 CC/C=C\CCN1CCC[C@H]1CF 60b47269dd77e22b62eb73171791aecb [0,1,0,0,0,0|2,0,1]=4 378 B13R1.137 CC/C=C\CCN1CCC[C@H]1CO 78c9ddef9cce68611fa22c5d394e0604 [0,1,0,0,0,0|1,0,2]=4 379 B13R1.167 C/C(=C/COCC1CCCC1=O)/I 1c3104d188198f6bf26fec107da984d6 [0,1,0,0,0,0|1,0,2]=4 380 B13R1.167 C/C(=C\COCC1CCCC1=O)/Cl bc8575016ee81cf79c3b35fd30c68d5b [0,1,0,0,0,0|1,0,2]=4 381 B13R1.167 CC(=CCCOC1CCCC1=O)C 989269ed529298052461c83c8f0f5c66 [0,1,0,0,0,0|1,0,2]=4 382 B13R1.167 CC(=CCOCC1CCCC1=O)C a4b029893ba68b96fe71a2147b57f534 [0,1,0,0,0,0|1,0,2]=4 383 B13R1.167 CC(=CCOCC1CCCC1=O)Cl de3f756cf1081622f72bf758e2ebca38 [0,1,0,0,0,0|1,0,2]=4 384 B13R1.167 CC(=CCOCC1CCCC1=O)I 97703deace3c142da9452b1f081eb50c [0,1,0,0,0,0|1,0,2]=4 385 B13R1.167 CC(C)/C=C/CNC1CCCC1O 3b283cd4c108665f8d11a85c3485249d [0,1,0,0,0,0|1,0,2]=4 386 B13R1.167 CC(C)/C=C/CNC1CCNC1=O 9b3bcd0475e1ec0fb5b879b00434e67c [0,1,0,0,0,0|2,0,0]=3 387 B13R1.167 CC(C)/C=C/CNC1CCSC1=O 45f88072f0dc6db9a8747213004ae9c7 [0,1,0,0,0,0|2,0,0]=3 388 B13R1.167 CC(C)/C=C/CNC1CONC1=O 955fd4a8388d8f8f4aee4d352a236cb0 [0,1,0,0,0,0|3,0,0]=4 389 B13R1.167 CC(C)/C=C/CN[C@@H]1CCC[C@@H]1O b788d86ea7ebaa91f5823430fb040d85 [0,1,0,0,0,0|1,0,2]=4 390 B13R1.167 CC(C)/C=C/CN[C@@H]1CCC[C@H]1O 028d630954a55e5ae3f21404586130de [0,1,0,0,0,0|1,0,2]=4 391 B13R1.167 CC(C)/C=C/CN[C@@H]1CCNC1=O f61f298662600ccbda1ad79b44680e57 [0,1,0,0,0,0|2,0,0]=3 392 B13R1.167 CC(C)/C=C/CN[C@@H]1CCOC1=O 67c69e511603243a4911ad77eb5f5b9a [0,1,0,0,0,0|2,0,0]=3 393 B13R1.167 CC(C)/C=C/CN[C@@H]1CONC1=O 2a0a71413081cadcb41659b4d14e50b3 [0,1,0,0,0,0|3,0,0]=4 394 B13R1.167 CC(C)/C=C/CN[C@H]1CCC[C@@H]1O 8e03171ef937f13486f12c39579ab05f [0,1,0,0,0,0|1,0,2]=4 395 B13R1.167 CC(C)/C=C/CN[C@H]1CCC[C@H]1O 11303b6f72caf9ea9ee50f44270bc10b [0,1,0,0,0,0|1,0,2]=4 396 B13R1.167 CC(C)/C=C/CN[C@H]1CCNC1=O b80758a36604cdbb94262c09333f5646 [0,1,0,0,0,0|2,0,0]=3 397 B13R1.167 CC(C)/C=C/CN[C@H]1CCOC1=O 18dac41779fd8128313ff77e5b3c9b3b [0,1,0,0,0,0|2,0,0]=3 398 B13R1.167 CC(C)/C=C/CN[C@H]1CONC1=O 11714994e9511da5efc159a96012d5f7 [0,1,0,0,0,0|3,0,0]=4 399 B13R1.167 CC(C)/C=C/COC1=CCCC1=O 40b291f1b084bdb47bbc04fcc7dab162 [0,1,0,0,0,0|1,0,2]=4 400 B13R1.167 CC(C)/C=C/COC1CCC=C1Br deac4003e366583ad8df9873991b734b [0,1,0,0,0,0|2,0,1]=4 401 B13R1.167 CC(C)/C=C/COC1CCCC1=O 897316952d9421381f92de4f0281fadd [0,1,0,0,0,0|1,0,0]=2 402 B13R1.167 CC(C)/C=C/COC1CCCC1C 711ccbd7701bcb0951e77227b7b2d1fa [0,1,0,0,0,0|2,0,1]=4 403 B13R1.167 CC(C)/C=C/COC1CCNC1=O 8adfcbd1bee7d79fda4ad7c0d77a29c6 [0,1,0,0,0,0|2,0,0]=3 404 B13R1.167 CC(C)/C=C/COC1CCOC1=O 6df205feff78ea205142dfed9f691795 [0,1,0,0,0,0|2,0,0]=3 405 B13R1.167 CC(C)/C=C/CO[C@@H]1CCC[C@@H]1C 7c7cb9cdc0d170ec39df7111f231f985 [0,1,0,0,0,0|2,0,1]=4 406 B13R1.167 CC(C)/C=C/CO[C@@H]1CCC[C@H]1C ec3af5e0b0599acd069459b7aa22c900 [0,1,0,0,0,0|2,0,1]=4 407 B13R1.167 CC(C)/C=C/CO[C@@H]1CCC[C@H]1F 03483c29d69335d041f8775f4474db7f [0,1,0,0,0,0|2,0,1]=4 408 B13R1.167 CC(C)/C=C/CO[C@@H]1CCNC1=O f03b6984e00d87149db98b2731d09748 [0,1,0,0,0,0|2,0,0]=3 409 B13R1.167 CC(C)/C=C/CO[C@@H]1CCOC1=O 3076dc6b568a6cd026b58ebb655cc571 [0,1,0,0,0,0|2,0,0]=3 410 B13R1.167 CC(C)/C=C/CO[C@H]1CCC[C@@H]1C da6f6bcf1bcda9884ce62200dab5e033 [0,1,0,0,0,0|2,0,1]=4 411 B13R1.167 CC(C)/C=C/CO[C@H]1CCC[C@H]1C 56ed0b66ae75c100b6a5914fc8c0801f [0,1,0,0,0,0|2,0,1]=4 412 B13R1.167 CC(C)/C=C/CO[C@H]1CCNC1=O 06b3eaefac5440adf89355056a27234b [0,1,0,0,0,0|2,0,0]=3 413 B13R1.167 CC(C)/C=C/CO[C@H]1CCOC1=O 4a02bfd4774772a27320a02a13450a30 [0,1,0,0,0,0|2,0,0]=3 414 B13R1.167 CC(C)CCCOC1CCCC1=O 353ffbbe10cbd7886518b5ca57b45a18 [0,1,0,0,0,0|1,0,2]=4 415 B13R1.167 CC(C)CCOCC1CCCC1=O 66baed753be4dff89f038f84272a224e [0,1,0,0,0,0|1,0,2]=4 416 B13R1.167 CC(C)CNCCC1CCNC1=O 89d140eae65ac51e9e0e61b291a9c426 [0,1,0,0,0,0|2,0,1]=4 417 B13R1.167 CC(C)CNCCN1CCCC1=O f49945b967324ade2465964230c72e71 [0,1,0,0,0,0|2,0,1]=4 418 B13R1.167 CC(C)COCCC1CCNC1=O 27f155095d76537401f9ee2a3101cea6 [0,1,0,0,0,0|2,0,1]=4 419 B13R1.167 CC(C)COCCN1CCCC1=O 8719e1d0ffdf9fe903bb9941680d5dc5 [0,1,0,0,0,0|2,0,1]=4 420 B13R1.167 CC(C)NCCCN1CCCC1=O d01c33a39a2c916e34a6380375552332 [0,1,0,0,0,0|2,0,1]=4 421 B13R1.167 CC(C)OCCCN1CCCC1=O 10cbc989d4a63dacde0b91e1bc513856 [0,1,0,0,0,0|2,0,1]=4 422 B13R1.167 CC(C)OCCNC1CCCC1=O 94ad300a767630685768ceb84eb2f803 [0,1,0,0,0,0|2,0,1]=4 423 B13R1.167 CC(C)OCCOC1CCCC1=O 395afe16e6d20cd7b590b0f0af675a2d [0,1,0,0,0,0|2,0,1]=4 424 B13R1.167 CC(C)OCOCC1CCCC1=O ca71db040206dc7379a2d29927ccbc11 [0,1,0,0,0,0|2,0,1]=4 425 B13R1.167 CC(C)SCCOC1CCCC1=O 218035eb481eba8cd3a6d0de79dacb91 [0,1,0,0,0,0|2,0,1]=4 426 B13R1.167 CC(F)COCCC1CCNC1=O 574f7bbb478506e9247a3461550cea01 [0,1,0,0,0,0|2,0,1]=4 427 B13R1.167 CC(F)COCCN1CCCC1=O 94807ff7bd7d94fa682e96d85e911be9 [0,1,0,0,0,0|2,0,1]=4 428 B13R1.167 CC(O)CNCCC1CCNC1=O edd31a97fff7c41be920f2ab66caf4f8 [0,1,0,0,0,0|2,0,1]=4 429 B13R1.167 CC(O)CNCCN1CCCC1=O b2beb77b10af76f137ac1d3b0654399e [0,1,0,0,0,0|2,0,1]=4 430 B13R1.167 CC(S)COCCC1CCNC1=O 868ffeacb114694b6ea7e948984543d1 [0,1,0,0,0,0|2,0,1]=4 431 B13R1.167 CC(S)COCCN1CCCC1=O 5f376ce348a95cd73ecacb50f897c34f [0,1,0,0,0,0|2,0,1]=4 432 B13R1.167 C[C@@H](F)COCCC1CCNC1=O 4f843337c7c70c7289fcc78067c08db7 [0,1,0,0,0,0|2,0,1]=4 433 B13R1.167 C[C@@H](F)COCCN1CCCC1=O 96405f856ac2b8ca61d85851fc3215ca [0,1,0,0,0,0|2,0,1]=4 434 B13R1.167 C[C@@H](O)CNCCC1CCNC1=O e6648e4da749079c51f5da47448e3247 [0,1,0,0,0,0|2,0,1]=4 435 B13R1.167 C[C@@H](O)CNCCN1CCCC1=O f0323d74ff3eca04ef1683dc1442ce77 [0,1,0,0,0,0|2,0,1]=4 436 B13R1.167 C[C@H](F)COCCC1CCNC1=O f3e18d51792d13a9d7636aded84b8a17 [0,1,0,0,0,0|2,0,1]=4 437 B13R1.167 C[C@H](F)COCCN1CCCC1=O eb472e8a375de7c09620cce1a64b5638 [0,1,0,0,0,0|2,0,1]=4 438 B13R1.167 C[C@H](O)CNCCC1CCNC1=O b3c3e91977c04ef99575ee841b615017 [0,1,0,0,0,0|2,0,1]=4 439 B13R1.167 C[C@H](O)CNCCN1CCCC1=O 7bf9476801bbc3c95057c4d6477aca38 [0,1,0,0,0,0|2,0,1]=4 440 B13R1.167 O=C(O)/C=C/CNC1CCCC1=O 03a0131e5fdd28b1f276c21bf8e569ff [0,1,0,0,0,0|2,0,1]=4 441 B13R1.167 O=C(O)/C=C/COC1CCCC1=O 60ccd3e9db8f46f5b5634437faf4f18d [0,1,0,0,0,0|2,0,1]=4 442 B13R1.167 O=C(O)C=CCNC1CCCC1=O f84d50d54a2a60d705c29f64412ccac8 [0,1,0,0,0,0|2,0,1]=4 443 B13R1.167 O=C(O)C=CCOC1CCCC1=O 2e4e0342fa1e05c20e47f3c6e3f7df20 [0,1,0,0,0,0|2,0,1]=4 444 B13R1.190 CC/C=C/CNC1CC(=O)NC1=O 8c4f41427a04379fbef1231f9621acb5 [0,1,0,0,0,0|2,0,1]=4 445 B13R1.190 CC/C=C/CN[C@@H]1CC(=O)NC1=O a6d0fa4461070af7b46b66c56a134526 [0,1,0,0,0,0|2,0,1]=4 446 B13R1.190 CC/C=C/CN[C@H]1CC(=O)NC1=O ac150f8e6433a0f22841ca83cf0f6443 [0,1,0,0,0,0|2,0,1]=4 447 B13R1.190 CC/C=C/COC1CC(OC1=O)C 6762c59c7bc70a00f6d02c3af3ca1b2d [0,1,0,0,0,0|2,0,0]=3 448 B13R1.190 CC/C=C/CO[C@@H]1C[C@@H](NC1=O)C 56643a1c9e0c758b9f0f12412299b46e [0,1,0,0,0,0|2,0,0]=3 449 B13R1.190 CC/C=C\CCN1C[C@@H](C[C@@H]1C)F bb3b3fa60d4ec373ed0f650b98a76957 [0,1,0,0,0,0|2,0,1]=4 450 B13R1.190 CC/C=C\CCN1C[C@@H](C[C@@H]1C)O bfcda7d4cd172be20ed1c06fcbcea3ad [0,1,0,0,0,0|2,0,1]=4 451 B13R1.190 CC/C=C\CCN1C[C@@H](C[C@H]1C)F a6d1f892a3e6b2d04b1f7f7242340ff3 [0,1,0,0,0,0|2,0,1]=4 452 B13R1.190 CC/C=C\CCN1C[C@@H](C[C@H]1C)O 47dfc6460ab1a428f9ae1b5601806171 [0,1,0,0,0,0|2,0,1]=4 453 B13R1.190 CC/C=C\CCN1C[C@H](C[C@@H]1C)F 61dcccce62810d4ae0656c0cc84a147a [0,1,0,0,0,0|2,0,1]=4 454 B13R1.190 CC/C=C\CCN1C[C@H](C[C@@H]1C)O c2b3ac7372f985087c6037c1d91e3041 [0,1,0,0,0,0|2,0,1]=4 455 B13R1.190 CC/C=C\CCN1C[C@H](C[C@H]1C)F 000761afa957b3746b7a663f6090c77f [0,1,0,0,0,0|2,0,1]=4 456 B13R1.190 CC/C=C\CCN1C[C@H](C[C@H]1C)O a6049c52e16e9f71cda83d851c83231b [0,1,0,0,0,0|2,0,1]=4 457 B13R1.190 CC/C=C\COC1CC(OC1=O)C 0ca28572a1c32a64128a21da28ab5c86 [0,1,0,0,0,0|2,0,0]=3 458 B13R1.193 CC/C=C/CNC1CCCC1(C)C b0846246afeed0f49b324d6cf2029394 [0,1,0,0,0,0|2,0,1]=4 459 B13R1.193 CC/C=C/CNC1CCCC1(C)O d85c956a1d93d375a64513593bb46e72 [0,1,0,0,0,0|1,0,2]=4 460 B13R1.193 CC/C=C/CNC1CCCC1(F)F 615bb3f17a786c94a94d9057ad391660 [0,1,0,0,0,0|2,0,1]=4 461 B13R1.193 CC/C=C/CN[C@@H]1CCC[C@@]1(C)O cec34645221f2ed06db79d5057ecada1 [0,1,0,0,0,0|1,0,2]=4 462 B13R1.193 CC/C=C/CN[C@H]1CCC[C@]1(C)O 9cc902ec94cf4e8c8eb0498fb880296c [0,1,0,0,0,0|1,0,2]=4 463 B13R1.193 CC/C=C/COC1CCCC1(C)C e61a35b3fa7b6b325d46a0df86ae4aa1 [0,1,0,0,0,0|2,0,1]=4 464 B13R1.193 CC/C=C/COC1CCCC1(F)F a15ea70dc759585f910c5cbff2453dd3 [0,1,0,0,0,0|2,0,1]=4 465 B13R1.193 CC/C=C/CO[C@@H]1CCCC1(C)C bce8a3368a5d821a4bf3faa3ecf70dca [0,1,0,0,0,0|2,0,1]=4 466 B13R1.193 CC/C=C/CO[C@H]1CCCC1(C)C 20395d9e62900f456edc1b04c36048cb [0,1,0,0,0,0|2,0,1]=4 467 B13R1.193 CC/C=C\CCN1CCCC1(C)C 8247bd6b719e2943993e09db1ced792a [0,1,0,0,0,0|2,0,1]=4 468 B13R1.193 CC/C=C\COC1CCCC1(F)F e6664c2ec49bfde42843edf090d6ea53 [0,1,0,0,0,0|2,0,1]=4 469 B13R1.444 C/C=C/C(=O)NCC1CCNC1=O fdf1ed0c1b4fbe31aa23d6e608e2d008 [0,1,0,0,0,0|2,0,1]=4 470 B13R1.444 CCCC(=O)CNC1CCNC1=O 7021722815c9174a3789357468670fab [0,1,0,0,0,0|2,0,1]=4 471 B13R1.444 CCCC(=O)CNC1CCSC1=O 9421b6148eb4387cee7b82e51e2450c5 [0,1,0,0,0,0|2,0,1]=4 472 B13R1.444 CCCC(=O)CN[C@@H]1CCNC1=O 74836ee9e6b10ccd7c04dc66e3802669 [0,1,0,0,0,0|2,0,1]=4 473 B13R1.444 CCCC(=O)CN[C@@H]1CCOC1=O 73dd8bfc6f7191176982ac63e0dfb08c [0,1,0,0,0,0|2,0,1]=4 474 B13R1.444 CCCC(=O)CN[C@H]1CCNC1=O a60f335ec5fb5cc7d99caa5571b3105b [0,1,0,0,0,0|2,0,1]=4 475 B13R1.444 CCCC(=O)CN[C@H]1CCOC1=O dcf0212476c37582a34b24c4053556fe [0,1,0,0,0,0|2,0,1]=4 476 B13R1.444 CCCC(=O)COC1CCNC1=O 5bd0150db986eb6a4521dc1fb29769f3 [0,1,0,0,0,0|2,0,1]=4 477 B13R1.444 CCCC(=O)CO[C@@H]1CCNC1=O 24b3f347e2c5ad7a31d14d42e69c27a0 [0,1,0,0,0,0|2,0,1]=4 478 B13R1.444 CCCC(=O)CO[C@H]1CCNC1=O 6a4addd0341d576c860c0dff4a1eb002 [0,1,0,0,0,0|2,0,1]=4 479 B13R1.444 CCCC(=O)NCC1CCNC1=O 94b0295c4ca9caf0c6e5b49c7d9f509b [0,1,0,0,0,0|2,0,1]=4 480 B13R1.444 CCCC(=S)OCN1CCCC1=O 2084b2dd051ec03c64fe570dc4181d2e [0,1,0,0,0,0|2,0,1]=4 481 B13R1.444 CCCC(C)OCC1CCCC1=O 317f7bcf854dbe8f6ad9ef50a15a29cd [0,1,0,0,0,0|1,0,2]=4 482 B13R1.444 CCCC(O)CNC1CCCC1=O 74227deac063c80db0414bcb8b160754 [0,1,0,0,0,0|1,0,2]=4 483 B13R1.444 CCCN(C)CCC1CCNC1=O 9777da1e5c1759b84dd09332d3466409 [0,1,0,0,0,0|2,0,1]=4 484 B13R1.444 CCCN(C)CCN1CCCC1=O ef44cb37d37ef524c3474dde7ebeb441 [0,1,0,0,0,0|2,0,1]=4 485 B13R1.444 CCNC(=O)CNC1CCCC1=O ab312aa57c133444fc5f8a81da2c2fe8 [0,1,0,0,0,0|2,0,0]=3 486 B13R1.444 CCNC(=O)CNC1CCNC1=O 18dd5ec5cf6862baf1cb87c385f8c9ea [0,1,0,0,0,0|3,0,0]=4 487 B13R1.444 CCNC(=O)CNC1CCSC1=O c59bf085836900552a4d2fb4025c9eb0 [0,1,0,0,0,0|3,0,0]=4 488 B13R1.444 CCNC(=O)CN[C@@H]1CCNC1=O 97ad30f0da68073910d18607653a86ae [0,1,0,0,0,0|3,0,0]=4 489 B13R1.444 CCNC(=O)CN[C@@H]1CCOC1=O 0ce9cfa07bb11449e6e0b1d8a8ac0531 [0,1,0,0,0,0|3,0,0]=4 490 B13R1.444 CCNC(=O)CN[C@H]1CCNC1=O 195bb5a37daa09382ef7bcb4df6c7db7 [0,1,0,0,0,0|3,0,0]=4 491 B13R1.444 CCNC(=O)CN[C@H]1CCOC1=O d2150cd90b2616c2691bd70745dea026 [0,1,0,0,0,0|3,0,0]=4 492 B13R1.444 CCNC(=O)COC1CCCC1=O b9f3fdc5d3c5d37088138ccce2913e47 [0,1,0,0,0,0|2,0,0]=3 493 B13R1.444 CCNC(=O)COC1CCNC1=O db37e0b9c7d8bf7446a2837ff44732ae [0,1,0,0,0,0|3,0,0]=4 494 B13R1.444 CCNC(=O)COC1CCOC1=O e1e5949a1e274ed9e8d5acef74a7be75 [0,1,0,0,0,0|3,0,0]=4 495 B13R1.444 CCNC(=O)CO[C@@H]1CCNC1=O f547d341e3a06d8153f938a32841ba18 [0,1,0,0,0,0|3,0,0]=4 496 B13R1.444 CCNC(=O)CO[C@@H]1CCOC1=O 5eb75a1ce2ace4dfc676f91b8973cb3d [0,1,0,0,0,0|3,0,0]=4 497 B13R1.444 CCNC(=O)CO[C@H]1CCNC1=O a33574d25782c0b1ce0a77db75cff629 [0,1,0,0,0,0|3,0,0]=4 498 B13R1.444 CCNC(=O)CO[C@H]1CCOC1=O ff26ef46c4ed6702bc4a94868c464a2f [0,1,0,0,0,0|3,0,0]=4 499 B13R1.444 CCOC(=O)CNC1CCCC1=O 00e01a9b1572462dfd4402d368f603d0 [0,1,0,0,0,0|2,0,0]=3 500 B13R1.444 CCOC(=O)CNC1CCNC1=O 18aa7fef0852489c7a1c02e3d01558ec [0,1,0,0,0,0|3,0,0]=4 501 B13R1.444 CCOC(=O)CNC1CCSC1=O 16f5a44fdfcbc6ab16c12bb61dbef632 [0,1,0,0,0,0|3,0,0]=4 502 B13R1.444 CCOC(=O)CN[C@@H]1CCNC1=O e2a366c366e77ca6b838eb440764a52a [0,1,0,0,0,0|3,0,0]=4 503 B13R1.444 CCOC(=O)CN[C@@H]1CCOC1=O f192654877d53c0d0d28a2c199a53275 [0,1,0,0,0,0|3,0,0]=4 504 B13R1.444 CCOC(=O)CN[C@H]1CCNC1=O 0ab9a3e21d6ec04075d92274df0103c6 [0,1,0,0,0,0|3,0,0]=4 505 B13R1.444 CCOC(=O)CN[C@H]1CCOC1=O 61f4d2a67c2c6093882d4626adb3abd5 [0,1,0,0,0,0|3,0,0]=4 506 B13R1.444 CCOC(=O)COC1CCCC1=O 1abb927ecf63fc99e9e2ef1274807c1d [0,1,0,0,0,0|2,0,0]=3 507 B13R1.444 CCOC(=O)COC1CCNC1=O 265944e25c556fd5e1b39aad89440b11 [0,1,0,0,0,0|3,0,0]=4 508 B13R1.444 CCOC(=O)COC1CCOC1=O 46e9741805c7a46323e8de70f608032f [0,1,0,0,0,0|3,0,0]=4 509 B13R1.444 CCOC(=O)CO[C@@H]1CCNC1=O 54ebe7852a0acb8295eb7a275a77ae0e [0,1,0,0,0,0|3,0,0]=4 510 B13R1.444 CCOC(=O)CO[C@@H]1CCOC1=O 27384eaa28add98d7c1b53ab28100371 [0,1,0,0,0,0|3,0,0]=4 511 B13R1.444 CCOC(=O)CO[C@H]1CCNC1=O 558efc58b958f7978837d0eb1a97e8f4 [0,1,0,0,0,0|3,0,0]=4 512 B13R1.444 CCOC(=O)CO[C@H]1CCOC1=O ea35db8403575981bc66f1e5db253c54 [0,1,0,0,0,0|3,0,0]=4 513 B13R1.444 CCOC(C)CNC1CCCC1=O 6f350e8aae0b2a74e9b56e89934c4228 [0,1,0,0,0,0|2,0,1]=4 514 B13R1.599 C#C/C(=C/COC1CCCC1=O)/C b193abf39d9bfb44f9f888ffb0203148 [0,1,0,0,0,0|1,0,2]=4 515 B13R1.599 C#C/C(=C\COC1CCCC1=O)/C 00bd2afdf06970bece691f14513db8ea [0,1,0,0,0,0|1,0,2]=4 516 B13R1.599 C=C(CC)CNCC1CCNC1=O f746a63ec04a602e12f2ae29cfcadcc5 [0,1,0,0,0,0|2,0,1]=4 517 B13R1.599 C=C(CC)COCC1CCCC1=O 475f3fe2f23c71691aa31dfcd57db1e0 [0,1,0,0,0,0|1,0,1]=3 518 B13R1.599 C=C(CC)COCC1CCNC1=O 0bddd09a8e96ca51b30415008392b854 [0,1,0,0,0,0|2,0,1]=4 519 B13R1.599 C=C(CC)COCN1CCCC1=O 1407facd8f33d6c6415afadb681bc1a2 [0,1,0,0,0,0|2,0,1]=4 520 B13R1.599 C=C(COCC1CCCC1=O)OC 856a4324fa4a18b7d6f20614c7d6d952 [0,1,0,0,0,0|2,0,1]=4 521 B13R1.599 CCC(=O)CNCC1CCNC1=O 9a2ea77dae8f80f2873eed84921bdff2 [0,1,0,0,0,0|2,0,1]=4 522 B13R1.599 CCC(=O)COCC1CCCC1=O ab24369b063c38041561b816bdd0774b [0,1,0,0,0,0|1,0,1]=3 523 B13R1.599 CCC(=O)COCC1CCNC1=O 4a25387c39202d4de15cbc053ecb7972 [0,1,0,0,0,0|2,0,1]=4 524 B13R1.599 CCC(=O)COCN1CCCC1=O 1d3a2b0f93d281b6d32aabfe8f138e51 [0,1,0,0,0,0|2,0,1]=4 525 B13R1.599 CCC(=O)NCCC1CCCN1C bbe54528e0c2a7f162ee3617bc75706c [0,1,0,0,0,0|3,0,0]=4 526 B13R1.599 CCC(=O)NCCN1CCCC1=O 44bf2332e88e369a269e4aeea96e7f49 [0,1,0,0,0,0|2,0,0]=3 527 B13R1.599 CCC(=O)NCCN1CCNC1=O 66a8ba1126d229fb171a6afafafeae2c [0,1,0,0,0,0|3,0,0]=4 528 B13R1.599 CCC(=O)NCC[C@@H]1CCCN1C f2b9984a21fcd0eeb97476acb6c583ab [0,1,0,0,0,0|3,0,0]=4 529 B13R1.599 CCC(=O)NCC[C@H]1CCCN1C efc7c88941deb60fd29044109d9794ce [0,1,0,0,0,0|3,0,0]=4 530 B13R1.599 CCC(=O)OCNC1CCNC1=O a9b9aac1c4ab71a7f5999842ed061776 [0,1,0,0,0,0|3,0,0]=4 531 B13R1.599 CCC(=O)OCNC1CCSC1=O b8c370ce05e59de1290066ebb5679cbf [0,1,0,0,0,0|3,0,0]=4 532 B13R1.599 CCC(=O)OCN[C@@H]1CCNC1=O 20ff93370b9af9144ca9e7b2ee2a9ce4 [0,1,0,0,0,0|3,0,0]=4 533 B13R1.599 CCC(=O)OCN[C@@H]1CCOC1=O 296027f73c698aed6cf8cc07e40b9aac [0,1,0,0,0,0|3,0,0]=4 534 B13R1.599 CCC(=O)OCN[C@H]1CCNC1=O 4a3839f88a38b2ad93e78ff69a8aafbd [0,1,0,0,0,0|3,0,0]=4 535 B13R1.599 CCC(=O)OCN[C@H]1CCOC1=O 62411a8abfaae0da55e83245c3db03a2 [0,1,0,0,0,0|3,0,0]=4 536 B13R1.599 CCC(=O)OCOC1CCCC1=O 7cc47c5a203167987e75e400b8a67104 [0,1,0,0,0,0|2,0,0]=3 537 B13R1.599 CCC(=O)OCOC1CCNC1=O 4f0facbccebce5e598d632a042417ad6 [0,1,0,0,0,0|3,0,0]=4 538 B13R1.599 CCC(=O)OCOC1CCOC1=O d4dcedca0869471276d864ce4416a25a [0,1,0,0,0,0|3,0,0]=4 539 B13R1.599 CCC(=O)OCO[C@@H]1CCNC1=O f907ff033ed8c824b8471effb922118c [0,1,0,0,0,0|3,0,0]=4 540 B13R1.599 CCC(=O)OCO[C@@H]1CCOC1=O c11390f4a5b8a0afba40525f72ceab5a [0,1,0,0,0,0|3,0,0]=4 541 B13R1.599 CCC(=O)OCO[C@H]1CCNC1=O 321f8c72598064ebdfb8130318721977 [0,1,0,0,0,0|3,0,0]=4 542 B13R1.599 CCC(=O)OCO[C@H]1CCOC1=O 7de8223dbbc284895802ea6bb39a1d91 [0,1,0,0,0,0|3,0,0]=4 543 B13R1.599 CCC(C)CCNC1CCCC1=O d97d13f87431886c7204153f12b10966 [0,1,0,0,0,0|1,0,2]=4 544 B13R1.599 CCC(C)CCOC1CCCC1=O 53f9ee50e502612d99cec4a8e9703426 [0,1,0,0,0,0|1,0,2]=4 545 B13R1.599 CCC(C)COCC1CCCC1=O cd7685ad9ca1c5c1e35e6c179e0216f1 [0,1,0,0,0,0|1,0,2]=4 546 B13R1.599 CCC(C)NCCC1CCNC1=O 2edca0259ae46ad969a56990c8da59fe [0,1,0,0,0,0|2,0,1]=4 547 B13R1.599 CCC(C)NCCN1CCCC1=O 33c5b5008e631df3e64e9826ee48ebae [0,1,0,0,0,0|2,0,1]=4 548 B13R1.599 CCC(C)OCCC1CCNC1=O e26e4d89a05cc3623b5d8d3a355cc942 [0,1,0,0,0,0|2,0,1]=4 549 B13R1.599 CCC(C)OCCN1CCCC1=O 4d95460880b8db12452f17ce113bce6e [0,1,0,0,0,0|2,0,1]=4 550 B13R1.599 CCC(S)CCOC1CCCC1=O 3129ef5eea515276d5ccc7c7d2f32da3 [0,1,0,0,0,0|1,0,2]=4 551 B13R1.599 CCN(C)CCCN1CCCC1=O 014b8b86ea0b57c46d4c267d4a92e56e [0,1,0,0,0,0|2,0,1]=4 552 B13R1.599 CC[C@@H](C)COCC1CCCC1=O 595c905c446eeb31d178dbe41c6ab7c0 [0,1,0,0,0,0|1,0,2]=4 553 B13R1.599 CC[C@@H](C)NCCC1CCNC1=O ef80bb1094339f7050f7c6c9a997b81b [0,1,0,0,0,0|2,0,1]=4 554 B13R1.599 CC[C@@H](C)NCCN1CCCC1=O 2c236a0f55e949be6148fe005dd4d9d2 [0,1,0,0,0,0|2,0,1]=4 555 B13R1.599 CC[C@@H](C)OCCC1CCNC1=O 3e0d37322e21fd72d4d52820b6b018bd [0,1,0,0,0,0|2,0,1]=4 556 B13R1.599 CC[C@@H](C)OCCN1CCCC1=O 591ca67ffb7f470bdb999a631aba488b [0,1,0,0,0,0|2,0,1]=4 557 B13R1.599 CC[C@H](C)CCOC1CCCC1=O 9afe166aef69de99aac3e6418020578d [0,1,0,0,0,0|1,0,2]=4 558 B13R1.599 CC[C@H](C)COCC1CCCC1=O 931ff22db67bd504dc89a771aebb268e [0,1,0,0,0,0|1,0,2]=4 559 B13R1.599 CC[C@H](C)NCCC1CCNC1=O 60bb08e1e20b06dff089239b95f0d31d [0,1,0,0,0,0|2,0,1]=4 560 B13R1.599 CC[C@H](C)NCCN1CCCC1=O 8b042fa8e8930ca304dce52a8548c56b [0,1,0,0,0,0|2,0,1]=4 561 B13R1.599 CC[C@H](C)OCCC1CCNC1=O 4a9160ecca5028011c8d776465bf778a [0,1,0,0,0,0|2,0,1]=4 562 B13R1.599 CC[C@H](C)OCCN1CCCC1=O 1964dde8189b3cd0d8fbf47c4e8ca44f [0,1,0,0,0,0|2,0,1]=4 563 B13R1.599 CNC(=O)CCNC1CCCC1=O 96f7f23ea132796494bf50d50c737cb7 [0,1,0,0,0,0|2,0,1]=4 564 B13R1.599 CNC(=O)CCOC1CCCC1=O 4438956737fe3623df47956d35ca0ae2 [0,1,0,0,0,0|2,0,1]=4 565 B13R1.599 CNC(=O)COCC1CCCC1=O a3691a42ae5d4e98445db0b51b8b2746 [0,1,0,0,0,0|2,0,1]=4 566 B13R1.599 COC(=O)CCOC1CCCC1=O 225af6256411d525bc139fe7162b1917 [0,1,0,0,0,0|2,0,1]=4 567 B13R1.599 COC(=O)COCC1CCCC1=O 7eabb6e22960d672122f4d0dad566515 [0,1,0,0,0,0|2,0,1]=4 568 B13R1.599 COC(=O)OCOC1CCCC1=O 2b591dee3ff83f2e7e35e1aca92694dd [0,1,0,0,0,0|3,0,0]=4 569 B13R1.599 O=C(CF)NCCN1CCCC1=O 24949df860c3a0a5b2522e9b51f34d18 [0,1,0,0,0,0|3,0,0]=4 570 B13R1.599 O=C(CO)NCCN1CCCC1=O ecbbf60a9d3cf30a16157951f8bb4283 [0,1,0,0,0,0|3,0,0]=4 571 B13R1.599 O=C(CS)NCCN1CCCC1=O 84e016fa393dbc99b330f777c4a2147b [0,1,0,0,0,0|3,0,0]=4 572 B13R1.654 C/C=C/C=C/COC1CCCC1=O e6c395718a2bfbafafb316242286e462 [0,1,0,0,0,0|0,0,2]=3 573 B13R1.654 C/C=C/C=C/COC1CCNC1=O a233c72b9eb4c58bc9761bcb06fe5f9a [0,1,0,0,0,0|1,0,2]=4 574 B13R1.654 C/C=C/C=C/COC1CCOC1=O 363ea257d70e0d1ef62eb0a5c4431853 [0,1,0,0,0,0|1,0,2]=4 575 B13R1.654 C/C=C/CCCOC1CCCC1=O 142ca9b35b3b0a8a6e6a1ed80e9537e3 [0,1,0,0,0,0|0,0,2]=3 576 B13R1.654 C/C=C/CCCOC1CCNC1=O 4a39c439a15ca831642a5fc9f650def5 [0,1,0,0,0,0|1,0,2]=4 577 B13R1.654 C/C=C/CCCOC1CCOC1=O f43cde0e6b28726c1b3c2b95eed6dbd9 [0,1,0,0,0,0|1,0,2]=4 578 B13R1.654 C/C=C/CCOCN1CCCC1=O 39f2f3971f1875310ff7bbfaa7d9f625 [0,1,0,0,0,0|1,0,2]=4 579 B13R1.654 C/C=C/CNCCN1CCCC1=O d1c05be57a0bceb6b81da21935aa9550 [0,1,0,0,0,0|1,0,2]=4 580 B13R1.654 C/C=C/COCCC1CCNC1=O f438cab4bc8698f7822f60af99ad5e7d [0,1,0,0,0,0|1,0,2]=4 581 B13R1.654 C/C=C/COCCN1CCCC1=O 04569287fa6bb621a2eb1edfc9734229 [0,1,0,0,0,0|1,0,2]=4 582 B13R1.654 C/C=C\CCCNC1CCNC1=O 2757d90f839679829514d1fc8ae75900 [0,1,0,0,0,0|1,0,2]=4 583 B13R1.654 C/C=C\CCCNC1CCSC1=O a3944e15bd324356c5751e0f22515120 [0,1,0,0,0,0|1,0,2]=4 584 B13R1.654 C/C=C\CCCN[C@@H]1CCNC1=O 7939c3c00ebea682484f4890111d9dbd [0,1,0,0,0,0|1,0,2]=4 585 B13R1.654 C/C=C\CCCN[C@@H]1CCOC1=O 25b10e71d7f26dc958f8f3ad7f7feac4 [0,1,0,0,0,0|1,0,2]=4 586 B13R1.654 C/C=C\CCCN[C@H]1CCNC1=O 78dd2399ce0d5a39b839b2b7ea4903f1 [0,1,0,0,0,0|1,0,2]=4 587 B13R1.654 C/C=C\CCCN[C@H]1CCOC1=O 19dcd0c0565b7f7695f1dfef5f19b8ff [0,1,0,0,0,0|1,0,2]=4 588 B13R1.654 C/C=C\CCCOC1CCCC1=O 29116f8ede01aade72f1ae3359c12247 [0,1,0,0,0,0|0,0,2]=3 589 B13R1.654 C/C=C\CCCOC1CCNC1=O 3bfdc154f824e2e9550a6ce7d1506745 [0,1,0,0,0,0|1,0,2]=4 590 B13R1.654 C/C=C\CCCOC1CCOC1=O 9dfa169faff66393b09c8dde7c2b5b76 [0,1,0,0,0,0|1,0,2]=4 591 B13R1.654 C/C=C\CCCO[C@@H]1CCNC1=O 7b3d9892ed0e3062ff85e0e68b8203ad [0,1,0,0,0,0|1,0,2]=4 592 B13R1.654 C/C=C\CCCO[C@@H]1CCOC1=O f6d8fa2b9fe6b1c52b03015180c720be [0,1,0,0,0,0|1,0,2]=4 593 B13R1.654 C/C=C\CCCO[C@H]1CCNC1=O b58ba29633d711d1bbf2473caa366eca [0,1,0,0,0,0|1,0,2]=4 594 B13R1.654 C/C=C\CCCO[C@H]1CCOC1=O 55b13a885bc2284b452a0bbfbafc532f [0,1,0,0,0,0|1,0,2]=4 595 B13R1.654 C/C=C\CNCCN1CCCC1=O 3a4f0397031936e470d120180ce66b94 [0,1,0,0,0,0|1,0,2]=4 596 B13R1.654 C/C=C\COCCC1CCNC1=O 9382c98109ab0afcbf25c066e519b574 [0,1,0,0,0,0|1,0,2]=4 597 B13R1.654 C/C=C\COCCN1CCCC1=O 9bfe08c8120f12f7af722897be1af309 [0,1,0,0,0,0|1,0,2]=4 598 B13R1.654 C=C/C=C/CCNC1CCCC1=O 7369477fc7418de2c4fff9ca88229bd9 [0,1,0,0,0,0|0,0,2]=3 599 B13R1.654 C=C/C=C/CCNC1CCNC1=O 99b460147a78eeee40c2f07de2408c2b [0,1,0,0,0,0|1,0,2]=4 600 B13R1.654 C=C/C=C/CCNC1CCOC1=O 57d3ba09e3b4b5a8186139e0dc6de407 [0,1,0,0,0,0|1,0,2]=4 601 B13R1.654 CC#CCCCOC1CCCC1=O a3b7058298f1c2bc1da348bf1472778d [0,1,0,0,0,0|0,0,3]=4 602 B13R1.654 CC/C=C/CCOC1CCCC1=O 4239fad136752ccf63ac5801089be8f0 [0,1,0,0,0,0|0,0,0]=1 603 B13R1.654 CC/C=C/CCOC1CCNC1=O 179409e302f30b0baa684e1d9f5058e3 [0,1,0,0,0,0|1,0,0]=2 604 B13R1.654 CC/C=C/CCOC1CCOC1=O d9caf9c847c6540c7d9c576a6b36352c [0,1,0,0,0,0|1,0,0]=2 605 B13R1.654 CC/C=C/CNCC1CCCC1O a923f158c371c3ce377aabaa680104d9 [0,1,0,0,0,0|0,0,2]=3 606 B13R1.654 CC/C=C/CNCC1CCCN1C 9d553ae9890001606473f49bc9c18d29 [0,1,0,0,0,0|2,0,0]=3 607 B13R1.654 CC/C=C/CNCC1CCNC1=O b32870cdc90f09881d46f31540098ef1 [0,1,0,0,0,0|1,0,0]=2 608 B13R1.654 CC/C=C/CNC[C@@H]1CCCN1C a148d12097aa3da365cee85e2d0c6498 [0,1,0,0,0,0|2,0,0]=3 609 B13R1.654 CC/C=C/CNC[C@@H]1COC[C@@H]1O dc0946c4a08062820b046ae96411c14a [0,1,0,0,0,0|1,0,2]=4 610 B13R1.654 CC/C=C/CNC[C@H]1CCCN1C ff83a82cbb15fb78b53bfb191f52249d [0,1,0,0,0,0|2,0,0]=3 611 B13R1.654 CC/C=C/COCC1=CCCC1=O eb73a27d03ff07034ef0d84f87ae1bba [0,1,0,0,0,0|0,0,2]=3 612 B13R1.654 CC/C=C/COCC1CCCC1=O 23537d3c067c36e038f04de82fbd7e8f [0,1,0,0,0,0|0,0,0]=1 613 B13R1.654 CC/C=C/COCC1CCCC1C caee133ce9b65d26b9dc189bac24a3c6 [0,1,0,0,0,0|1,0,1]=3 614 B13R1.654 CC/C=C/COCC1CCCN1C c027b97db0ddedd01af8c97b8329f70f [0,1,0,0,0,0|2,0,0]=3 615 B13R1.654 CC/C=C/COCC1CCNC1=O 5a468d5f0cbbbff5bd868dd3c1f5975c [0,1,0,0,0,0|1,0,0]=2 616 B13R1.654 CC/C=C/COCC1COCC1C 868782e47797e3c6ebc8de57e0c7a94f [0,1,0,0,0,0|2,0,1]=4 617 B13R1.654 CC/C=C/COCC1OCCC1C 37e22bd479c8838b00a9cff6ec4ad518 [0,1,0,0,0,0|2,0,1]=4 618 B13R1.654 CC/C=C/COCN1CCCC1=O a9d6113cc223e106edcee08f2bb8c95d [0,1,0,0,0,0|1,0,0]=2 619 B13R1.654 CC/C=C/COC[C@@H]1CCCN1C dbf931c679a1cf8287f88ef4a872d0b4 [0,1,0,0,0,0|2,0,0]=3 620 B13R1.654 CC/C=C/COC[C@@H]1CCC[C@H]1F ba2176b74c69b5fbb126b31e673ad6d6 [0,1,0,0,0,0|1,0,1]=3 621 B13R1.654 CC/C=C/COC[C@@H]1CCO[C@@H]1C 25fd720be0502ee73938cf58874c3fb2 [0,1,0,0,0,0|2,0,1]=4 622 B13R1.654 CC/C=C/COC[C@H]1CCCN1C 3e4a5340f202a1612915db0311590851 [0,1,0,0,0,0|2,0,0]=3 623 B13R1.654 CC/C=C\CCNC1CCCC1O 692152957f5615c70326d038217207f6 [0,1,0,0,0,0|0,0,2]=3 624 B13R1.654 CC/C=C\CCNC1CCNC1=O cb0e840e53ec8ad913317ba97103f9e3 [0,1,0,0,0,0|1,0,0]=2 625 B13R1.654 CC/C=C\CCNC1CCSC1=O 8cbcdf8f94df8de7ef2393adef487607 [0,1,0,0,0,0|1,0,0]=2 626 B13R1.654 CC/C=C\CCNC1COCC1O d787aab35be9b378d26cd2d7ddb5a20c [0,1,0,0,0,0|1,0,2]=4 627 B13R1.654 CC/C=C\CCNC1CONC1=O a6ce747917b40483fb00958de7897df0 [0,1,0,0,0,0|2,0,0]=3 628 B13R1.654 CC/C=C\CCN[C@@H]1CCC[C@@H]1O 2a12bfff18855c3bc47b0e36d21bef5d [0,1,0,0,0,0|0,0,2]=3 629 B13R1.654 CC/C=C\CCN[C@@H]1CCC[C@H]1O f1b775770eeb45c3bcfa84f50006cd0a [0,1,0,0,0,0|0,0,2]=3 630 B13R1.654 CC/C=C\CCN[C@@H]1CCNC1=O 592c5e84a790cd524d3a9588e3a965cb [0,1,0,0,0,0|1,0,0]=2 631 B13R1.654 CC/C=C\CCN[C@@H]1CCOC1=O 7468797e02a2b720d4a1a9771a2ed3e9 [0,1,0,0,0,0|1,0,0]=2 632 B13R1.654 CC/C=C\CCN[C@@H]1COC[C@@H]1O bec25df53c330707a89eecd1caad6975 [0,1,0,0,0,0|1,0,2]=4 633 B13R1.654 CC/C=C\CCN[C@@H]1COC[C@H]1O 8b6df1faec83df8d6285ffd42e1758a9 [0,1,0,0,0,0|1,0,2]=4 634 B13R1.654 CC/C=C\CCN[C@@H]1CONC1=O ce2669b87c37da397613ea8d819963e0 [0,1,0,0,0,0|2,0,0]=3 635 B13R1.654 CC/C=C\CCN[C@H]1CCC[C@@H]1O c0ea672cbf87122f967e928822c78b16 [0,1,0,0,0,0|0,0,2]=3 636 B13R1.654 CC/C=C\CCN[C@H]1CCC[C@H]1O cee555c0e0119d582b51a58fa3530b6d [0,1,0,0,0,0|0,0,2]=3 637 B13R1.654 CC/C=C\CCN[C@H]1CCNC1=O cfce13f9aba2a24381418d74ac968529 [0,1,0,0,0,0|1,0,0]=2 638 B13R1.654 CC/C=C\CCN[C@H]1CCOC1=O acf518ee4c711ecc5ef1c0376eebea30 [0,1,0,0,0,0|1,0,0]=2 639 B13R1.654 CC/C=C\CCN[C@H]1COC[C@@H]1O 16556a361cc38cf2ab109c206e5bac77 [0,1,0,0,0,0|1,0,2]=4 640 B13R1.654 CC/C=C\CCN[C@H]1COC[C@H]1F 923ec4a10ee71999aa75bc496df537b8 [0,1,0,0,0,0|2,0,1]=4 641 B13R1.654 CC/C=C\CCN[C@H]1COC[C@H]1O 682a2655d47a5bbb173fb83cfed3641f [0,1,0,0,0,0|1,0,2]=4 642 B13R1.654 CC/C=C\CCN[C@H]1CONC1=O 6d41d47d2ff79130b217637c5241da0b [0,1,0,0,0,0|2,0,0]=3 643 B13R1.654 CC/C=C\CCOC1=CCCC1=O 23ade626d789a827137b785161f97137 [0,1,0,0,0,0|0,0,2]=3 644 B13R1.654 CC/C=C\CCOC1CCC=C1Br 1f6be629a7bd9d8ef09f1b53ca32d9e4 [0,1,0,0,0,0|1,0,1]=3 645 B13R1.654 CC/C=C\CCOC1CCCC1=O e59ece57115cdfd8588305d191bfd9d8 [0,1,0,0,0,0|0,0,0]=1 646 B13R1.654 CC/C=C\CCOC1CCCC1C 2b656d8b10d291c1a65ea258dd8ec0f4 [0,1,0,0,0,0|1,0,1]=3 647 B13R1.654 CC/C=C\CCOC1CCNC1=O 1854ff71be574fb53eab21216cca9919 [0,1,0,0,0,0|1,0,0]=2 648 B13R1.654 CC/C=C\CCOC1CCOC1=O c5b526ea939b76de88465b54b002181b [0,1,0,0,0,0|1,0,0]=2 649 B13R1.654 CC/C=C\CCOC1COCC1C 4884de3e5fca9288b11fa8d081b0f036 [0,1,0,0,0,0|2,0,1]=4 650 B13R1.654 CC/C=C\CCOC1COCC1F f65328d25248f779f7f787f4e6227722 [0,1,0,0,0,0|2,0,1]=4 651 B13R1.654 CC/C=C\CCO[C@@H]1CCC[C@@H]1C 7dfd39974cb2e33a399e2d1378a84e98 [0,1,0,0,0,0|1,0,1]=3 652 B13R1.654 CC/C=C\CCO[C@@H]1CCC[C@H]1C c4c94ba8f73060bf6eb5fb8c75c26ae6 [0,1,0,0,0,0|1,0,1]=3 653 B13R1.654 CC/C=C\CCO[C@@H]1CCC[C@H]1F 0080b5a0e6576367471d2136e8cced14 [0,1,0,0,0,0|1,0,1]=3 654 B13R1.654 CC/C=C\CCO[C@@H]1CCNC1=O 8402cd9bfc7bb82535319c023834cc06 [0,1,0,0,0,0|1,0,0]=2 655 B13R1.654 CC/C=C\CCO[C@@H]1CCOC1=O 29ab8063c5616cebb9a626fe0a093255 [0,1,0,0,0,0|1,0,0]=2 656 B13R1.654 CC/C=C\CCO[C@@H]1COC[C@@H]1C 72e6a449a6a260b7d46dbbbeea8d46b2 [0,1,0,0,0,0|2,0,1]=4 657 B13R1.654 CC/C=C\CCO[C@@H]1COC[C@H]1F a310c5bc8c0661537953fd2b3cf37c85 [0,1,0,0,0,0|2,0,1]=4 658 B13R1.654 CC/C=C\CCO[C@H]1CCC[C@@H]1C 1067887e11f4bb0855984d8170957526 [0,1,0,0,0,0|1,0,1]=3 659 B13R1.654 CC/C=C\CCO[C@H]1CCC[C@H]1C 72f8d896c77a26acfe87952551ffb983 [0,1,0,0,0,0|1,0,1]=3 660 B13R1.654 CC/C=C\CCO[C@H]1CCNC1=O 8faf530b666a88b8ccbb68798fcf65ab [0,1,0,0,0,0|1,0,0]=2 661 B13R1.654 CC/C=C\CCO[C@H]1CCOC1=O 2a890484b2bd420650f60e70b769edd2 [0,1,0,0,0,0|1,0,0]=2 662 B13R1.654 CC/C=C\CCO[C@H]1COC[C@@H]1C 79af715586e4a215b55d57668cd9cc70 [0,1,0,0,0,0|2,0,1]=4 663 B13R1.654 CC/C=C\CCO[C@H]1COC[C@H]1C 336dfaef14fb30db0aea988b8cc91742 [0,1,0,0,0,0|2,0,1]=4 664 B13R1.654 CC/C=C\CCO[C@H]1COC[C@H]1F e700094527423ebad9ffbd79de1aeb91 [0,1,0,0,0,0|2,0,1]=4 665 B13R1.654 CC/C=C\COCC1COCC1C edc422a1d00d57ed607d03e62fd7d8df [0,1,0,0,0,0|2,0,1]=4 666 B13R1.654 CC/C=C\COCN1CCCC1=O cc543777150faf442f35b0e5d6c49bb6 [0,1,0,0,0,0|1,0,0]=2 667 B13R1.654 CC=C=CCCOC1CCCC1=O d6ff9fedff760d943d8ae273343dd0cb [0,1,0,0,0,0|0,0,2]=3 668 B13R1.654 CC=C=CCCOC1CCNC1=O 8822ec4b2ca0f71be7c0a520904439cc [0,1,0,0,0,0|1,0,2]=4 669 B13R1.654 CC=CC=CCOC1CCCC1=O f24f82f7468689f52290579f026d6307 [0,1,0,0,0,0|0,0,2]=3 670 B13R1.654 CC=CC=CCOC1CCNC1=O 6016ab1c181c7075d1464dccec81ad82 [0,1,0,0,0,0|1,0,2]=4 671 B13R1.654 CC=CC=CCOC1CCOC1=O e61cf778bb56394bd5f2397b87007631 [0,1,0,0,0,0|1,0,2]=4 672 B13R1.654 CC=CCCCOC1CCCC1=O 1bc3b570560f45264e683f251cf5bae7 [0,1,0,0,0,0|0,0,2]=3 673 B13R1.654 CC=CCCCOC1CCNC1=O 8d769c3e3ef09a59aefb82f98a4bee07 [0,1,0,0,0,0|1,0,2]=4 674 B13R1.654 CC=CCCCOC1CCOC1=O 20bed426debefdb2bca4ac8291f85720 [0,1,0,0,0,0|1,0,2]=4 675 B13R1.654 CC=CCNCCC1CCNC1=O a41d397ddb5fa2b56f3265a4d0f00d1f [0,1,0,0,0,0|1,0,2]=4 676 B13R1.654 CC=CCNCCN1CCCC1=O e18dc3c9cfd0d24575ae4e6a27b7af2d [0,1,0,0,0,0|1,0,2]=4 677 B13R1.654 CC=CCOCCC1CCNC1=O 9fc389eb005b85e01edffcc46a6c3053 [0,1,0,0,0,0|1,0,2]=4 678 B13R1.654 CC=CCOCCN1CCCC1=O c84215d10ac5fc67bcaddfba82e44b42 [0,1,0,0,0,0|1,0,2]=4 679 B13R1.654 CCC#CCOCN1CCCC1=O 8fc9b56c03dcd3790ebeae9e72b74bab [0,1,0,0,0,0|1,0,2]=4 680 B13R1.654 CCC/C=C/CNC1CCCC1O 4d22b3904330640ed02fe384b97c0361 [0,1,0,0,0,0|1,0,2]=4 681 B13R1.654 CCC/C=C/CNC1CCNC1=O a80078f665dd6d5ada45d50fe3134f31 [0,1,0,0,0,0|2,0,0]=3 682 B13R1.654 CCC/C=C/CNC1CCSC1=O fcc0399b54e4341b29ae64f1d829afd4 [0,1,0,0,0,0|2,0,0]=3 683 B13R1.654 CCC/C=C/CNC1CONC1=O 634dd35ee16d10554bd21c1b38f68f7c [0,1,0,0,0,0|3,0,0]=4 684 B13R1.654 CCC/C=C/CN[C@@H]1CCC[C@@H]1O 0ab3a3d91898bea652be7fa195915c91 [0,1,0,0,0,0|1,0,2]=4 685 B13R1.654 CCC/C=C/CN[C@@H]1CCC[C@H]1O 969213f44df40df0a81b65a0129bab3d [0,1,0,0,0,0|1,0,2]=4 686 B13R1.654 CCC/C=C/CN[C@@H]1CCNC1=O 3dc06c1cfa4f9d6fabe99617a0e0daab [0,1,0,0,0,0|2,0,0]=3 687 B13R1.654 CCC/C=C/CN[C@@H]1CCOC1=O c8b82109f837d0a1f157a8773fe316c9 [0,1,0,0,0,0|2,0,0]=3 688 B13R1.654 CCC/C=C/CN[C@@H]1CONC1=O 3173964e71c48aeb4383e5e626dc8df9 [0,1,0,0,0,0|3,0,0]=4 689 B13R1.654 CCC/C=C/CN[C@H]1CCC[C@@H]1O 8fab3ff19a5c520f54bac8bfad33b376 [0,1,0,0,0,0|1,0,2]=4 690 B13R1.654 CCC/C=C/CN[C@H]1CCC[C@H]1O 39915979583b1d21f779e6a96f50c85a [0,1,0,0,0,0|1,0,2]=4 691 B13R1.654 CCC/C=C/CN[C@H]1CCNC1=O d0980e84f343ca63b0f5ba590ad419fa [0,1,0,0,0,0|2,0,0]=3 692 B13R1.654 CCC/C=C/CN[C@H]1CCOC1=O 8fa8316efbe855dd62c022d9f4dc9fcc [0,1,0,0,0,0|2,0,0]=3 693 B13R1.654 CCC/C=C/CN[C@H]1CONC1=O bf1962634b71dd132235ba440f1ed519 [0,1,0,0,0,0|3,0,0]=4 694 B13R1.654 CCC/C=C/COC1=CCCC1=O db8f702142d47acfc3054968f957c4b7 [0,1,0,0,0,0|1,0,2]=4 695 B13R1.654 CCC/C=C/COC1CCC=C1Br 6b832265a4c1698b895510635508db1f [0,1,0,0,0,0|2,0,1]=4 696 B13R1.654 CCC/C=C/COC1CCCC1=O 10b59ac57edf347a6672c4b984996ba3 [0,1,0,0,0,0|1,0,0]=2 697 B13R1.654 CCC/C=C/COC1CCCC1C 71d734bbd9ca52dc73c13e5b35b59b46 [0,1,0,0,0,0|2,0,1]=4 698 B13R1.654 CCC/C=C/COC1CCNC1=O adecee725db00457e35e32614ef0cc32 [0,1,0,0,0,0|2,0,0]=3 699 B13R1.654 CCC/C=C/COC1CCOC1=O b46eb52f07b559d0d7e29b9194ca6e54 [0,1,0,0,0,0|2,0,0]=3 700 B13R1.654 CCC/C=C/CO[C@@H]1CCC[C@@H]1C a63aa3df1396a2cb16d4e208d083a0fd [0,1,0,0,0,0|2,0,1]=4 701 B13R1.654 CCC/C=C/CO[C@@H]1CCC[C@H]1C 879d50605d2dd57ef3f868c0bfeb903b [0,1,0,0,0,0|2,0,1]=4 702 B13R1.654 CCC/C=C/CO[C@@H]1CCC[C@H]1F e07a30c9ef4e2344721ca5760a5fc664 [0,1,0,0,0,0|2,0,1]=4 703 B13R1.654 CCC/C=C/CO[C@@H]1CCNC1=O 0271a41f5246dba31ded1217bffca895 [0,1,0,0,0,0|2,0,0]=3 704 B13R1.654 CCC/C=C/CO[C@@H]1CCOC1=O 54f347107b5a05dd050394f98274044c [0,1,0,0,0,0|2,0,0]=3 705 B13R1.654 CCC/C=C/CO[C@H]1CCC[C@@H]1C 0d539f571c56cb878a0afb53b11471f7 [0,1,0,0,0,0|2,0,1]=4 706 B13R1.654 CCC/C=C/CO[C@H]1CCC[C@H]1C 0567ef6e55147d793fe39e3eaca92c35 [0,1,0,0,0,0|2,0,1]=4 707 B13R1.654 CCC/C=C/CO[C@H]1CCNC1=O feaf851d23dacb376016034392950409 [0,1,0,0,0,0|2,0,0]=3 708 B13R1.654 CCC/C=C/CO[C@H]1CCOC1=O 1c4be224b62c01358bbd9238ac1a51e7 [0,1,0,0,0,0|2,0,0]=3 709 B13R1.654 CCC/C=C\CNC1CCCC1O 2f44264e858d42611df7a99d6a5bc48d [0,1,0,0,0,0|1,0,2]=4 710 B13R1.654 CCC/C=C\CNC1CCNC1=O 64867293c01d86e28b0e54db0391dd2d [0,1,0,0,0,0|2,0,0]=3 711 B13R1.654 CCC/C=C\CNC1CCSC1=O 74de359c1f4c791742d5a1cc8c2d1608 [0,1,0,0,0,0|2,0,0]=3 712 B13R1.654 CCC/C=C\CNC1CONC1=O edfbff4055831a98c1b66ffae8ba4beb [0,1,0,0,0,0|3,0,0]=4 713 B13R1.654 CCC/C=C\CN[C@@H]1CCC[C@@H]1O 904730db60d45ae526d5122e8bf2788c [0,1,0,0,0,0|1,0,2]=4 714 B13R1.654 CCC/C=C\CN[C@@H]1CCC[C@H]1O 900b9632617466a2ba1b0f9956f240eb [0,1,0,0,0,0|1,0,2]=4 715 B13R1.654 CCC/C=C\CN[C@@H]1CCNC1=O c988a0b8e4e2895cdcec90299e6f87ca [0,1,0,0,0,0|2,0,0]=3 716 B13R1.654 CCC/C=C\CN[C@@H]1CCOC1=O 89e87f03c57fae6b94da3150ab83058b [0,1,0,0,0,0|2,0,0]=3 717 B13R1.654 CCC/C=C\CN[C@@H]1CONC1=O 8f074df075ee9fcd73fe8faf44487b4a [0,1,0,0,0,0|3,0,0]=4 718 B13R1.654 CCC/C=C\CN[C@H]1CCC[C@@H]1O 4bdf6ebc4d27ac15a3f642df0c415109 [0,1,0,0,0,0|1,0,2]=4 719 B13R1.654 CCC/C=C\CN[C@H]1CCC[C@H]1O 1868bca470c8b4530f2b77521749ef3e [0,1,0,0,0,0|1,0,2]=4 720 B13R1.654 CCC/C=C\CN[C@H]1CCNC1=O d2b0efe54b294a254cfd5c5fa66e0354 [0,1,0,0,0,0|2,0,0]=3 721 B13R1.654 CCC/C=C\CN[C@H]1CCOC1=O b18adbc2c6cf3bd06d6182ba9c76ebf9 [0,1,0,0,0,0|2,0,0]=3 722 B13R1.654 CCC/C=C\CN[C@H]1CONC1=O 8175c536b4f07b54156dd8aac8a8e356 [0,1,0,0,0,0|3,0,0]=4 723 B13R1.654 CCC/C=C\COC1=CCCC1=O 243b3d917bcb7b85e79870ee0c12344b [0,1,0,0,0,0|1,0,2]=4 724 B13R1.654 CCC/C=C\COC1CCC=C1Br 5f428fe83e5678dcaf7e7a456f0bf1d8 [0,1,0,0,0,0|2,0,1]=4 725 B13R1.654 CCC/C=C\COC1CCCC1=O d478358a535dce45bb8c1c6dd235a7b8 [0,1,0,0,0,0|1,0,0]=2 726 B13R1.654 CCC/C=C\COC1CCCC1C 44d5d283bd29df485a4a939acb286b76 [0,1,0,0,0,0|2,0,1]=4 727 B13R1.654 CCC/C=C\COC1CCNC1=O 6fe80e90186d13d0b7c0c534ceb3bfe7 [0,1,0,0,0,0|2,0,0]=3 728 B13R1.654 CCC/C=C\COC1CCOC1=O 4a38fb3d45cbc31e8e27599629c67cfa [0,1,0,0,0,0|2,0,0]=3 729 B13R1.654 CCC/C=C\CO[C@@H]1CCC[C@@H]1C a9346f0ab87782b0ede7a68103d1c365 [0,1,0,0,0,0|2,0,1]=4 730 B13R1.654 CCC/C=C\CO[C@@H]1CCC[C@H]1C bea6c6ce7da5513bd502c886ba11b208 [0,1,0,0,0,0|2,0,1]=4 731 B13R1.654 CCC/C=C\CO[C@@H]1CCC[C@H]1F 33725bc80fbb5185c0ddb943253021b5 [0,1,0,0,0,0|2,0,1]=4 732 B13R1.654 CCC/C=C\CO[C@@H]1CCNC1=O 003f8400d2c118e5f688153e01b80454 [0,1,0,0,0,0|2,0,0]=3 733 B13R1.654 CCC/C=C\CO[C@@H]1CCOC1=O e716b2cf89be20b2db5bf7300e129356 [0,1,0,0,0,0|2,0,0]=3 734 B13R1.654 CCC/C=C\CO[C@H]1CCC[C@@H]1C 7eaa80addf5df22164401b813ebbad2b [0,1,0,0,0,0|2,0,1]=4 735 B13R1.654 CCC/C=C\CO[C@H]1CCC[C@H]1C 81e1976dcf57d142596416cf8e927175 [0,1,0,0,0,0|2,0,1]=4 736 B13R1.654 CCC/C=C\CO[C@H]1CCNC1=O f0dacdc016876f19ec9766358ebd51e9 [0,1,0,0,0,0|2,0,0]=3 737 B13R1.654 CCC/C=C\CO[C@H]1CCOC1=O d5cb922bb7a889d4cace1348aaafab38 [0,1,0,0,0,0|2,0,0]=3 738 B13R1.654 CCCCCCNC1CCCC1=O 9aaa4842f54b623dbfcfa28f84cbdb5f [0,1,0,0,0,0|0,0,2]=3 739 B13R1.654 CCCCCCNC1CCNC1=O 16856d3d3df2d9be3ddfc491c1bdee7a [0,1,0,0,0,0|1,0,2]=4 740 B13R1.654 CCCCCCNC1CCSC1=O 21124f9e5f6235e2c2caf5ef90af9619 [0,1,0,0,0,0|1,0,2]=4 741 B13R1.654 CCCCCCN[C@@H]1CCNC1=O b8bbe5a20407f3d9a35edd11f58d0c3e [0,1,0,0,0,0|1,0,2]=4 742 B13R1.654 CCCCCCN[C@@H]1CCOC1=O 9a949eebaeaa55ab73d8dd7129aa98d4 [0,1,0,0,0,0|1,0,2]=4 743 B13R1.654 CCCCCCN[C@H]1CCNC1=O 7df3bb6a3ac9f4a1ce86fcb5af56758f [0,1,0,0,0,0|1,0,2]=4 744 B13R1.654 CCCCCCN[C@H]1CCOC1=O 601339c92ed17b576b2ee00fa96d9f99 [0,1,0,0,0,0|1,0,2]=4 745 B13R1.654 CCCCCCOC1CCCC1=O a80a907d7b308c299bf8963f1fc533f6 [0,1,0,0,0,0|0,0,2]=3 746 B13R1.654 CCCCCCOC1CCNC1=O 0e334ced1b35f427edba3ba495bb8575 [0,1,0,0,0,0|1,0,2]=4 747 B13R1.654 CCCCCCO[C@@H]1CCNC1=O 6341aabeee636475721c11c098a03416 [0,1,0,0,0,0|1,0,2]=4 748 B13R1.654 CCCCCCO[C@H]1CCNC1=O 9e893d48def4b2a5b4cbaaa5d1ec7c51 [0,1,0,0,0,0|1,0,2]=4 749 B13R1.654 CCCCCNCC1CCNC1=O 757e47334be5e25ea16149b8fe155409 [0,1,0,0,0,0|1,0,2]=4 750 B13R1.654 CCCCCNCN1CCCC1=O ce958428a47e330d7f7ea95696d0816d [0,1,0,0,0,0|1,0,2]=4 751 B13R1.654 CCCCCOCC1CCCC1=O 104901fda33a6643c41dd04ffbd9fb98 [0,1,0,0,0,0|0,0,2]=3 752 B13R1.654 CCCCCOCC1CCNC1=O 0c538d4aaac264ab5d0ad53796975c02 [0,1,0,0,0,0|1,0,2]=4 753 B13R1.654 CCCCCOCN1CCCC1=O a063628a62e843e83537e2a5d2c51174 [0,1,0,0,0,0|1,0,2]=4 754 B13R1.654 CCCCNCCC1CCNC1=O 7e866dffb97fd80c3daf712d94a2879f [0,1,0,0,0,0|1,0,2]=4 755 B13R1.654 CCCCNCCN1CCCC1=O 2f916736fbe3a26f1b8bcc1a542dff04 [0,1,0,0,0,0|1,0,2]=4 756 B13R1.654 CCCCOCCC1CCNC1=O 94ecb7254df4b907df7d798115cb9781 [0,1,0,0,0,0|1,0,2]=4 757 B13R1.654 CCCCOCCN1CCCC1=O 87529874594d37e8a517768706195be7 [0,1,0,0,0,0|1,0,2]=4 758 B13R1.654 CCCNCCCN1CCCC1=O e1c0c29a95ab9f9b5ec7297da26b3375 [0,1,0,0,0,0|1,0,2]=4 759 B13R1.654 CCCOCCCN1CCCC1=O 3df14e28adc2d611343c155cf62188a3 [0,1,0,0,0,0|1,0,2]=4 760 B13R1.654 CCCOCCNC1CCCC1=O cceee1e3aae6774181d6ef8335d2a5d0 [0,1,0,0,0,0|1,0,1]=3 761 B13R1.654 CCCOCCNC1CCNC1=O 72b83b86725a786bd954e40a8b32fa50 [0,1,0,0,0,0|2,0,1]=4 762 B13R1.654 CCCOCCNC1CCSC1=O 296cb24176501e2a6555530485dd6740 [0,1,0,0,0,0|2,0,1]=4 763 B13R1.654 CCCOCCN[C@@H]1CCNC1=O 9abe79d48ae3ccabdfd7f1874f50cfb2 [0,1,0,0,0,0|2,0,1]=4 764 B13R1.654 CCCOCCN[C@H]1CCNC1=O e77031c9b1fccdbb9f95e93542289241 [0,1,0,0,0,0|2,0,1]=4 765 B13R1.654 CCCOCCOC1CCCC1=O f375f43a90eef1795d74d5f5bbe68fe0 [0,1,0,0,0,0|1,0,1]=3 766 B13R1.654 CCCOCCOC1CCNC1=O a281678fcbf51a8fd8a6ab3907d6fbf4 [0,1,0,0,0,0|2,0,1]=4 767 B13R1.654 CCCOCCOC1CCOC1=O edba185c63f3c5122d4aec95e0d0abc5 [0,1,0,0,0,0|2,0,1]=4 768 B13R1.654 CCCOCCO[C@@H]1CCNC1=O 68901702b4177d993f3c589b3e20cb95 [0,1,0,0,0,0|2,0,1]=4 769 B13R1.654 CCCOCCO[C@@H]1CCOC1=O cd7974eb85d362fc75b59d442bf3505b [0,1,0,0,0,0|2,0,1]=4 770 B13R1.654 CCCOCCO[C@H]1CCNC1=O 6b7ee957ed93f6062b66ff810999906e [0,1,0,0,0,0|2,0,1]=4 771 B13R1.654 CCCOCCO[C@H]1CCOC1=O 08ec1be27264af618a55caabd5a813a4 [0,1,0,0,0,0|2,0,1]=4 772 B13R1.654 CCCSCCOC1CCCC1=O f625ec796c9ffe90f7175ac228942f36 [0,1,0,0,0,0|1,0,1]=3 773 B13R1.654 CCCSCCOC1CCNC1=O e79f9a6ac4d2f093e70d2101742ce211 [0,1,0,0,0,0|2,0,1]=4 774 B13R1.654 CCOCCCNC1CCCC1=O a075a7ed749cfcc9e05fcfe23b9c9d73 [0,1,0,0,0,0|1,0,1]=3 775 B13R1.654 CCOCCCNC1CCNC1=O 8cd891982d27b5722aea48086dee2ad6 [0,1,0,0,0,0|2,0,1]=4 776 B13R1.654 CCOCCCNC1CCSC1=O f33c648cd78136ea6e65a55e4e0310dd [0,1,0,0,0,0|2,0,1]=4 777 B13R1.654 CCOCCCN[C@@H]1CCNC1=O 323c806a3b180c44ce7a642b05d5da83 [0,1,0,0,0,0|2,0,1]=4 778 B13R1.654 CCOCCCN[C@@H]1CCOC1=O f3a3e2746a32af0bbfd88927428325dc [0,1,0,0,0,0|2,0,1]=4 779 B13R1.654 CCOCCCN[C@H]1CCNC1=O 87d98ac10a991c10e15717b2e36afe3b [0,1,0,0,0,0|2,0,1]=4 780 B13R1.654 CCOCCCN[C@H]1CCOC1=O f993e56a821a69c9adc8d62133369286 [0,1,0,0,0,0|2,0,1]=4 781 B13R1.654 CCOCCCOC1CCCC1=O ac23c3eaa7699b136b284a11ae0c019c [0,1,0,0,0,0|1,0,1]=3 782 B13R1.654 CCOCCCOC1CCNC1=O 1ba72d3cf1ec346138887cce0202856e [0,1,0,0,0,0|2,0,1]=4 783 B13R1.654 CCOCCCOC1CCOC1=O 7cdf36d80d66ecc9830f5e2081005724 [0,1,0,0,0,0|2,0,1]=4 784 B13R1.654 CCOCCCO[C@@H]1CCNC1=O 7937a5464768db6457c9ea8f14d1be2e [0,1,0,0,0,0|2,0,1]=4 785 B13R1.654 CCOCCCO[C@@H]1CCOC1=O 8ff038ba8bace2a1712fa282dbb7a6e9 [0,1,0,0,0,0|2,0,1]=4 786 B13R1.654 CCOCCCO[C@H]1CCNC1=O 66d0617543a1302642952afb7b35d28f [0,1,0,0,0,0|2,0,1]=4 787 B13R1.654 CCOCCCO[C@H]1CCOC1=O c91335dd86ee8477a9f91791188a48f1 [0,1,0,0,0,0|2,0,1]=4 788 B13R1.654 CCOCCNCC1CCNC1=O 77d5cbbcdce58758f2e73162aab11daa [0,1,0,0,0,0|2,0,1]=4 789 B13R1.654 CCOCCNCN1CCCC1=O a1ad88f8815f916be7a319d24d1db709 [0,1,0,0,0,0|2,0,1]=4 790 B13R1.654 CCOCCOCC1CCCC1=O ca11f5d1e6036189f7fc4da6689f9019 [0,1,0,0,0,0|1,0,1]=3 791 B13R1.654 CCOCCOCC1CCNC1=O cff31970093d29789cbd0bc59c63b73b [0,1,0,0,0,0|2,0,1]=4 792 B13R1.654 CCOCCOCN1CCCC1=O 56487f38b1604ceee442b190bc0894f6 [0,1,0,0,0,0|2,0,1]=4 793 B13R1.654 CCOCNCCN1CCCC1=O e3eded81583c63e9bd089b9e864ad50b [0,1,0,0,0,0|2,0,1]=4 794 B13R1.654 CCOCOCCC1CCNC1=O 8dd13badd5dffc17c48b44ef1b5d7c11 [0,1,0,0,0,0|2,0,1]=4 795 B13R1.654 CCOCOCCN1CCCC1=O 7ec8735d505512e2f04b7c1386ed6007 [0,1,0,0,0,0|2,0,1]=4 796 B13R1.654 CCSCCCNC1CCNC1=O 963a971649d11971597ca2285c5338d1 [0,1,0,0,0,0|2,0,1]=4 797 B13R1.654 CCSCCCNC1CCSC1=O 285d2b359ba6666af93eb6c5a0b8c44f [0,1,0,0,0,0|2,0,1]=4 798 B13R1.654 CCSCCCN[C@@H]1CCNC1=O c776411cb9b96c4e18a83108e5310744 [0,1,0,0,0,0|2,0,1]=4 799 B13R1.654 CCSCCCN[C@@H]1CCOC1=O 1bffb09611640561351a0a820b203d85 [0,1,0,0,0,0|2,0,1]=4 800 B13R1.654 CCSCCCN[C@H]1CCNC1=O 37464ef77d32520e3caa4335032884e6 [0,1,0,0,0,0|2,0,1]=4 801 B13R1.654 CCSCCCN[C@H]1CCOC1=O 3e63415dfe40aa1a69093d0677992e70 [0,1,0,0,0,0|2,0,1]=4 802 B13R1.654 CCSCCCOC1CCCC1=O 915da654bd6eca37377a342c2d5bd41b [0,1,0,0,0,0|1,0,1]=3 803 B13R1.654 CCSCCCOC1CCNC1=O 707f4e421a3fc8ff3d595ce2daf06839 [0,1,0,0,0,0|2,0,1]=4 804 B13R1.654 CCSCCCO[C@@H]1CCNC1=O a395556035783d4c9480c86a78202223 [0,1,0,0,0,0|2,0,1]=4 805 B13R1.654 CCSCCCO[C@H]1CCNC1=O 6caa846417307e55deab98801705a8c9 [0,1,0,0,0,0|2,0,1]=4 806 B13R1.654 CCSCCNCC1CCNC1=O e3c616553831931cefdfb5ed6951eb17 [0,1,0,0,0,0|2,0,1]=4 807 B13R1.654 CCSCCNCN1CCCC1=O 6e557e776b335e3af4382c6bb4c4912b [0,1,0,0,0,0|2,0,1]=4 808 B13R1.654 CCSCCOCC1CCCC1=O fe3e82b100a35cfe4a7952a2d2c6837a [0,1,0,0,0,0|1,0,1]=3 809 B13R1.654 CCSCCOCC1CCNC1=O 6081d11ff61a3bd560a376e7c632d520 [0,1,0,0,0,0|2,0,1]=4 810 B13R1.654 CCSCCOCN1CCCC1=O 021cf7669922cd91f0014ac96f8a7434 [0,1,0,0,0,0|2,0,1]=4 811 B13R1.654 COCCCCOC1CCCC1=O b232363afc1b497adedd746c29af68cd [0,1,0,0,0,0|1,0,2]=4 812 B13R1.654 COCCCOCC1CCCC1=O 6df9515e5acaeb94d8eb21ab8e53375d [0,1,0,0,0,0|1,0,2]=4 813 B13R1.654 COCCNCCC1CCNC1=O 479cb4e0bee5bc47392b2b9411e88c92 [0,1,0,0,0,0|2,0,1]=4 814 B13R1.654 COCCNCCN1CCCC1=O 19df68695209748f077029ccaee11621 [0,1,0,0,0,0|2,0,1]=4 815 B13R1.654 COCCOCCC1CCNC1=O b52d3127da3511c5ce8b557f19249d37 [0,1,0,0,0,0|2,0,1]=4 816 B13R1.654 COCCOCCN1CCCC1=O d4c8f733ef352c68d296549b75363dca [0,1,0,0,0,0|2,0,1]=4 817 B13R1.654 COCCOCOC1CCCC1=O 0ebcbbfd7398bf4b27f73f76739087e1 [0,1,0,0,0,0|2,0,1]=4 818 B13R1.654 COCNCCCN1CCCC1=O a8a947d76f00124ff3f287bc94c3d6cb [0,1,0,0,0,0|2,0,1]=4 819 B13R1.654 COCOCCCN1CCCC1=O 6241af1a1c0c3522fe0965c3f58b6ecc [0,1,0,0,0,0|2,0,1]=4 820 B13R1.654 COCOCCOC1CCCC1=O f438b55e22ccb5128875329b4ee2051a [0,1,0,0,0,0|2,0,1]=4 821 B13R1.654 CSCCCCNC1CCCC1=O ad4c8bf9b67c528ab6d8af337cde404f [0,1,0,0,0,0|1,0,2]=4 822 B13R1.654 CSCCCCOC1CCCC1=O 901ebafc72bde61b086f6425bd60e144 [0,1,0,0,0,0|1,0,2]=4 823 B13R1.654 CSCCCOCC1CCCC1=O 8f0b004aa15ed47f6455603e792520d2 [0,1,0,0,0,0|1,0,2]=4 824 B13R1.654 CSCCNCCC1CCNC1=O a0f5b052ae4e404f113270d17318b730 [0,1,0,0,0,0|2,0,1]=4 825 B13R1.654 CSCCNCCN1CCCC1=O f14d0f17a95a1c8b5e0dfd7e77a091e6 [0,1,0,0,0,0|2,0,1]=4 826 B13R1.654 CSCCOCCC1CCNC1=O d5818280bd32298bf514a40092eb60a5 [0,1,0,0,0,0|2,0,1]=4 827 B13R1.654 CSCCOCCN1CCCC1=O d6a4efdf9372d71e983e65fef89da679 [0,1,0,0,0,0|2,0,1]=4 828 B13R1.654 CSCNCCCN1CCCC1=O 55c267f48eb0811e0d5f7bb60bc96219 [0,1,0,0,0,0|2,0,1]=4 829 B13R1.654 CSCOCCCN1CCCC1=O af49e2adb4daba4a1f391bba6790ff8e [0,1,0,0,0,0|2,0,1]=4 830 B13R1.654 N#CC=CCNCC1CCNC1=O 6772c5912b8c1df2c8d6db2cc8ceeacd [0,1,0,0,0,0|2,0,1]=4 831 B13R1.654 N#CC=CCOCC1CCCC1=O 77f66a11ec4301d77ce432290d7d9219 [0,1,0,0,0,0|1,0,1]=3 832 B13R1.654 N#CC=CCOCC1CCNC1=O 08d305cb3b69a770a62ab71bf2fdfffc [0,1,0,0,0,0|2,0,1]=4 833 B13R1.654 N#CC=CCOCN1CCCC1=O d2fbf9d98f677f5778f57b04757ca373 [0,1,0,0,0,0|2,0,1]=4 834 B13R1.654 O=C/C=C/COCN1CCCC1=O 7294094c6dcfc094aa281692dc187947 [0,1,0,0,0,0|2,0,1]=4 835 B13R1.654 O=C1CCCC1COCCCCF 72b07d679d44442044909edb80715b91 [0,1,0,0,0,0|1,0,2]=4 836 B13R1.654 O=C1CCCC1NCCCCCCl 7a7314d449eab7a3d0d0afff9e76e59a [0,1,0,0,0,0|1,0,2]=4 837 B13R1.654 O=C1CCCC1NCCCCCO 67ee2e07626d95c2c1fb9341633e8e61 [0,1,0,0,0,0|1,0,2]=4 838 B13R1.654 O=C1CCCC1NCCOCCO d1c63639f7e5d96ab0553529df0a53be [0,1,0,0,0,0|2,0,1]=4 839 B13R1.654 O=C1CCCC1NCCOCCS 77c17e214ab719cd7ed7749bec81cc47 [0,1,0,0,0,0|2,0,1]=4 840 B13R1.654 O=C1CCCC1NCCSCCO 6fd7bcd9b6eb586c37e7fe848e656d93 [0,1,0,0,0,0|2,0,1]=4 841 B13R1.654 O=C1CCCC1OCCCCCF 78408163d0cff7d9b5a3544411fde5d7 [0,1,0,0,0,0|1,0,2]=4 842 B13R1.654 O=C1CCCC1OCCOCCF 6debcec4c507670ea232749f26070503 [0,1,0,0,0,0|2,0,1]=4 843 B13R1.654 O=C1CCCC1OCCOCCS 0c501e030838128bb7e4cc086a608a1a [0,1,0,0,0,0|2,0,1]=4 844 B13R1.654 O=C1CCCN1CCCNCCBr 2bb29d222e9062dcade7b3472ab3625c [0,1,0,0,0,0|2,0,1]=4 845 B13R1.654 O=C1CCCN1CCCNCCF f93795e5bfc22bd5f8a9170d64fb997d [0,1,0,0,0,0|2,0,1]=4 846 B13R1.654 O=C1CCCN1CCCNCCI 85fafe9557b14fdaab604ededa85d6f7 [0,1,0,0,0,0|2,0,1]=4 847 B13R1.654 O=C1CCCN1CCCNCCO 29777d72c5c869c39ae31ae70362ebd6 [0,1,0,0,0,0|2,0,1]=4 848 B13R1.654 O=C1CCCN1CCCNCCS d5395b78535ba91ddf22a3e41198b898 [0,1,0,0,0,0|2,0,1]=4 849 B13R1.654 O=C1CCCN1CCCOCCF 49d18b1ae70554eb76c6c932bf92c844 [0,1,0,0,0,0|2,0,1]=4 850 B13R1.654 O=C1CCCN1CCCOCCS 0cf144e2178077090af713afec7e8841 [0,1,0,0,0,0|2,0,1]=4 851 B13R1.654 O=C1CCCN1CCNCCCCl f4bfcc0781621909fa47ef82de72ef84 [0,1,0,0,0,0|2,0,1]=4 852 B13R1.654 O=C1CCCN1CCNCCCF cb165e5c337ed7943f55d4eceee6b050 [0,1,0,0,0,0|2,0,1]=4 853 B13R1.654 O=C1CCCN1CCNCCCO dc5120156c73c85214823a5fd7c5ef7f [0,1,0,0,0,0|2,0,1]=4 854 B13R1.654 O=C1CCCN1CCNCCCS 01505221707560a3e278df68bd3e4ac1 [0,1,0,0,0,0|2,0,1]=4 855 B13R1.654 O=C1CCCN1CCOCCCF 41b3d6df3d214b52aa7dd6a41b73eb32 [0,1,0,0,0,0|2,0,1]=4 856 B13R1.654 O=C1CCCN1CCOCCCS cfae43a0f68f52b21c047c15ae3f0a3a [0,1,0,0,0,0|2,0,1]=4 857 B13R1.654 O=C1NCCC1CCNCCCCl 75d87dba7cbc88208ea5e5fda284e5a6 [0,1,0,0,0,0|2,0,1]=4 858 B13R1.654 O=C1NCCC1CCNCCCO 17e7c4f90aaea384e685786c5b31ea77 [0,1,0,0,0,0|2,0,1]=4 859 B13R1.654 O=C1NCCC1CCOCCCF f6bf52e5cf8b21abc4a7ee9a7b72c023 [0,1,0,0,0,0|2,0,1]=4 860 B13R1.654 O=C1NCCC1CCOCCCS 7669dd9c8bdb5527027bb2debb030e0c [0,1,0,0,0,0|2,0,1]=4 861 B13R1.686 CC/C=C/C(=O)NC1CCNC1=O 8726d1d5272e82eff0a1ffe020e4d42d [0,1,0,0,0,0|2,0,1]=4 862 B13R1.686 CC/C=C/C(=O)NC1CCSC1=O 85fbe51079e2a71227b977cdef619bfb [0,1,0,0,0,0|2,0,1]=4 863 B13R1.686 CC/C=C/C(=O)N[C@@H]1CCNC1=O ba77076feb15a9c50fed5ad43c720565 [0,1,0,0,0,0|2,0,1]=4 864 B13R1.686 CC/C=C/C(=O)N[C@@H]1CCOC1=O b84ca92b073c495288d5a26101ab8579 [0,1,0,0,0,0|2,0,1]=4 865 B13R1.686 CC/C=C/C(=O)N[C@H]1CCNC1=O 985e0daf5647f63e29374b531620ece2 [0,1,0,0,0,0|2,0,1]=4 866 B13R1.686 CC/C=C/C(=O)N[C@H]1CCOC1=O 39fa8a9d61ffd1b368c9a711bd3fd6f9 [0,1,0,0,0,0|2,0,1]=4 867 B13R1.686 CC/C=C\C(=O)NC1CCNC1=O 0fcfa76735cfaf1b7ba191a962766840 [0,1,0,0,0,0|2,0,1]=4 868 B13R1.686 CC/C=C\C(=O)NC1CCSC1=O 2ad93eddacb7d659218e831ab6dd43e2 [0,1,0,0,0,0|2,0,1]=4 869 B13R1.686 CC/C=C\C(=O)N[C@@H]1CCNC1=O f99a2b7fff2f64b16141872bd4d39924 [0,1,0,0,0,0|2,0,1]=4 870 B13R1.686 CC/C=C\C(=O)N[C@@H]1CCOC1=O ac595faf2c5ac96e6a3cb4ba90d2413f [0,1,0,0,0,0|2,0,1]=4 871 B13R1.686 CC/C=C\C(=O)N[C@H]1CCNC1=O b376b38fa58d89a2992a1ae873c92684 [0,1,0,0,0,0|2,0,1]=4 872 B13R1.686 CC/C=C\C(=O)N[C@H]1CCOC1=O 3d024a13821e80120a75d9411184ba49 [0,1,0,0,0,0|2,0,1]=4 873 B13R1.686 CCC=CC(=O)NC1CCNC1=O 8f7489f97dd103377f9ef2600bdc12d3 [0,1,0,0,0,0|2,0,1]=4 874 B13R1.686 CCC=CC(=O)NC1CCSC1=O 57c9bf63d75b2ba333872a2d35a4ef42 [0,1,0,0,0,0|2,0,1]=4 875 B13R1.686 CCC=CC(=O)N[C@@H]1CCNC1=O 9b4bb75cd32bad79ea65e71cdce368e8 [0,1,0,0,0,0|2,0,1]=4 876 B13R1.686 CCC=CC(=O)N[C@@H]1CCOC1=O 3c35d0cada52052630e7a64a79d257e5 [0,1,0,0,0,0|2,0,1]=4 877 B13R1.686 CCC=CC(=O)N[C@H]1CCNC1=O b92588aa02f9c89bf83be8f073a0c545 [0,1,0,0,0,0|2,0,1]=4 878 B13R1.686 CCC=CC(=O)N[C@H]1CCOC1=O 708610ee6996802a10dc25bd6122b801 [0,1,0,0,0,0|2,0,1]=4 879 B13R1.686 CCCCC(C)NC1CCCC1=O 0ed1eec14d74c225b52593f8f740ba96 [0,1,0,0,0,0|1,0,2]=4 880 B13R1.686 CCCC[C@@H](C)NC1CCCC1=O 12ed469dda8001465857e298a392860c [0,1,0,0,0,0|1,0,2]=4 881 B13R1.686 CCCNC(=O)CC1CCCC1=O a74ce9cfd59cbd7359d3989d85ae6105 [0,1,0,0,0,0|1,0,2]=4 882 B13R1.725 CC/C=C/CN(C)[C@@H]1CCC[C@@H]1O 4e8cbd3c2c735d2861a1f82971b5f778 [0,1,0,0,0,0|1,0,2]=4 883 B13R1.725 CC/C=C/CN(C)[C@@H]1CCC[C@H]1O bf6839726a4bb2cc1756e1f51055f31e [0,1,0,0,0,0|1,0,2]=4 884 B13R1.725 CC/C=C/CN(C)[C@H]1CCC[C@H]1O 4986bf18ccefa14667914d5f109829aa [0,1,0,0,0,0|1,0,2]=4 885 B13R1.1133 CC/C=C/CN[C@@H]1C(=O)NC[C@H]1O c9495c0e3f20423bd5bdc3b5d0042c8c [0,1,0,0,0,0|2,0,0]=3 886 B13R1.1133 CC/C=C/COC1=C(CCC1=O)C d4c653806ae7a13420375d2035aa866b [0,1,0,0,0,0|1,0,2]=4 887 B13R1.1133 CC/C=C/COC1C(=O)CCC1=O 89e3076a7c70c80d75eb2f03690e5f73 [0,1,0,0,0,0|1,0,1]=3 888 B13R1.1133 CC/C=C/COC1C(=O)COC1=O d977407da32715b9fe34f36948d6f149 [0,1,0,0,0,0|2,0,1]=4 889 B13R1.1133 CC/C=C\CCN1C(CCC1C)C 8ddc7a9418e10e5afb0dce6933999bf9 [0,1,0,0,0,0|2,0,1]=4 890 B13R1.1133 CC/C=C\CCN1[C@@H](CC[C@@H]1C)C ab51c892b4e35c8c0287387c82043e03 [0,1,0,0,0,0|2,0,1]=4 891 B13R1.1133 CC/C=C\CCN1[C@@H](CC[C@H]1C)C 0bdd3ab96e418525f9c52ade877fceeb [0,1,0,0,0,0|2,0,1]=4 892 B13R1.1133 CC/C=C\CCN1[C@H](CC[C@@H]1C)C 101a90a82eb61c1574a72a4a201b5e50 [0,1,0,0,0,0|2,0,1]=4 893 B13R1.1133 CC/C=C\COC1C(=O)CCC1=O fc190601c0a41c851a09e58dc93fb5e1 [0,1,0,0,0,0|1,0,1]=3 894 B13R1.1133 CC/C=C\COC1C(=O)COC1=O cfaa60b287dfc0e812a2131dc8251f4f [0,1,0,0,0,0|2,0,1]=4 895 B13R1.3440 CC/C=C/CNC1CCN(C1=O)C 0c3190216cabf401cd814a507d7e0360 [0,1,0,0,0,0|2,0,0]=3 896 B13R1.3440 CC/C=C/CNC1CCN(C1=O)O 5bb3f6419e1913d80dcd71195ce2a99b [0,1,0,0,0,0|2,0,0]=3 897 B13R1.3440 CC/C=C/CN[C@@H]1CCN(C1=O)C cd860952a148c3f21ea1122a63ad2e1d [0,1,0,0,0,0|2,0,0]=3 898 B13R1.3440 CC/C=C/CN[C@@H]1CCN(C1=O)O a211b28459e2057019cce9aabadf9421 [0,1,0,0,0,0|2,0,0]=3 899 B13R1.3440 CC/C=C/CN[C@H]1CCN(C1=O)C 7848e2e7e925786b0505a47044c95e56 [0,1,0,0,0,0|2,0,0]=3 900 B13R1.3440 CC/C=C/COC1CCN(C1=O)C 66af4f600f284bf64ed8dfb164be9108 [0,1,0,0,0,0|2,0,0]=3 901 B13R1.3440 CC/C=C/CO[C@@H]1CCN(C1=O)C 69f8809db312006d7b689e3182f2aaa4 [0,1,0,0,0,0|2,0,0]=3 902 B13R1.3440 CC/C=C\CCN1CCC(C1C)O d02bf6d6440df5a4206d2abe743db645 [0,1,0,0,0,0|2,0,1]=4 903 B13R1.3440 CC/C=C\CCN1CC[C@@H]([C@@H]1C)O 765eb2d4ee8d7dd88c06aee932fccb18 [0,1,0,0,0,0|2,0,1]=4 904 B13R1.3440 CC/C=C\CCN1CC[C@H]([C@H]1C)O 0dd2c957cacb40ef3f0d282eddc3c808 [0,1,0,0,0,0|2,0,1]=4 905 B13R1.3440 CC/C=C\COC1CCN(C1=O)C b8b07956f917d9f76fc3e279d18f9405 [0,1,0,0,0,0|2,0,0]=3 906 B13R1.4964 C/C=C/COCC1(CCCC1=O)C 8b07dbcd1636d21a3328f83f07cd592a [0,1,0,0,0,0|1,0,2]=4 907 B13R1.4964 C/C=C\COCC1(CCCC1=O)C 1557d152a4c05faac9e49cca3ebb7006 [0,1,0,0,0,0|1,0,2]=4 908 B13R1.4964 CC/C=C/CNC1(CCNC1=O)C 11697877f57e3aec940a1596b7855a66 [0,1,0,0,0,0|2,0,0]=3 909 B13R1.4964 CCCCOCC1(CCCC1=O)C 45d480d890aac01fa7efe71cada50d16 [0,1,0,0,0,0|1,0,2]=4 910 B11R0.3 C#CCCCCNC/C=C/CC deecd7dfa261d67bbb0c4b202db049e0 [0,0,1,0,0,0|2,0,1]=4 911 B11R0.3 C#CCCCCOC/C=C/CC e59a87ddfb4986ee1722bfdf044974fb [0,0,1,0,0,0|2,0,1]=4 912 B11R0.3 C#CCCCCOC/C=C\CC f91f7f045c232e729b90d067d873a275 [0,0,1,0,0,0|2,0,1]=4 913 B11R0.3 C#CCCCNCC/C=C\CC 3cd5459a1996863d4d020afe594ae379 [0,0,1,0,0,0|2,0,1]=4 914 B11R0.3 C#CCCCOCC/C=C/CC 6bc38f56792f3234470150204fc3bfef [0,0,1,0,0,0|2,0,1]=4 915 B11R0.3 C#CCCCOCC/C=C\CC 9b65faf9da063b37e8c4f0e66f4e1b83 [0,0,1,0,0,0|2,0,1]=4 916 B11R0.3 C#CCCOCCC/C=C\CC 0ce8e18b36b20c77e6c9ef977f962bae [0,0,1,0,0,0|2,0,1]=4 917 B11R0.3 C#CCOCCCC/C=C\CC 5f898bf087bac08db3649c86663ef173 [0,0,1,0,0,0|2,0,1]=4 918 B11R0.3 C/C=C/C=C/COCCCC=O 20b1ea00443f11fb867cc0e8a89b8419 [0,0,1,0,0,0|1,0,2]=4 919 B11R0.3 C/C=C/CCCOC/C=C/CC f60ba0ca7f4a653f0f0e5278ba414d9e [0,0,1,0,0,0|2,0,1]=4 920 B11R0.3 C/C=C/CCCOCCCC=O 7bcb0e0439cb2196243206e1ea6c159e [0,0,1,0,0,0|1,0,2]=4 921 B11R0.3 C/C=C/CCOCC/C=C\CC 130e75a457431060e807634c54ca368d [0,0,1,0,0,0|2,0,1]=4 922 B11R0.3 C/C=C/CCOCCCCC=O 6101818191c9a7a26ef7914bc4455eae [0,0,1,0,0,0|1,0,2]=4 923 B11R0.3 C/C=C/COCCC/C=C\CC ac0f77a7991921eea704a62a28f6be03 [0,0,1,0,0,0|2,0,1]=4 924 B11R0.3 C/C=C/COCCCCCC=O d4e9745163301d7b8e112f407d05beae [0,0,1,0,0,0|1,0,2]=4 925 B11R0.3 C/C=C\CCCOC/C=C/CC 46fd824f62ded9cde8e6ce13aaed782e [0,0,1,0,0,0|2,0,1]=4 926 B11R0.3 C/C=C\CCCOC/C=C\CC bd67041b899a2d720f48f667feb7725c [0,0,1,0,0,0|2,0,1]=4 927 B11R0.3 C/C=C\CCCOCCCC=O 07250c98eb751e21f337b02d3011f463 [0,0,1,0,0,0|1,0,2]=4 928 B11R0.3 C/C=C\COCCC/C=C\CC 1c4efa5a529a4137db3baf4477fc7535 [0,0,1,0,0,0|2,0,1]=4 929 B11R0.3 C/C=C\COCCCCCC=O 561e313e5399e3b9aac96be56cb260a2 [0,0,1,0,0,0|1,0,2]=4 930 B11R0.3 C=C/C=C/CCNCCCC=O 8ae9cffad8fed316370e0af54ed52beb [0,0,1,0,0,0|1,0,2]=4 931 B11R0.3 C=CCCCCCCCOCC ed14b0620af6de10a0e50df9aa44f9c3 [0,0,1,0,0,0|2,0,1]=4 932 B11R0.3 C=CCCCCCCNCCC a40bb91c630069b9a44746e8fb1ba5be [0,0,1,0,0,0|2,0,1]=4 933 B11R0.3 C=CCCCCCCOCCC af0fc2056d78c68262c9655cb905d458 [0,0,1,0,0,0|2,0,1]=4 934 B11R0.3 C=CCCCCNC/C=C/CC 9b71a28a1e520b8ca8349a8752d85022 [0,0,1,0,0,0|2,0,0]=3 935 B11R0.3 C=CCCCCOC/C=C/CC a0f385f2bffeec3770e35d3d37482130 [0,0,1,0,0,0|2,0,0]=3 936 B11R0.3 C=CCCCCOC/C=C\CC d1d7d2a2b454aa57361a60a489e4b18e [0,0,1,0,0,0|2,0,0]=3 937 B11R0.3 C=CCCCNCC/C=C\CC d03dad19c52f20b6243913828e440b50 [0,0,1,0,0,0|2,0,0]=3 938 B11R0.3 C=CCCCOCC/C=C/CC 1f450e7ca7b65d300cb21122a428399c [0,0,1,0,0,0|2,0,0]=3 939 B11R0.3 C=CCCCOCC/C=C\CC e23031b9cc28cc8c778a8a97ebb1b9b8 [0,0,1,0,0,0|2,0,0]=3 940 B11R0.3 C=CCCOCCC/C=C\CC ac91f7a1770420c0b0c2a17c914981fc [0,0,1,0,0,0|2,0,0]=3 941 B11R0.3 C=CCOCCCC/C=C\CC d84fc03c3f74cdecd791c42a556adf15 [0,0,1,0,0,0|2,0,0]=3 942 B11R0.3 C=CCOCCOC/C=C/CC 6271b7ffba5f3772e6b8ecb6c1ba1f21 [0,0,1,0,0,0|3,0,0]=4 943 B11R0.3 C=CCOCCOC/C=C\CC 31bc4971f0f67716a76a9d8e4aa94a77 [0,0,1,0,0,0|3,0,0]=4 944 B11R0.3 C=COCCCNC/C=C/CC 149708665ed18e53067444c1c7c27ee3 [0,0,1,0,0,0|3,0,0]=4 945 B11R0.3 C=COCCNCC/C=C\CC 9754600cdca151beed17e64a3b046c06 [0,0,1,0,0,0|3,0,0]=4 946 B11R0.3 C=COCCOCC/C=C\CC 0bdafb7e20fcc0001dd6ee9a2f00156f [0,0,1,0,0,0|3,0,0]=4 947 B11R0.3 CC/C=C/CCOCCCC#N 0e70b981d7441d01ebb742447c5be12b [0,0,1,0,0,0|2,0,1]=4 948 B11R0.3 CC/C=C/CCOCCCC=O 79e09c746fec07f02c875cafd0d74dfe [0,0,1,0,0,0|1,0,0]=2 949 B11R0.3 CC/C=C/CCOCCCCC b53d7a6c46eb728d1471fa5f092df813 [0,0,1,0,0,0|2,0,1]=4 950 B11R0.3 CC/C=C/CCOCCCCF db27d0c9635d0c213d73aac13911a160 [0,0,1,0,0,0|2,0,1]=4 951 B11R0.3 CC/C=C/CCOCCCOC bb57789fef830566880a8c794032bf0d [0,0,1,0,0,0|3,0,0]=4 952 B11R0.3 CC/C=C/CCOCCCSC 39df8352e504f047e1955c139750b56a [0,0,1,0,0,0|3,0,0]=4 953 B11R0.3 CC/C=C/CNCCCCC#N e2e6292c9df6c8b664613c501b7148b6 [0,0,1,0,0,0|2,0,1]=4 954 B11R0.3 CC/C=C/CNCCCCCC 4ea6a89a67bd880060b4122692e295c2 [0,0,1,0,0,0|2,0,1]=4 955 B11R0.3 CC/C=C/CNCCCCCCl a505ead9b9085cdca2d3a3f992727599 [0,0,1,0,0,0|2,0,1]=4 956 B11R0.3 CC/C=C/CNCCCCCO 11c74b6eec366a8c158ee3c9d35eee5f [0,0,1,0,0,0|1,0,2]=4 957 B11R0.3 CC/C=C/CNCCCCOC 90e8540c5abae5652417534f34909d2a [0,0,1,0,0,0|3,0,0]=4 958 B11R0.3 CC/C=C/CNCCCCSC f16892310e3b9547746ac40140d79e59 [0,0,1,0,0,0|3,0,0]=4 959 B11R0.3 CC/C=C/COCCCCC#N 52e781753fc1b11ed357442a69f8017c [0,0,1,0,0,0|2,0,1]=4 960 B11R0.3 CC/C=C/COCCCCC=O 506cc39572219735fcb7f1d39b2d0883 [0,0,1,0,0,0|1,0,0]=2 961 B11R0.3 CC/C=C/COCCCCCC eb90121bb3484ddc510c42f4817c7d41 [0,0,1,0,0,0|2,0,1]=4 962 B11R0.3 CC/C=C/COCCCCCF 7b75038d11bb46fe8e249d2dcb96fcd6 [0,0,1,0,0,0|2,0,1]=4 963 B11R0.3 CC/C=C/COCCCCOC e7c3d87b782983344570a27572ffbf26 [0,0,1,0,0,0|3,0,0]=4 964 B11R0.3 CC/C=C/COCCCCSC 091663aae70043d65b211f8f597d86e9 [0,0,1,0,0,0|3,0,0]=4 965 B11R0.3 CC/C=C/COCCOCC=O 44fab10886deaa0dd7af98f5b0a42821 [0,0,1,0,0,0|2,0,0]=3 966 B11R0.3 CC/C=C\CCCCCNC#N 5c1b3d22ecb43ea2b1809d0bc78c8228 [0,0,1,0,0,0|2,0,1]=4 967 B11R0.3 CC/C=C\CCCCCOCC 3fcd157868f9d6a02a7d59a5bad0c445 [0,0,1,0,0,0|2,0,1]=4 968 B11R0.3 CC/C=C\CCCCCOCF 88c2314ac1477d9cbb27a282088e0e9c [0,0,1,0,0,0|2,0,1]=4 969 B11R0.3 CC/C=C\CCCCOCC#N 7fc7337b00c4b59f33d6280d96e5f3fc [0,0,1,0,0,0|2,0,1]=4 970 B11R0.3 CC/C=C\CCCCOCC=O b5f80b1483dedcb31839f7941e987188 [0,0,1,0,0,0|1,0,0]=2 971 B11R0.3 CC/C=C\CCCCOCCC b91b66aedbd8d3f44f429a8b1d860578 [0,0,1,0,0,0|2,0,1]=4 972 B11R0.3 CC/C=C\CCCCOCCF 4a4cbf595b7e51561611f5e4cde6e72e [0,0,1,0,0,0|2,0,1]=4 973 B11R0.3 CC/C=C\CCCCOCCS 4cd0bb21ea6d9c8fe3cd6b7f5ee9b92c [0,0,1,0,0,0|1,1,1]=4 974 B11R0.3 CC/C=C\CCCCOCOC 04af3dae1c0d7b437217da0b40b08b0e [0,0,1,0,0,0|3,0,0]=4 975 B11R0.3 CC/C=C\CCCCOCSC b552717453d997ad0b5d699c8715cdd6 [0,0,1,0,0,0|3,0,0]=4 976 B11R0.3 CC/C=C\CCCOC/C=C/Cl c4a1bd1965512e83caa8abb70051fee6 [0,0,1,0,0,0|2,0,1]=4 977 B11R0.3 CC/C=C\CCCOC/C=C\Cl e705403b592d8ce3c8ebc83142cba563 [0,0,1,0,0,0|2,0,1]=4 978 B11R0.3 CC/C=C\CCCOCCC#N 2c5a60c3ad9c63b35b764782a7fb7c85 [0,0,1,0,0,0|2,0,1]=4 979 B11R0.3 CC/C=C\CCCOCCC=O 741499873b60375251ed2f97fbdcc1a0 [0,0,1,0,0,0|1,0,0]=2 980 B11R0.3 CC/C=C\CCCOCCCC 4cdaf8803428e2d9f645148af5a0d0b2 [0,0,1,0,0,0|2,0,1]=4 981 B11R0.3 CC/C=C\CCCOCCCF 98835682c1129b1c7916d471184b4885 [0,0,1,0,0,0|2,0,1]=4 982 B11R0.3 CC/C=C\CCCOCCCS 665272f90257bf8bbc1f5634ba395f6f [0,0,1,0,0,0|1,1,1]=4 983 B11R0.3 CC/C=C\CCCOCCOC b1bbbe91f93c611f79d8b0fb289f6aad [0,0,1,0,0,0|3,0,0]=4 984 B11R0.3 CC/C=C\CCCOCCSC 0d602f7c41af76f66157c88769ec6ec6 [0,0,1,0,0,0|3,0,0]=4 985 B11R0.3 CC/C=C\CCNCCCC#N 9ac42a748b33c26bd36b0f25de5b09d7 [0,0,1,0,0,0|2,0,1]=4 986 B11R0.3 CC/C=C\CCNCCCCC ca3a0d15ea7c79f615890d56cab14290 [0,0,1,0,0,0|2,0,1]=4 987 B11R0.3 CC/C=C\CCNCCCCCl dda2a530611fdbf5cddb0da844142b75 [0,0,1,0,0,0|2,0,1]=4 988 B11R0.3 CC/C=C\CCNCCCCO 8f9446d6f8c1d403a5239feba0633bcf [0,0,1,0,0,0|1,0,2]=4 989 B11R0.3 CC/C=C\CCNCCCCS 41e22787e6bd684e714fb3824d1a92b3 [0,0,1,0,0,0|1,1,1]=4 990 B11R0.3 CC/C=C\CCNCCCOC 38419656a7bfb9551b88b8ef34315094 [0,0,1,0,0,0|3,0,0]=4 991 B11R0.3 CC/C=C\CCNCCCSC 093fb32e4e5e7565a978551e5033c7ed [0,0,1,0,0,0|3,0,0]=4 992 B11R0.3 CC/C=C\CCOC/C=C/C=O f1c60130363257e354eb44ee0f654b7c [0,0,1,0,0,0|1,0,2]=4 993 B11R0.3 CC/C=C\CCOCCCC#N 6f51585e5cf231cccdf7e8868b34a8e6 [0,0,1,0,0,0|2,0,1]=4 994 B11R0.3 CC/C=C\CCOCCCC=O d9f9e81c0e1218665dea141d10997379 [0,0,1,0,0,0|1,0,0]=2 995 B11R0.3 CC/C=C\CCOCCCCC 26ad29cfc366b08d786d9b655a0964e4 [0,0,1,0,0,0|2,0,1]=4 996 B11R0.3 CC/C=C\CCOCCCCF 3fd058640593676b2194ed4dd999eb72 [0,0,1,0,0,0|2,0,1]=4 997 B11R0.3 CC/C=C\CCOCCCCS 85bb847715880a394fd78eea2b3c923b [0,0,1,0,0,0|1,1,1]=4 998 B11R0.3 CC/C=C\CCOCCCOC 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CC=CCCCOC/C=C/CC bfd53d4eead7d06756a4c323beeabeaa [0,0,1,0,0,0|2,0,1]=4 1011 B11R0.3 CC=CCCCOCCCC=O de5095d65c7ef50436cd82d28dece0dc [0,0,1,0,0,0|1,0,2]=4 1012 B11R0.3 CC=CCNCCCCCC=O d5b11777982cc0778e5c44030b28be26 [0,0,1,0,0,0|1,0,2]=4 1013 B11R0.3 CC=CCOCCCCCC=O 593c902611cc57a64bfe84343d2aa1d0 [0,0,1,0,0,0|1,0,2]=4 1014 B11R0.3 CCC#CCCOCCCC=O 29bede86558c08b637fc4d71373fe9e4 [0,0,1,0,0,0|1,0,2]=4 1015 B11R0.3 CCC#CCOCCCCC=O 22187454d8110a759711d6dd8bc5ecab [0,0,1,0,0,0|1,0,2]=4 1016 B11R0.3 CCC/C=C/CCCOCC=O 80b0453301dde9f22c59a805454d1105 [0,0,1,0,0,0|1,0,2]=4 1017 B11R0.3 CCC/C=C/COCCCC=O 68fa2dbb50a3d6a5fa866aec83a64e72 [0,0,1,0,0,0|1,0,2]=4 1018 B11R0.3 CCC/C=C\CCCOCC=O 46aaea05e98f74a03f8a24aa62e33886 [0,0,1,0,0,0|1,0,2]=4 1019 B11R0.3 CCC/C=C\CCOCCC=O d4f37345b92910f6955592ce6a7812ec [0,0,1,0,0,0|1,0,2]=4 1020 B11R0.3 CCC/C=C\COCCCC=O a84ae4db9b72baac18c30307a69923a7 [0,0,1,0,0,0|1,0,2]=4 1021 B11R0.3 CCC=CCCCCCOCC acb4ebc5d4b9da3999d78f72f192ac9b [0,0,1,0,0,0|2,0,1]=4 1022 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CCCNCCCCCCC=O c21851ba291c00a5db0d5d6b91dbd36c [0,0,1,0,0,0|1,0,1]=3 1035 B11R0.3 CCCOCCCCCCC=O 94f0c4ecacac557229497fd5ef55ea31 [0,0,1,0,0,0|1,0,1]=3 1036 B11R0.3 CCCOCCCNCCC=O 190496854629812b57ad087982f6cd3b [0,0,1,0,0,0|2,0,1]=4 1037 B11R0.3 CCCOCCCOCCC=O 9ea405398ef924e3d18013f743b35505 [0,0,1,0,0,0|2,0,1]=4 1038 B11R0.3 CCCOCCNCCCC=O 367befcb66d3e5dd9daa0507bec3d17f [0,0,1,0,0,0|2,0,1]=4 1039 B11R0.3 CCCOCCOCCCC=O ea74ad93f7f42fe064b37576b5f19dee [0,0,1,0,0,0|2,0,1]=4 1040 B11R0.3 CCCSCCCCNCC=O 70ab921c7b3edcf680852892631c7a93 [0,0,1,0,0,0|2,0,1]=4 1041 B11R0.3 CCCSCCOCCCC=O 600c33f2feed5a99f1ab4bbaa43a3bd1 [0,0,1,0,0,0|2,0,1]=4 1042 B11R0.3 CCOCCCNCCCC=O 542b1613ecfee7b742cfddac50e7e775 [0,0,1,0,0,0|2,0,1]=4 1043 B11R0.3 CCOCCCOCCCC=O 059d31c5447ede56a7b0d577b20a2e41 [0,0,1,0,0,0|2,0,1]=4 1044 B11R0.3 CCOCCNCCCCC=O 0d9a7feea148a34ff8c8ffe115bb2069 [0,0,1,0,0,0|2,0,1]=4 1045 B11R0.3 CCOCCOCCCCC=O 09c87bf7ea35bea11e509e5060aab89b [0,0,1,0,0,0|2,0,1]=4 1046 B11R0.3 CCSCCCCNCCC=O 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[0,0,1,0,0,0|2,0,1]=4 1093 B11R0.4 CCCOCCCC(=O)OCC 44f3c08715c24b28a3685ca7f9c36e30 [0,0,1,0,0,0|2,0,1]=4 1094 B11R0.4 CCCOCCNC(=O)CCC 95c055b4347bfd7bfa9c570d9719ea75 [0,0,1,0,0,0|2,0,1]=4 1095 B11R0.4 CCCOCCOC(=O)CCC 94efe85d85fae3af0976a73792f0222f [0,0,1,0,0,0|2,0,1]=4 1096 B11R0.4 CCOCCCCC(=O)OCC dff7da0a71f6e7070ea70a6d5afe214a [0,0,1,0,0,0|2,0,1]=4 1097 B11R0.76 CC/C=C/CNC(CC)C(=O)N e3de91bb2cce2dc72857607d609ffcf2 [0,0,1,0,0,0|2,0,0]=3 1098 B11R0.76 CC/C=C/CNC(CC)C(=O)O 9a4c6ad3ba63dc9bc830f6107c7252e7 [0,0,1,0,0,0|2,0,0]=3 1099 B11R0.76 CC/C=C/CNC(CC)C(C)C 5117b53fa3f4fb6647fe327f5e9b6837 [0,0,1,0,0,0|2,0,1]=4 1100 B11R0.76 CC/C=C/CNC(CCl)C(=O)O 1411b21cc53cd6e5f0f58a0a6c85c5b5 [0,0,1,0,0,0|3,0,0]=4 1101 B11R0.76 CC/C=C/CNC(CF)C(=O)O a87955fcdd83050558d13b5e22eb588f [0,0,1,0,0,0|3,0,0]=4 1102 B11R0.76 CC/C=C/CNC(CO)C(=O)N 0b6316ad332dd4e8eedbf0ebe2a29df1 [0,0,1,0,0,0|3,0,0]=4 1103 B11R0.76 CC/C=C/CNC(CO)C(=O)O 4ff011bea9c8f5178fb1faa08f223e28 [0,0,1,0,0,0|3,0,0]=4 1104 B11R0.76 CC/C=C/CNC(CS)C(=O)O 1ac40c6020fbd1f946bfb2c89f96c3a0 [0,0,1,0,0,0|3,0,0]=4 1105 B11R0.76 CC/C=C/CN[C@@H](CC)C(=O)N 37ffc1d12dce7d262ce2a50f1b63f215 [0,0,1,0,0,0|2,0,0]=3 1106 B11R0.76 CC/C=C/CN[C@@H](CC)C(=O)O 8df3b8e3a6f3d23549eb0c4b4304c09a [0,0,1,0,0,0|2,0,0]=3 1107 B11R0.76 CC/C=C/CN[C@@H](CC)[C@@H](C)O 2a06a070213992aa53d0fcc5044d1319 [0,0,1,0,0,0|1,0,2]=4 1108 B11R0.76 CC/C=C/CN[C@@H](CCl)C(=O)O 6712eaca90883666c7b1f459ece7565a [0,0,1,0,0,0|3,0,0]=4 1109 B11R0.76 CC/C=C/CN[C@@H](CO)C(=O)N de3fbe389cf7276882dafd88b5d8e6a9 [0,0,1,0,0,0|3,0,0]=4 1110 B11R0.76 CC/C=C/CN[C@@H](CO)C(=O)O b056ba9db0cd720ef3672c3389b77cc2 [0,0,1,0,0,0|3,0,0]=4 1111 B11R0.76 CC/C=C/CN[C@@H](CS)C(=O)O a5beb3a1fadc906249b53cdf5ab73740 [0,0,1,0,0,0|3,0,0]=4 1112 B11R0.76 CC/C=C/CN[C@H](CC)C(=O)O a1b42a96e2f8e235b6d8a990592479d0 [0,0,1,0,0,0|2,0,0]=3 1113 B11R0.76 CC/C=C/CN[C@H](CC)[C@@H](C)O 527949f7c7fb192c5a4db066277409ef [0,0,1,0,0,0|1,0,2]=4 1114 B11R0.76 CC/C=C/CN[C@H](CC)[C@H](C)O db2e39d9afae7617e85ecef18d2a7c09 [0,0,1,0,0,0|1,0,2]=4 1115 B11R0.76 CC/C=C/CN[C@H](CCl)C(=O)O 3150ee54418ee522bea723f16e9436a1 [0,0,1,0,0,0|3,0,0]=4 1116 B11R0.76 CC/C=C/CN[C@H](CO)C(=O)O cad2532e0b413a3a69d2f44655ff74d9 [0,0,1,0,0,0|3,0,0]=4 1117 B11R0.76 CC/C=C/CN[C@H](CS)C(=O)O f3b93d39633576c073610b7963ef845b [0,0,1,0,0,0|3,0,0]=4 1118 B11R0.76 CC/C=C/COC(CC)C(=O)N a2408a112365ea56dad4f68d082b738d [0,0,1,0,0,0|2,0,0]=3 1119 B11R0.76 CC/C=C/COC(CC)C(=O)O b1f60295d84eb0aaaecd37525e107e3a [0,0,1,0,0,0|2,0,0]=3 1120 B11R0.76 CC/C=C/COC(CC)C(C)C 799ad9d4696dcb6286a109fccd5478a5 [0,0,1,0,0,0|2,0,1]=4 1121 B11R0.76 CC/C=C/COC(CF)C(=O)O 2396ada4196fc123eda1b8fef30b27aa [0,0,1,0,0,0|3,0,0]=4 1122 B11R0.76 CC/C=C/CO[C@@H](CC)C(=O)O 71a4438a2fac2f92dd81946cdaa8526e [0,0,1,0,0,0|2,0,0]=3 1123 B11R0.76 CC/C=C/CO[C@H](CC)C(=O)O ab1b965bf641a0d0a64fa67fb4ec7f17 [0,0,1,0,0,0|2,0,0]=3 1124 B11R0.76 CC/C=C/CO[C@H](CF)C(=O)O 57a252177830f81f8afecfbe3ba119ae [0,0,1,0,0,0|3,0,0]=4 1125 B11R0.76 CC/C=C\CCN(CC)C(C)C 6c4ca8b65736a55dd326fa59dc575bba [0,0,1,0,0,0|2,0,1]=4 1126 B11R0.76 CC/C=C\COC(CC)C(=O)N f0f3a7878a92353d848ec9dd1f260ab8 [0,0,1,0,0,0|2,0,0]=3 1127 B11R0.76 CC/C=C\COC(CF)C(=O)O 9e5f4f62c2f7f54ad1213173e61ea724 [0,0,1,0,0,0|3,0,0]=4 1128 B11R0.142 C/C=C/CCOC(C)C(=O)CC b89e6d5d68b460ebd301180bf64d57c2 [0,0,1,0,0,0|1,0,2]=4 1129 B11R0.142 CC/C=C/CNC(C)C(=O)NC aad0a2c3dd6aa5e29b481197e83916f3 [0,0,1,0,0,0|2,0,0]=3 1130 B11R0.142 CC/C=C/CNC(C)C(C)CC 6c94a2d333793dafbfbb54a4b9db9ecd [0,0,1,0,0,0|2,0,1]=4 1131 B11R0.142 CC/C=C/COC(C)C(=O)CC 0710dfbd62cf0b1125a93cf464520ce0 [0,0,1,0,0,0|1,0,0]=2 1132 B11R0.142 CC/C=C/COC(C)C(=O)NC 19437792ed1ecfa0672813b8d1cc34c8 [0,0,1,0,0,0|2,0,0]=3 1133 B11R0.142 CC/C=C/COC(C)C(=O)OC 883ddfeed9764f60736bbfdbe92c6873 [0,0,1,0,0,0|2,0,0]=3 1134 B11R0.142 CC/C=C/COC(C)C(C)CC ac0d0b11b9ca2384a20bbf29f7bba083 [0,0,1,0,0,0|2,0,1]=4 1135 B11R0.142 CC/C=C/COC(F)C(=O)NC ece45e1ff7ec5814e0bd11e7be8da4e6 [0,0,1,0,0,0|3,0,0]=4 1136 B11R0.142 CC/C=C/CO[C@@H](C)C(=O)OC 8289bc4650f51a57e2b24a429e3de164 [0,0,1,0,0,0|2,0,0]=3 1137 B11R0.142 CC/C=C/CO[C@H](C)C(=O)OC 5980fb709061ede990a575ca1a797077 [0,0,1,0,0,0|2,0,0]=3 1138 B11R0.142 CC/C=C\CCN(C)C(C)CC fc75b598f482955b4f54f65bbe7ff04d [0,0,1,0,0,0|2,0,1]=4 1139 B11R0.142 CC/C=C\COC(C)C(=O)CC 73963507c29f2774c51d8ce74b1cce64 [0,0,1,0,0,0|1,0,0]=2 1140 B11R0.142 CC/C=C\COC(C)C(=O)NC 181bfe5ee83dc00af1066aa76bd9ab12 [0,0,1,0,0,0|2,0,0]=3 1141 B11R0.142 CC/C=C\COC(C)C(=O)OC 3b12ec088f4c95b2213dcfb52ae57cc9 [0,0,1,0,0,0|2,0,0]=3 1142 B11R0.142 CC/C=C\COC(F)C(=O)NC cdce29b7232096e7c5793ce2a1f3ce40 [0,0,1,0,0,0|3,0,0]=4 1143 B11R0.142 CC/C=C\CO[C@@H](C)C(=O)OC 9d730c48039d7ab9cb4b0070fcf4f2a4 [0,0,1,0,0,0|2,0,0]=3 1144 B11R0.142 CC/C=C\CO[C@H](C)C(=O)OC 03c1b3187d820e873b0b8443a2c53b18 [0,0,1,0,0,0|2,0,0]=3 1145 B11R0.142 CCC#CCOC(C)C(=O)CC de1a2afdf9166b3515e607986300567a [0,0,1,0,0,0|1,0,2]=4 1146 B11R0.142 CCC(=O)C(C)OC/C=C/C=O aba198bc69b32781b6ef58aee84c26f5 [0,0,1,0,0,0|2,0,1]=4 1147 B11R0.142 CCCCCCN(C)C(=O)CC c25fee109e3505330a0f823c56988e5a [0,0,1,0,0,0|1,0,2]=4 1148 B11R0.142 CCCCCNC(C)C(=O)CC f08ad8041b9881421294dcf33e95a044 [0,0,1,0,0,0|1,0,2]=4 1149 B11R0.142 CCCCCOC(C)C(=O)CC e1ca68c4c69b484481885dc7e641f465 [0,0,1,0,0,0|1,0,2]=4 1150 B11R0.142 CCCNCCC(C)C(=O)OC 1c2ea45b264e72292927d13f97c0a2c0 [0,0,1,0,0,0|2,0,1]=4 1151 B11R0.142 CCCOCCC(C)C(=O)OC 16254c5922c3369c7e34436020a43f8f [0,0,1,0,0,0|2,0,1]=4 1152 B11R0.142 CCOCCNC(C)C(=O)CC e1228d4a618386a7d0687740dff08eaa [0,0,1,0,0,0|2,0,1]=4 1153 B11R0.142 CCOCCOC(C)C(=O)CC 2d410c72a3ccada8b4376b239c7d3f0d [0,0,1,0,0,0|2,0,1]=4 1154 B11R0.142 CCSCCNC(C)C(=O)CC 21ae0dab4545c2ceac8143207f8af7f5 [0,0,1,0,0,0|2,0,1]=4 1155 B11R0.142 CCSCCOC(C)C(=O)CC 04a87ea176c2366c869bb8dceb53fa5f [0,0,1,0,0,0|2,0,1]=4 1156 B11R0.161 C#CC(CCC)OC/C=C/CC e167e2b75d77696f6cab9ced38efeb7a [0,0,1,0,0,0|2,0,1]=4 1157 B11R0.161 C=CC(CCC)OC/C=C/CC 85211e77f58049f701662ccefee7f253 [0,0,1,0,0,0|2,0,0]=3 1158 B11R0.161 CC/C=C/CNC(CO)CCC 7a33325179acabcc441ddae53a98782f [0,0,1,0,0,0|1,0,2]=4 1159 B11R0.161 CC/C=C/CN[C@@H](CO)CCC e486879407104d3d9f1ffe11406edb24 [0,0,1,0,0,0|1,0,2]=4 1160 B11R0.161 CC/C=C/CN[C@H](CO)CCC 13250abc10dbaea6c45c39378bae5628 [0,0,1,0,0,0|1,0,2]=4 1161 B11R0.161 CC/C=C/COC(C#N)CCC 53d0da6c004062003ab3592fb8c56439 [0,0,1,0,0,0|2,0,1]=4 1162 B11R0.161 CC/C=C/COC(CC)CCC 1bbdcc5fca8108eeeb638fb3d78cc0fa [0,0,1,0,0,0|2,0,1]=4 1163 B11R0.161 CC/C=C/CO[C@H](CC)CCC 6235691545508d1d150e6161368964ce [0,0,1,0,0,0|2,0,1]=4 1164 B11R0.161 CC/C=C\CCN(CC)CCC dbd317682f16ec26aa2e77a8725d8aa3 [0,0,1,0,0,0|2,0,1]=4 1165 B11R0.161 CC/C=C\COC(CC)CCC 67a1a11af686676ea6e0175915509b27 [0,0,1,0,0,0|2,0,1]=4 1166 B13R2.15 O=C1CCCC1N2CCCSC2 96fe7daf3bf8755fc2e4aafa7342f39c [0,0,0,1,0,0|2,0,1]=4 1167 B13R2.15 O=C1CCCC1N2CCOCC2 65a1f08952490768fcfed6563e29c933 [0,0,0,1,0,0|2,0,1]=4 1168 B13R2.15 O=C1CCCC1N2CCSCC2 3a3d00ca431b15a3679a14962712887f [0,0,0,1,0,0|2,0,1]=4 1169 B13R2.15 O=C1NCCC1N2CC=CCC2 d3628d275b4ae97941a434ddbbd19ffe [0,0,0,1,0,0|2,0,0]=3 1170 B13R2.15 OC1CCCC1N2CC=CCC2 104108714d68fae56601a7fdee5b5dbf [0,0,0,1,0,0|1,0,2]=4 1171 B13R2.15 O[C@@H]1CCC[C@H]1N2CC=CCC2 18e95ce8202b7017bd7393a4920addb5 [0,0,0,1,0,0|1,0,2]=4 1172 B13R2.15 O[C@H]1CCC[C@@H]1N2CC=CCC2 41d828eca82f5fa742a58e8cc4aa76f9 [0,0,0,1,0,0|1,0,2]=4 1173 B13R2.29 O=C1CCCC1NC2CC=CC2 f4fd9826cee70c93a9c98e3fd2807a31 [0,0,0,1,0,0|1,0,2]=4 1174 B13R2.29 O=C1CCCC1NC2CCCC2 00adfe7c8a96616caef6275a8029c3fc [0,0,0,1,0,0|1,0,2]=4 1175 B13R2.29 O=C1CCCC1NC2CCOC2 2791465879a2e112974a0507fe8c703e [0,0,0,1,0,0|2,0,1]=4 1176 B13R2.29 O=C1CCCC1N[C@@H]2CCOC2 fdd2e2d4e356c69363165cdff9cd6529 [0,0,0,1,0,0|2,0,1]=4 1177 B13R2.29 O=C1CCCC1N[C@H]2CCOC2 4cc6aa27579b64b8ade9883ecf0358dc [0,0,0,1,0,0|2,0,1]=4 1178 B13R2.29 O=C1CCCC1OC2CCCC2 74165ea22dfbfdf8bcc49b8268b2777f [0,0,0,1,0,0|1,0,2]=4 1179 B13R2.179 CC1CC1COC2CCCC2=O 74f2965a755af79b30105853ec1215e6 [0,0,0,1,0,0|1,0,2]=4 1180 B13R2.179 C[C@@H]1C[C@H]1COC2CCCC2=O 204b8a67a61129a2ca4b62157ae7f492 [0,0,0,1,0,0|1,0,2]=4 1181 B13R2.179 C[C@H]1C[C@@H]1COC2CCCC2=O ad90df1d570aae29450433b8c2679287 [0,0,0,1,0,0|1,0,2]=4 1182 B13R2.179 C[C@H]1C[C@H]1COC2CCCC2=O 5bab64df4fef56ef3acfc4e250e74729 [0,0,0,1,0,0|1,0,2]=4 1183 B13R2.360 CC1OCC1NC2CCCC2=O d7ff1b31afd0ddb4f1cec8abf3816b94 [0,0,0,1,0,0|2,0,1]=4 1184 B13R2.360 CC1OCC1OC2CCCC2=O d045a8ed8a54cfe716deebd915067e30 [0,0,0,1,0,0|2,0,1]=4 1185 B13R2.360 C[C@@H]1CC[C@@H]1NC2CCCC2=O 7e21e0ab940e222bdef535b0c53d040b [0,0,0,1,0,0|1,0,2]=4 1186 B13R2.360 C[C@@H]1CC[C@H]1NC2CCCC2=O 4e60ec1786c32bc34d1c4abe42235082 [0,0,0,1,0,0|1,0,2]=4 1187 B13R2.515 CCCNC1CC2CC1OC2=O f84f20a647c246ec19e0c68e218cb9b1 [0,0,0,1,0,0|2,0,1]=4 1188 B13R2.653 CCC1CCN1C2CCCC2=O 2ff4d592a33c8a6f7fcbbd98ed5102b8 [0,0,0,1,0,0|1,0,2]=4 1189 B13R2.701 CC/C=C/CN1CC2C1CCC2 765a3b381167260cabb71c944be1ebd6 [0,0,0,1,0,0|2,0,1]=4 1190 B13R2.701 CC/C=C/CN1C[C@H]2[C@@H]1CCC2 0fb51b1b1686ce0eb4865610a54a730b [0,0,0,1,0,0|2,0,1]=4 1191 B13R2.1227 CC/C=C\CCN1CC2CC1C2 95b53a989ef97618f8cf54cbc8e6f294 [0,0,0,1,0,0|2,0,1]=4 1192 B13R2.3140 O=C1CCCC1COCC2CC2 fb1f286ad5cb0c3ea3096c37135735f2 [0,0,0,1,0,0|1,0,2]=4 1193 B13R2.3140 O=C1CCCC1NCCN2CC2 fad9752d8902c1427b5198e2af0e4fd6 [0,0,0,1,0,0|2,0,1]=4 1194 B13R2.3140 O=C1CCCC1OCCC2CC2 0ad59a1dc0b7615b5aeed805f9cf2b44 [0,0,0,1,0,0|1,0,2]=4 1195 B13R2.3140 O=C1CCCC1OCCN2CC2 b159347cc63fd78e0449e759084ee5b0 [0,0,0,1,0,0|2,0,1]=4 1196 B13R2.3140 O=C1CCCN1CCNC2CC2 13fc11df3f4ed986c1009a1f6c1b4927 [0,0,0,1,0,0|2,0,1]=4 1197 B13R2.3140 O=C1CCCN1CCOC2CC2 6661a01b79473ef9201aa2db25b90396 [0,0,0,1,0,0|2,0,1]=4 1198 B13R2.3140 O=C1NCCC1CCNC2CC2 1899fbddea98a2ccf4d5181718771b85 [0,0,0,1,0,0|2,0,1]=4 1199 B13R2.3140 O=C1NCCC1CCOC2CC2 eae732df6baa577257f477b4102f5ce5 [0,0,0,1,0,0|2,0,1]=4 1200 B13R2.3152 O=C1CCCC1COC2CCC2 ec3ce5a0defe21c4f5b965f89160200d [0,0,0,1,0,0|1,0,2]=4 1201 B13R2.3152 O=C1CCCC1NCC2CCC2 47690df9b4125cabe20745923f1e53a1 [0,0,0,1,0,0|1,0,2]=4 1202 B13R2.3152 O=C1CCCC1NCC2CCO2 155f7e002e888fd4076811798a8e99fd [0,0,0,1,0,0|2,0,1]=4 1203 B13R2.3152 O=C1CCCC1NC[C@@H]2CCO2 8f1717015eb3c0de7a5958a555a4fd8a [0,0,0,1,0,0|2,0,1]=4 1204 B13R2.3152 O=C1CCCC1NC[C@H]2CCO2 48c72d5a5833822c23d2b3f61dee8376 [0,0,0,1,0,0|2,0,1]=4 1205 B13R2.3152 O=C1CCCC1OCC2CCC2 d80adb3e30d74330dd4521d8aa9fc427 [0,0,0,1,0,0|1,0,2]=4 1206 B13R2.3152 O=C1CCCC1OCC2CCO2 ad972aa400323d09cac6665db6f81c51 [0,0,0,1,0,0|2,0,1]=4 1207 B13R2.3152 O=C1CCCC1OC[C@@H]2CCO2 901148e65d6715387d029e415d179b11 [0,0,0,1,0,0|2,0,1]=4 1208 B13R2.3152 O=C1CCCC1OC[C@H]2CCO2 e7ec5e91e6000bf067d02cae0d8263b5 [0,0,0,1,0,0|2,0,1]=4 1209 B13R2.3152 O=C1CCCN1CCN2CCC2 94c014cab6336389d7c5b44df1850a7b [0,0,0,1,0,0|2,0,1]=4 1210 B13R2.3152 O=C1NCCC1CCN2CCC2 d6942498121bbff457e912e88e72b0bf [0,0,0,1,0,0|2,0,1]=4 1211 B13R2.3194 CC/C=C/COC1CCC2C1C2 d21584c8f87d7919fd884631cb87744c [0,0,0,1,0,0|2,0,1]=4 1212 B13R2.3194 CC/C=C/CO[C@@H]1CC[C@@H]2[C@H]1C2 354812f8368dd1abd8cb3b1c0b8340d8 [0,0,0,1,0,0|2,0,1]=4 1213 B13R2.3194 CC/C=C\CCN1CCC2C1C2 73ba4c85d8d2032a003d56b4047a38fa [0,0,0,1,0,0|2,0,1]=4 1214 B11R1.190 C/C=C/CCOC1CCC1=O 00fa01ee56ab6f284f3a4f1494b1ff04 [0,0,0,0,1,0|1,0,2]=4 1215 B11R1.190 C/C=C/COCC1CCC1=O c3964fef8d88eb93937a166a85e4bc6d [0,0,0,0,1,0|1,0,2]=4 1216 B11R1.190 C/C=C\COCC1CCC1=O c8a52460603782996c9a3f97941c40b7 [0,0,0,0,1,0|1,0,2]=4 1217 B11R1.190 CC/C=C/CNC1CCC1F 4e505ed6b2325fce7758123b26eb60a1 [0,0,0,0,1,0|2,0,1]=4 1218 B11R1.190 CC/C=C/CNC1CCC1O e11d5d56851f044c6113905135287a11 [0,0,0,0,1,0|1,0,2]=4 1219 B11R1.190 CC/C=C/CN[C@@H]1CC[C@@H]1O 1943e041ead5f8ce421d0ef94422709a [0,0,0,0,1,0|1,0,2]=4 1220 B11R1.190 CC/C=C/CN[C@@H]1CC[C@H]1C 1faad789915f89670e5991a75456bc8e [0,0,0,0,1,0|2,0,1]=4 1221 B11R1.190 CC/C=C/CN[C@@H]1CC[C@H]1O 7a05c1fe1b208e1d098044c8bae7d4a1 [0,0,0,0,1,0|1,0,2]=4 1222 B11R1.190 CC/C=C/CN[C@H]1CC[C@@H]1O 99d52512f00717d58059fe304233b1e5 [0,0,0,0,1,0|1,0,2]=4 1223 B11R1.190 CC/C=C/CN[C@H]1CC[C@H]1C 69586106f34ad43fe495d59a38d2961e [0,0,0,0,1,0|2,0,1]=4 1224 B11R1.190 CC/C=C/CN[C@H]1CC[C@H]1O 63b86854ab22a4f48045e6fa907fa668 [0,0,0,0,1,0|1,0,2]=4 1225 B11R1.190 CC/C=C/CN[C@H]1CNC1=O c05709a37e4f8698f820087246803249 [0,0,0,0,1,0|2,0,0]=3 1226 B11R1.190 CC/C=C/COC1CCC1=O 14312e9f37ec9002e8fb423e88f41e33 [0,0,0,0,1,0|1,0,0]=2 1227 B11R1.190 CC/C=C\COC1CCC1=O 06b7efaf2d52a7c75734f43756327448 [0,0,0,0,1,0|1,0,0]=2 1228 B11R1.190 CCCCCOC1CCC1=O 355911051df85b56020429c0f95056f7 [0,0,0,0,1,0|1,0,2]=4 1229 B11R1.190 CCCCOCC1CCC1=O f257a7edcf4781b415caf68b4efc97ae [0,0,0,0,1,0|1,0,2]=4 1230 B11R1.190 CCCNCCC1CCC1=O 0df107ac77dd6110f0f6944cef3eb9cb [0,0,0,0,1,0|1,0,1]=3 1231 B11R1.190 CCCOCCC1CCC1=O 3983d0cb93d7fc373cd10be3938cd7ef [0,0,0,0,1,0|1,0,1]=3 1232 B11R1.190 CCOCCOC1CCC1=O 9136854ec08833177fa127fa4aa2a799 [0,0,0,0,1,0|2,0,1]=4 1233 B11R1.190 CCOCOCC1CCC1=O f53c8460eb6b25ff1818c8c816e0c07f [0,0,0,0,1,0|2,0,1]=4 1234 B11R1.190 COCOCCC1CCC1=O 1b902c3135b01ed7c14160c6514c9e7d [0,0,0,0,1,0|2,0,1]=4 1235 B11R1.190 CSCOCCC1CCC1=O cd1ac41154f135523f059991ea45fe2f [0,0,0,0,1,0|2,0,1]=4 1236 B11R1.190 N#CC=CCOC1CCC1=O 3e7d2b1abf4dec2e92eb7b8cda37a6b6 [0,0,0,0,1,0|2,0,1]=4 1237 B11R1.190 O=C1CCC1CCNCCBr 5e565a732115d6aa0a2c0477c532c8da [0,0,0,0,1,0|2,0,1]=4 1238 B11R1.190 O=C1CCC1CCNCCF 7be9c3041a82e074b588945af86f0bc9 [0,0,0,0,1,0|2,0,1]=4 1239 B11R1.190 O=C1CCC1CCNCCI 666a782bf8913fd995d8c4c6babfaaed [0,0,0,0,1,0|2,0,1]=4 1240 B11R1.190 O=C1CCC1CCNCCO 701f1a99110aea4553209584f7ebc192 [0,0,0,0,1,0|2,0,1]=4 1241 B11R1.190 O=C1CCC1CCNCCS e6a5da2c89821c6db4117250b69c19f5 [0,0,0,0,1,0|2,0,1]=4 1242 B11R1.190 O=C1CCC1CCOCCF d784d851219d3287289c76aa3e37ac18 [0,0,0,0,1,0|2,0,1]=4 1243 B11R1.190 O=C1CCC1CCOCCS ad78671cf8811410842220d360daa455 [0,0,0,0,1,0|2,0,1]=4 1244 B13R1.6 C/C=C/CCOC1CCCC(=O)C1 a575d77329e2d627b8108dbbaebb79b5 [0,0,0,0,0,1|1,0,2]=4 1245 B13R1.6 C/C=C/CNCC1CCCC(=O)N1 2876dd6f42f88ba6dd4fe43c5936a38d [0,0,0,0,0,1|1,0,2]=4 1246 B13R1.6 C/C=C/COCC1CCCC(=O)C1 2e023115a1a73ff7bc644288660b55bc [0,0,0,0,0,1|1,0,2]=4 1247 B13R1.6 C/C=C/COCC1CCCC(=O)N1 40ff778ab0b8bd40c34e5ac1dc70ed1e [0,0,0,0,0,1|1,0,2]=4 1248 B13R1.6 C/C=C/COC[C@@H]1CCCC(=O)N1 3e8843f03f8ae5087dba46b570e957ff [0,0,0,0,0,1|1,0,2]=4 1249 B13R1.6 C/C=C/COC[C@H]1CCCC(=O)N1 f3b92246407481c0e7b577090bfa4860 [0,0,0,0,0,1|1,0,2]=4 1250 B13R1.6 C/C=C\CCCN1CCCC(=O)C1 44c66b4604501063e38c76f3f6750ca4 [0,0,0,0,0,1|1,0,2]=4 1251 B13R1.6 C/C=C\CNCC1CCCC(=O)N1 77b953d416e8f0e74c067b4ec7b96915 [0,0,0,0,0,1|1,0,2]=4 1252 B13R1.6 C/C=C\COCC1CCCC(=O)C1 9c43e9d3874f8ddb177de893cf8c90b0 [0,0,0,0,0,1|1,0,2]=4 1253 B13R1.6 C/C=C\COCC1CCCC(=O)N1 2c28a2ff25ac762c7a8df39cdb430955 [0,0,0,0,0,1|1,0,2]=4 1254 B13R1.6 C/C=C\COC[C@@H]1CCCC(=O)N1 f3c8e08facb73acccc0893023b18be27 [0,0,0,0,0,1|1,0,2]=4 1255 B13R1.6 C/C=C\COC[C@H]1CCCC(=O)N1 f53478b56eb99a0b4653fbeb7fa00a45 [0,0,0,0,0,1|1,0,2]=4 1256 B13R1.6 CC/C=C/CNC1CCCC(C1)C 64666cef207f98bcb46018c5bbd5765f [0,0,0,0,0,1|2,0,1]=4 1257 B13R1.6 CC/C=C/CNC1CCCC(C1)O 54a2f577de50bb95a7c48d7a7547a7be [0,0,0,0,0,1|1,0,2]=4 1258 B13R1.6 CC/C=C/CNC1CCCN(C1)C c0ec1657743b9ff2ce0bbe9c968402c3 [0,0,0,0,0,1|3,0,0]=4 1259 B13R1.6 CC/C=C/CNC1CCNC(=O)C1 b9f54517cbc503ef2e75a6545ec92da4 [0,0,0,0,0,1|2,0,0]=3 1260 B13R1.6 CC/C=C/CN[C@@H]1CCCN(C1)C 82bd8bdc5f7b072050193a13624b8b8e [0,0,0,0,0,1|3,0,0]=4 1261 B13R1.6 CC/C=C/CN[C@@H]1CCC[C@@H](C1)O ea0964af34f832e27c3144bb9e2c3740 [0,0,0,0,0,1|1,0,2]=4 1262 B13R1.6 CC/C=C/CN[C@@H]1CCC[C@H](C1)C dbf8f605da6a212cd348769e8cf4466a [0,0,0,0,0,1|2,0,1]=4 1263 B13R1.6 CC/C=C/CN[C@@H]1CCC[C@H](C1)O 6c0e7de98bbda8834762ed011070ffc7 [0,0,0,0,0,1|1,0,2]=4 1264 B13R1.6 CC/C=C/CN[C@@H]1CCNC(=O)C1 193980b81c8521fa2cc4fd31ccc5cd0d [0,0,0,0,0,1|2,0,0]=3 1265 B13R1.6 CC/C=C/CN[C@H]1CCCN(C1)C 3d1a9df1f829996aeb846ee3c0221b03 [0,0,0,0,0,1|3,0,0]=4 1266 B13R1.6 CC/C=C/CN[C@H]1CCC[C@@H](C1)O 1e13566483a36ddf611f7df858dddba2 [0,0,0,0,0,1|1,0,2]=4 1267 B13R1.6 CC/C=C/CN[C@H]1CCC[C@H](C1)O 8f94589bfc76909154714d03970aaa21 [0,0,0,0,0,1|1,0,2]=4 1268 B13R1.6 CC/C=C/CN[C@H]1CCNC(=O)C1 6c2e666b87f306dac5c19197e8057920 [0,0,0,0,0,1|2,0,0]=3 1269 B13R1.6 CC/C=C/COC1=CC(=O)CCC1 db01b4fb09c0f9f95d9b4a8b326ca3da [0,0,0,0,0,1|1,0,1]=3 1270 B13R1.6 CC/C=C/COC1C=C(CCC1)C 4826e6b7f41b71f5b16f1bd5896882cd [0,0,0,0,0,1|2,0,0]=3 1271 B13R1.6 CC/C=C/COC1C=C(COC1)Br 24cbbdaf845e70f58146be79c94f68aa [0,0,0,0,0,1|3,0,0]=4 1272 B13R1.6 CC/C=C/COC1CCCC(=O)C1 de14220cc62164829777176878872799 [0,0,0,0,0,1|1,0,0]=2 1273 B13R1.6 CC/C=C/COC1CCCC(C1)C 35018dcf941c6543c6285316d6da7527 [0,0,0,0,0,1|2,0,1]=4 1274 B13R1.6 CC/C=C/COC1CCCN(C1)C 9659a53ded556de81f5597c131603e64 [0,0,0,0,0,1|3,0,0]=4 1275 B13R1.6 CC/C=C/COC1CCNC(=O)C1 13dcc7f4541ae050479d7c70443636af [0,0,0,0,0,1|2,0,0]=3 1276 B13R1.6 CC/C=C/CO[C@@H]1CCCN(C1)C a6b296127af91b7503d9fd374c1f6495 [0,0,0,0,0,1|3,0,0]=4 1277 B13R1.6 CC/C=C/CO[C@@H]1CCC[C@@H](C1)C 2669cddd75443da4ad443439ee7c8c9a [0,0,0,0,0,1|2,0,1]=4 1278 B13R1.6 CC/C=C/CO[C@@H]1CCNC(=O)C1 6d0ee691d436eb15d472b9e6e151d979 [0,0,0,0,0,1|2,0,0]=3 1279 B13R1.6 CC/C=C/CO[C@H]1CCCN(C1)C b1c27e485509ebb7afeae10069f0eab9 [0,0,0,0,0,1|3,0,0]=4 1280 B13R1.6 CC/C=C/CO[C@H]1CCC[C@@H](C1)C a7c43aeaccd7a5e6c1a3fd673dc37871 [0,0,0,0,0,1|2,0,1]=4 1281 B13R1.6 CC/C=C/CO[C@H]1CCC[C@H](C1)C 787a49af8ac5bda90243b3a095f1f1e0 [0,0,0,0,0,1|2,0,1]=4 1282 B13R1.6 CC/C=C/CO[C@H]1CCNC(=O)C1 1f46ebd80380a59e0078e1158db93e11 [0,0,0,0,0,1|2,0,0]=3 1283 B13R1.6 CC/C=C\CCN1CCCC(=O)C1 ea03c05a5f788cfbe2509855df45ff09 [0,0,0,0,0,1|1,0,0]=2 1284 B13R1.6 CC/C=C\CCN1CCCC(C1)C d66928dfa92447c1b99baef36eb2b16b [0,0,0,0,0,1|2,0,1]=4 1285 B13R1.6 CC/C=C\CCN1CCCC(C1)F c404369258829cc127f7a570ca54afb4 [0,0,0,0,0,1|2,0,1]=4 1286 B13R1.6 CC/C=C\CCN1CCCC(C1)O 541488be574780435ad9cec89f782118 [0,0,0,0,0,1|1,0,2]=4 1287 B13R1.6 CC/C=C\CCN1CCC[C@@H](C1)C 59d7501874eb109fc25d0e6f99d583e7 [0,0,0,0,0,1|2,0,1]=4 1288 B13R1.6 CC/C=C\CCN1CCC[C@@H](C1)F 335d456801e3116313d24e0d83c2c318 [0,0,0,0,0,1|2,0,1]=4 1289 B13R1.6 CC/C=C\CCN1CCC[C@@H](C1)O 567d1f12ae6fa842570256133a30e290 [0,0,0,0,0,1|1,0,2]=4 1290 B13R1.6 CC/C=C\CCN1CCC[C@H](C1)C 16a8852642e922ba567b6be40acf4b04 [0,0,0,0,0,1|2,0,1]=4 1291 B13R1.6 CC/C=C\CCN1CCC[C@H](C1)F d3f13396ad24dbac69589e43c20ebd17 [0,0,0,0,0,1|2,0,1]=4 1292 B13R1.6 CC/C=C\CCN1CCC[C@H](C1)O d8844eab3ba73baa1a0dadd8a9c5e178 [0,0,0,0,0,1|1,0,2]=4 1293 B13R1.6 CC/C=C\CCN1CCNC(=O)C1 82df7d1374edd89ae6c0888485b58a7b [0,0,0,0,0,1|2,0,0]=3 1294 B13R1.6 CC/C=C\CCN1CCOC(=O)C1 ad74ff5bd72829c630364da49222c058 [0,0,0,0,0,1|2,0,0]=3 1295 B13R1.6 CC/C=C\COC1CCCC(=O)C1 297590e64076add439deb56f8a286a7d [0,0,0,0,0,1|1,0,0]=2 1296 B13R1.6 CC/C=C\CO[C@@H]1CCCN(C1)C 42090d675700e23de2b5afc4d7a027cd [0,0,0,0,0,1|3,0,0]=4 1297 B13R1.6 CC/C=C\CO[C@H]1CCCN(C1)C 899d6569121eddfc08e0794b1fab714e [0,0,0,0,0,1|3,0,0]=4 1298 B13R1.6 CCC/C=C/CN1CCCC(=O)C1 5a08b121eb3fb54fed9cb0c44b7ac965 [0,0,0,0,0,1|1,0,2]=4 1299 B13R1.6 CCC/C=C\CN1CCCC(=O)C1 b1c0f3cde4bab18ac1bc38dc843a4c3e [0,0,0,0,0,1|1,0,2]=4 1300 B13R1.6 CCCCCCN1CCCC(=O)C1 bb46bfa9e79877aff95a0f89ed3859de [0,0,0,0,0,1|1,0,2]=4 1301 B13R1.6 CCCCCNC1CCCC(=O)C1 f4adbee4bc7bf8035cf9711c7c626d81 [0,0,0,0,0,1|1,0,2]=4 1302 B13R1.6 CCCCCOC1CCCC(=O)C1 4c0bf9a524c1874a0dd45767b0c699db [0,0,0,0,0,1|1,0,2]=4 1303 B13R1.6 CCCCNCC1CCCC(=O)N1 89482884f60a8de78f6ebb72c45d0beb [0,0,0,0,0,1|1,0,2]=4 1304 B13R1.6 CCCCOCC1CCCC(=O)C1 4237d4e470698d994b85f6ae2b60d298 [0,0,0,0,0,1|1,0,2]=4 1305 B13R1.6 CCCCOCC1CCCC(=O)N1 babe5f789fdc20f812570a13c2b04c6c [0,0,0,0,0,1|1,0,2]=4 1306 B13R1.6 CCCCOC[C@@H]1CCCC(=O)N1 7083870063003620c1c86e04d1fdc8b7 [0,0,0,0,0,1|1,0,2]=4 1307 B13R1.6 CCCCOC[C@H]1CCCC(=O)N1 0c12a9d68e4ce050b7f5e6d8f632c068 [0,0,0,0,0,1|1,0,2]=4 1308 B13R1.6 CCCOCCN1CCCC(=O)C1 fabc8b1ea3236eef95756d7605d4bc4d [0,0,0,0,0,1|2,0,1]=4 1309 B13R1.6 CCOCCCN1CCCC(=O)C1 9987c70c7e3636b221e70a918c666fdd [0,0,0,0,0,1|2,0,1]=4 1310 B13R1.6 CCOCCNC1CCCC(=O)C1 75c6092c0ac04fdab970b9d90a8ac61b [0,0,0,0,0,1|2,0,1]=4 1311 B13R1.6 CCOCCOC1CCCC(=O)C1 3534990cb10c93a819eb5e25d3c36930 [0,0,0,0,0,1|2,0,1]=4 1312 B13R1.6 CCOCOCC1CCCC(=O)N1 b36c6454acb54fa8f161e545fd0c0b57 [0,0,0,0,0,1|2,0,1]=4 1313 B13R1.6 CCOCOC[C@@H]1CCCC(=O)N1 2389dd99ab5bf1034543bebe327e86a4 [0,0,0,0,0,1|2,0,1]=4 1314 B13R1.6 CCOCOC[C@H]1CCCC(=O)N1 11a3261f01d497ee2528f8a8f170959e [0,0,0,0,0,1|2,0,1]=4 1315 B13R1.6 CCSCCCN1CCCC(=O)C1 34e257a715b2732437fcacd00e10b100 [0,0,0,0,0,1|2,0,1]=4 1316 B13R1.6 CCSCCNC1CCCC(=O)C1 af39879b89a6cfd4af1b67c02747d87a [0,0,0,0,0,1|2,0,1]=4 1317 B13R1.6 CCSCCOC1CCCC(=O)C1 640520d65d3b943c19344911879068d7 [0,0,0,0,0,1|2,0,1]=4 1318 B13R1.6 N#CC=CCOC1CCCC(=O)C1 655fc7588b93c028af1373acfcb0b307 [0,0,0,0,0,1|2,0,1]=4 1319 B13R1.6 O=C/C=C/COC1CCCC(=O)C1 99d81baaf28ff8b5ad2a4d9123c33ac0 [0,0,0,0,0,1|2,0,1]=4 1320 B13R1.555 C/C=C/CCOC1CCCCC1=O 4151c9c158ed0a6b179aa430b22f4d92 [0,0,0,0,0,1|1,0,2]=4 1321 B13R1.555 C/C=C/CCOC1CCCNC1=O a849183578ca50891e05af94010a7ebd [0,0,0,0,0,1|1,0,2]=4 1322 B13R1.555 C/C=C/CCOC1COCCC1=O dd8847153db79a6343b39ebb7eec73fb [0,0,0,0,0,1|1,0,2]=4 1323 B13R1.555 C/C=C/CCOC1SCCCC1=O fe1968c210d6e4ee2777a0f0b792515a [0,0,0,0,0,1|1,0,2]=4 1324 B13R1.555 C/C=C/COCC1CCCCC1=O 26493f0b7e43d7ab7af979aa1a5a4bcb [0,0,0,0,0,1|1,0,2]=4 1325 B13R1.555 C/C=C/COCC1CCCNC1=O 14f7aca4b70395f3ad5e35b701364a8a [0,0,0,0,0,1|1,0,2]=4 1326 B13R1.555 C/C=C\COCC1CCCCC1=O ec159a118b30b0b5b5d938d0225358a3 [0,0,0,0,0,1|1,0,2]=4 1327 B13R1.555 C/C=C\COCC1CCCNC1=O 8de0c306e0d767be3a0b6e14ce23e705 [0,0,0,0,0,1|1,0,2]=4 1328 B13R1.555 CC/C=C/CNC1CCCCC1C 608237ab33083046cf782c1a798a4db3 [0,0,0,0,0,1|2,0,1]=4 1329 B13R1.555 CC/C=C/CNC1CCCCC1O cdf4864774a1dd93114b5d5765f474e4 [0,0,0,0,0,1|1,0,2]=4 1330 B13R1.555 CC/C=C/CNC1CCCNC1=O a748ddcd2995bd19e605b088acfab677 [0,0,0,0,0,1|1,0,0]=2 1331 B13R1.555 CC/C=C/CNC1CCOCC1C d92a8c0fb6a186353e1b58b6dd9fdafc [0,0,0,0,0,1|2,0,1]=4 1332 B13R1.555 CC/C=C/CNC1CCOCC1O 845d6ad203a2c7f0a484db9919939ded [0,0,0,0,0,1|1,0,2]=4 1333 B13R1.555 CC/C=C/CN[C@@H]1CCCC[C@@H]1C 0b12e9c1c91d2b2ac22b4b444566cc2c [0,0,0,0,0,1|2,0,1]=4 1334 B13R1.555 CC/C=C/CN[C@@H]1CCCC[C@H]1C 31eae36c8476ccf03ce38a54e325560d [0,0,0,0,0,1|2,0,1]=4 1335 B13R1.555 CC/C=C/CN[C@@H]1CCCC[C@H]1O d47ae60e78a91367551f5c1195ff957a [0,0,0,0,0,1|1,0,2]=4 1336 B13R1.555 CC/C=C/CN[C@@H]1CCCNC1=O 295aa79fb94d874e4a7b3a8e7e2ef9b4 [0,0,0,0,0,1|1,0,0]=2 1337 B13R1.555 CC/C=C/CN[C@@H]1CCOC[C@@H]1C e7ab96129a99f913ab7702a2b6da442f [0,0,0,0,0,1|2,0,1]=4 1338 B13R1.555 CC/C=C/CN[C@@H]1CCOC[C@@H]1O 9e2a2675d2e9524afbf7e86fef140473 [0,0,0,0,0,1|1,0,2]=4 1339 B13R1.555 CC/C=C/CN[C@@H]1CCOC[C@H]1F 42d8f6776ab94d2fe550ba7fba44670f [0,0,0,0,0,1|2,0,1]=4 1340 B13R1.555 CC/C=C/CN[C@@H]1CCOC[C@H]1O 6f0e96a342a1405e3cdb474e2fab0a1c [0,0,0,0,0,1|1,0,2]=4 1341 B13R1.555 CC/C=C/CN[C@@H]1COCC[C@@H]1O 298b71384e6566ac82df0de858da36e1 [0,0,0,0,0,1|1,0,2]=4 1342 B13R1.555 CC/C=C/CN[C@@H]1COCC[C@H]1O 506bc41e6fb7d8fdb3cda79d9a7a9359 [0,0,0,0,0,1|1,0,2]=4 1343 B13R1.555 CC/C=C/CN[C@H]1CCCC[C@@H]1C 3e087820866a8551d6fa8fb345d17e53 [0,0,0,0,0,1|2,0,1]=4 1344 B13R1.555 CC/C=C/CN[C@H]1CCCC[C@@H]1O 05788b09f8db2fa11d839ca460dc2ce8 [0,0,0,0,0,1|1,0,2]=4 1345 B13R1.555 CC/C=C/CN[C@H]1CCCC[C@H]1C be4e9d850122849bb03750b62e7812ad [0,0,0,0,0,1|2,0,1]=4 1346 B13R1.555 CC/C=C/CN[C@H]1CCCC[C@H]1O df76e89eb615f1378c9b244e9d59f6fd [0,0,0,0,0,1|1,0,2]=4 1347 B13R1.555 CC/C=C/CN[C@H]1CCCNC1=O 55ce56e6c841262678f20a4fd7081018 [0,0,0,0,0,1|1,0,0]=2 1348 B13R1.555 CC/C=C/CN[C@H]1CCOC[C@@H]1F cd9442f30920c9dc3dfb3eb6913c10bd [0,0,0,0,0,1|2,0,1]=4 1349 B13R1.555 CC/C=C/CN[C@H]1CCOC[C@@H]1O 9eaf4cb8682f9093e457cd2d113c3644 [0,0,0,0,0,1|1,0,2]=4 1350 B13R1.555 CC/C=C/CN[C@H]1CCOC[C@H]1C d2a015bbf06feb6e3f8c7d9f1d8ac129 [0,0,0,0,0,1|2,0,1]=4 1351 B13R1.555 CC/C=C/CN[C@H]1CCOC[C@H]1O 146670af0e11937eb128d6743588b15f [0,0,0,0,0,1|1,0,2]=4 1352 B13R1.555 CC/C=C/CN[C@H]1COCC[C@@H]1O ccf2a0de212a28478922aaf7fc2dbfff [0,0,0,0,0,1|1,0,2]=4 1353 B13R1.555 CC/C=C/CN[C@H]1COCC[C@H]1O 336ded64456bf92fd6d03f8cb8420fa7 [0,0,0,0,0,1|1,0,2]=4 1354 B13R1.555 CC/C=C/COC1CCCC=C1Br eabaf6b1bdc0cda2a66f84dd4710a0ee [0,0,0,0,0,1|2,0,0]=3 1355 B13R1.555 CC/C=C/COC1CCCCC1=O f535ff55bb04cbcebf6af1d9dcd058d7 [0,0,0,0,0,1|1,0,0]=2 1356 B13R1.555 CC/C=C/COC1CCCCC1C 3db543b8f18600e50dd9016f619aad9c [0,0,0,0,0,1|2,0,1]=4 1357 B13R1.555 CC/C=C/COC1CCCCC1F bc81df4f0c3a4fe2da7845377110c4e4 [0,0,0,0,0,1|2,0,1]=4 1358 B13R1.555 CC/C=C/COC1CCCNC1=O c69812e56f1728f9971f3d8ebb8e6301 [0,0,0,0,0,1|1,0,0]=2 1359 B13R1.555 CC/C=C/COC1CCCOC1=O 7a64c15b58f71e93ee4475e848203af2 [0,0,0,0,0,1|1,0,0]=2 1360 B13R1.555 CC/C=C/COC1CCOCC1C 8498b5f9951fe554bcdadbe37e5a8d38 [0,0,0,0,0,1|2,0,1]=4 1361 B13R1.555 CC/C=C/COC1CCOCC1F d818ed74cdab4a314aceaf3b63f25d95 [0,0,0,0,0,1|2,0,1]=4 1362 B13R1.555 CC/C=C/COC1COCCC1=O 1850cf3a49c50a661aa3bd0b7ff3544b [0,0,0,0,0,1|1,0,0]=2 1363 B13R1.555 CC/C=C/COC1SCCCC1=O d7ebe5fe2cf1c45282eb87d40c25ae61 [0,0,0,0,0,1|1,0,0]=2 1364 B13R1.555 CC/C=C/CO[C@@H]1CCCC[C@@H]1C 5e4287b7b691c129a5f47112c09ab766 [0,0,0,0,0,1|2,0,1]=4 1365 B13R1.555 CC/C=C/CO[C@@H]1CCCC[C@H]1F 5c7109049acfd2152ca9a83f56226557 [0,0,0,0,0,1|2,0,1]=4 1366 B13R1.555 CC/C=C/CO[C@@H]1CCCNC1=O a9152ad80a5f2b06cfc40b50009ee9e0 [0,0,0,0,0,1|1,0,0]=2 1367 B13R1.555 CC/C=C/CO[C@@H]1CCOC[C@@H]1F b24a9c87e424d377211ab774ad274924 [0,0,0,0,0,1|2,0,1]=4 1368 B13R1.555 CC/C=C/CO[C@H]1CCCC[C@@H]1C 7bf629c0a8d3de43675fd210662e1c6e [0,0,0,0,0,1|2,0,1]=4 1369 B13R1.555 CC/C=C/CO[C@H]1CCCC[C@H]1C c8e0e9112b0d2d6473847c1492af5e01 [0,0,0,0,0,1|2,0,1]=4 1370 B13R1.555 CC/C=C/CO[C@H]1CCCNC1=O 19bc3ffb326e640942993d0e95e90b16 [0,0,0,0,0,1|1,0,0]=2 1371 B13R1.555 CC/C=C/CO[C@H]1CCOC[C@@H]1F 15299e5924198baa4fcae239d79025f9 [0,0,0,0,0,1|2,0,1]=4 1372 B13R1.555 CC/C=C/CO[C@H]1CCOC[C@H]1F f901a049932ce77855e318eb4b5dad90 [0,0,0,0,0,1|2,0,1]=4 1373 B13R1.555 CC/C=C\CCN1CCCCC1C 35236e8eec6a9a50590baa932ae3dd35 [0,0,0,0,0,1|2,0,1]=4 1374 B13R1.555 CC/C=C\CCN1CCCC[C@@H]1C f9273d954ce4df3add9efa1be663e875 [0,0,0,0,0,1|2,0,1]=4 1375 B13R1.555 CC/C=C\CCN1CCCC[C@H]1C 8104f7435bd077b3ef49da6ecfd5d5ce [0,0,0,0,0,1|2,0,1]=4 1376 B13R1.555 CC/C=C\CCN1CCOCC1C 9c91ae5b04179df52b1cd0b6618a8fbd [0,0,0,0,0,1|2,0,1]=4 1377 B13R1.555 CC/C=C\CCN1CCOC[C@@H]1C 057b5ae164492efea00805bbdf3ced1d [0,0,0,0,0,1|2,0,1]=4 1378 B13R1.555 CC/C=C\CCN1CCOC[C@H]1C a4f30717bfff3d9c6541dde3ad8e05ef [0,0,0,0,0,1|2,0,1]=4 1379 B13R1.555 CC/C=C\COC1CCCCC1=O 26f0beb87eec4d333cb7abf1b68b1224 [0,0,0,0,0,1|1,0,0]=2 1380 B13R1.555 CC/C=C\COC1CCCCC1F a242657243f7b3d2db600bd235145805 [0,0,0,0,0,1|2,0,1]=4 1381 B13R1.555 CC/C=C\COC1CCCNC1=O c7eb69d23ab9ae43ea93f241f479761b [0,0,0,0,0,1|1,0,0]=2 1382 B13R1.555 CC/C=C\COC1COCCC1=O 50bc4aa538e01eda312bb3c2f48bd73a [0,0,0,0,0,1|1,0,0]=2 1383 B13R1.555 CC/C=C\COC1SCCCC1=O fb134414c0b643560b21bad1a29f81ad [0,0,0,0,0,1|1,0,0]=2 1384 B13R1.555 CC/C=C\CO[C@H]1CCCC[C@H]1C c266c80eb7b5e4d9fbf5df70c66813f8 [0,0,0,0,0,1|2,0,1]=4 1385 B13R1.555 CCC#CCNC1CCCNC1=O b36f7e71f16cee5b81e4e188ff1fdf84 [0,0,0,0,0,1|1,0,2]=4 1386 B13R1.555 CCC#CCN[C@@H]1CCCNC1=O 95067e9e8a3c6365315455fcc5df3f01 [0,0,0,0,0,1|1,0,2]=4 1387 B13R1.555 CCC#CCN[C@H]1CCCNC1=O 8070920bc44ae8b615852fcfa5c19df9 [0,0,0,0,0,1|1,0,2]=4 1388 B13R1.555 CCC#CCOC1SCCCC1=O aa23c302d487283c7b4fa8356d5ed8b6 [0,0,0,0,0,1|1,0,2]=4 1389 B13R1.555 CCCCCNC1CCCCC1=O f38e9b26fee56e5191cec8661384d7a1 [0,0,0,0,0,1|1,0,2]=4 1390 B13R1.555 CCCCCNC1CCCNC1=O 7b53842d57374daeb08c28403da29c40 [0,0,0,0,0,1|1,0,2]=4 1391 B13R1.555 CCCCCNC1COCCC1=O 6385fa8a2a3ef5ab1d20841e5a8819bc [0,0,0,0,0,1|1,0,2]=4 1392 B13R1.555 CCCCCNC1SCCCC1=O 52c2c21efa6525f3d5236d7dad6a737d [0,0,0,0,0,1|1,0,2]=4 1393 B13R1.555 CCCCCN[C@@H]1CCCNC1=O 7acb83eedff889334812cae162ab366e [0,0,0,0,0,1|1,0,2]=4 1394 B13R1.555 CCCCCN[C@H]1CCCNC1=O 1ab29a34272034056c9d66b8a7b7579d [0,0,0,0,0,1|1,0,2]=4 1395 B13R1.555 CCCCCOC1CCCCC1=O bd8b50d106abed3c6d04832077dd35f3 [0,0,0,0,0,1|1,0,2]=4 1396 B13R1.555 CCCCCOC1CCCNC1=O 2d51138a41e7272ec61c56edb28149bf [0,0,0,0,0,1|1,0,2]=4 1397 B13R1.555 CCCCCOC1CCCOC1=O 848e64200f37edbec60eb16e1bda0757 [0,0,0,0,0,1|1,0,2]=4 1398 B13R1.555 CCCCCOC1COCCC1=O 5b47142ce79d64f1c0655c7e6bc3d9e5 [0,0,0,0,0,1|1,0,2]=4 1399 B13R1.555 CCCCCOC1SCCCC1=O 3d2864d81fe95d7f4406ea4ea6e1082c [0,0,0,0,0,1|1,0,2]=4 1400 B13R1.555 CCCCCO[C@@H]1CCCNC1=O 1a13cd5fec5a4bdb6d90ba968ce1ad02 [0,0,0,0,0,1|1,0,2]=4 1401 B13R1.555 CCCCCO[C@H]1CCCNC1=O 386f96045d8972abec56e72fea49c735 [0,0,0,0,0,1|1,0,2]=4 1402 B13R1.555 CCCCOCC1CCCCC1=O f4f299f14f8860858e5b1cea01bed6f8 [0,0,0,0,0,1|1,0,2]=4 1403 B13R1.555 CCCCOCC1CCCNC1=O d7fb44d1a315c3c25dffb7c99251dc3f [0,0,0,0,0,1|1,0,2]=4 1404 B13R1.555 CCCNCCN1CCCCC1=O ea3318a0d515c9984928bc96af0ab557 [0,0,0,0,0,1|2,0,1]=4 1405 B13R1.555 CCNCCCN1CCCCC1=O 2fb8aea51a810d0379bc9df12a576f21 [0,0,0,0,0,1|2,0,1]=4 1406 B13R1.555 CCOCCNC1CCCNC1=O b9d1d9317cc5082ae7d4ef57a2dbc2a4 [0,0,0,0,0,1|2,0,1]=4 1407 B13R1.555 CCOCCNC1SCCCC1=O 3064d10cdff61f9953c23c700e02a197 [0,0,0,0,0,1|2,0,1]=4 1408 B13R1.555 CCOCCN[C@@H]1CCCNC1=O 5e170d9f38657e01d7c96069d5b54c36 [0,0,0,0,0,1|2,0,1]=4 1409 B13R1.555 CCOCCN[C@H]1CCCNC1=O 3cdae0b8baf91bf42138d40c3876c514 [0,0,0,0,0,1|2,0,1]=4 1410 B13R1.555 CCOCCOC1CCCCC1=O a07b7342b6cea4c026fca06241e26a11 [0,0,0,0,0,1|2,0,1]=4 1411 B13R1.555 CCOCCOC1CCCNC1=O 70b1a6fe897cafe59c3c7cb950225dd5 [0,0,0,0,0,1|2,0,1]=4 1412 B13R1.555 CCOCCOC1CCCOC1=O 0ebaff7935e63837ec8dac60bfda385d [0,0,0,0,0,1|2,0,1]=4 1413 B13R1.555 CCOCCOC1COCCC1=O 8dcdfe52e712185ff3741d692fc96444 [0,0,0,0,0,1|2,0,1]=4 1414 B13R1.555 CCOCCOC1SCCCC1=O a9de76a28b324bfb95cb39e1273d8826 [0,0,0,0,0,1|2,0,1]=4 1415 B13R1.555 CCOCCO[C@@H]1CCCNC1=O a7f92561ad2840882c2ad79855e327e5 [0,0,0,0,0,1|2,0,1]=4 1416 B13R1.555 CCOCCO[C@H]1CCCNC1=O f4f4a2e9af3295330243567503ef53d7 [0,0,0,0,0,1|2,0,1]=4 1417 B13R1.555 CCOCOCC1CCCCC1=O c7766ba812bbb4ddc859e1a644ece08d [0,0,0,0,0,1|2,0,1]=4 1418 B13R1.555 CCOCOCC1CCCNC1=O 358b49e122c901f557c25c7e51de1ed0 [0,0,0,0,0,1|2,0,1]=4 1419 B13R1.555 CCSCCNC1CCCCC1=O 5f389532c3cd6a5add36e11ed24c0121 [0,0,0,0,0,1|2,0,1]=4 1420 B13R1.555 CCSCCNC1CCCNC1=O 63d3f251fe3912187318e1f4fb0103d1 [0,0,0,0,0,1|2,0,1]=4 1421 B13R1.555 CCSCCNC1COCCC1=O e28ea0527900ff6c5e08602031a2f39d [0,0,0,0,0,1|2,0,1]=4 1422 B13R1.555 CCSCCNC1SCCCC1=O 3bdf76f30bfa042cf740b71b271837c1 [0,0,0,0,0,1|2,0,1]=4 1423 B13R1.555 CCSCCN[C@@H]1CCCNC1=O bd4b703c60b84827c8b11310a891644f [0,0,0,0,0,1|2,0,1]=4 1424 B13R1.555 CCSCCN[C@H]1CCCNC1=O 2ce86f6412756cbc0403cdf1b65f9c74 [0,0,0,0,0,1|2,0,1]=4 1425 B13R1.555 CCSCCOC1CCCCC1=O 757d5d5a5ac6463eca78efbf2af2c8ef [0,0,0,0,0,1|2,0,1]=4 1426 B13R1.555 CCSCCOC1CCCNC1=O bc3d0944c7dcf6dd52f7b8e15306f2f4 [0,0,0,0,0,1|2,0,1]=4 1427 B13R1.555 CCSCCOC1CCCOC1=O 0a9a6432937c064a693181129f2bd206 [0,0,0,0,0,1|2,0,1]=4 1428 B13R1.555 CCSCCOC1COCCC1=O 0f826a0c8f5f8f54fc245b4f966ef7bc [0,0,0,0,0,1|2,0,1]=4 1429 B13R1.555 CCSCCOC1SCCCC1=O bdc7baff9e793227177afb6719b67d81 [0,0,0,0,0,1|2,0,1]=4 1430 B13R1.555 CCSCCO[C@@H]1CCCNC1=O 0945af63eeacd4b92579251f6425eb67 [0,0,0,0,0,1|2,0,1]=4 1431 B13R1.555 CCSCCO[C@H]1CCCNC1=O bcb48aaa053c5a9fe89c4effa4322615 [0,0,0,0,0,1|2,0,1]=4 1432 B13R1.555 N#CC=CCNC1CCCNC1=O 7501c7060fd77bb573ea9f2250371e2c [0,0,0,0,0,1|2,0,1]=4 1433 B13R1.555 N#CC=CCN[C@@H]1CCCNC1=O eae738bd08253f4fa245b78f47bc0fdc [0,0,0,0,0,1|2,0,1]=4 1434 B13R1.555 N#CC=CCN[C@H]1CCCNC1=O 5e4aaf2cf39249f150c23558f7b47dd1 [0,0,0,0,0,1|2,0,1]=4 1435 B13R1.555 N#CC=CCOC1CCCCC1=O 4b05c2d9096b015108409fb87478ab0e [0,0,0,0,0,1|2,0,1]=4 1436 B13R1.555 N#CC=CCOC1CCCNC1=O 742c8ae6680a10bf5f0e313f32a1b079 [0,0,0,0,0,1|2,0,1]=4 1437 B13R1.555 N#CC=CCOC1CCCOC1=O 065e1d791c199ed1d8b1cf6826f751cf [0,0,0,0,0,1|2,0,1]=4 1438 B13R1.555 N#CC=CCO[C@@H]1CCCNC1=O 0516efadafafffb6fe16257dd3f3c3f5 [0,0,0,0,0,1|2,0,1]=4 1439 B13R1.555 N#CC=CCO[C@H]1CCCNC1=O 33a456ff64d03ccb023e2044f8598c3f [0,0,0,0,0,1|2,0,1]=4 1440 B13R1.555 O=C/C=C/COC1CCCCC1=O c07118ea8985ea6aba302f507767fc3e [0,0,0,0,0,1|2,0,1]=4 1441 B13R1.555 O=C/C=C/COC1CCCNC1=O 22dd37343c4d672e8502aaed4f55c491 [0,0,0,0,0,1|2,0,1]=4 1442 B13R1.555 O=C/C=C/COC1COCCC1=O 4d079b3954fe3909ceab3f2c5aa64bb0 [0,0,0,0,0,1|2,0,1]=4 1443 B13R1.555 O=C/C=C/COC1SCCCC1=O 8e061e6719b7a34c06d455b1883ab078 [0,0,0,0,0,1|2,0,1]=4 1444 B10R0.71 C/C=C/CCCOCCC=O 099c08e5c9575bdb23438e08c620b76f [1,0,1,0,0,0|1,0,0]=3 1445 B10R0.71 C/C=C/CCOCCCC=O 46be8a5f234e47ed5f7141f11d130e36 [1,0,1,0,0,0|1,0,0]=3 1446 B10R0.71 C/C=C/COCCCCC=O c69191768fd3a5cdc75c8954e68658dc [1,0,1,0,0,0|1,0,0]=3 1447 B10R0.71 C/C=C/COCCOCC=O 98060e0d46b258a323fc667ca96014ed [1,0,1,0,0,0|2,0,0]=4 1448 B10R0.71 C/C=C\CCCOCCC=O ab415cdd81ed9ccdd379943059deca49 [1,0,1,0,0,0|1,0,0]=3 1449 B10R0.71 C/C=C\COCCCCC=O 24a162bb69ad155abd28d7f92eba7dd3 [1,0,1,0,0,0|1,0,0]=3 1450 B10R0.71 C/C=C\COCCOCC=O 585672a9d99d0242d084391fa60a0355 [1,0,1,0,0,0|2,0,0]=4 1451 B10R0.71 C=CCCCCCCOCC 6dbc32c9d3b20eeb8cee0cf24e365bb6 [1,0,1,0,0,0|2,0,0]=4 1452 B10R0.71 C=CCCCCNC/C=C/C b187f5daabcb7717f4009e5f5891f787 [1,0,1,0,0,0|2,0,0]=4 1453 B10R0.71 C=CCCCCNC/C=C\C 4427ba864a032953578f9b062980a646 [1,0,1,0,0,0|2,0,0]=4 1454 B10R0.71 C=CCCCCNCC=CC cc17eb739dc6d917aa61240a870edff9 [1,0,1,0,0,0|2,0,0]=4 1455 B10R0.71 C=CCCCCOC/C=C/C 8c165375cd561db84918789b359f451f [1,0,1,0,0,0|2,0,0]=4 1456 B10R0.71 C=CCCCCOC/C=C\C f91cc334e33c429e7b12087f94beaccf [1,0,1,0,0,0|2,0,0]=4 1457 B10R0.71 C=CCCCCOCC=CC ad9bd00385f76ac9e6759fecfe40079c [1,0,1,0,0,0|2,0,0]=4 1458 B10R0.71 C=CCCCNC/C=C/CC 1e3285dd379f6e56d0a775af9b4a12d4 [1,0,1,0,0,0|1,0,1]=4 1459 B10R0.71 C=CCCCOC/C=C/CC a5e416301f67fbeecf3884a65c1e75d5 [1,0,1,0,0,0|1,0,1]=4 1460 B10R0.71 C=CCCCOC/C=C\CC 5817bbc19275d674c88e7be04dfb2e91 [1,0,1,0,0,0|1,0,1]=4 1461 B10R0.71 C=CCCCOCC/C=C/C 916dde146cf16e6009a56ecc85109198 [1,0,1,0,0,0|2,0,0]=4 1462 B10R0.71 C=CCCNCC/C=C\CC e2d8b76f51e05a4185770bed26689e53 [1,0,1,0,0,0|1,0,1]=4 1463 B10R0.71 C=CCCNCCC/C=C\C 4d51b8d3651c5b1333eaa2e9aad13940 [1,0,1,0,0,0|2,0,0]=4 1464 B10R0.71 C=CCCOCC/C=C/CC 34e932e8340213e918b96915d5caa9f2 [1,0,1,0,0,0|1,0,1]=4 1465 B10R0.71 C=CCCOCC/C=C\CC 6c8897552831f137e84ed17b901023a1 [1,0,1,0,0,0|1,0,1]=4 1466 B10R0.71 C=CCCOCCC/C=C/C 366adcae3df75a7151ff9428c4c5c140 [1,0,1,0,0,0|2,0,0]=4 1467 B10R0.71 C=CCCOCCC/C=C\C 6f6ba2c3652beccce2db6344401ac97b [1,0,1,0,0,0|2,0,0]=4 1468 B10R0.71 C=CCCOCCCC=CC ae9a837aec567c1fa3fbc294bf721a77 [1,0,1,0,0,0|2,0,0]=4 1469 B10R0.71 C=CCOCCC/C=C\CC 68e100c3623cfb70bd643caec38df012 [1,0,1,0,0,0|1,0,1]=4 1470 B10R0.71 CC/C=C/CCOCCC=O 6872b8e489d755d1798fb75aec622df4 [1,0,1,0,0,0|1,0,0]=3 1471 B10R0.71 CC/C=C/CCOCCCC c8bbe4a116e9837c5acb0bd130d88747 [1,0,1,0,0,0|1,0,1]=4 1472 B10R0.71 CC/C=C/CCOCCCF 88ecb959ca18d6af5da622832f1b87e9 [1,0,1,0,0,0|2,0,0]=4 1473 B10R0.71 CC/C=C/CCOCCCS 2d2a5e2c573307f1405dd0f398018841 [1,0,1,0,0,0|1,1,0]=4 1474 B10R0.71 CC/C=C/CNCCCCC 396ae7fd2aad2d3062225091f1ed8121 [1,0,1,0,0,0|1,0,1]=4 1475 B10R0.71 CC/C=C/CNCCCCCl b42c2c34e27433fc2354da416eb9469c [1,0,1,0,0,0|2,0,0]=4 1476 B10R0.71 CC/C=C/CNCCCCO 30e9e1d97d59f6d1e084daccf819227a [1,0,1,0,0,0|1,0,1]=4 1477 B10R0.71 CC/C=C/CNCCCCS 86ba226c0d5f01c0e9f63d09ca7eb4f3 [1,0,1,0,0,0|1,1,0]=4 1478 B10R0.71 CC/C=C/COC/C=C/CC 92878b2f196e753b5f98a0bdc3fcafb6 [1,0,1,0,0,0|1,0,1]=4 1479 B10R0.71 CC/C=C/COCCCC=O 829bce9be10f62a1676336886e3aa317 [1,0,1,0,0,0|1,0,0]=3 1480 B10R0.71 CC/C=C/COCCCCC 4244476ee625bb91d4c75005fa57b26a [1,0,1,0,0,0|1,0,1]=4 1481 B10R0.71 CC/C=C/COCCCCF 1dc81d22ea6c57418304e0917a0631f2 [1,0,1,0,0,0|2,0,0]=4 1482 B10R0.71 CC/C=C/COCCCCS 07e5800718cf1f4b5355166f60667667 [1,0,1,0,0,0|1,1,0]=4 1483 B10R0.71 CC/C=C/COCCNC=O f691983a52e826ea64d648d234c00a34 [1,0,1,0,0,0|2,0,0]=4 1484 B10R0.71 CC/C=C/COCCOC=O 9a387c88100608d11948b84782156bf4 [1,0,1,0,0,0|2,0,0]=4 1485 B10R0.71 CC/C=C\CCCCOCC 6f672bd2ab358cb454803e83d5c0e284 [1,0,1,0,0,0|1,0,1]=4 1486 B10R0.71 CC/C=C\CCCCOCF 0dfb6757c3e7d01b47aa75f03e28a2ec [1,0,1,0,0,0|2,0,0]=4 1487 B10R0.71 CC/C=C\CCCOCC=O 36e95cc5d25b5bd1fc3c8ddd865fe102 [1,0,1,0,0,0|1,0,0]=3 1488 B10R0.71 CC/C=C\CCCOCCC 7fa768d31f02c71335efb28537f1ed87 [1,0,1,0,0,0|1,0,0]=3 1489 B10R0.71 CC/C=C\CCCOCCF 658a9ea094f43dddd25b292c6dad7039 [1,0,1,0,0,0|2,0,0]=4 1490 B10R0.71 CC/C=C\CCCOCCS 1514e3b49942a76ee0a62089e52656bf [1,0,1,0,0,0|1,1,0]=4 1491 B10R0.71 CC/C=C\CCCOCOC 91c800ab417e820667e507a61cd92b15 [1,0,1,0,0,0|2,0,0]=4 1492 B10R0.71 CC/C=C\CCCOCSC 499c8ff2bc650384a31a8ed4ececed9a [1,0,1,0,0,0|2,0,0]=4 1493 B10R0.71 CC/C=C\CCNCCCC c4f059f6ebacdc59905230714b6eff68 [1,0,1,0,0,0|1,0,1]=4 1494 B10R0.71 CC/C=C\CCNCCCCl 51cddba674b0299a3a928cf64999c244 [1,0,1,0,0,0|2,0,0]=4 1495 B10R0.71 CC/C=C\CCNCCCO 289e512a3da0d8201ff3b6a7f6c8a4e6 [1,0,1,0,0,0|1,0,1]=4 1496 B10R0.71 CC/C=C\CCOCCC=O d85d7dfe4e2e6e8d032a753a156249ad [1,0,1,0,0,0|1,0,0]=3 1497 B10R0.71 CC/C=C\CCOCCCC 8e83903dc8b2dc055f80be84ab4a3d9c [1,0,1,0,0,0|1,0,1]=4 1498 B10R0.71 CC/C=C\CCOCCCF 4430bc766f9eb0d9c26980dd0840755d [1,0,1,0,0,0|2,0,0]=4 1499 B10R0.71 CC/C=C\CCOCCCS a1e1396ab724ae1f920f1f57a0489d4e [1,0,1,0,0,0|1,1,0]=4 1500 B10R0.71 CC/C=C\COC/C=C/CC 3e9e707d6092368519a29ee0f99c7f32 [1,0,1,0,0,0|1,0,1]=4 1501 B10R0.71 CC/C=C\COCCCC=O 7aa3cddfd58e704fd000ac2756cf879c [1,0,1,0,0,0|1,0,0]=3 1502 B10R0.71 CC/C=C\COCCCCC 273210e5829d96509e829e222979bc8b [1,0,1,0,0,0|1,0,1]=4 1503 B10R0.71 CC/C=C\COCCCCF cceb6301c3fc703ee59d20a210d8e3fb [1,0,1,0,0,0|2,0,0]=4 1504 B10R0.71 CC=CCCCOCCC=O 97c9f6fdd6a4de3b92d2d85ba134118f [1,0,1,0,0,0|1,0,0]=3 1505 B10R0.71 CC=CCNCCCCC=O d8b092d9ef5e9f30b928b9bc7ef62f08 [1,0,1,0,0,0|1,0,0]=3 1506 B10R0.71 CC=CCNCCOCC=O 9cb7f34fd735095864579bdbea27edd1 [1,0,1,0,0,0|2,0,0]=4 1507 B10R0.71 CC=CCOCCCCC=O 85eab19089cebb2153fb1e7f93e60c1a [1,0,1,0,0,0|1,0,0]=3 1508 B10R0.71 CC=CCOCCOCC=O b68afe275d648d6670d42e23904ca107 [1,0,1,0,0,0|2,0,0]=4 1509 B10R0.71 CCCCCCCCNC=O bc03f137b33aec3f705c81e5d5bac7bb [1,0,1,0,0,0|1,0,1]=4 1510 B10R0.71 CCCCCCCNCC=O bfb56bc7341eb925b4f8d6df80cbc0e0 [1,0,1,0,0,0|1,0,1]=4 1511 B10R0.71 CCCCCCCOCC=O 85a03949435365a6a1fdeda7013cb46a [1,0,1,0,0,0|1,0,1]=4 1512 B10R0.71 CCCCCCNCCC=O 7011a6760ad05bee90b4b5fe1ddade10 [1,0,1,0,0,0|1,0,1]=4 1513 B10R0.71 CCCCCCOCCC=O 52e11fbfda6e705332503dbf6ca57c21 [1,0,1,0,0,0|1,0,1]=4 1514 B10R0.71 CCCCCNCCCC=O 6680464fa50f8e11fa1a82d02cb758f7 [1,0,1,0,0,0|1,0,1]=4 1515 B10R0.71 CCCCCOCCCC=O 37cad7ef5e51a341a4958cbb40245746 [1,0,1,0,0,0|1,0,1]=4 1516 B10R0.71 CCCCNCCCCC=O dbb1efb0684adf2cb0a6d780179e9b96 [1,0,1,0,0,0|1,0,1]=4 1517 B10R0.71 CCCCOCCCCC=O 87caad785ee1de0ab8952b818b81a155 [1,0,1,0,0,0|1,0,1]=4 1518 B10R0.71 CCCNCCCCCC=O ea13b9738fa632ac5ce864b8fef8c315 [1,0,1,0,0,0|1,0,1]=4 1519 B10R0.71 CCCOCCCCCC=O f9a394720b00a6dd92dae6c05c91a7d4 [1,0,1,0,0,0|1,0,1]=4 1520 B10R0.71 CCOCCCNCCC=O 919c30e425f23fce621e7b3f87b21a82 [1,0,1,0,0,0|2,0,0]=4 1521 B10R0.71 CCOCCCOCCC=O 92e4346ec52c6edbbc2511fd64330f33 [1,0,1,0,0,0|2,0,0]=4 1522 B10R0.71 CCOCCNCCCC=O a8e3974e3a3fa2b0a2c573f75b0c1bfc [1,0,1,0,0,0|2,0,0]=4 1523 B10R0.71 CCOCCOCCCC=O b24127ff9c79cd4d7017e2d84818fe52 [1,0,1,0,0,0|2,0,0]=4 1524 B10R0.71 CCOCOCCCCC=O 806ea60cee9ee60c73146305a4648194 [1,0,1,0,0,0|2,0,0]=4 1525 B10R0.71 CCSCCCCNCC=O 1ab6546c36a47293d1614a30d9ce2b9b [1,0,1,0,0,0|2,0,0]=4 1526 B10R0.71 CCSCCCOCCC=O b3576a09b39df7307cc45f7dc67d57ae [1,0,1,0,0,0|2,0,0]=4 1527 B10R0.71 CCSCCNCCCC=O cd3237ae64f38a142c6c221750b0fc89 [1,0,1,0,0,0|2,0,0]=4 1528 B10R0.71 CCSCCOCCCC=O 0e80ab4c57e8d8dffb2a4be0fb1f4459 [1,0,1,0,0,0|2,0,0]=4 1529 B10R0.71 O=CCCCCOC/C=C/Cl b42f6b0b4cd8d37db0816db728f2725b [1,0,1,0,0,0|2,0,0]=4 1530 B10R0.71 O=CCCCCOC/C=C\Cl bd6d5cdc6c6a74b69415c851b31c837b [1,0,1,0,0,0|2,0,0]=4 1531 B10R0.71 O=CCCCCOCC=CCl c3ac485cecbb88ff0d79e0436fb23b3e [1,0,1,0,0,0|2,0,0]=4 1532 B10R0.1 C/C=C/C(C)OC/C=C/CC b4a53aa1a13a4d7fefb381622397c19b [1,0,1,0,0,0|1,0,1]=4 1533 B10R0.1 C/C=C/CNCC(=O)NCC 6da7ccf83f0df6666252737683f4c55c [1,0,1,0,0,0|2,0,0]=4 1534 B10R0.1 C/C=C/CNCC(=O)OCC 3971c1466964639190b06b77f21694e6 [1,0,1,0,0,0|2,0,0]=4 1535 B10R0.1 C/C=C/COCC(=O)CCC e705dd41e10e42b7866df48e1ca92157 [1,0,1,0,0,0|1,0,0]=3 1536 B10R0.1 C/C=C/COCC(=O)COC d77dd1a2d4dbc277b2d104a80dc79fe5 [1,0,1,0,0,0|2,0,0]=4 1537 B10R0.1 C/C=C/COCC(=O)NCC 663a8cdb002c012a342c8cf08b6e3beb [1,0,1,0,0,0|2,0,0]=4 1538 B10R0.1 C/C=C/COCC(=O)OCC c4a5c491f257cf2590570911846cd739 [1,0,1,0,0,0|2,0,0]=4 1539 B10R0.1 C/C=C\CCCN(C)CCC c6c2d29d68753c11dc5b705876c478c2 [1,0,1,0,0,0|2,0,0]=4 1540 B10R0.1 C/C=C\CNCC(=O)NCC d0fd4945fa43645f792602405c52ba20 [1,0,1,0,0,0|2,0,0]=4 1541 B10R0.1 C/C=C\CNCC(=O)OCC 81a2937d3e1606796de18eacc70c2e46 [1,0,1,0,0,0|2,0,0]=4 1542 B10R0.1 C/C=C\COCC(=O)CCC 8bf6bfccd0bb73cc8d5f50cefcee622b [1,0,1,0,0,0|1,0,0]=3 1543 B10R0.1 C/C=C\COCC(=O)COC 6841815b680bc330b62ec59ce01be8f6 [1,0,1,0,0,0|2,0,0]=4 1544 B10R0.1 C/C=C\COCC(=O)NCC 7cb40f8775d0286b0bfe4806518dc060 [1,0,1,0,0,0|2,0,0]=4 1545 B10R0.1 C/C=C\COCC(=O)OCC 9ac79a3ef898c8e8f64d66a3f23e6f21 [1,0,1,0,0,0|2,0,0]=4 1546 B10R0.1 CC/C=C/CNC(C)CCC c31c035fd54ff502a1330a759d07e9ed [1,0,1,0,0,0|1,0,1]=4 1547 B10R0.1 CC/C=C/CN[C@@H](C)CCC 12e7de162aafe542e99e1428a5af703d [1,0,1,0,0,0|1,0,1]=4 1548 B10R0.1 CC/C=C/COC(=S)CCC 70ec4c0977dbca2d1155ab6d62691382 [1,0,1,0,0,0|1,1,0]=4 1549 B10R0.1 CC/C=C/COC(C)CCC 19690a47d49baee7bb1487f172789f12 [1,0,1,0,0,0|1,0,1]=4 1550 B10R0.1 CC/C=C/CO[C@@H](C)CCC dce6e8e95e54b6a2e50952d6c8d1337c [1,0,1,0,0,0|1,0,1]=4 1551 B10R0.1 CC/C=C/CO[C@H](C)CCC 379a4b7cbe36b8805d03e2a84d75416d [1,0,1,0,0,0|1,0,1]=4 1552 B10R0.1 CC/C=C\CCN(C)CCC 7274204e740762d854b5b58a93bd1eab [1,0,1,0,0,0|1,0,1]=4 1553 B10R0.1 CC/C=C\COC(C)CCC 1b6a3cfa3da8e4e04cdead2fa0778ebd [1,0,1,0,0,0|1,0,1]=4 1554 B10R0.1 CC=CC(C)OC/C=C/CC eeb5e78004acf2547f28c99bfc359fda [1,0,1,0,0,0|1,0,1]=4 1555 B10R0.1 CC=CCNCC(=O)CCC 82640ac2c5fa5f7a65f6439c940d2283 [1,0,1,0,0,0|1,0,0]=3 1556 B10R0.1 CC=CCNCC(=O)COC 4873ab0d318397f75c15d07d58b844d2 [1,0,1,0,0,0|2,0,0]=4 1557 B10R0.1 CC=CCNCC(=O)NCC 05715f7c0aa3ebca4ea3d82b6d30cdf3 [1,0,1,0,0,0|2,0,0]=4 1558 B10R0.1 CC=CCNCC(=O)OCC 6ee97b5c39a02117843fc083e4a99768 [1,0,1,0,0,0|2,0,0]=4 1559 B10R0.1 CC=CCOCC(=O)CCC 8f6ba979a3d95982df241a72b750c80a [1,0,1,0,0,0|1,0,0]=3 1560 B10R0.1 CC=CCOCC(=O)COC a7e313ff76e1a3f8383c512638cca52e [1,0,1,0,0,0|2,0,0]=4 1561 B10R0.1 CC=CCOCC(=O)NCC c342711bc2f84f9d6ae0927435296353 [1,0,1,0,0,0|2,0,0]=4 1562 B10R0.1 CC=CCOCC(=O)OCC 519288c260291b5ecd988148a2e2aaa1 [1,0,1,0,0,0|2,0,0]=4 1563 B10R0.1 CCCC(=O)COC/C=C/Cl d6024e8bb75eb3c96c9b440758570c27 [1,0,1,0,0,0|2,0,0]=4 1564 B10R0.1 CCCC(=O)COCC=CCl 4042f5df871c9edf6b768688a3fe68a2 [1,0,1,0,0,0|2,0,0]=4 1565 B10R0.1 CCCC(=O)NCCOCC 79d9b92616c769d2cdcd747927c60328 [1,0,1,0,0,0|2,0,0]=4 1566 B10R0.1 CCCC(=O)NCCSCC 80b0e19972a11cccc458980ea52b2299 [1,0,1,0,0,0|2,0,0]=4 1567 B10R0.1 CCCC(=O)OCCOCC 9a285a2c378d3b3e5e911c97d35a22b7 [1,0,1,0,0,0|2,0,0]=4 1568 B10R0.1 CCCCCNC(=O)CCC cd3617b761f054cae655d3c214537a01 [1,0,1,0,0,0|1,0,1]=4 1569 B10R0.1 CCCCNCC(=O)CCC 453fddd4efd403580a47150fb6a1b943 [1,0,1,0,0,0|1,0,1]=4 1570 B10R0.1 CCCCOCC(=O)CCC 3c18382cf685be3b48662cc000c9f11f [1,0,1,0,0,0|1,0,1]=4 1571 B10R0.1 CCNCCCC(=O)OCC ec7ea6af2e873221783738c3262f1017 [1,0,1,0,0,0|2,0,0]=4 1572 B10R0.1 CCOCCCC(=O)OCC 065e688430f5956cbb53aefa5e1e9a90 [1,0,1,0,0,0|2,0,0]=4 1573 B10R0.74 C=C(CC)COC/C=C/CC 03d8ab80e9f13fad0cc493c078800673 [1,0,1,0,0,0|2,0,0]=4 1574 B10R0.74 C=C(CC)COC/C=C\CC ed33ac598dd56362b1bc14da7c02baa7 [1,0,1,0,0,0|2,0,0]=4 1575 B10R0.74 CC/C=C/CNCC(=O)NC 63e4c7d7f9817e6f9f8b7dfc36081749 [1,0,1,0,0,0|2,0,0]=4 1576 B10R0.74 CC/C=C/CNCC(=O)OC 19854a993a13e81af2b3e81b0a9b52b8 [1,0,1,0,0,0|2,0,0]=4 1577 B10R0.74 CC/C=C/COCC(=O)CC a01b136a5ca1f88d863986a7bbd53488 [1,0,1,0,0,0|1,0,0]=3 1578 B10R0.74 CC/C=C/COCC(=O)NC 62a1e2bf37767c32bd0352f84e8a2b81 [1,0,1,0,0,0|2,0,0]=4 1579 B10R0.74 CC/C=C/COCC(=O)OC df91b6626dbab8528a78f4a8549ba0f2 [1,0,1,0,0,0|2,0,0]=4 1580 B10R0.74 CC/C=C\COCC(=O)CC 1dc130138fd1a08506cef35fcfe2aa39 [1,0,1,0,0,0|1,0,0]=3 1581 B10R0.74 CC/C=C\COCC(=O)NC 8cdd9bcbcb2dd2013ffb75baa49780e8 [1,0,1,0,0,0|2,0,0]=4 1582 B10R0.74 CC/C=C\COCC(=O)OC 14e106e074a4f78b35a827be1b81d218 [1,0,1,0,0,0|2,0,0]=4 1583 B10R0.41 C=CC(CC)OC/C=C/CC 30a56d1366c22848e075899010f4d17c [1,0,1,0,0,0|1,0,1]=4 1584 B10R0.41 CC/C=C/CNC(CC)CC 753ce02bd7ebb6b9825d8020c02466ff [1,0,1,0,0,0|1,0,1]=4 1585 B10R0.41 CC/C=C/COC(C=O)CC 13e2eeafa9c35e9b4f2b5a9484394963 [1,0,1,0,0,0|1,0,0]=3 1586 B10R0.41 CC/C=C/COC(CC)CC 08eb71737c4b446194132ae3142be354 [1,0,1,0,0,0|1,0,1]=4 1587 B10R0.41 CC/C=C\COC(C=O)CC f1c230c668d6b4ded61633b4508ffb35 [1,0,1,0,0,0|1,0,0]=3 1588 B10R0.41 CC/C=C\COC(CC)CC c4961c23a02350196e54abbbb08aeaef [1,0,1,0,0,0|1,0,1]=4 1589 B10R0.75 CC/C=C/CNC(C)C(=O)N cc936d77d122ac630bf68fa31c16cd3f [1,0,1,0,0,0|2,0,0]=4 1590 B10R0.75 CC/C=C/CNC(C)C(=O)O b73729c0a57a0de61e403e53e5ecf0f8 [1,0,1,0,0,0|2,0,0]=4 1591 B10R0.75 CC/C=C/CN[C@@H](C)C(=O)N c46c652b7cf290c82396340068aded5e [1,0,1,0,0,0|2,0,0]=4 1592 B10R0.75 CC/C=C/CN[C@@H](C)C(=O)O 1c1c73eadc7407db5f3461ca35d35734 [1,0,1,0,0,0|2,0,0]=4 1593 B10R0.75 CC/C=C/CN[C@H](C)C(=O)N d91faf51c75463d8936aa6b5941a40fd [1,0,1,0,0,0|2,0,0]=4 1594 B10R0.75 CC/C=C/CN[C@H](C)C(=O)O 554aacbf0d81fdeb5e13925268740237 [1,0,1,0,0,0|2,0,0]=4 1595 B10R0.75 CC/C=C/COC(C)C(=O)C ad11df17e6181f894f43ffe0def2e3e7 [1,0,1,0,0,0|1,0,0]=3 1596 B10R0.75 CC/C=C/COC(C)C(=O)N 858e4c0f320de4559d065ff8bd3e0b6c [1,0,1,0,0,0|2,0,0]=4 1597 B10R0.75 CC/C=C/COC(C)C(=O)O e63a3abca1262b3f3ebc8a0991fcaa91 [1,0,1,0,0,0|2,0,0]=4 1598 B10R0.75 CC/C=C/CO[C@@H](C)C(=O)N e81eddf9833bfa1c9455f34a8b90441b [1,0,1,0,0,0|2,0,0]=4 1599 B10R0.75 CC/C=C/CO[C@@H](C)C(=O)O d03a90621c9beefcf422a2e33c398b7b [1,0,1,0,0,0|2,0,0]=4 1600 B10R0.75 CC/C=C/CO[C@H](C)C(=O)N d1d34bf675a233da1794c57e0b25d558 [1,0,1,0,0,0|2,0,0]=4 1601 B10R0.75 CC/C=C/CO[C@H](C)C(=O)O 348bfb69d3b27b412a2c506d8783ae3f [1,0,1,0,0,0|2,0,0]=4 1602 B10R0.75 CC/C=C\COC(C)C(=O)C 0d8c0ebbda1c8f2ecbeaab0690705d4a [1,0,1,0,0,0|1,0,0]=3 1603 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[1,0,1,0,0,0|2,0,0]=4 1614 B10R0.86 C/C=C/CO[C@H](CC)C(=O)O 21a13625707c56c603ed09ee8c4646d9 [1,0,1,0,0,0|2,0,0]=4 1615 B10R0.86 C/C=C\CNC(CC)C(=O)N 298883709d7d5f4f7300d11523d01ff6 [1,0,1,0,0,0|2,0,0]=4 1616 B10R0.86 C/C=C\CNC(CC)C(=O)O 09a0a35e9d89993157e01f58842b4922 [1,0,1,0,0,0|2,0,0]=4 1617 B10R0.86 C/C=C\CN[C@@H](CC)C(=O)N fce41f5614e8a0dd53f0bfe68b2521a1 [1,0,1,0,0,0|2,0,0]=4 1618 B10R0.86 C/C=C\CN[C@@H](CC)C(=O)O 3c9cd02ff6a8730a17d9da27d6736974 [1,0,1,0,0,0|2,0,0]=4 1619 B10R0.86 C/C=C\CN[C@H](CC)C(=O)O c3eea7aa9e74d8c90e2e0ed320350e5b [1,0,1,0,0,0|2,0,0]=4 1620 B10R0.86 C/C=C\COC(CC)C(=O)N 887201f2ada36bde0dc3f4886023dda3 [1,0,1,0,0,0|2,0,0]=4 1621 B10R0.86 C/C=C\COC(CC)C(=O)O 69034239148f6b5a99c74159ae0f99e9 [1,0,1,0,0,0|2,0,0]=4 1622 B10R0.86 C/C=C\CO[C@@H](CC)C(=O)O 62331d3ba0b15efeb487c25a424fe44c [1,0,1,0,0,0|2,0,0]=4 1623 B10R0.86 C/C=C\CO[C@H](CC)C(=O)O 648b6ce28f05235933533f6dc95ed8ac [1,0,1,0,0,0|2,0,0]=4 1624 B10R0.86 CC=CCNC(CC)C(=O)N 846e10adf4a8d98a81a6c94c6c15cb6d [1,0,1,0,0,0|2,0,0]=4 1625 B10R0.86 CC=CCNC(CC)C(=O)O 97922add6f9da7abbb6c24e42bffaa21 [1,0,1,0,0,0|2,0,0]=4 1626 B10R0.86 CC=CCN[C@@H](CC)C(=O)O c7d3585ee7835c3372aa2f7199c5fb69 [1,0,1,0,0,0|2,0,0]=4 1627 B10R0.86 CC=CCN[C@H](CC)C(=O)O 8c005286f6f6e9354f4f9213659c2eca [1,0,1,0,0,0|2,0,0]=4 1628 B10R0.86 CC=CCOC(CC)C(=O)N 70ed4aaa427277c91adaeb2075d6ca88 [1,0,1,0,0,0|2,0,0]=4 1629 B10R0.86 CC=CCOC(CC)C(=O)O c5539e8e9fd16db7dabdcf2fbc762851 [1,0,1,0,0,0|2,0,0]=4 1630 B10R0.86 CC=CCO[C@@H](CC)C(=O)O 231e79df75c48bd6b5e25da2e546ebfb [1,0,1,0,0,0|2,0,0]=4 1631 B10R0.86 CC=CCO[C@H](CC)C(=O)O 6a1d132c3c0d71b3a00c90575d890d1c [1,0,1,0,0,0|2,0,0]=4 1632 B10R0.86 CCOCCN(CC)C(=O)C acc81bd1c5329e990bd9e237645a8b2b [1,0,1,0,0,0|2,0,0]=4 1633 B10R0.83 C/C=C/CNC(C)C(=O)NC 19f1960b468ff4bb4dd78b65ae51b53e [1,0,1,0,0,0|2,0,0]=4 1634 B10R0.83 C/C=C/COC(C)C(=O)CC 4a192fdf10d514a5c5493950bd654ced [1,0,1,0,0,0|1,0,0]=3 1635 B10R0.83 C/C=C/COC(C)C(=O)OC fd85a35618b571918683a23e84f08ded [1,0,1,0,0,0|2,0,0]=4 1636 B10R0.83 C/C=C/CO[C@@H](C)C(=O)OC 44db5ef15d376be76c94f11e8f51534e [1,0,1,0,0,0|2,0,0]=4 1637 B10R0.83 C/C=C/CO[C@H](C)C(=O)OC 00bb7168235bbca18e48c0437c9ce5c9 [1,0,1,0,0,0|2,0,0]=4 1638 B10R0.83 C/C=C\CNC(C)C(=O)NC b8e8b01dac92c64be1be33e4931fc260 [1,0,1,0,0,0|2,0,0]=4 1639 B10R0.83 C/C=C\COC(C)C(=O)CC 6e1b62fff2c4a530bb993ff2ad435ea2 [1,0,1,0,0,0|1,0,0]=3 1640 B10R0.83 C/C=C\COC(C)C(=O)OC 8152f55821681b5ae333a4ad3adb522e [1,0,1,0,0,0|2,0,0]=4 1641 B10R0.83 C/C=C\CO[C@@H](C)C(=O)OC ebb3c57b099bfd5861642390d3d0e47e [1,0,1,0,0,0|2,0,0]=4 1642 B10R0.83 C/C=C\CO[C@H](C)C(=O)OC 3569ae167394b399f74eeeb1db4fbb22 [1,0,1,0,0,0|2,0,0]=4 1643 B10R0.83 CC=CCNC(C)C(=O)CC 004197f8a5389a94e52fe7ad06c58523 [1,0,1,0,0,0|1,0,0]=3 1644 B10R0.83 CC=CCNC(C)C(=O)NC fad1ef9bd88eec74f5caac616f8af00a [1,0,1,0,0,0|2,0,0]=4 1645 B10R0.83 CC=CCNC(C)C(=O)OC e40b8e6fa71c87c5449320d0a3d6ae04 [1,0,1,0,0,0|2,0,0]=4 1646 B10R0.83 CC=CCN[C@@H](C)C(=O)OC 337427131f1636606806fa8ed9d63ad2 [1,0,1,0,0,0|2,0,0]=4 1647 B10R0.83 CC=CCN[C@H](C)C(=O)OC d337912d17e44c9ba49d8039d75edc67 [1,0,1,0,0,0|2,0,0]=4 1648 B10R0.83 CC=CCOC(C)C(=O)CC 79fc9895be2fbab163a142d047b056e7 [1,0,1,0,0,0|1,0,0]=3 1649 B10R0.83 CC=CCOC(C)C(=O)OC 62cdd8948f53e1b08dbafd50426c6b96 [1,0,1,0,0,0|2,0,0]=4 1650 B10R0.83 CC=CCO[C@@H](C)C(=O)OC d24a0e1b6c97fae2215f52ec356473eb [1,0,1,0,0,0|2,0,0]=4 1651 B10R0.83 CC=CCO[C@H](C)C(=O)OC 86803194511166edfb1cefeef825cb5e [1,0,1,0,0,0|2,0,0]=4 1652 B10R0.83 CCC(=O)C(C)OC/C=C/Cl c8f05e038313a68c02152fa2bc698d47 [1,0,1,0,0,0|2,0,0]=4 1653 B10R0.83 CCC(=O)C(C)OCC=CCl ecb3e1a3c8b77212e26d9848d7dca0e8 [1,0,1,0,0,0|2,0,0]=4 1654 B10R0.83 CCCCCN(C)C(=O)CC b714f204559ab56e69d035e1a6eb55ad [1,0,1,0,0,0|1,0,1]=4 1655 B10R0.83 CCCCNC(C)C(=O)CC 0b8cc318bd42138f4fec3c3c2490d8fc [1,0,1,0,0,0|1,0,1]=4 1656 B10R0.83 CCCCOC(C)C(=O)CC 6b72afd5b0a419f5df66b8ed25e56ddc [1,0,1,0,0,0|1,0,1]=4 1657 B10R0.83 CCOCCN(C)C(=O)CC 648e2f7d04c6b92d5d49095b4484ab9d [1,0,1,0,0,0|2,0,0]=4 1658 B10R0.24 C=CC(CCC)OC/C=C/C 9a5fca9d2fb65ba388510ae1f1617456 [1,0,1,0,0,0|2,0,0]=4 1659 B10R0.24 C=CC(CCC)OC/C=C\C 903015bf7745de9beba81ae12adc95df [1,0,1,0,0,0|2,0,0]=4 1660 B10R0.24 CCCCCN(C=O)CCC 8646abf1faa254eafc312659290c903a [1,0,1,0,0,0|1,0,1]=4 1661 B10R1.21 C/C=C/CNC1CCCC1 f261ba78d73aae5efe1c061484a44dc5 [2,0,0,0,0,0|1,0,1]=4 1662 B10R1.21 C/C=C/COC1C=CCC1 8fda2f524c25e0b2fc67d17e71fa2435 [2,0,0,0,0,0|1,0,1]=4 1663 B10R1.21 C/C=C/COC1CCCC1 bdbe26064b4f1863e9e15d1f2890bcc9 [2,0,0,0,0,0|1,0,1]=4 1664 B10R1.21 C/C=C/COC1CCCO1 065398478186a46e3ebaa26095b8a6f8 [2,0,0,0,0,0|2,0,0]=4 1665 B10R1.21 C/C=C\CNC1CCCC1 9614c506fb7f31ee4e5e7974a724d35e [2,0,0,0,0,0|1,0,1]=4 1666 B10R1.21 C/C=C\COC1C=CCC1 2c0e7503bfe586287d687fed48161218 [2,0,0,0,0,0|1,0,1]=4 1667 B10R1.21 C/C=C\COC1CCCC1 e236b932345e43e30b00a93f0ddc53e0 [2,0,0,0,0,0|1,0,1]=4 1668 B10R1.21 C/C=C\COC1CCCO1 236cfb7898a43610c2ad370e000ea3a3 [2,0,0,0,0,0|2,0,0]=4 1669 B10R1.21 CC=CCNC1CCCC1 c8872ea926c5c73bcb9674987bc73c88 [2,0,0,0,0,0|1,0,1]=4 1670 B10R1.21 CC=CCOC1CCCC1 5b0a62dfdbdaa58d7ad6eb6ae47e96b7 [2,0,0,0,0,0|1,0,1]=4 1671 B10R1.21 CCNCCC1CCCC1 4298e7da1f2a581aa4744ee10a845ea5 [2,0,0,0,0,0|1,0,1]=4 1672 B10R1.21 CCNCCC1CCCO1 ec581c3d19e3b2a023c62cdb86e4dc14 [2,0,0,0,0,0|2,0,0]=4 1673 B10R1.21 CCOCCC1CCCC1 635c7a31aec6fa4a0699c0f9f96cad8a [2,0,0,0,0,0|1,0,1]=4 1674 B10R1.21 CCOCCC1CCCO1 259f96ba320a3b49deb223b863f40fa3 [2,0,0,0,0,0|2,0,0]=4 1675 B10R1.29 C=CCNC1CCNC1=O b52ff4f80d13277b660ee5c2a11eccc4 [2,0,0,0,0,0|2,0,0]=4 1676 B10R1.29 C=CCNC1CCSC1=O 6e9ffe80ce0ab62261a8191cbdb866aa [2,0,0,0,0,0|2,0,0]=4 1677 B10R1.29 C=CCN[C@@H]1CCNC1=O ce96b6618fed311336c6034d1d3e9c5d [2,0,0,0,0,0|2,0,0]=4 1678 B10R1.29 C=CCN[C@@H]1CCOC1=O d6154d084ee2779ad7e85a27d4df18fd [2,0,0,0,0,0|2,0,0]=4 1679 B10R1.29 C=CCN[C@H]1CCNC1=O 5e2b88ef89cdbba9eaa370b61768de51 [2,0,0,0,0,0|2,0,0]=4 1680 B10R1.29 C=CCN[C@H]1CCOC1=O d685f9edc04f02dcf1ac56cc7d516e32 [2,0,0,0,0,0|2,0,0]=4 1681 B10R1.29 C=CCOC1CCCC1=O 5ff875b2b7a0ee8c8572dd815a4d957f [2,0,0,0,0,0|1,0,0]=3 1682 B10R1.29 C=CCOC1CCNC1=O e1e83f23d61ad82a87951320ba3ef8f1 [2,0,0,0,0,0|2,0,0]=4 1683 B10R1.29 C=CCOC1CCOC1=O 6c3d19d58bb2b1228716506b6f2d616c [2,0,0,0,0,0|2,0,0]=4 1684 B10R1.29 C=CCO[C@@H]1CCNC1=O ffc7a7e907b26286503e2dfeec9c6b31 [2,0,0,0,0,0|2,0,0]=4 1685 B10R1.29 C=CCO[C@@H]1CCOC1=O 1995cc2c262c20b377fe79a1da93fe5e [2,0,0,0,0,0|2,0,0]=4 1686 B10R1.29 C=CCO[C@H]1CCNC1=O 75e035e224a02236fc72662dcec8f4f4 [2,0,0,0,0,0|2,0,0]=4 1687 B10R1.29 C=CCO[C@H]1CCOC1=O 77996eb527d9685bed2037afd820a46a [2,0,0,0,0,0|2,0,0]=4 1688 B10R1.29 CCCNC1CCCC1=O 92270db65b4e768bf74c060f3ddca1d2 [2,0,0,0,0,0|1,0,0]=3 1689 B10R1.29 CCCNC1CCNC1=O 826c3328fa4dd7dd5dd8c3d568a3408e [2,0,0,0,0,0|2,0,0]=4 1690 B10R1.29 CCCNC1CCSC1=O 2f88eaf0893fc5d79036a5fe5a76847c [2,0,0,0,0,0|2,0,0]=4 1691 B10R1.29 CCCN[C@@H]1CCNC1=O 881bee3ef919f2d395ee9f82cce415b2 [2,0,0,0,0,0|2,0,0]=4 1692 B10R1.29 CCCN[C@@H]1CCOC1=O 093e5b8bf1b7aee96a6d4b18a27dd8a3 [2,0,0,0,0,0|2,0,0]=4 1693 B10R1.29 CCCN[C@H]1CCNC1=O 28513bf65ca36f558ae2e34f11c0860c [2,0,0,0,0,0|2,0,0]=4 1694 B10R1.29 CCCN[C@H]1CCOC1=O 6fb700cd323815a8f11591a44ec6a9ee [2,0,0,0,0,0|2,0,0]=4 1695 B10R1.29 CCCOC1CCCC1=O 6b93fa99d3716532fe6b9fa26488dd4e [2,0,0,0,0,0|1,0,0]=3 1696 B10R1.29 CCCOC1CCNC1=O 53dd243a9f8f1e7eacf3fc4b0133cfbe [2,0,0,0,0,0|2,0,0]=4 1697 B10R1.29 CCCOC1CCOC1=O 81b1a44df3caf13a7904e6e1637022cc [2,0,0,0,0,0|2,0,0]=4 1698 B10R1.29 CCCO[C@@H]1CCNC1=O defea96294aac13f1e3bb47afec7acb5 [2,0,0,0,0,0|2,0,0]=4 1699 B10R1.29 CCCO[C@@H]1CCOC1=O a61cf9ea463c92a0de26354c56c59a42 [2,0,0,0,0,0|2,0,0]=4 1700 B10R1.29 CCCO[C@H]1CCNC1=O 0c65acf6b283fd1270fb0902388bc278 [2,0,0,0,0,0|2,0,0]=4 1701 B10R1.29 CCCO[C@H]1CCOC1=O 0ca8453d27df7ed3deef2a5f6389b306 [2,0,0,0,0,0|2,0,0]=4 1702 B10R1.29 CCNCC1CCNC1=O cfa18f78ea048520c0930de42321c56e [2,0,0,0,0,0|2,0,0]=4 1703 B10R1.29 CCOCC1CCCC1=O 4cec2785468e0a623009b869bd6f12fe [2,0,0,0,0,0|1,0,0]=3 1704 B10R1.29 CCOCC1CCNC1=O a7897437545e0e6eb8d60f714a585f46 [2,0,0,0,0,0|2,0,0]=4 1705 B10R1.29 CCOCN1CCCC1=O f60cc8131648e9114d88fd2170c106e5 [2,0,0,0,0,0|2,0,0]=4 1706 B10R1.29 COCOC1CCCC1=O 99ae3d640fc5b5b82d50a7c2a08dc381 [2,0,0,0,0,0|2,0,0]=4 1707 B10R1.29 CSCOC1CCCC1=O 78c5762b883610ef1d622e4151d61a47 [2,0,0,0,0,0|2,0,0]=4 1708 B10R1.29 O=C1CCCC1COCF 2677f7e38192aa3f9766c71ca7874350 [2,0,0,0,0,0|2,0,0]=4 1709 B10R1.29 O=C1CCCC1NCCBr 290d3c72b0f0ece08be4b88910ed41af [2,0,0,0,0,0|2,0,0]=4 1710 B10R1.29 O=C1CCCC1NCCI bc8f7bd50f547f74fa5fcbb6da0febc5 [2,0,0,0,0,0|2,0,0]=4 1711 B10R1.29 O=C1CCCC1NCCO c0c0b931d9c69710892d72abef2c7869 [2,0,0,0,0,0|2,0,0]=4 1712 B10R1.29 O=C1CCCC1NCCS ced2dcba1c7d80e404bf89a0a611c948 [2,0,0,0,0,0|2,0,0]=4 1713 B10R1.29 O=C1CCCC1OCCF 0174d93134951fe7900bc47f43e53e9e [2,0,0,0,0,0|2,0,0]=4 1714 B10R1.29 O=C1CCCC1OCCS 8c0da7cd7435196cda6a567a58e043c9 [2,0,0,0,0,0|2,0,0]=4 1715 B10R1.29 O=CCOC1CCCC1=O 4eff49ffc86550920140ccf5b8449986 [2,0,0,0,0,0|2,0,0]=4 1716 B12R0.1 C=CCC(C)COCC/C=C/CC 0caed9e492e9f5cb351482c27f0dfd7b [0,1,1,0,0,0|2,0,0]=4 1717 B12R0.1 C=CCC(C)COCC/C=C\CC d2a11a40b3d93509e3f0898dc5045799 [0,1,1,0,0,0|2,0,0]=4 1718 B12R0.1 C=CCC(O)CNCC/C=C\CC 14b5064937840c6373e4f61d592396c8 [0,1,1,0,0,0|2,0,0]=4 1719 B12R0.1 CCCC(=O)COCCCCC=O beee483473efcf814efdf8e12d1f3bc5 [0,1,1,0,0,0|1,0,1]=4 1720 B12R0.1 CCCC(=S)OCCCCCC=O d0c8655e54388cc2eab73b3485db4342 [0,1,1,0,0,0|1,0,1]=4 1721 B12R0.1 CCCN(C)CCCCCCC=O dffc5758b7394afde6305fbacbbc1840 [0,1,1,0,0,0|1,0,1]=4 1722 B12R0.1 CCNC(=O)CCOCCCC=O 283218332c0bbdea19f2aab353002fa0 [0,1,1,0,0,0|2,0,0]=4 1723 B12R0.1 CCNC(=O)CNCCCCC=O cb2ed47588ddc772008c137542ff811f [0,1,1,0,0,0|2,0,0]=4 1724 B12R0.1 CCNC(=O)COCCCCC=O ec274109c8c393a19c7ed1a2797e6445 [0,1,1,0,0,0|2,0,0]=4 1725 B12R0.1 CCOC(=O)CCCCCNC=O 99038442ab0550a5bcf3317f15529e47 [0,1,1,0,0,0|2,0,0]=4 1726 B12R0.1 CCOC(=O)CCCCOCC=O 988378328243c917302bdccf60924c95 [0,1,1,0,0,0|2,0,0]=4 1727 B12R0.1 CCOC(=O)CCCNCCC=O 296c65a0ed52eb828bb9efba30b2729a [0,1,1,0,0,0|2,0,0]=4 1728 B12R0.1 CCOC(=O)CCCOCCC=O d3f4b5e0077d90a478521cdc0de46b75 [0,1,1,0,0,0|2,0,0]=4 1729 B12R0.1 CCOC(=O)CCNCCCC=O 06c2aa097ec584b003679c085f797f85 [0,1,1,0,0,0|2,0,0]=4 1730 B12R0.1 CCOC(=O)CCOCCCC=O 0a162877a85606d781b61cc7e363f013 [0,1,1,0,0,0|2,0,0]=4 1731 B12R0.1 CCOC(=O)CNCCCCC=O e784c4db38543fc7782571a0ecafb75d [0,1,1,0,0,0|2,0,0]=4 1732 B12R0.1 CCOC(=O)COCCCCC=O 8bbea6e9d9b52cb43a4bbf3454a822f3 [0,1,1,0,0,0|2,0,0]=4 1733 B12R0.5 C#CCCCCCNC/C=C/CC 3f943f98ffe79bcf7ac2cb827c16553b [0,1,1,0,0,0|1,0,1]=4 1734 B12R0.5 C#CCCCCCOC/C=C/CC eb68f7716ace8b6df51ec62e593b40fd [0,1,1,0,0,0|1,0,1]=4 1735 B12R0.5 C#CCCCCCOC/C=C\CC b9c6ee664054706d314527bdd10b861e [0,1,1,0,0,0|1,0,1]=4 1736 B12R0.5 C#CCCCCNCC/C=C\CC 7179518e700d69d56345caad39e5ed07 [0,1,1,0,0,0|1,0,1]=4 1737 B12R0.5 C#CCCCCOCC/C=C/CC c383c25d19ec73e4380b5d69abb69453 [0,1,1,0,0,0|1,0,1]=4 1738 B12R0.5 C#CCCCCOCC/C=C\CC fcbdf598fb174ea504deeac24f7502de [0,1,1,0,0,0|1,0,1]=4 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3444c86c4f615ee03f677d0c8e020da2 [0,1,1,0,0,0|2,0,0]=4 1774 B12R0.5 C=CCOCCOCC/C=C\CC 3a155914e91618c9ea011dbaf7080c4f [0,1,1,0,0,0|2,0,0]=4 1775 B12R0.5 C=COCCCCOC/C=C/CC d2d4b1cd3ff38dd77412840fd16413ab [0,1,1,0,0,0|2,0,0]=4 1776 B12R0.5 C=COCCCNCC/C=C\CC 8f7c2a4381ae39654033fad3a0fb1da3 [0,1,1,0,0,0|2,0,0]=4 1777 B12R0.5 CC/C=C/CC/C=C/COCC=O 3b18b0492429cff41c78dadc207a8dbd [0,1,1,0,0,0|0,0,2]=4 1778 B12R0.5 CC/C=C/CCOCCCCC#N 705eafe11f5645564edf1fe0642c3c30 [0,1,1,0,0,0|1,0,1]=4 1779 B12R0.5 CC/C=C/CCOCCCCC=O 6d55b6e6a4837cfb96478f243218bd95 [0,1,1,0,0,0|0,0,0]=2 1780 B12R0.5 CC/C=C/CCOCCCCCC 767871e5a0d73feb9eb5a7defcfb49c5 [0,1,1,0,0,0|1,0,1]=4 1781 B12R0.5 CC/C=C/CCOCCCCCF 2b55f02c10e3ccdd6df31b1e0ba6a449 [0,1,1,0,0,0|1,0,1]=4 1782 B12R0.5 CC/C=C/CCOCCCCOC e2b39f528317979cb9d1de9d5265ad73 [0,1,1,0,0,0|2,0,0]=4 1783 B12R0.5 CC/C=C/CCOCCOCC=O f5e36313acd2026f2352355ac9a94ba5 [0,1,1,0,0,0|1,0,0]=3 1784 B12R0.5 CC/C=C/CNCCCCCC#N 5f91c1da1192a389b78de6d70a602fd2 [0,1,1,0,0,0|1,0,1]=4 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B12R0.5 CC/C=C\CCCCCOCOC bff16d3142ae4a79dedeab3cc89e4313 [0,1,1,0,0,0|2,0,0]=4 1809 B12R0.5 CC/C=C\CCCCCOCSC ab40f0b80d750f4f0d4471f4cc0a86c1 [0,1,1,0,0,0|2,0,0]=4 1810 B12R0.5 CC/C=C\CCCCOC/C=C/Cl 85890dc892bb08c7005d88d35d53442c [0,1,1,0,0,0|1,0,1]=4 1811 B12R0.5 CC/C=C\CCCCOC/C=C\Cl 5431e14b66b4a22dda4fa4fce121ae7f [0,1,1,0,0,0|1,0,1]=4 1812 B12R0.5 CC/C=C\CCCCOCCC#N fa30d1052d47c5e5334d61401149adfc [0,1,1,0,0,0|1,0,1]=4 1813 B12R0.5 CC/C=C\CCCCOCCC=O 20a50154e295dea1cb35b59b3cf31e50 [0,1,1,0,0,0|0,0,0]=2 1814 B12R0.5 CC/C=C\CCCCOCCCC ae170e71a50bb653be2dba2606dad3f4 [0,1,1,0,0,0|1,0,1]=4 1815 B12R0.5 CC/C=C\CCCCOCCCF 4d330ab861b6af2483c52bf0bcaa5069 [0,1,1,0,0,0|1,0,1]=4 1816 B12R0.5 CC/C=C\CCCCOCCCS c2a1bcf54749b9359c31dd3cc6c81cb3 [0,1,1,0,0,0|0,1,1]=4 1817 B12R0.5 CC/C=C\CCCCOCCOC 176bab47df541131235f1983146c69c1 [0,1,1,0,0,0|2,0,0]=4 1818 B12R0.5 CC/C=C\CCCCOCCSC 3688e500590a0e5a2f793fd0964ddfc3 [0,1,1,0,0,0|2,0,0]=4 1819 B12R0.5 CC/C=C\CCCOCCCC#N 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B12R0.5 CC/C=C\CCOCCCCC#N 3f837ec2be81ca026659778c5ae7f5f6 [0,1,1,0,0,0|1,0,1]=4 1832 B12R0.5 CC/C=C\CCOCCCCC=O 0f8dc160371f8f38e3ede5953a911f59 [0,1,1,0,0,0|0,0,0]=2 1833 B12R0.5 CC/C=C\CCOCCCCCC 117d4e26b4f19482ce885b8297aa45c2 [0,1,1,0,0,0|1,0,1]=4 1834 B12R0.5 CC/C=C\CCOCCCCCF 6fb45212300edcfa96669f4cc7373ec4 [0,1,1,0,0,0|1,0,1]=4 1835 B12R0.5 CC/C=C\CCOCCCCOC c0830f32361612f79a3ed408b3777eb6 [0,1,1,0,0,0|2,0,0]=4 1836 B12R0.5 CC/C=C\CCOCCCCSC a7f64699d7d5aa3195d03046c1e80d72 [0,1,1,0,0,0|2,0,0]=4 1837 B12R0.5 CC/C=C\CCOCCOCC=O 69cb7f1d53acdbbc6fcd0f4321857537 [0,1,1,0,0,0|1,0,0]=3 1838 B12R0.5 CC/C=C\COCCCCCC#N 487788383a9a6603ceef52bf34b4b139 [0,1,1,0,0,0|1,0,1]=4 1839 B12R0.5 CC/C=C\COCCCCCC=O 4c7b25cdbd5f1b25be49bd2c2f8e4ffe [0,1,1,0,0,0|0,0,0]=2 1840 B12R0.5 CC/C=C\COCCCCCCC 77fa88fde0cce04fe5442e2aa45989e5 [0,1,1,0,0,0|1,0,1]=4 1841 B12R0.5 CC/C=C\COCCCCCCF 17b221ff13a4e30ab288c45536a65f71 [0,1,1,0,0,0|1,0,1]=4 1842 B12R0.5 CC/C=C\COCCCCCOC 38e9bf0627a08f1dd4c499539ac92400 [0,1,1,0,0,0|2,0,0]=4 1843 B12R0.5 CC=C=CCCOCCCCC=O 7421d8f135078307c61f3d396146a035 [0,1,1,0,0,0|0,0,2]=4 1844 B12R0.5 CC=CC=CCOCCCCC=O 0e46a742a883633d52e1044148bd69c8 [0,1,1,0,0,0|0,0,2]=4 1845 B12R0.5 CC=CCCCOCC/C=C\CC 8a9ded81b3b0bb8697c200a61a20c1f5 [0,1,1,0,0,0|1,0,1]=4 1846 B12R0.5 CC=CCCCOCCCCC=O 54014bbd72895389203d0e38da758183 [0,1,1,0,0,0|0,0,2]=4 1847 B12R0.5 CC=CCNCCCCCCC=O 8c49dafa950bf58c6b302fe7bc3ee69d [0,1,1,0,0,0|0,0,2]=4 1848 B12R0.5 CC=CCOCCCCCCC=O 52c0ea617c1b8a928ca14ca95bab3fdf [0,1,1,0,0,0|0,0,2]=4 1849 B12R0.5 CCC#CCCOCCCCC=O a04daccd3d6442ea510a1f4a6702bb0d [0,1,1,0,0,0|0,0,2]=4 1850 B12R0.5 CCC#CCOCCCCCC=O f5f746690b3c06f0ce20a8c05d99bd44 [0,1,1,0,0,0|0,0,2]=4 1851 B12R0.5 CCC/C=C/CCCOCCC=O 9370892c7b0e91b1d784e3bf66175de6 [0,1,1,0,0,0|1,0,0]=3 1852 B12R0.5 CCC/C=C/COCCCCC=O 175980462845d74433ac2d4504e2a46d [0,1,1,0,0,0|1,0,0]=3 1853 B12R0.5 CCC/C=C/COCCOCC=O ce10e502cbc4a90e84354080b0b21e56 [0,1,1,0,0,0|2,0,0]=4 1854 B12R0.5 CCC/C=C\CCCOCCC=O ad6c2b70d24c790e6008cfa32c0daebd [0,1,1,0,0,0|1,0,0]=3 1855 B12R0.5 CCC/C=C\CCOCCCC=O dcaf05ab84b68c38f82e96f33e82d12f [0,1,1,0,0,0|1,0,0]=3 1856 B12R0.5 CCC/C=C\COCCCCC=O 875a9580aca15745b2a34b1d831bd716 [0,1,1,0,0,0|1,0,0]=3 1857 B12R0.5 CCC/C=C\COCCOCC=O 2d708ea87eca5680c4ba58242f78c267 [0,1,1,0,0,0|2,0,0]=4 1858 B12R0.5 CCC=CCC=CCCOCC=O f19c54178281588d24903fda440b3b67 [0,1,1,0,0,0|0,0,2]=4 1859 B12R0.5 CCC=CCCC=CCOCC=O 03c980d112e6e79d3e274cea24f6726d [0,1,1,0,0,0|0,0,2]=4 1860 B12R0.5 CCC=CCCCCCOCC#N d887235a74b2a1f938ca140447bbf92f [0,1,1,0,0,0|1,0,1]=4 1861 B12R0.5 CCC=CCCCCCOCC=O 35f5484b716447ca9f948dd3dc5b6357 [0,1,1,0,0,0|0,0,0]=2 1862 B12R0.5 CCC=CCCCCCOCCC a1e5b51b658af73fa132b283edd1b582 [0,1,1,0,0,0|1,0,1]=4 1863 B12R0.5 CCC=CCCCCCOCCF c35e5af75001db9cd3ac5d56d7ec011b [0,1,1,0,0,0|1,0,1]=4 1864 B12R0.5 CCC=CCCCCCOCCS 54480ebfaa3ca46cc7d1fb2a7d8f5eb5 [0,1,1,0,0,0|0,1,1]=4 1865 B12R0.5 CCC=CCCCCCOCOC 328ac4efca7471f47d0b79af1857f482 [0,1,1,0,0,0|2,0,0]=4 1866 B12R0.5 CCC=CCCCCCOCSC d04d8ff7268c84199eb705a530fc625a [0,1,1,0,0,0|2,0,0]=4 1867 B12R0.5 CCCCCCCCCCNC=O 1537f14124df364d279abcf5b660d0c5 [0,1,1,0,0,0|0,0,2]=4 1868 B12R0.5 CCCCCCCCCNCC=O 3553ec83c2ba17cf5ee24ef3c87e1ab1 [0,1,1,0,0,0|0,0,2]=4 1869 B12R0.5 CCCCCCCCCOCC=O 4b28d29150f193742f2a23373046bf98 [0,1,1,0,0,0|0,0,2]=4 1870 B12R0.5 CCCCCCCCNCCC=O c63b4d3dda11ab1f15fca12549c294f9 [0,1,1,0,0,0|0,0,2]=4 1871 B12R0.5 CCCCCCCCOCCC=O d5590d4e338368a5ce166fd30f905848 [0,1,1,0,0,0|0,0,2]=4 1872 B12R0.5 CCCCCCCNCCCC=O 585c2de31b042ea27632ddc61b31272f [0,1,1,0,0,0|0,0,2]=4 1873 B12R0.5 CCCCCCCOCCCC=O a2f9552506f2014609248faf87b21fa0 [0,1,1,0,0,0|0,0,2]=4 1874 B12R0.5 CCCCCCNCCCCC=O 02ed7ddbeee0c8680654413663afd4e6 [0,1,1,0,0,0|0,0,2]=4 1875 B12R0.5 CCCCCCOCCCCC=O 8d79f2e0847cc796c48cf03a84be16d9 [0,1,1,0,0,0|0,0,2]=4 1876 B12R0.5 CCCCCNCCCCCC=O 94a027e2122ac62fbcb81bda6cf6c8a6 [0,1,1,0,0,0|0,0,2]=4 1877 B12R0.5 CCCCCOCCCCCC=O 86a9ac24a54eb8ff4ef6f9626ffa179c [0,1,1,0,0,0|0,0,2]=4 1878 B12R0.5 CCCCNCCCCCCC=O 8acf1384b6868103b5f69e76077259af [0,1,1,0,0,0|0,0,2]=4 1879 B12R0.5 CCCCOCCCCCCC=O 28134e772868132f33bd474b6dac0ea3 [0,1,1,0,0,0|0,0,2]=4 1880 B12R0.5 CCCOCCCNCCCC=O 396016f093025d88f6b509268ca373c6 [0,1,1,0,0,0|1,0,1]=4 1881 B12R0.5 CCCOCCCOCCCC=O a3792f78e8c5e37a194b415697c086dd [0,1,1,0,0,0|1,0,1]=4 1882 B12R0.5 CCCOCCNCCCCC=O 2da96110958816acdaaee43eba4ae428 [0,1,1,0,0,0|1,0,1]=4 1883 B12R0.5 CCCOCCOCCCCC=O 99a73c6a4ef87248c57193e8d7cba99c [0,1,1,0,0,0|1,0,1]=4 1884 B12R0.5 CCCSCCCCNCCC=O 4c0542a1c0169f110e72e017cbf91eb9 [0,1,1,0,0,0|1,0,1]=4 1885 B12R0.5 CCCSCCOCCCCC=O f5d1cdcc1d12f65df6a1b2605af32db6 [0,1,1,0,0,0|1,0,1]=4 1886 B12R0.5 CCOCCCNCCCCC=O 734f0af3d21812ff67e29e5a1fa3fabb [0,1,1,0,0,0|1,0,1]=4 1887 B12R0.5 CCOCCCOCCCCC=O b3d7c7da518a24858e059f51aefb4e1b [0,1,1,0,0,0|1,0,1]=4 1888 B12R0.5 CCOCCNCCCCCC=O 81e918be13e1a06bbca8f2f7e60cd2b4 [0,1,1,0,0,0|1,0,1]=4 1889 B12R0.5 CCOCCOCCCCCC=O 48a23b64265ed8af5f6bc5e6020d4653 [0,1,1,0,0,0|1,0,1]=4 1890 B12R0.5 CCSCCCCNCCCC=O 7aee4f378bf1233c9962846ab5fd1a5b [0,1,1,0,0,0|1,0,1]=4 1891 B12R0.5 CCSCCCOCCCCC=O 1bb0c72b7686edda1d149a15030d0b25 [0,1,1,0,0,0|1,0,1]=4 1892 B12R0.5 CCSCCNCCCCCC=O 247c86c6ab10484d2fa204e84cea9c79 [0,1,1,0,0,0|1,0,1]=4 1893 B12R0.5 CCSCCOCCCCCC=O ddc4f47cb182b014ab6e7aff0819b71d [0,1,1,0,0,0|1,0,1]=4 1894 B12R0.5 COCCNCCCCCCC=O 9473dd6b8594fdf2fec7aef4c556c902 [0,1,1,0,0,0|1,0,1]=4 1895 B12R0.5 COCCOCCCCCCC=O 5d4772fc866c2ede5f292e7cc1d4458f [0,1,1,0,0,0|1,0,1]=4 1896 B12R0.5 CSCCNCCCCCCC=O 38403c1dddd2f86895712394ff5282f7 [0,1,1,0,0,0|1,0,1]=4 1897 B12R0.5 CSCCOCCCCCCC=O e586d05d105e5608c94e081a6e3866ba [0,1,1,0,0,0|1,0,1]=4 1898 B12R0.5 O=C/C=C/COCCCCCC=O 510ae7d837bad9bd9e1d57ae34cd3c29 [0,1,1,0,0,0|1,0,1]=4 1899 B12R0.5 O=CCCCCCCNCCCCl 1b631fcd6c284f12fa58af0dadcf136a [0,1,1,0,0,0|1,0,1]=4 1900 B12R0.5 O=CCCCCCCNCCCO b0d16c90b38b9479b454f20d66afce9f [0,1,1,0,0,0|1,0,1]=4 1901 B12R0.5 O=CCCCCCCOCCCF 3c0bb3a9341015fb79f163f42cb3ef21 [0,1,1,0,0,0|1,0,1]=4 1902 B12R0.5 O=CCCCCCCOCCCS 85aefa3fca1d2923efb3caa0960eef72 [0,1,1,0,0,0|1,0,1]=4 1903 B12R0.47 C=CCCCCN(C)C/C=C/CC e956963633b124c1b8306276c16ae2e4 [0,1,1,0,0,0|2,0,0]=4 1904 B12R0.47 C=CCCCN(C)CC/C=C\CC 7f73b048570043d5d26aa6210db2a03a [0,1,1,0,0,0|2,0,0]=4 1905 B12R0.47 C=CCCC[C@H](C)OC/C=C/CC 3b34bfa8530fc272d7cd6384aec587c8 [0,1,1,0,0,0|2,0,0]=4 1906 B12R0.206 C=CCCC(C)OCC/C=C/CC 359635063a8bc773489c6ed7445c5e32 [0,1,1,0,0,0|2,0,0]=4 1907 B12R0.206 C=CCCC(C)OCC/C=C\CC cb7ff1a3ed89abcef0ed90ada0129139 [0,1,1,0,0,0|2,0,0]=4 1908 B12R0.206 C=CCCC(O)CNC/C=C/CC d12cce623f5e79ca79d0c656675bdafa [0,1,1,0,0,0|2,0,0]=4 1909 B12R0.206 C=CCC[C@@H](C)OCC/C=C\CC cd0342dee14628ebe56f736747b13465 [0,1,1,0,0,0|2,0,0]=4 1910 B12R0.234 C=C(Br)COCCCC/C=C\CC 2aaf91ada030303aac880c7a113b897c [0,1,1,0,0,0|2,0,0]=4 1911 B12R0.234 C=C(C)CCCOCC/C=C/CC adf71f1b8230b42ab1b442dbfbaab0c5 [0,1,1,0,0,0|2,0,0]=4 1912 B12R0.234 C=C(C)CCCOCC/C=C\CC bf76c732764b20800fbf7b753830ca20 [0,1,1,0,0,0|2,0,0]=4 1913 B12R0.234 C=C(C)CCOCCC/C=C\CC f06c421c6a5104b9b9c03957cbb53e22 [0,1,1,0,0,0|2,0,0]=4 1914 B12R0.234 C=C(C)COCCCC/C=C\CC 0ab9742f2a20781390dc9fdeb87f9772 [0,1,1,0,0,0|2,0,0]=4 1915 B12R0.234 C=C(Cl)COCCCC/C=C\CC 24f8463f065a1410f3be9047bf80a0e6 [0,1,1,0,0,0|2,0,0]=4 1916 B12R0.234 C=C(F)COCCCC/C=C\CC 9cc7ad8adf0054329622fa688cbe75b8 [0,1,1,0,0,0|2,0,0]=4 1917 B12R0.234 C=CCCCCNC/C=C/C(C)C 86ef8ce0042aadd9982177c76d701203 [0,1,1,0,0,0|2,0,0]=4 1918 B12R0.234 C=CCCCCOC/C=C/C(C)C 1275c96fd6fbd7421e7732caba028262 [0,1,1,0,0,0|2,0,0]=4 1919 B12R0.234 CC(C)/C=C/COCCCCC=O 078e4f8525bc3fc0b5d33831af70f679 [0,1,1,0,0,0|1,0,0]=3 1920 B12R0.234 CC(C)/C=C/COCCOCC=O 4c22280668763eeaa9572533c80620a4 [0,1,1,0,0,0|2,0,0]=4 1921 B12R0.234 CC(C)CNCCCCCCC=O 52fa641ef1a934ad47d6903d5c67c0be [0,1,1,0,0,0|1,0,1]=4 1922 B12R0.234 CC(C)COCCCCCCC=O 12f4de3759320a9474e25191bd70fbdf [0,1,1,0,0,0|1,0,1]=4 1923 B12R0.234 CC(F)COCCCCCCC=O dc5badd5f804e168475868ccbcdc40d7 [0,1,1,0,0,0|1,0,1]=4 1924 B12R0.234 CC(O)CNCCCCCCC=O 7c2d56d8116339d2adc17331e4a6d185 [0,1,1,0,0,0|1,0,1]=4 1925 B12R0.234 CC(S)COCCCCCCC=O 96dc1d76b6f2669927b77a829926abe2 [0,1,1,0,0,0|1,0,1]=4 1926 B12R0.234 CC/C=C/CCOCCCC(=O)C 5ff156b625ccad76578ef5eaf9b4618e [0,1,1,0,0,0|1,0,0]=3 1927 B12R0.234 CC/C=C/CCOCCCC(=O)N 48ba1b7b9cf24ea5bc88cb3140e7f293 [0,1,1,0,0,0|1,0,0]=3 1928 B12R0.234 CC/C=C/CCOCCCC(=O)O d91b5cffbe356fdcb01b34cffae4c0bc [0,1,1,0,0,0|1,0,0]=3 1929 B12R0.234 CC/C=C/CCOCCC[N+](=O)[O-] 29a692cfe909aa0a2f3e19e1e3def824 [0,1,1,0,0,0|2,0,0]=4 1930 B12R0.234 CC/C=C/CCOCCNC(=O)C 6fd648c15bf879331f822edc7c5ba7c6 [0,1,1,0,0,0|2,0,0]=4 1931 B12R0.234 CC/C=C/CCOCCNC(=O)N e3d5460edb2a2cdf7a5348a51c1e1ccf [0,1,1,0,0,0|2,0,0]=4 1932 B12R0.234 CC/C=C/CCOCCOC(=O)C 57d9f7b3feccede0078f4a22acdb6250 [0,1,1,0,0,0|2,0,0]=4 1933 B12R0.234 CC/C=C/CCOCCSC(=O)C 7d49d2195b790395423ec9882b0cd62b [0,1,1,0,0,0|2,0,0]=4 1934 B12R0.234 CC/C=C/CNCCCCC(=O)N cbdd74a7ac008de47ee8535d10973f25 [0,1,1,0,0,0|1,0,0]=3 1935 B12R0.234 CC/C=C/CNCCCCC(=O)O a303742afc7fd0c87b07f590e8f75d8a [0,1,1,0,0,0|1,0,0]=3 1936 B12R0.234 CC/C=C/CNCCCNC(=O)C 7ae8018bb92ece74e2705a0b870de09a [0,1,1,0,0,0|2,0,0]=4 1937 B12R0.234 CC/C=C/CNCCOCC(=O)O 88d78ece86b8edc1ce7cca729a44c9c5 [0,1,1,0,0,0|2,0,0]=4 1938 B12R0.234 CC/C=C/CNCCSCC(=O)O b76a6b239338aa0a4e8890f6c7d390bc [0,1,1,0,0,0|2,0,0]=4 1939 B12R0.234 CC/C=C/COCCCCC(=O)C 3ab3917684129170903183d5838c173f [0,1,1,0,0,0|1,0,0]=3 1940 B12R0.234 CC/C=C/COCCCCC(=O)N 0362ecbb3835959634476a7bd811f700 [0,1,1,0,0,0|1,0,0]=3 1941 B12R0.234 CC/C=C/COCCCCC(=O)O c97c2122729e7f0dca9ce004885fb5d8 [0,1,1,0,0,0|1,0,0]=3 1942 B12R0.234 CC/C=C/COCCCC[N+](=O)[O-] 7d7e33b6517b077539489e923245887c [0,1,1,0,0,0|2,0,0]=4 1943 B12R0.234 CC/C=C/COCCCNC(=O)C af68aa2c0fc18c0ba362aa45a8f0fbbb [0,1,1,0,0,0|2,0,0]=4 1944 B12R0.234 CC/C=C/COCCCOC(=O)C cafa73a7ec4bf9529a4bfd7a7d070702 [0,1,1,0,0,0|2,0,0]=4 1945 B12R0.234 CC/C=C/COCCCSC(=O)C eaa2aed274f265d7512c8b25bf31d3e4 [0,1,1,0,0,0|2,0,0]=4 1946 B12R0.234 CC/C=C/COCCOCC(=O)N 0009a45efb2a58f755926e394ff068a9 [0,1,1,0,0,0|2,0,0]=4 1947 B12R0.234 CC/C=C/COCCOCC(=O)O 3b80523e8ad8781625693a24e04e09d0 [0,1,1,0,0,0|2,0,0]=4 1948 B12R0.234 CC/C=C/COCCSCC(=O)N c441431ee34f1d959f931abfaae16790 [0,1,1,0,0,0|2,0,0]=4 1949 B12R0.234 CC/C=C\CCCCOCC(=O)N 9ddf5df679aae8d9f23fc38e7fc6b78d [0,1,1,0,0,0|1,0,0]=3 1950 B12R0.234 CC/C=C\CCCCOCC(=O)O b71a31d787eeb570d764dc99175b65bb [0,1,1,0,0,0|1,0,0]=3 1951 B12R0.234 CC/C=C\CCCCOC[N+](=O)[O-] 1385f8c580486f1b15e0ddd20dc66f66 [0,1,1,0,0,0|2,0,0]=4 1952 B12R0.234 CC/C=C\CCCOCCC(=O)C f5b56266d805e6125613210f70e7169f [0,1,1,0,0,0|1,0,0]=3 1953 B12R0.234 CC/C=C\CCCOCCC(=O)N 712372be9c38e8dbb5a20a9303f1daaf [0,1,1,0,0,0|1,0,0]=3 1954 B12R0.234 CC/C=C\CCCOCCC(=O)O 22d0ce978d0e1a8dd01f94141fe6523d [0,1,1,0,0,0|1,0,0]=3 1955 B12R0.234 CC/C=C\CCCOCCS(=O)C bbd4c7ce6d3a28f6799e2907a2f342af [0,1,1,0,0,0|2,0,0]=4 1956 B12R0.234 CC/C=C\CCCOCOC(=O)C cebf0648b1a04f53f05fd19f0cf67c06 [0,1,1,0,0,0|2,0,0]=4 1957 B12R0.234 CC/C=C\CCCOCSC(=O)N 472a03a5ebe197272a94fe3803f45e08 [0,1,1,0,0,0|2,0,0]=4 1958 B12R0.234 CC/C=C\CCNCCCC(=O)N a47dad37db09e3cc0671eecf3ea7a7c0 [0,1,1,0,0,0|1,0,0]=3 1959 B12R0.234 CC/C=C\CCNCCCC(=O)O 47cc71e13b69add0a2b9b5d6a6813971 [0,1,1,0,0,0|1,0,0]=3 1960 B12R0.234 CC/C=C\CCNCCCS(=O)C 82de6d0b12fb3f7bff4dfbaabe7a26a5 [0,1,1,0,0,0|2,0,0]=4 1961 B12R0.234 CC/C=C\CCNCCNC(=O)C 273007daade04c803e51f028cc16b2dc [0,1,1,0,0,0|2,0,0]=4 1962 B12R0.234 CC/C=C\CCOCCCC(=O)C 9a0ab707ba3df73a5a9fc9ca0eaba9d3 [0,1,1,0,0,0|1,0,0]=3 1963 B12R0.234 CC/C=C\CCOCCCC(=O)N e9df1e167e25401c705041bdb4ad6287 [0,1,1,0,0,0|1,0,0]=3 1964 B12R0.234 CC/C=C\CCOCCCC(=O)O 8eec8965786c5e5d1e4fae8aa95e8bbd [0,1,1,0,0,0|1,0,0]=3 1965 B12R0.234 CC/C=C\CCOCCC[N+](=O)[O-] 49914c883348334107227dc59d723f50 [0,1,1,0,0,0|2,0,0]=4 1966 B12R0.234 CC/C=C\CCOCCNC(=O)C 474466f6265296ebbc84e60fca727069 [0,1,1,0,0,0|2,0,0]=4 1967 B12R0.234 CC/C=C\CCOCCNC(=O)N a259231bce7c49877f565235358cd671 [0,1,1,0,0,0|2,0,0]=4 1968 B12R0.234 CC/C=C\CCOCCOC(=O)C a7f5b561138907c6ba09aa2b9be35baf [0,1,1,0,0,0|2,0,0]=4 1969 B12R0.234 CC/C=C\CCOCCSC(=O)C 0a1ef857db151fbc30954ae83ad3ca1d [0,1,1,0,0,0|2,0,0]=4 1970 B12R0.234 CC/C=C\COCCCCC(=O)C 96b9eab5077cbc47ffc86e810df2931f [0,1,1,0,0,0|1,0,0]=3 1971 B12R0.234 CC/C=C\COCCCCC(=O)N 05754aafa8ef5f9bec173c294ce0a062 [0,1,1,0,0,0|1,0,0]=3 1972 B12R0.234 CC/C=C\COCCCCC(=O)O f83bcaaa2d821beac7765c6c0abbf64c [0,1,1,0,0,0|1,0,0]=3 1973 B12R0.234 CC/C=C\COCCCNC(=O)C 7ab0ccf13daa4327088290c9dd1e0660 [0,1,1,0,0,0|2,0,0]=4 1974 B12R0.234 CC/C=C\COCCCOC(=O)C e304d303266ebe84b3d6b09db0b571db [0,1,1,0,0,0|2,0,0]=4 1975 B12R0.234 CC/C=C\COCCCSC(=O)C 614230cd4727f480267251dacb8c8e50 [0,1,1,0,0,0|2,0,0]=4 1976 B12R0.234 CC/C=C\COCCOCC(=O)N be039ce41f9e2b25444553695e0a0901 [0,1,1,0,0,0|2,0,0]=4 1977 B12R0.234 CC/C=C\COCCOCC(=O)O 978a46425171d2842587fafb33297639 [0,1,1,0,0,0|2,0,0]=4 1978 B12R0.234 CCCNCCCCCCC(=O)O 1209be85d19fc9719e4624682259ccba [0,1,1,0,0,0|1,0,1]=4 1979 B12R0.234 CCCOCCCCCCC(=O)N ef902ab8dc24827b5e068c394e3cd23d [0,1,1,0,0,0|1,0,1]=4 1980 B12R0.234 CCCOCCCCCCC(=O)O 184e565df245740558281f57f62af0c1 [0,1,1,0,0,0|1,0,1]=4 1981 B12R0.234 CCNCCCCCCCC(=O)O 4129974f68a0ceef8ab0e96914078837 [0,1,1,0,0,0|1,0,1]=4 1982 B12R0.234 CCOCCCCCCCC(=O)C 84451fa23ed3e3143a5a1d446125857e [0,1,1,0,0,0|1,0,1]=4 1983 B12R0.234 CCOCCCCCCCC(=O)O 46aa100c5035c7dc38e92b0892435701 [0,1,1,0,0,0|1,0,1]=4 1984 B12R0.234 C[C@@H](F)COCCCCCCC=O ba55aa62a8342f41fb3499efe96b5d35 [0,1,1,0,0,0|1,0,1]=4 1985 B12R0.234 C[C@@H](O)CNCCCCCCC=O 497c1867da55792079c8798350b7c357 [0,1,1,0,0,0|1,0,1]=4 1986 B12R0.234 C[C@H](F)COCCCCCCC=O 2c349480f75667298225aeb7464e1655 [0,1,1,0,0,0|1,0,1]=4 1987 B12R0.234 C[C@H](O)CNCCCCCCC=O aa820cd7ec5c9c4dc85e98584a2ea50b [0,1,1,0,0,0|1,0,1]=4 1988 B12R0.248 C=CC(C)OCCCC/C=C\CC c71535e560d31f9bff49222a4f2a4717 [0,1,1,0,0,0|2,0,0]=4 1989 B12R0.248 CC/C=C\CCCCOC(C)C=O fdc52ca10fe0ba3293e552ca48de45e3 [0,1,1,0,0,0|1,0,0]=3 1990 B12R0.248 CC/C=C\CCCCO[C@H](C)C=O 3cac0440815770e74d753c041c803a6e [0,1,1,0,0,0|1,0,0]=3 1991 B12R0.248 CC/C=C\CCOCCN(C)C=O 42b2912fdafbc6c9745fa82fc9abb9a1 [0,1,1,0,0,0|2,0,0]=4 1992 B12R0.248 CCC(=O)CCCCOCCC=O 2189cf16333eff03e2d4f8abb6f5151d [0,1,1,0,0,0|1,0,1]=4 1993 B12R0.248 CCC(=O)COCCCCCC=O e1dd528893d2434bb260d457d1e5cae5 [0,1,1,0,0,0|1,0,1]=4 1994 B12R0.248 CCC(=O)NCCNCCCC=O b43bbd83ef3adea6713383990245d18d [0,1,1,0,0,0|2,0,0]=4 1995 B12R0.248 CCC(=O)NCCOCCCC=O 225ac2959020c70d6d102984a07266e8 [0,1,1,0,0,0|2,0,0]=4 1996 B12R0.248 CCC(=O)OCCOCCCC=O ae6c7066d911327c7a5f4a016610b09b [0,1,1,0,0,0|2,0,0]=4 1997 B12R0.248 CCC(=O)OCOCCCCC=O 0bd732186646992f6d8f381ae3e66012 [0,1,1,0,0,0|2,0,0]=4 1998 B12R0.248 CCC(C)NCCCCCCC=O a031308945c6ed5ca5e8fc97d1685606 [0,1,1,0,0,0|1,0,1]=4 1999 B12R0.248 CCC(C)OCCCCCCC=O c84ce449e3e3920770101aaf4faab16f [0,1,1,0,0,0|1,0,1]=4 2000 B12R0.248 CC[C@@H](C)NCCCCCCC=O b5dd0b1555cada43782d1629fb6c751b [0,1,1,0,0,0|1,0,1]=4 2001 B12R0.248 CC[C@@H](C)OCCCCCCC=O f3c51a43fc1ca064e8dc83fdeae215a0 [0,1,1,0,0,0|1,0,1]=4 2002 B12R0.248 CC[C@H](C)NCCCCCCC=O 42bc2803ad40810fed6397f2a86ae65c [0,1,1,0,0,0|1,0,1]=4 2003 B12R0.248 CC[C@H](C)OCCCCCCC=O 98ee86f288cd867b84941679446abd92 [0,1,1,0,0,0|1,0,1]=4 2004 B12R0.4 CC/C=C/CNCC(=O)NC(C)C bd0b523040a886e4f9aa570cdfcdf741 [0,1,1,0,0,0|2,0,0]=4 2005 B12R0.4 CC/C=C/COCC(=O)CC(C)C ea0d9305b3a45f1d1f0f4bf2f33a3be5 [0,1,1,0,0,0|1,0,0]=3 2006 B12R0.4 CC/C=C/COCC(=O)NC(C)C cafb84523768f2dbf77c41e7b3322ca3 [0,1,1,0,0,0|2,0,0]=4 2007 B12R0.4 CC/C=C/COCC(=O)OC(C)C fbeaf085116023d33bc0ae2072f13cdd [0,1,1,0,0,0|2,0,0]=4 2008 B12R0.4 CC/C=C\COCC(=O)CC(C)C c7a68c976505b0ee4502e0173c895200 [0,1,1,0,0,0|1,0,0]=3 2009 B12R0.4 CC/C=C\COCC(=O)NC(C)C 53ffd229f0017d970e7994f2a0c9b150 [0,1,1,0,0,0|2,0,0]=4 2010 B12R0.4 CC/C=C\COCC(=O)OC(C)C ce073b6ca3ecc520f888b358f984c2b2 [0,1,1,0,0,0|2,0,0]=4 2011 B12R0.49 CC/C=C/CNCC(=O)N(C)CC c2dfb0a4ade6c215ec95c0344e220e67 [0,1,1,0,0,0|2,0,0]=4 2012 B12R0.49 CC/C=C/COCC(=O)C(C)CC 8c54d1f6fd0e669b4317afe0560e7a89 [0,1,1,0,0,0|1,0,0]=3 2013 B12R0.49 CC/C=C/COCC(=O)N(C)CC e8f73cf036ef0a8f675b5e91f96857a9 [0,1,1,0,0,0|2,0,0]=4 2014 B12R0.49 CC/C=C\COCC(=O)C(C)CC 0d6005c9323435f280a912ffed36d843 [0,1,1,0,0,0|1,0,0]=3 2015 B12R0.49 CC/C=C\COCC(=O)N(C)CC e8ab28a425aedd3ed2471c3adcde4604 [0,1,1,0,0,0|2,0,0]=4 2016 B12R0.114 CC/C=C/CN[C@@H](C)C(=O)NCC 39754b4a14af569b6f35da4a2459aaed [0,1,1,0,0,0|2,0,0]=4 2017 B12R0.114 CC/C=C/CN[C@H](C)C(=O)OCC b3e5591ca458497461557e786d7835cc [0,1,1,0,0,0|2,0,0]=4 2018 B12R0.114 CC/C=C/COC(C)C(=O)NCC 6868db27689000425adc5813e765fcbd [0,1,1,0,0,0|2,0,0]=4 2019 B12R0.114 CC/C=C/COC(C)C(=O)OCC f2cea9971444dbcffed0c2feb288e262 [0,1,1,0,0,0|2,0,0]=4 2020 B12R0.114 CC/C=C/COC(F)C(=O)OCC 27b6cef80ab9f902e5ce534e316f461e [0,1,1,0,0,0|2,0,0]=4 2021 B12R0.114 CC/C=C/CO[C@@H](C)C(=O)OCC 36449a9ff657caa97446b20039345a40 [0,1,1,0,0,0|2,0,0]=4 2022 B12R0.114 CC/C=C/CO[C@H](C)C(=O)OCC 63c660edec86631b3ef8b3102d12021d [0,1,1,0,0,0|2,0,0]=4 2023 B12R0.114 CC/C=C\COC(C)C(=O)NCC 604fcbfc25593e4f1ce0b3c6b40d72d4 [0,1,1,0,0,0|2,0,0]=4 2024 B12R0.114 CC/C=C\COC(C)C(=O)OCC fd865918001f654f9e23fefefb163d40 [0,1,1,0,0,0|2,0,0]=4 2025 B12R0.114 CC/C=C\COC(F)C(=O)OCC 5ef91f001e8f47c71a3f4d195dd315a5 [0,1,1,0,0,0|2,0,0]=4 2026 B12R0.114 CC/C=C\CO[C@@H](C)C(=O)OCC e9172c691cd549b87f1b4ba422e4f43f [0,1,1,0,0,0|2,0,0]=4 2027 B12R0.114 CC/C=C\CO[C@H](C)C(=O)OCC c2cae9bbaf303a255a18189fd31454f6 [0,1,1,0,0,0|2,0,0]=4 2028 B12R0.276 CCCC(=O)NCCNC(=O)CC b34acb0ac4f8f5b80c853213c5dd2688 [0,1,1,0,0,0|2,0,0]=4 2029 B12R0.276 CCOC(=O)CCCNC(=O)CC ef05590912234997853b2f5a970cfbd0 [0,1,1,0,0,0|2,0,0]=4 2030 B12R0.277 CCNC(=O)CNC/C=C/C(C)C 5d2795e344739534ee39c8ff225d5589 [0,1,1,0,0,0|2,0,0]=4 2031 B12R0.277 CCNC(=O)COC/C=C/C(C)C bc37556b1245e92f24d8893e30274c76 [0,1,1,0,0,0|2,0,0]=4 2032 B12R0.277 CCOC(=O)CNC/C=C/C(C)C 5b662f49c6619a721bb8d1b64ab2d828 [0,1,1,0,0,0|2,0,0]=4 2033 B12R0.277 CCOC(=O)COC/C=C/C(C)C f3c073c120dd5dfacaf778bf43b56092 [0,1,1,0,0,0|2,0,0]=4 2034 B12R0.285 CCCC(=O)CNCC(=O)NCC d9c1d00d3bed65207ca66f874a5e414e [0,1,1,0,0,0|2,0,0]=4 2035 B12R0.285 CCCC(=O)CNCC(=O)OCC 4273b410c54abbca5e56f1e24fcf3456 [0,1,1,0,0,0|2,0,0]=4 2036 B12R0.285 CCCC(=O)COCC(=O)NCC 9a0a615b1fcc645e4218f557b1ef35e8 [0,1,1,0,0,0|2,0,0]=4 2037 B12R0.285 CCCC(=O)COCC(=O)OCC cfebe1bb4f0b1a45ba0eabc2a4ae09be [0,1,1,0,0,0|2,0,0]=4 2038 B12R0.285 CCCC(=O)NCCC(=O)OCC 2a4c82757e413b6c1114d6f6ab2b9be3 [0,1,1,0,0,0|2,0,0]=4 2039 B12R0.17 CCOC(=O)CCN(CC)C(=O)C d211e2fd90bea8b94bcd97887514e921 [0,1,1,0,0,0|2,0,0]=4 2040 B12R0.108 CC/C=C/CN(C)C(CC)C(=O)N 9c4227806f8dac50d5cb3f5b3a37bc4f [0,1,1,0,0,0|2,0,0]=4 2041 B12R0.108 CC/C=C/CN(C)[C@@H](CC)C(=O)O 8adf0458fb7fa93337299b7668af0b4a [0,1,1,0,0,0|2,0,0]=4 2042 B12R0.112 CC/C=C/CNC(C(=O)O)C(C)C 1321574f479af69593fcea336d0ee2ac [0,1,1,0,0,0|2,0,0]=4 2043 B12R0.112 CC/C=C/CNC(C(=O)O)C(C)F af3a9ad30f2ae674ebe95d5885fb7b0b [0,1,1,0,0,0|2,0,0]=4 2044 B12R0.112 CC/C=C/CNC(C(=O)O)C(C)O 0f5afc323ac888456025a548f77ebec0 [0,1,1,0,0,0|2,0,0]=4 2045 B12R0.112 CC/C=C/CNC(C(=O)O)[C@H](C)O dd769e27d126c41bab8e1ba511b8f3a6 [0,1,1,0,0,0|2,0,0]=4 2046 B12R0.112 CC/C=C/CN[C@@H](C(=O)O)C(C)C aa29f57dcf4f8cd6bf1a50e2696490e6 [0,1,1,0,0,0|2,0,0]=4 2047 B12R0.112 CC/C=C/CN[C@@H](C(=O)O)[C@@H](C)O 4d7e50244f54fb1925631e778b28a39d [0,1,1,0,0,0|2,0,0]=4 2048 B12R0.112 CC/C=C/CN[C@@H](C(=O)O)[C@H](C)O 14fcf7d9b90f2e5fa411b0ec3ec30e22 [0,1,1,0,0,0|2,0,0]=4 2049 B12R0.112 CC/C=C/CN[C@H](C(=O)N)[C@@H](C)O feb6b6ba4a0c015d3042d595009537db [0,1,1,0,0,0|2,0,0]=4 2050 B12R0.112 CC/C=C/CN[C@H](C(=O)O)C(C)C 59a66455da357fe190be75abef34c386 [0,1,1,0,0,0|2,0,0]=4 2051 B12R0.112 CC/C=C/CN[C@H](C(=O)O)[C@@H](C)O 6e6f763e42d0aae37d5e9a6ceb4c00bd [0,1,1,0,0,0|2,0,0]=4 2052 B12R0.112 CC/C=C/CN[C@H](C(=O)O)[C@H](C)O 226735e1b987a8187a1adee947005095 [0,1,1,0,0,0|2,0,0]=4 2053 B12R0.112 CC/C=C/COC(C(=O)C)C(=O)C 559559d0709cd8d18782178efb90dba1 [0,1,1,0,0,0|1,0,1]=4 2054 B12R0.112 CC/C=C/COC(C(=O)N)C(C)C 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CC/C=C/CO[C@H](CCC)C(=O)O d5b4bb7ac58a7559860365ab660fa238 [0,1,1,0,0,0|2,0,0]=4 2149 B12R0.203 CC/C=C\COC(CCC)C(=O)C 01723f6dfccbb19fd4888074c8ce9276 [0,1,1,0,0,0|1,0,0]=3 2150 B12R0.203 CC/C=C\COC(COC)C(=O)O d5c8a71d1358b3a65a9b74d259758bd0 [0,1,1,0,0,0|2,0,0]=4 2151 B12R0.238 CCC(NC/C=C/C(C)C)C(=O)N ffbb2742cc45227fdad946487a3c0e66 [0,1,1,0,0,0|2,0,0]=4 2152 B12R0.238 CCC(NC/C=C/C(C)C)C(=O)O 143cc0cbffa029d3b9f6a1f8a1b44c37 [0,1,1,0,0,0|2,0,0]=4 2153 B12R0.238 CCC(OC/C=C/C(C)C)C(=O)N 4df459be0ea8f77b3552af565d881f0a [0,1,1,0,0,0|2,0,0]=4 2154 B12R0.238 CCC(OC/C=C/C(C)C)C(=O)O 948dda49ebe3d201845bb27aae8ea6d1 [0,1,1,0,0,0|2,0,0]=4 2155 B12R0.238 CC[C@@H](NC/C=C/C(C)C)C(=O)O edc7b8727195fbc3176daf1f32365c18 [0,1,1,0,0,0|2,0,0]=4 2156 B12R0.238 CC[C@@H](OC/C=C/C(C)C)C(=O)O d449be7959259ee1670369847ad161e5 [0,1,1,0,0,0|2,0,0]=4 2157 B12R0.238 CC[C@H](NC/C=C/C(C)C)C(=O)N 8cbd64d3128a600155a4ad4bcb1e4a90 [0,1,1,0,0,0|2,0,0]=4 2158 B12R0.238 CC[C@H](NC/C=C/C(C)C)C(=O)O d7cf9794c94b49a6f2883d13f2c8475f [0,1,1,0,0,0|2,0,0]=4 2159 B12R0.238 CC[C@H](OC/C=C/C(C)C)C(=O)O 65b4f423fc118a21b66cc0b0f681a599 [0,1,1,0,0,0|2,0,0]=4 2160 B12R0.459 CC/C=C/CNC(C)(CC)C(=O)N 3978ffb384d45d5e847abaa7865e5e09 [0,1,1,0,0,0|2,0,0]=4 2161 B12R0.459 CC/C=C/CNC(C)(CC)C(=O)O 6de5aadce6db804cde0c00d73493cb51 [0,1,1,0,0,0|2,0,0]=4 2162 B12R0.459 CC/C=C/CN[C@@](C)(CC)C(=O)O 2a1edfd62f6a6e391541c4fb9eef878d [0,1,1,0,0,0|2,0,0]=4 2163 B12R0.459 CC/C=C/CN[C@](C)(CC)C(=O)O 09d3d32eeff5c4d6cb8761b194286c98 [0,1,1,0,0,0|2,0,0]=4 2164 B12R0.46 CC/C=C/CNC(C)C(=O)N(C)C f9c9d833ee270b079c51b7502737c8db [0,1,1,0,0,0|2,0,0]=4 2165 B12R0.46 CC/C=C/CN[C@@H](C)C(=O)N(C)C 8114dc5c449b98ca3499bf1dd18c64c6 [0,1,1,0,0,0|2,0,0]=4 2166 B12R0.46 CC/C=C/COC(C)C(=O)C(=O)C c5a37de5d5cbc25a968ce47d7e793623 [0,1,1,0,0,0|1,0,1]=4 2167 B12R0.46 CC/C=C/COC(C)C(=O)C(C)C 0f7cfa0ea7a95303bdee2c74c1bb6abd [0,1,1,0,0,0|1,0,0]=3 2168 B12R0.46 CC/C=C/COC(C)C(=O)N(C)C 466f085082c7242733f67b6d6d83375c [0,1,1,0,0,0|2,0,0]=4 2169 B12R0.46 CC/C=C/CO[C@H](C)C(=O)N(C)C 77aed1581c99c993b080224a0c626e67 [0,1,1,0,0,0|2,0,0]=4 2170 B12R0.46 CC/C=C\COC(C)C(=O)C(=O)C c14b9b6f9792615e44ab75fd13e0d451 [0,1,1,0,0,0|1,0,1]=4 2171 B12R0.46 CC/C=C\COC(C)C(=O)C(C)C c6609a002d0660a148c20bd2d7409ce4 [0,1,1,0,0,0|1,0,0]=3 2172 B12R0.46 CC/C=C\COC(C)C(=O)N(C)C 50896d57c33b47b6e4c05ec13a65b56b [0,1,1,0,0,0|2,0,0]=4 2173 B12R0.79 CCNC(=O)CNC(C)C(=O)CC 8457f27ba72f41cfb526e27573308f19 [0,1,1,0,0,0|2,0,0]=4 2174 B12R0.79 CCNC(=O)COC(C)C(=O)CC 4c3f01194e74ec41c33705234f949041 [0,1,1,0,0,0|2,0,0]=4 2175 B12R0.79 CCOC(=O)CCN(C)C(=O)CC 259f70f7c16449540cd68bff674844f6 [0,1,1,0,0,0|2,0,0]=4 2176 B12R0.79 CCOC(=O)CNC(C)C(=O)CC 8f5d4b7ca0c7b474589bedf743129bed [0,1,1,0,0,0|2,0,0]=4 2177 B12R0.79 CCOC(=O)COC(C)C(=O)CC 8bfe732600ad9029c4b006ffaa934181 [0,1,1,0,0,0|2,0,0]=4 2178 B12R0.86 CNC(=O)C(C)NC/C=C/C(C)C bdab275950ee3a77900161b73095581e [0,1,1,0,0,0|2,0,0]=4 2179 B12R0.86 COC(=O)C(C)OC/C=C/C(C)C 7d7ba8628057eeafb5bac4b740187853 [0,1,1,0,0,0|2,0,0]=4 2180 B12R0.86 COC(=O)[C@@H](C)OC/C=C/C(C)C edb5b69a0f5bf0f3d30615209ee1cdca [0,1,1,0,0,0|2,0,0]=4 2181 B12R0.86 COC(=O)[C@H](C)OC/C=C/C(C)C 82de42a5d3c497f024f6748706877b7c [0,1,1,0,0,0|2,0,0]=4 2182 B12R0.110 CC/C=C/CN(C)C(C)C(=O)NC aa17e7e1c8b9bb0a002854fd4e58592e [0,1,1,0,0,0|2,0,0]=4 2183 B12R0.110 CC/C=C/CN(C)C(C)C(=O)OC 32debb5eabfde0a342e087045daebb55 [0,1,1,0,0,0|2,0,0]=4 2184 B12R0.600 CC/C=C/CNC(C)(C)C(=O)OC 930ee34b619c78adae18fc69da8ad98a [0,1,1,0,0,0|2,0,0]=4 2185 B12R0.111 C=CC(CCCC)OC/C=C/CC bc1eb305d8dce8cd68d3a6bd3c60a4f4 [0,1,1,0,0,0|2,0,0]=4 2186 B12R0.202 C=CC(CC(C)C)OC/C=C/CC 40f9ef2dad09b9389104ae424378d446 [0,1,1,0,0,0|2,0,0]=4 2187 B12R0.205 C=CCN(CCC)CC/C=C\CC eec56abfe21b4e62749ff8eeb9b675b6 [0,1,1,0,0,0|2,0,0]=4 2188 B12R0.224 C=CC(CCC)OC/C=C/C(C)C 1450eccac81e8918c4f7e3a574b7bc2f [0,1,1,0,0,0|2,0,0]=4 2189 B12R1.7 CC/C=C/CNC1CCC(C1)C 18eb604e01afeaca7bc7fa8effe5e294 [1,1,0,0,0,0|1,0,1]=4 2190 B12R1.7 CC/C=C/CNC1CCC(C1)O 957fd7e33633f8c0d3c2f6e7a191b82f [1,1,0,0,0,0|1,0,1]=4 2191 B12R1.7 CC/C=C/CN[C@@H]1C=C[C@@H](C1)O 2dfc08f564f4da4ce7eaf89ea7503592 [1,1,0,0,0,0|1,0,1]=4 2192 B12R1.7 CC/C=C/CN[C@@H]1CC[C@@H](C1)O ff498d112eb5a71a42ff306e05a366e9 [1,1,0,0,0,0|1,0,1]=4 2193 B12R1.7 CC/C=C/CN[C@@H]1CC[C@H](C1)O 94575a90f71ae782584ab26109eaa8fe [1,1,0,0,0,0|1,0,1]=4 2194 B12R1.7 CC/C=C/CN[C@H]1C=C[C@H](C1)O eaae24d5c123530c8e3768a6a150430d [1,1,0,0,0,0|1,0,1]=4 2195 B12R1.7 CC/C=C/CN[C@H]1CC[C@@H](C1)O 38f124b6e481cf4a1ed68e31a7e17218 [1,1,0,0,0,0|1,0,1]=4 2196 B12R1.7 CC/C=C/CN[C@H]1CC[C@H](C1)O de87cac5f535a65db591731259abd33f [1,1,0,0,0,0|1,0,1]=4 2197 B12R1.7 CC/C=C/COC1CCC(C1)C 8e481785b4567dc3f7dd9b60b0272bd4 [1,1,0,0,0,0|1,0,1]=4 2198 B12R1.7 CC/C=C/COC1CCC(C1)F 18a0350b0333fc18b034c469755d8db5 [1,1,0,0,0,0|1,0,1]=4 2199 B12R1.7 CC/C=C\CCN1CCC(C1)C bc265d5e22c56c48835403f8bd4eb10c [1,1,0,0,0,0|1,0,1]=4 2200 B12R1.7 CC/C=C\CCN1CCC(C1)F b615ce415c1fc12722b646f21ed574ef [1,1,0,0,0,0|1,0,1]=4 2201 B12R1.7 CC/C=C\CCN1CCC(C1)O a4bf685982d7c4d2980c81048714a56c [1,1,0,0,0,0|1,0,1]=4 2202 B12R1.7 CC/C=C\CCN1CC[C@@H](C1)F 1c390704c5e57cad66dec1011cb302d0 [1,1,0,0,0,0|1,0,1]=4 2203 B12R1.7 CC/C=C\CCN1CC[C@@H](C1)O 9f065933f6d8ec904ccf5267f2620c10 [1,1,0,0,0,0|1,0,1]=4 2204 B12R1.7 CC/C=C\CCN1CC[C@H](C1)F b4aa287c3217d657b057b7af281f964d [1,1,0,0,0,0|1,0,1]=4 2205 B12R1.7 CC/C=C\CCN1CC[C@H](C1)O ecc9e07ba0a5c02bb2aa42382ea47e83 [1,1,0,0,0,0|1,0,1]=4 2206 B12R1.35 CC/C=C/CN(C)C1CCCC1 339f567eb2822d317d336e598a2474df [1,1,0,0,0,0|1,0,1]=4 2207 B12R1.37 CC/C=C/CCOC1CCCC1 ddcd652bd1d83f24d68ba31d077aa1e0 [1,1,0,0,0,0|0,0,1]=3 2208 B12R1.37 CC/C=C/CCOC1CCOC1 e71a62ce6e40c42916357f3beb14d861 [1,1,0,0,0,0|1,0,1]=4 2209 B12R1.37 CC/C=C/CCO[C@@H]1CCOC1 572c6c7203a5e9d8df98fa156d85dcda [1,1,0,0,0,0|1,0,1]=4 2210 B12R1.37 CC/C=C/CCO[C@H]1CCOC1 294ff299dbdaaa385d929647c0b694f0 [1,1,0,0,0,0|1,0,1]=4 2211 B12R1.37 CC/C=C/CNCC1CCCC1 3bcd617011425c8ea3072bebd4df51b0 [1,1,0,0,0,0|0,0,1]=3 2212 B12R1.37 CC/C=C/CNCC1CCCO1 385ed3ee9793c7b3b7d86c754186ac46 [1,1,0,0,0,0|1,0,0]=3 2213 B12R1.37 CC/C=C/CNCC1CCOC1 6aff9bb7d86ffbd5c294b8238a538125 [1,1,0,0,0,0|1,0,1]=4 2214 B12R1.37 CC/C=C/CNC[C@@H]1CCCO1 952df779487d528a3ba8cb2f4f56a2be [1,1,0,0,0,0|1,0,0]=3 2215 B12R1.37 CC/C=C/CNC[C@@H]1CCOC1 e9b13843dbf14d07051208d7b9e5a2af [1,1,0,0,0,0|1,0,1]=4 2216 B12R1.37 CC/C=C/CNC[C@H]1CCCO1 4e71436cfa79fd923e1c21cab36a9284 [1,1,0,0,0,0|1,0,0]=3 2217 B12R1.37 CC/C=C/CNC[C@H]1CCOC1 2cfa695cbfe50fda79688559f1f3bcf1 [1,1,0,0,0,0|1,0,1]=4 2218 B12R1.37 CC/C=C/COCC1=CCCC1 fe7df03b7991d02f6768611744bf7f02 [1,1,0,0,0,0|0,0,1]=3 2219 B12R1.37 CC/C=C/COCC1C=CCC1 534b33b403bd76b186df390224d2e064 [1,1,0,0,0,0|0,0,1]=3 2220 B12R1.37 CC/C=C/COCC1CCCC1 d12b0ac75363f47b5bbb385caa470a7b [1,1,0,0,0,0|0,0,1]=3 2221 B12R1.37 CC/C=C/COCC1CCCO1 d7d7367adf93910f5a906d129ee7d0bb [1,1,0,0,0,0|1,0,0]=3 2222 B12R1.37 CC/C=C/COCC1CCCS1 b3f7ac86b2d6353c5e83ae9db2be0b0e [1,1,0,0,0,0|1,0,0]=3 2223 B12R1.37 CC/C=C/COCC1CCOC1 235460201c1a70417300d4876ebadb19 [1,1,0,0,0,0|1,0,1]=4 2224 B12R1.37 CC/C=C/COCN1CCCC1 0af140a777a2cf491aa1034bd6621f39 [1,1,0,0,0,0|1,0,1]=4 2225 B12R1.37 CC/C=C/COC[C@@H]1CCCO1 309e4228ff61098cbb59dad693b6d850 [1,1,0,0,0,0|1,0,0]=3 2226 B12R1.37 CC/C=C/COC[C@@H]1CCOC1 009d40f1bfb7454f13c0eccff31f0bd1 [1,1,0,0,0,0|1,0,1]=4 2227 B12R1.37 CC/C=C/COC[C@H]1CCCO1 00ef88f1b0bcb7792509733af02d600e [1,1,0,0,0,0|1,0,0]=3 2228 B12R1.37 CC/C=C/COC[C@H]1CCOC1 e9136b57734ee721bc723879a7eae1a1 [1,1,0,0,0,0|1,0,1]=4 2229 B12R1.37 CC/C=C\CCNC1CCCC1 43ec2659d1850e69fc9e66343408bde1 [1,1,0,0,0,0|0,0,1]=3 2230 B12R1.37 CC/C=C\CCNC1CCOC1 d17c1a37c09efcd1369d0e8fb4652443 [1,1,0,0,0,0|1,0,1]=4 2231 B12R1.37 CC/C=C\CCNC1CCSC1 44cfe21f0a8129333793d111ceeeea82 [1,1,0,0,0,0|1,0,1]=4 2232 B12R1.37 CC/C=C\CCN[C@@H]1CCOC1 e3f16eb024d6f896bc3ee507c22a8735 [1,1,0,0,0,0|1,0,1]=4 2233 B12R1.37 CC/C=C\CCN[C@H]1CCOC1 38cdf071d259bac33ecfa424c487dbce [1,1,0,0,0,0|1,0,1]=4 2234 B12R1.37 CC/C=C\CCOC1C=CCC1 dd95ede8be45839819672269d03b66f9 [1,1,0,0,0,0|0,0,1]=3 2235 B12R1.37 CC/C=C\CCOC1CCCC1 6697c31ca6f1d37dedfede98e97cbc54 [1,1,0,0,0,0|0,0,1]=3 2236 B12R1.37 CC/C=C\CCOC1CCCO1 6e8584a96797af38114b7c67b2bf9a63 [1,1,0,0,0,0|1,0,0]=3 2237 B12R1.37 CC/C=C\CCOC1CCOC1 84a0e980d618b007b8ec839d82c5571e [1,1,0,0,0,0|1,0,1]=4 2238 B12R1.37 CC/C=C\CCOC1CCSC1 6941d240f20eae382b9fbfbde93c7bf1 [1,1,0,0,0,0|1,0,1]=4 2239 B12R1.37 CC/C=C\CCO[C@@H]1CCOC1 792eebefd512a71ef8cd02555a7fd0ee [1,1,0,0,0,0|1,0,1]=4 2240 B12R1.37 CC/C=C\CCO[C@@H]1CCSC1 230561fc84e8d6ea170786957ca4325b [1,1,0,0,0,0|1,0,1]=4 2241 B12R1.37 CC/C=C\CCO[C@H]1CCOC1 19c2e2a799fdc63b30cd31f35256abef [1,1,0,0,0,0|1,0,1]=4 2242 B12R1.37 CC/C=C\CCO[C@H]1CCSC1 f7d8fe5f50778d50d647ea5f48c7165c [1,1,0,0,0,0|1,0,1]=4 2243 B12R1.37 CC/C=C\COCC1=CCCC1 c2f0296dd9d12ada27b45a9ed923e8f9 [1,1,0,0,0,0|0,0,1]=3 2244 B12R1.37 CC/C=C\COCC1CCCC1 b29f7a78a7e0b723f49700765c2cec03 [1,1,0,0,0,0|0,0,1]=3 2245 B12R1.37 CC/C=C\COCC1CCCO1 9989b156c7959f16480cee4c89e76e35 [1,1,0,0,0,0|1,0,0]=3 2246 B12R1.37 CC/C=C\COCC1CCOC1 6b60eac2527bcaf50300715bd10b4956 [1,1,0,0,0,0|1,0,1]=4 2247 B12R1.37 CCC/C=C/CNC1CCCC1 7c36578571d67f512a4e314bca6c1811 [1,1,0,0,0,0|1,0,1]=4 2248 B12R1.37 CCC/C=C/COC1C=CCC1 6b4bb8ea5f260f3f95f7b46c688ad2e4 [1,1,0,0,0,0|1,0,1]=4 2249 B12R1.37 CCC/C=C/COC1CCCC1 8c1091c2225f857a2c8e1429639ceba7 [1,1,0,0,0,0|1,0,1]=4 2250 B12R1.37 CCC/C=C/COC1CCCO1 6d97f1124ee2224f8491a08f1f39577d [1,1,0,0,0,0|2,0,0]=4 2251 B12R1.37 CCC/C=C\CNC1CCCC1 21a69538d502ab9772cedf5200e0a286 [1,1,0,0,0,0|1,0,1]=4 2252 B12R1.37 CCC/C=C\COC1C=CCC1 eee9bffd7f868a03d2208db073559305 [1,1,0,0,0,0|1,0,1]=4 2253 B12R1.37 CCC/C=C\COC1CCCC1 b143435cc26d9b3ce055fa116c4103ee [1,1,0,0,0,0|1,0,1]=4 2254 B12R1.37 CCC/C=C\COC1CCCO1 1d552b079d711de490fecc8e36323b07 [1,1,0,0,0,0|2,0,0]=4 2255 B12R1.255 CC(C)/C=C/CNC1CCCC1 0dd2a9e226d463ed11eaa13d04bf3a3d [1,1,0,0,0,0|1,0,1]=4 2256 B12R1.255 CC(C)/C=C/COC1C=CCC1 87ec19c68e956e132cfc7d85f7a3c640 [1,1,0,0,0,0|1,0,1]=4 2257 B12R1.255 CC(C)/C=C/COC1CCCC1 17daa47c331bb579face2b1763e7180e [1,1,0,0,0,0|1,0,1]=4 2258 B12R1.255 CC(C)/C=C/COC1CCCO1 0a6e83d01a1c983f46aba590a7c31dbd [1,1,0,0,0,0|2,0,0]=4 2259 B12R1.477 CCC(=O)NCCC1CCCC1 b67cf06d1e0a23d3026b35a48b608ff0 [1,1,0,0,0,0|1,0,1]=4 2260 B12R1.477 CCC(=O)NCCC1CCCO1 e82ee9ec4c520b5eca6fdd9b30b5d2e2 [1,1,0,0,0,0|2,0,0]=4 2261 B12R1.1758 CC/C=C/CNC1(CCCC1)C 4d504385cac713842a7965af2479b4f1 [1,1,0,0,0,0|1,0,1]=4 2262 B12R1.130 C/C(=C/CNC1CCNC1=O)/I 90552fe718e7835ccab1ea09f6d1a273 [1,1,0,0,0,0|2,0,0]=4 2263 B12R1.130 C/C(=C/CNC1CCSC1=O)/I ea8ec7411bdf50ed9155e263c62cfa08 [1,1,0,0,0,0|2,0,0]=4 2264 B12R1.130 C/C(=C/CN[C@@H]1CCNC1=O)/I 55d70c83193020ed1c49291f43442ab3 [1,1,0,0,0,0|2,0,0]=4 2265 B12R1.130 C/C(=C/CN[C@@H]1CCOC1=O)/I d74df074b9b4c43e9a5acc42e60101ec [1,1,0,0,0,0|2,0,0]=4 2266 B12R1.130 C/C(=C/CN[C@H]1CCNC1=O)/I 925ca092819a94e7a31a1ac01d54f067 [1,1,0,0,0,0|2,0,0]=4 2267 B12R1.130 C/C(=C/CN[C@H]1CCOC1=O)/I 355f6aa678e02697d18f1cbab319843b [1,1,0,0,0,0|2,0,0]=4 2268 B12R1.130 C/C(=C/COC1CCCC1=O)/Cl 7580b23e2277628690779a7ecfbf71e9 [1,1,0,0,0,0|1,0,0]=3 2269 B12R1.130 C/C(=C/COC1CCCC1=O)/I 64d4aeec7f381be103f51148d569ead5 [1,1,0,0,0,0|1,0,0]=3 2270 B12R1.130 C/C(=C/COC1CCNC1=O)/Cl 0077d6b60995d9499fcd835d8a84ba8b [1,1,0,0,0,0|2,0,0]=4 2271 B12R1.130 C/C(=C/COC1CCNC1=O)/I 9e86512af4e11b99103cfb6127b2396b [1,1,0,0,0,0|2,0,0]=4 2272 B12R1.130 C/C(=C/COC1CCOC1=O)/Cl 2ff833eb567e4a0b25ff18726e33d76a [1,1,0,0,0,0|2,0,0]=4 2273 B12R1.130 C/C(=C/COC1CCOC1=O)/I fb31af90ca90c36ff087d59e7c274475 [1,1,0,0,0,0|2,0,0]=4 2274 B12R1.130 C/C(=C/CO[C@@H]1CCNC1=O)/I b46c916ed06d44a1847e72d68f73e020 [1,1,0,0,0,0|2,0,0]=4 2275 B12R1.130 C/C(=C/CO[C@@H]1CCOC1=O)/I 3013277d0835785154720b6fe03b119c [1,1,0,0,0,0|2,0,0]=4 2276 B12R1.130 C/C(=C/CO[C@H]1CCNC1=O)/I feee1218ae856533e991a579c59c2ca1 [1,1,0,0,0,0|2,0,0]=4 2277 B12R1.130 C/C(=C/CO[C@H]1CCOC1=O)/I cb9fb8160dbb1ef74f601b4e5f0caf13 [1,1,0,0,0,0|2,0,0]=4 2278 B12R1.130 C/C(=C\CNC1CCNC1=O)/Cl e814998b71b8364522c46be5b07d7ca7 [1,1,0,0,0,0|2,0,0]=4 2279 B12R1.130 C/C(=C\CNC1CCSC1=O)/Cl 4193a21a9951a57fa6c0c9e794ca27bb [1,1,0,0,0,0|2,0,0]=4 2280 B12R1.130 C/C(=C\CN[C@@H]1CCNC1=O)/Cl 4606ae3bd267d04cf612359dc058bc5d [1,1,0,0,0,0|2,0,0]=4 2281 B12R1.130 C/C(=C\CN[C@@H]1CCOC1=O)/Cl 6e83a523c82f6df264b736ba690dbbb9 [1,1,0,0,0,0|2,0,0]=4 2282 B12R1.130 C/C(=C\CN[C@H]1CCNC1=O)/Cl bf25df5303f9b3651755126cb76ac7f2 [1,1,0,0,0,0|2,0,0]=4 2283 B12R1.130 C/C(=C\CN[C@H]1CCOC1=O)/Cl e9ac8fd140fbce23dd46c7a600d7fe84 [1,1,0,0,0,0|2,0,0]=4 2284 B12R1.130 C/C(=C\COC1CCCC1=O)/Cl e39580ff4e93f745080d338e9fe3c9fe [1,1,0,0,0,0|1,0,0]=3 2285 B12R1.130 C/C(=C\COC1CCNC1=O)/Cl b449944afffef1515acb01d843b8d836 [1,1,0,0,0,0|2,0,0]=4 2286 B12R1.130 C/C(=C\COC1CCOC1=O)/Cl f80f6a827110711349201c51d82fc923 [1,1,0,0,0,0|2,0,0]=4 2287 B12R1.130 C/C(=C\CO[C@@H]1CCNC1=O)/Cl 3d3ac15a28276068cc15fe69fe47111a [1,1,0,0,0,0|2,0,0]=4 2288 B12R1.130 C/C(=C\CO[C@@H]1CCOC1=O)/Cl 340e804bfc7d12bf14855b12c3b08269 [1,1,0,0,0,0|2,0,0]=4 2289 B12R1.130 C/C(=C\CO[C@H]1CCNC1=O)/Cl e859209a8dea299b49a9bb88760be273 [1,1,0,0,0,0|2,0,0]=4 2290 B12R1.130 C/C(=C\CO[C@H]1CCOC1=O)/Cl 6556e15b38231f588ccda07156ae22ad [1,1,0,0,0,0|2,0,0]=4 2291 B12R1.130 C=C(C)CCOC1CCCC1=O e253b16e352f920ba8fed5458cac9902 [1,1,0,0,0,0|1,0,1]=4 2292 B12R1.130 C=C(C)COCC1CCCC1=O e8a245e55449d7c319330824c129d583 [1,1,0,0,0,0|1,0,1]=4 2293 B12R1.130 CC(=CCNC1CCCC1=O)C 4e3c74b293aa25c29113bd13028d6ed0 [1,1,0,0,0,0|1,0,0]=3 2294 B12R1.130 CC(=CCNC1CCNC1=O)C a25e4090a0c209b4463f9e69acc57800 [1,1,0,0,0,0|2,0,0]=4 2295 B12R1.130 CC(=CCNC1CCNC1=O)Cl d9bcf6eb956c6e10d701657475855b3c [1,1,0,0,0,0|2,0,0]=4 2296 B12R1.130 CC(=CCNC1CCNC1=O)I 17c71744891c8640ddfc7cb1b8c9161e [1,1,0,0,0,0|2,0,0]=4 2297 B12R1.130 CC(=CCNC1CCOC1=O)C ce02c2eb3080ad103e459569d1f0527a [1,1,0,0,0,0|2,0,0]=4 2298 B12R1.130 CC(=CCNC1CCSC1=O)C 3255e5e5b717ff3838a55d6506421732 [1,1,0,0,0,0|2,0,0]=4 2299 B12R1.130 CC(=CCNC1CCSC1=O)Cl cabeabf038bd6ac3690fc705f154cf71 [1,1,0,0,0,0|2,0,0]=4 2300 B12R1.130 CC(=CCNC1CCSC1=O)I a57c1aece183527613b7f84436306789 [1,1,0,0,0,0|2,0,0]=4 2301 B12R1.130 CC(=CCN[C@@H]1CCNC1=O)C b306321ad134862c4cd5eeccb0050c24 [1,1,0,0,0,0|2,0,0]=4 2302 B12R1.130 CC(=CCN[C@@H]1CCNC1=O)Cl 834bf555e35db7f4cf20f6f2dff9f29d [1,1,0,0,0,0|2,0,0]=4 2303 B12R1.130 CC(=CCN[C@@H]1CCNC1=O)I 3b648c8cf6e37200641bf1cabe969276 [1,1,0,0,0,0|2,0,0]=4 2304 B12R1.130 CC(=CCN[C@@H]1CCOC1=O)C 99b8fa03caf010dc1bd3873eedd9980a [1,1,0,0,0,0|2,0,0]=4 2305 B12R1.130 CC(=CCN[C@@H]1CCOC1=O)Cl a840d0bd2f9c0a7ed4c65b1634752d76 [1,1,0,0,0,0|2,0,0]=4 2306 B12R1.130 CC(=CCN[C@@H]1CCOC1=O)I 0dc56c91bbd20957d2f92d01e0d62b8c [1,1,0,0,0,0|2,0,0]=4 2307 B12R1.130 CC(=CCN[C@H]1CCNC1=O)C 3e45374c91070b83b13aea81f93cf4fd [1,1,0,0,0,0|2,0,0]=4 2308 B12R1.130 CC(=CCN[C@H]1CCNC1=O)Cl 4c7f212dd127baf50f4a1e0bd44f3f6e [1,1,0,0,0,0|2,0,0]=4 2309 B12R1.130 CC(=CCN[C@H]1CCNC1=O)I 1ebd6be96189047b0ea31eae605a268e [1,1,0,0,0,0|2,0,0]=4 2310 B12R1.130 CC(=CCN[C@H]1CCOC1=O)C e673a3147f40297e5b554c2ba7cda599 [1,1,0,0,0,0|2,0,0]=4 2311 B12R1.130 CC(=CCN[C@H]1CCOC1=O)Cl 75e367cd1f40b79ec993c361bd6bcf4d [1,1,0,0,0,0|2,0,0]=4 2312 B12R1.130 CC(=CCN[C@H]1CCOC1=O)I 406d24661fc9e90761719514eaa3c502 [1,1,0,0,0,0|2,0,0]=4 2313 B12R1.130 CC(=CCOC1CCCC1=O)C ceee3ccb8b3b91955bdba9f309dbbd23 [1,1,0,0,0,0|1,0,0]=3 2314 B12R1.130 CC(=CCOC1CCCC1=O)Cl f55d5e97ff62f2e814ee34427e38957e [1,1,0,0,0,0|1,0,0]=3 2315 B12R1.130 CC(=CCOC1CCCC1=O)I de6ed8c3f55f17ee74933824d3083f01 [1,1,0,0,0,0|1,0,0]=3 2316 B12R1.130 CC(=CCOC1CCNC1=O)C 9b57b347947f275b31b4a46d0f87f33d [1,1,0,0,0,0|2,0,0]=4 2317 B12R1.130 CC(=CCOC1CCNC1=O)Cl e729eadef492fd9ef7ee540b1ab2d720 [1,1,0,0,0,0|2,0,0]=4 2318 B12R1.130 CC(=CCOC1CCNC1=O)I 5677cd065cfc23e36f2ee688dfa89d1f [1,1,0,0,0,0|2,0,0]=4 2319 B12R1.130 CC(=CCOC1CCOC1=O)C 14ed3b2956998ec31748f6d65b6ad25e [1,1,0,0,0,0|2,0,0]=4 2320 B12R1.130 CC(=CCOC1CCOC1=O)Cl 69dec1b9f4c5bd4fed034b454df4cb7c [1,1,0,0,0,0|2,0,0]=4 2321 B12R1.130 CC(=CCOC1CCOC1=O)I e1c727c55eaa9d6a7a5cfc19f0a524e8 [1,1,0,0,0,0|2,0,0]=4 2322 B12R1.130 CC(=CCO[C@@H]1CCNC1=O)C 3a6366b54329f3b54b46daff0d525c02 [1,1,0,0,0,0|2,0,0]=4 2323 B12R1.130 CC(=CCO[C@@H]1CCNC1=O)Cl 76d2763ffa6e351924eb70c0a1e0e070 [1,1,0,0,0,0|2,0,0]=4 2324 B12R1.130 CC(=CCO[C@@H]1CCNC1=O)I f2d19c69ff05b7d24ad4e80d41897218 [1,1,0,0,0,0|2,0,0]=4 2325 B12R1.130 CC(=CCO[C@@H]1CCOC1=O)C 37c45a24725d6bbc1d54c56da2d9b203 [1,1,0,0,0,0|2,0,0]=4 2326 B12R1.130 CC(=CCO[C@@H]1CCOC1=O)Cl 7e216bf174d30dc4d60a12aa110ec258 [1,1,0,0,0,0|2,0,0]=4 2327 B12R1.130 CC(=CCO[C@@H]1CCOC1=O)I 6cfdbb5f5bd27067302601b179129439 [1,1,0,0,0,0|2,0,0]=4 2328 B12R1.130 CC(=CCO[C@H]1CCNC1=O)C fbd693c2bf1138d47906852b73ebcfb3 [1,1,0,0,0,0|2,0,0]=4 2329 B12R1.130 CC(=CCO[C@H]1CCNC1=O)Cl f3452ca43595bc35113166584bb9b54c [1,1,0,0,0,0|2,0,0]=4 2330 B12R1.130 CC(=CCO[C@H]1CCNC1=O)I 2a3d57ef5f8d8619e01356fe44531c57 [1,1,0,0,0,0|2,0,0]=4 2331 B12R1.130 CC(=CCO[C@H]1CCOC1=O)C 643bb44b7155c183e2106bf31f5a7d56 [1,1,0,0,0,0|2,0,0]=4 2332 B12R1.130 CC(=CCO[C@H]1CCOC1=O)Cl a494d5c6374f2d88e86483b405c40179 [1,1,0,0,0,0|2,0,0]=4 2333 B12R1.130 CC(=CCO[C@H]1CCOC1=O)I 33424c61e5d650d0bea1792590d7774a [1,1,0,0,0,0|2,0,0]=4 2334 B12R1.130 CC(=O)CCOC1CCCC1=O 2e7bd6e0d76e424877ed4b699dbab07f [1,1,0,0,0,0|1,0,1]=4 2335 B12R1.130 CC(=O)NCCN1CCCC1=O 9ddf2861dde324a787a1d65093f2ce7f [1,1,0,0,0,0|2,0,0]=4 2336 B12R1.130 CC(=O)NCOC1CCCC1=O 15727a1543013b7ce6fda475a6931c67 [1,1,0,0,0,0|2,0,0]=4 2337 B12R1.130 CC(=O)OCOC1CCCC1=O b4e27fb9446d9c71a48f647607a9030e [1,1,0,0,0,0|2,0,0]=4 2338 B12R1.130 CC(C)CCOC1CCCC1=O d88d313049e0fc1e3ac7c43d24fe8987 [1,1,0,0,0,0|1,0,1]=4 2339 B12R1.130 CC(C)COCC1CCCC1=O f792d4269ccf6c55fef908e464db1764 [1,1,0,0,0,0|1,0,1]=4 2340 B12R1.130 CC(C)NCCN1CCCC1=O 65f715d23a0174875563ea472b9f55f9 [1,1,0,0,0,0|2,0,0]=4 2341 B12R1.130 CC(C)OCCC1CCNC1=O f1fd900f82d46e0c5dbf7aad328fe586 [1,1,0,0,0,0|2,0,0]=4 2342 B12R1.130 CC(C)OCCN1CCCC1=O 5d0fe27852e2ed1c7cf3f31290c24bc3 [1,1,0,0,0,0|2,0,0]=4 2343 B12R1.130 O=C1CCCC1OCC=C(Cl)Cl f64ead09e1fe252b8c05e157b120da10 [1,1,0,0,0,0|2,0,0]=4 2344 B12R1.318 C/C=C/C(C)OC1CCCC1=O b0bb2f2b5fe9c6a09efef5372209d9a1 [1,1,0,0,0,0|1,0,0]=3 2345 B12R1.318 C/C=C/C(C)OC1CCNC1=O a8486b130574073db159ad8795dfa398 [1,1,0,0,0,0|2,0,0]=4 2346 B12R1.318 CC=CC(C)OC1CCCC1=O 2b52a2b3ea1bbc61e3be304f554ed8f5 [1,1,0,0,0,0|1,0,0]=3 2347 B12R1.318 CC=CC(C)OC1CCNC1=O be75de1be4e4a3a53a14b41bb9b4c6e5 [1,1,0,0,0,0|2,0,0]=4 2348 B12R1.318 CCCC(=S)OC1CCCC1=O d7b9a74837a4e342282f2263c8cb3625 [1,1,0,0,0,0|1,0,1]=4 2349 B12R1.318 CCCC(C)NC1CCCC1=O 8577d7b58e30707e28b298cce8836096 [1,1,0,0,0,0|1,0,1]=4 2350 B12R1.318 CCC[C@H](C)NC1CCCC1=O 10835da88e18fb4cdf4319cede141ec8 [1,1,0,0,0,0|1,0,1]=4 2351 B12R1.353 C/C(=C\I)/COC1CCCC1=O cad5147dcf2b6478494e403426071c6e [1,1,0,0,0,0|2,0,0]=4 2352 B12R1.353 C=C(CC)CNC1CCNC1=O 666800c47b7833c0d0d78a194d9d376f [1,1,0,0,0,0|2,0,0]=4 2353 B12R1.353 C=C(CC)CNC1CCSC1=O 6967fb5907e9c60fdaf2369dd3a3c948 [1,1,0,0,0,0|2,0,0]=4 2354 B12R1.353 C=C(CC)CN[C@@H]1CCNC1=O 963c9c6625c3dca55cd8d4a58bf4ecaf [1,1,0,0,0,0|2,0,0]=4 2355 B12R1.353 C=C(CC)CN[C@@H]1CCOC1=O 5b85cd0aaa8b2e9ad7f5f71ea8d31785 [1,1,0,0,0,0|2,0,0]=4 2356 B12R1.353 C=C(CC)CN[C@H]1CCNC1=O ac558ad6a9bf2322bff195d375ab44bf [1,1,0,0,0,0|2,0,0]=4 2357 B12R1.353 C=C(CC)CN[C@H]1CCOC1=O 4ce5d306b7758a650e5d861dbdf345e9 [1,1,0,0,0,0|2,0,0]=4 2358 B12R1.353 C=C(CC)COC1CCCC1=O 2127da17b3f434c00fcbfbfdfc549399 [1,1,0,0,0,0|1,0,0]=3 2359 B12R1.353 C=C(CC)COC1CCNC1=O 7416d00dca4d1d2b24a6cf37d22f01f4 [1,1,0,0,0,0|2,0,0]=4 2360 B12R1.353 C=C(CC)CO[C@@H]1CCNC1=O 784a38ccf6fe0356b6aa30f775fdfb3e [1,1,0,0,0,0|2,0,0]=4 2361 B12R1.353 C=C(CC)CO[C@H]1CCNC1=O a736788ac8650e97afe6f6f8aa4476df [1,1,0,0,0,0|2,0,0]=4 2362 B12R1.353 C=C(COC1CCCC1=O)OC ec80f822fa26bc4d672611c326e680c4 [1,1,0,0,0,0|2,0,0]=4 2363 B12R1.353 CC(=CI)COC1CCCC1=O 53b596ad2cdce5129b90b701b2199205 [1,1,0,0,0,0|2,0,0]=4 2364 B12R1.353 CCC(=O)CNC1CCNC1=O 80ad8dd1ddc508d6340ffd2dba814fb6 [1,1,0,0,0,0|2,0,0]=4 2365 B12R1.353 CCC(=O)CNC1CCSC1=O 5fe03f7688c8fd86888042ec8ac51acf [1,1,0,0,0,0|2,0,0]=4 2366 B12R1.353 CCC(=O)CN[C@@H]1CCNC1=O c3e2c36375ea84319521fd6dc7399eff [1,1,0,0,0,0|2,0,0]=4 2367 B12R1.353 CCC(=O)CN[C@@H]1CCOC1=O b8ba6712a822a71ef4cc3adf3d6226f8 [1,1,0,0,0,0|2,0,0]=4 2368 B12R1.353 CCC(=O)CN[C@H]1CCNC1=O c562313a6df49373b25c99270372be0e [1,1,0,0,0,0|2,0,0]=4 2369 B12R1.353 CCC(=O)CN[C@H]1CCOC1=O 61f83f61469cb97f122ef7108c059348 [1,1,0,0,0,0|2,0,0]=4 2370 B12R1.353 CCC(=O)COC1CCCC1=O 779788e35e5153299dea538d141dfd11 [1,1,0,0,0,0|1,0,0]=3 2371 B12R1.353 CCC(=O)COC1CCNC1=O 5274547fb4504e78d0666019f5e7e638 [1,1,0,0,0,0|2,0,0]=4 2372 B12R1.353 CCC(=O)COC1CCOC1=O 49b394d7a3a13ed209b0765b738ba9aa [1,1,0,0,0,0|2,0,0]=4 2373 B12R1.353 CCC(=O)CO[C@@H]1CCNC1=O 7d7e709d0b7e1547b3136dfe50324bb3 [1,1,0,0,0,0|2,0,0]=4 2374 B12R1.353 CCC(=O)CO[C@@H]1CCOC1=O ee81409c9cce869c6d87be42eded0627 [1,1,0,0,0,0|2,0,0]=4 2375 B12R1.353 CCC(=O)CO[C@H]1CCNC1=O 176b317f114aa572b716c805e3992882 [1,1,0,0,0,0|2,0,0]=4 2376 B12R1.353 CCC(=O)CO[C@H]1CCOC1=O fba6dd98ca29c52bd102bfa859c9baa6 [1,1,0,0,0,0|2,0,0]=4 2377 B12R1.353 CCC(=O)NCC1CCNC1=O 7abbb25e34b88280849bb344371a1db2 [1,1,0,0,0,0|2,0,0]=4 2378 B12R1.353 CCC(C)CNC1CCCC1=O 847ccccd669cc16036aa3683becb570f [1,1,0,0,0,0|1,0,1]=4 2379 B12R1.353 CCC(C)COC1CCCC1=O 0a0d0b2981db4721fb14b3b8892c5d8e [1,1,0,0,0,0|1,0,1]=4 2380 B12R1.353 CCC(C)OCC1CCCC1=O 37454923ba302bffb23791918d6b0833 [1,1,0,0,0,0|1,0,1]=4 2381 B12R1.353 CCC(O)CNC1CCCC1=O 12fd9785bcd14f7edb19c6fe30986515 [1,1,0,0,0,0|1,0,1]=4 2382 B12R1.353 CCN(C)CCC1CCNC1=O 8ee7aa1a6e618e73c8013701a7585ed0 [1,1,0,0,0,0|2,0,0]=4 2383 B12R1.353 CCN(C)CCN1CCCC1=O 7f542a9e61dfc3a75a749ea9f0f16193 [1,1,0,0,0,0|2,0,0]=4 2384 B12R1.353 CC[C@@H](C)COC1CCCC1=O 371e7aab76d875c526fba0ee4936de0f [1,1,0,0,0,0|1,0,1]=4 2385 B12R1.353 CC[C@@H](O)CNC1CCCC1=O 7bc7bbce4986b6c424a3cc0ac542ebe4 [1,1,0,0,0,0|1,0,1]=4 2386 B12R1.353 CC[C@H](C)CNC1CCCC1=O 7d51878d1f3e8043b49e1de06d847120 [1,1,0,0,0,0|1,0,1]=4 2387 B12R1.353 CC[C@H](C)COC1CCCC1=O 80aa56aa5f0675be923955aeb6d67edb [1,1,0,0,0,0|1,0,1]=4 2388 B12R1.353 CNC(=O)CNC1CCCC1=O d69ef94556f7c52713ca850c57aebf35 [1,1,0,0,0,0|2,0,0]=4 2389 B12R1.353 CNC(=O)COC1CCCC1=O 199d1174f45dac8d23168f260fab13ae [1,1,0,0,0,0|2,0,0]=4 2390 B12R1.353 COC(=O)COC1CCCC1=O 0afbb45bb6d5d583bfd173ff486ef02e [1,1,0,0,0,0|2,0,0]=4 2391 B12R1.353 O=C1CCCC1OC/C(=C/Cl)/Cl 25059c3ca65d60c799cac92a53b79cf4 [1,1,0,0,0,0|2,0,0]=4 2392 B12R1.456 C/C=C/COC1CC(OC1=O)C 2f580dd909130bef5b3f0d54f621d7f0 [1,1,0,0,0,0|2,0,0]=4 2393 B12R1.456 C/C=C/CO[C@@H]1C[C@@H](NC1=O)C f9927e7925ade76895d3e6cbd88fa64f [1,1,0,0,0,0|2,0,0]=4 2394 B12R1.456 C/C=C\COC1CC(OC1=O)C 449f03a2c476ca2604570c61fff0a7d4 [1,1,0,0,0,0|2,0,0]=4 2395 B12R1.456 C/C=C\CO[C@@H]1C[C@@H](NC1=O)C 2e5cab9eab2e65b0dcc01dbd09b27c1f [1,1,0,0,0,0|2,0,0]=4 2396 B12R1.456 CC=CCNC1CC(OC1=O)C 0e4337894df7ebed624ab3a166c30c98 [1,1,0,0,0,0|2,0,0]=4 2397 B12R1.456 CC=CCOC1CC(OC1=O)C 8ebf6a35d8f705575ece8f3ef19dc03e [1,1,0,0,0,0|2,0,0]=4 2398 B12R1.527 C/C=C/CNC1CCN(C1=O)C 734ce44bfb17f30157ebc3e3868743ad [1,1,0,0,0,0|2,0,0]=4 2399 B12R1.527 C/C=C/CNC1CCN(C1=O)O 4b05f3e24092289d25699e8a30e6cabf [1,1,0,0,0,0|2,0,0]=4 2400 B12R1.527 C/C=C/CN[C@@H]1CCN(C1=O)C fc628072a3df53c6ad10e7188b493497 [1,1,0,0,0,0|2,0,0]=4 2401 B12R1.527 C/C=C/CN[C@@H]1CCN(C1=O)O 4e6c6126383389b3c78c293fc2c8cd82 [1,1,0,0,0,0|2,0,0]=4 2402 B12R1.527 C/C=C/CN[C@H]1CCN(C1=O)C 36673eb7b19e61af300d0677de1edeab [1,1,0,0,0,0|2,0,0]=4 2403 B12R1.527 C/C=C/CO[C@@H]1CCN(C1=O)C d7785db2057a28042ed1b538c0e4205e [1,1,0,0,0,0|2,0,0]=4 2404 B12R1.527 C/C=C\CNC1CCN(C1=O)C 13bfd66d442ab9850689448ec7cbd6ba [1,1,0,0,0,0|2,0,0]=4 2405 B12R1.527 C/C=C\CNC1CCN(C1=O)O 9b22509e449ec7f4a704b0e193001879 [1,1,0,0,0,0|2,0,0]=4 2406 B12R1.527 C/C=C\CN[C@@H]1CCN(C1=O)C 4d40b99bf778965fcd47b66d31f7c71a [1,1,0,0,0,0|2,0,0]=4 2407 B12R1.527 C/C=C\CN[C@@H]1CCN(C1=O)O 0099bd6557f6bfde8b68ead51dfa88bf [1,1,0,0,0,0|2,0,0]=4 2408 B12R1.527 C/C=C\CN[C@H]1CCN(C1=O)C 8e65a75740f83f82050bac1bf0182093 [1,1,0,0,0,0|2,0,0]=4 2409 B12R1.527 C/C=C\CO[C@@H]1CCN(C1=O)C 10faa6860ccfe3000e2b7c53f4d19232 [1,1,0,0,0,0|2,0,0]=4 2410 B12R1.527 CC=CCNC1CCN(C1=O)C 315919eec42a69aa3e37e9578195264c [1,1,0,0,0,0|2,0,0]=4 2411 B12R1.567 C/C=C/CN[C@@H]1C(=O)NC[C@H]1O 4a2219e1c9be693756b4eb0b3bcd4947 [1,1,0,0,0,0|2,0,0]=4 2412 B12R1.567 C/C=C/COC1C(=O)CCC1=O f2d21c59348e2e1662d6ce2514ae52a5 [1,1,0,0,0,0|1,0,1]=4 2413 B12R1.567 C/C=C\CN[C@@H]1C(=O)NC[C@H]1O 19f36cc36ab3db2f9aad043032e58b71 [1,1,0,0,0,0|2,0,0]=4 2414 B12R1.567 C/C=C\COC1C(=O)CCC1=O ea8ea7711ba022c5ee31ea3b93744ffe [1,1,0,0,0,0|1,0,1]=4 2415 B12R1.567 CC=CCNC1C(=O)CCC1=O 72bc83704a7730b217e40e12906372e3 [1,1,0,0,0,0|1,0,1]=4 2416 B12R1.567 CC=CCN[C@@H]1C(=O)OC[C@@H]1O 23ffd4a5642ae243cdb0e3680279594b [1,1,0,0,0,0|2,0,0]=4 2417 B12R1.567 CC=CCOC1C(=O)CCC1=O 6ebf74c35c7991a4a699ff0ac64740a3 [1,1,0,0,0,0|1,0,1]=4 2418 B12R1.3204 C/C=C/CNC1(CCNC1=O)C 0258a1281bc4054ccd0694694a6e6d96 [1,1,0,0,0,0|2,0,0]=4 2419 B12R1.3204 C/C=C\CNC1(CCNC1=O)C 5b9466f299c270c04ccd827fdfea4942 [1,1,0,0,0,0|2,0,0]=4 2420 B12R1.3204 CCCOCC1(CCCC1=O)C e0f52260e7399082704014cfd6fec503 [1,1,0,0,0,0|1,0,1]=4 2421 B12R1.229 CC(C)/C=C/CN[C@H]1CNC1=O a12a0853b68f58e3389180db94506521 [0,1,0,0,1,0|2,0,0]=4 2422 B12R1.229 CC(C)/C=C/COC1CCC1=O 3540ec442abe51b581fef1bac0fcd6bb [0,1,0,0,1,0|1,0,0]=3 2423 B12R1.229 CC(C)CNCCC1CCC1=O 14838bb4dc5ebda467cfe1ba66a70dd2 [0,1,0,0,1,0|1,0,1]=4 2424 B12R1.229 CC(C)COCCC1CCC1=O 9a2f4c06e0d0703cdd59419bbe8ed43c [0,1,0,0,1,0|1,0,1]=4 2425 B12R1.229 CC(F)COCCC1CCC1=O 68bf558183d54708f33196258751ee0a [0,1,0,0,1,0|1,0,1]=4 2426 B12R1.229 CC(O)CNCCC1CCC1=O 5de3ae42573e6739f48ee80fb17db1fa [0,1,0,0,1,0|1,0,1]=4 2427 B12R1.229 CC(S)COCCC1CCC1=O 32f9ecec367ef8e8d9303c0c1edf43ab [0,1,0,0,1,0|1,0,1]=4 2428 B12R1.229 C[C@@H](F)COCCC1CCC1=O 27e68255be34411f7aab438fa0252be9 [0,1,0,0,1,0|1,0,1]=4 2429 B12R1.229 C[C@@H](O)CNCCC1CCC1=O cc950ebe6735362d6b419fcdd0d1a429 [0,1,0,0,1,0|1,0,1]=4 2430 B12R1.229 C[C@H](F)COCCC1CCC1=O 94e1eee7290dbfdc8cb38f9b44da3de8 [0,1,0,0,1,0|1,0,1]=4 2431 B12R1.229 C[C@H](O)CNCCC1CCC1=O a2c4182c36d1aa46d7d55a38edae596a [0,1,0,0,1,0|1,0,1]=4 2432 B12R1.311 CCCN(C)CCC1CCC1=O e23da0c019135975479eefead70d4674 [0,1,0,0,1,0|1,0,1]=4 2433 B12R1.311 CCNC(=O)CNC1CCC1=O 47d549148246767246343f8a6d9d3453 [0,1,0,0,1,0|2,0,0]=4 2434 B12R1.311 CCNC(=O)COC1CCC1=O c6b6e041310faa83d61dd4a6718bcbd0 [0,1,0,0,1,0|2,0,0]=4 2435 B12R1.311 CCOC(=O)COC1CCC1=O 0f857c0b0f868747ab73292ad0956c83 [0,1,0,0,1,0|2,0,0]=4 2436 B12R1.364 C=C(CC)COCC1CCC1=O 7264119a65de7a397c177c6294533f25 [0,1,0,0,1,0|1,0,1]=4 2437 B12R1.364 CCC(=O)COCC1CCC1=O a77df657f7b1c64e6eea26b0b4f02c67 [0,1,0,0,1,0|1,0,1]=4 2438 B12R1.364 CCC(=O)OCOC1CCC1=O f2fa578feca8cd74b5bea03adb5e8f33 [0,1,0,0,1,0|2,0,0]=4 2439 B12R1.364 CCC(C)NCCC1CCC1=O 194d3d9e34a4eee3046357dc039ed0c4 [0,1,0,0,1,0|1,0,1]=4 2440 B12R1.364 CCC(C)OCCC1CCC1=O 6987570cd1ee6e83f319b217c500083d [0,1,0,0,1,0|1,0,1]=4 2441 B12R1.364 CC[C@@H](C)NCCC1CCC1=O 184840e8395be34542efb8d65d9a8ffc [0,1,0,0,1,0|1,0,1]=4 2442 B12R1.364 CC[C@@H](C)OCCC1CCC1=O fa174d2d3a50d821bf309087f8ccf306 [0,1,0,0,1,0|1,0,1]=4 2443 B12R1.364 CC[C@H](C)NCCC1CCC1=O be9bf40b52d177f570be2a2e4d308c1d [0,1,0,0,1,0|1,0,1]=4 2444 B12R1.364 CC[C@H](C)OCCC1CCC1=O f8ca53bf8fd7f0b09513e2834205ba23 [0,1,0,0,1,0|1,0,1]=4 2445 B12R1.383 C/C=C/C=C/COC1CCC1=O 540c20a588580c90b5f1918592ac0947 [0,1,0,0,1,0|0,0,2]=4 2446 B12R1.383 C/C=C/CCCOC1CCC1=O 21fe4519603a2a2f40eb1cf036258dbb [0,1,0,0,1,0|0,0,2]=4 2447 B12R1.383 C/C=C/COCCC1CCC1=O 1b5369ad3991b527fd55378466254ae2 [0,1,0,0,1,0|0,0,2]=4 2448 B12R1.383 C/C=C\CCCOC1CCC1=O 4517e29ec1f0443674ad901479be46f0 [0,1,0,0,1,0|0,0,2]=4 2449 B12R1.383 C/C=C\COCCC1CCC1=O 6c72035093fbb8a578d7feaa6b53d521 [0,1,0,0,1,0|0,0,2]=4 2450 B12R1.383 C=C/C=C/CCNC1CCC1=O ccfd9c8b09c104315ad6862543753e68 [0,1,0,0,1,0|0,0,2]=4 2451 B12R1.383 CC/C=C/CCOC1CCC1=O fcc62bcd4764f142f8836ee0d035a10f [0,1,0,0,1,0|0,0,0]=2 2452 B12R1.383 CC/C=C/CNCC1CCN1C 466f8fbdaa25e0dbc3d24c57d397b6ae [0,1,0,0,1,0|2,0,0]=4 2453 B12R1.383 CC/C=C/COCC1CCC1=O f77bd6f9d594655ad7bb6b5b56d9a105 [0,1,0,0,1,0|0,0,0]=2 2454 B12R1.383 CC/C=C/COCC1CCC1F 6ba8adab2ed3b9ea9e9fe76d5083c73d [0,1,0,0,1,0|1,0,1]=4 2455 B12R1.383 CC/C=C/COCC1CCN1C 364318e888959fe220bb9194c4937e80 [0,1,0,0,1,0|2,0,0]=4 2456 B12R1.383 CC/C=C/COCC1COC1=O 4f1a53b0bbf2d81ca036806ae6040b96 [0,1,0,0,1,0|1,0,0]=3 2457 B12R1.383 CC/C=C/COC[C@@H]1CCN1C a5853d6e2c98d7b60d4405fe8aec11ca [0,1,0,0,1,0|2,0,0]=4 2458 B12R1.383 CC/C=C/COC[C@H]1CCN1C d9a60efe89ba5a50a63a9383d9a367fb [0,1,0,0,1,0|2,0,0]=4 2459 B12R1.383 CC/C=C\CCNC1CCC1F a919ee2375ed4455d01b778d9695447c [0,1,0,0,1,0|1,0,1]=4 2460 B12R1.383 CC/C=C\CCNC1CCC1O 7b7f8f705cebde37bc8d147ba382621f [0,1,0,0,1,0|0,0,2]=4 2461 B12R1.383 CC/C=C\CCN[C@@H]1CC[C@@H]1O 42109e76a5c72b734f5816876131eff9 [0,1,0,0,1,0|0,0,2]=4 2462 B12R1.383 CC/C=C\CCN[C@@H]1CC[C@H]1C 57d51e9c047e41dbc3daf13a69a8887f [0,1,0,0,1,0|1,0,1]=4 2463 B12R1.383 CC/C=C\CCN[C@@H]1CC[C@H]1O 3415e825e5b8c2792812bcc054788d09 [0,1,0,0,1,0|0,0,2]=4 2464 B12R1.383 CC/C=C\CCN[C@H]1CC[C@@H]1O f62c57271f35a1d34d9773a325e96573 [0,1,0,0,1,0|0,0,2]=4 2465 B12R1.383 CC/C=C\CCN[C@H]1CC[C@H]1C 8dd2dcbf62be9c74e8bd04d8fa3b715d [0,1,0,0,1,0|1,0,1]=4 2466 B12R1.383 CC/C=C\CCN[C@H]1CC[C@H]1O d77a51e8076106139b90290733c23fe3 [0,1,0,0,1,0|0,0,2]=4 2467 B12R1.383 CC/C=C\CCN[C@H]1CNC1=O f3cc8a4078d30a5a6ca8aebecfd89a6d [0,1,0,0,1,0|1,0,0]=3 2468 B12R1.383 CC/C=C\CCOC1CCC1=O 0a67c436f2fccc897ad757724cb77fcf [0,1,0,0,1,0|0,0,0]=2 2469 B12R1.383 CC/C=C\COCC1COC1=O 747430d13370557411c48467bcaa0931 [0,1,0,0,1,0|1,0,0]=3 2470 B12R1.383 CC=CC=CCOC1CCC1=O 30d5cb01e0ae83703dd27eaa2ea598e1 [0,1,0,0,1,0|0,0,2]=4 2471 B12R1.383 CC=CCCCOC1CCC1=O b20844a6eec1d6b6795732e95781d8f3 [0,1,0,0,1,0|0,0,2]=4 2472 B12R1.383 CC=CCNCCC1CCC1=O bc9b692f8921cce733efe2bbd6533984 [0,1,0,0,1,0|0,0,2]=4 2473 B12R1.383 CC=CCOCCC1CCC1=O d1f3a314f0f5749cb8fe64df6305589d [0,1,0,0,1,0|0,0,2]=4 2474 B12R1.383 CCC/C=C/CN[C@H]1CNC1=O dd8a043ec7cd5a1d42e3197cb9955d82 [0,1,0,0,1,0|2,0,0]=4 2475 B12R1.383 CCC/C=C/COC1CCC1=O a9b3f03a620f15a9950fd72585ad87ae [0,1,0,0,1,0|1,0,0]=3 2476 B12R1.383 CCC/C=C\CN[C@H]1CNC1=O 16ee8a4e7ac854bfd6b37b1328c7cbc0 [0,1,0,0,1,0|2,0,0]=4 2477 B12R1.383 CCC/C=C\COC1CCC1=O 1f4678b5d420d4cf432e8e3b5c247171 [0,1,0,0,1,0|1,0,0]=3 2478 B12R1.383 CCCCCCOC1CCC1=O fb3755ef5063eb81004edbf86e8d619b [0,1,0,0,1,0|0,0,2]=4 2479 B12R1.383 CCCCCOCC1CCC1=O 824001eada13aa6b0137a01f47c0f088 [0,1,0,0,1,0|0,0,2]=4 2480 B12R1.383 CCCCNCCC1CCC1=O 1ba5f39faed4c4930fad4ab1e9742767 [0,1,0,0,1,0|0,0,2]=4 2481 B12R1.383 CCCCOCCC1CCC1=O bd043f47fcf89c2fc89c93924776f988 [0,1,0,0,1,0|0,0,2]=4 2482 B12R1.383 CCCOCCOC1CCC1=O 3c86b99999296a12e709ff3544a2958b [0,1,0,0,1,0|1,0,1]=4 2483 B12R1.383 CCOCCCOC1CCC1=O 1a9d2acacc999958e56544d9171a8499 [0,1,0,0,1,0|1,0,1]=4 2484 B12R1.383 CCOCCOCC1CCC1=O 1a8566d7478fccf346ac1cc1723d622b [0,1,0,0,1,0|1,0,1]=4 2485 B12R1.383 CCSCCOCC1CCC1=O b2c88cbb0ac9dcdc24fc5330f2a0e658 [0,1,0,0,1,0|1,0,1]=4 2486 B12R1.383 COCCNCCC1CCC1=O 548ad20deb5638866d83c8009c9b4188 [0,1,0,0,1,0|1,0,1]=4 2487 B12R1.383 COCCOCCC1CCC1=O c0e3866b9d40cf0f69bcc6cfac9c2d72 [0,1,0,0,1,0|1,0,1]=4 2488 B12R1.383 CSCCNCCC1CCC1=O 1b58e4116750bbd1f2a2718177f15d3e [0,1,0,0,1,0|1,0,1]=4 2489 B12R1.383 CSCCOCCC1CCC1=O 984ae453427895de610cb57a20dbdc55 [0,1,0,0,1,0|1,0,1]=4 2490 B12R1.383 N#CC=CCOCC1CCC1=O 130cc710553240c750f6668bae18e306 [0,1,0,0,1,0|1,0,1]=4 2491 B12R1.383 O=C1CCC1CCNCCCCl 9a1a4de0f7bf644c237a0d23d9db08fe [0,1,0,0,1,0|1,0,1]=4 2492 B12R1.383 O=C1CCC1CCNCCCO c205495f7590d2d8a227488ce7983157 [0,1,0,0,1,0|1,0,1]=4 2493 B12R1.383 O=C1CCC1CCOCCCF 28f6736cd2cef7a4b849c0be3e2794c0 [0,1,0,0,1,0|1,0,1]=4 2494 B12R1.383 O=C1CCC1CCOCCCS 51c081557c83783bd3f0f2850eb88192 [0,1,0,0,1,0|1,0,1]=4 2495 B12R1.1759 CC/C=C/CN[C@@H]1CN(C1=O)C d7763db4f5739931edad731015b1d6b5 [0,1,0,0,1,0|2,0,0]=4 2496 B12R1.1759 CC/C=C/CN[C@H]1CN(C1=O)C 107ad7c698798e6e8215871174a570d7 [0,1,0,0,1,0|2,0,0]=4 2497 B14R1.9 CC/C=C/COC1=C(C(=O)CCC1)Cl 3002c6e2b0c91fb1e18a5c5a6ae32f90 [0,1,0,0,0,1|1,0,1]=4 2498 B14R1.9 CC/C=C/COC1=C(C(=O)CCC1)I ef5861d6cfb77379d9e16a35187f06d5 [0,1,0,0,0,1|1,0,1]=4 2499 B14R1.9 CC/C=C\CCN1CCNC(=O)C1C 19724d9568e785da10aba76d28bdbf3a [0,1,0,0,0,1|2,0,0]=4 2500 B14R1.9 CC/C=C\CCN1CCNC(=O)[C@@H]1C fd68bab20f513501e7f5c6f31a614743 [0,1,0,0,0,1|2,0,0]=4 2501 B14R1.9 CC/C=C\CCN1CCNC(=O)[C@H]1C 2aabc2c47a2122a5e50cf34b85bca6a4 [0,1,0,0,0,1|2,0,0]=4 2502 B14R1.20 CC/C=C/CC(=O)N1CCCC(=O)C1 ad283683be1f6c290e6bd89da24b58ad [0,1,0,0,0,1|1,0,1]=4 2503 B14R1.20 CC/C=C\CC(=O)N1CCCC(=O)C1 9ee8361af6d1b3c4eb0b9e9c83ded914 [0,1,0,0,0,1|1,0,1]=4 2504 B14R1.20 CCC=CCC(=O)N1CCCC(=O)C1 086c73bd7385201fea1415b5eb651256 [0,1,0,0,0,1|1,0,1]=4 2505 B14R1.26 C/C=C/C=C/COC1CCCC(=O)C1 b363dbbcc4b13a2c8e7fab183d07be86 [0,1,0,0,0,1|0,0,2]=4 2506 B14R1.26 C/C=C/CCCOC1CCCC(=O)C1 ca611958dc2b498b9461d11f7ff55cbd [0,1,0,0,0,1|0,0,2]=4 2507 B14R1.26 C/C=C\CCCOC1CCCC(=O)C1 a2010f6e19628dcce492d221afb82551 [0,1,0,0,0,1|0,0,2]=4 2508 B14R1.26 C=C/C=C/CCNC1CCCC(=O)C1 2606651e299d5afdb427393052c3de4e [0,1,0,0,0,1|0,0,2]=4 2509 B14R1.26 CC/C=C/CCOC1CCCC(=O)C1 81076292898a3cac050b2505efb04e7d [0,1,0,0,0,1|0,0,0]=2 2510 B14R1.26 CC/C=C/CCO[C@@H]1CCCN(C1)C 21082a38b63a5335874383791c6b24d2 [0,1,0,0,0,1|2,0,0]=4 2511 B14R1.26 CC/C=C/CCO[C@H]1CCCN(C1)C 286882aaa558365323760ea5f623073e [0,1,0,0,0,1|2,0,0]=4 2512 B14R1.26 CC/C=C/CNCC1CCCC(=O)N1 01e03a94bf8d2a65123f1e53c0f066c0 [0,1,0,0,0,1|0,0,0]=2 2513 B14R1.26 CC/C=C/CNCC1CCCC(C1)C 7db017793c14f7054539041e213323a7 [0,1,0,0,0,1|1,0,1]=4 2514 B14R1.26 CC/C=C/CNCC1CCCC(C1)O 247370bc4be06c8ea20dd7665ef0db85 [0,1,0,0,0,1|0,0,2]=4 2515 B14R1.26 CC/C=C/CNCC1CCCN(C1)C 9f14c195427984cb17ab50c1ee55c88a [0,1,0,0,0,1|2,0,0]=4 2516 B14R1.26 CC/C=C/CNCC1CCNC(=O)C1 c2abee90c1248a23367eed02ef19c7f5 [0,1,0,0,0,1|1,0,0]=3 2517 B14R1.26 CC/C=C/CNC[C@@H]1CCCN(C1)C 00e26a7a55504cf198444ea4fb123af0 [0,1,0,0,0,1|2,0,0]=4 2518 B14R1.26 CC/C=C/CNC[C@H]1CCCN(C1)C 8934f88f189b5e21b9a53451cb392157 [0,1,0,0,0,1|2,0,0]=4 2519 B14R1.26 CC/C=C/CNC[C@H]1CCC[C@H](C1)O 086470ce097726e77e5cfabafa33e8cd [0,1,0,0,0,1|0,0,2]=4 2520 B14R1.26 CC/C=C/COCC1CCCC(=O)C1 346e94b591e48a5afa50929d0b48112c [0,1,0,0,0,1|0,0,0]=2 2521 B14R1.26 CC/C=C/COCC1CCCC(=O)N1 8dcdf994cfcc790dfb9c465c2a05add6 [0,1,0,0,0,1|0,0,0]=2 2522 B14R1.26 CC/C=C/COCC1CCCC(C1)C c9458fec3a1ffce8d85fefbb28c24f7e [0,1,0,0,0,1|1,0,1]=4 2523 B14R1.26 CC/C=C/COCC1CCCN(C1)C 01ad22c781278033cb581b6def0745ef [0,1,0,0,0,1|2,0,0]=4 2524 B14R1.26 CC/C=C/COCC1CCNC(=O)C1 0c2a4a66ede3a08637b27ca394fff259 [0,1,0,0,0,1|1,0,0]=3 2525 B14R1.26 CC/C=C/COCC1COCC(=O)N1 a1dcfbb3ed7b0585e610074be3dc9f08 [0,1,0,0,0,1|1,0,0]=3 2526 B14R1.26 CC/C=C/COC[C@@H]1CCCC(=O)N1 edd4ffeb886ec2e018d38def9d5b39a9 [0,1,0,0,0,1|0,0,0]=2 2527 B14R1.26 CC/C=C/COC[C@@H]1CCCN(C1)C 86a25ba3bac7591b258718e63c45833e [0,1,0,0,0,1|2,0,0]=4 2528 B14R1.26 CC/C=C/COC[C@@H]1COCC(=O)N1 4dab6075d4d1c555534478821576d94a [0,1,0,0,0,1|1,0,0]=3 2529 B14R1.26 CC/C=C/COC[C@H]1CCCC(=O)N1 2bf1cd8933805c61402b5f5bac62e061 [0,1,0,0,0,1|0,0,0]=2 2530 B14R1.26 CC/C=C/COC[C@H]1CCCN(C1)C f577e07d904aeb8fe672fc4314e9ee8c [0,1,0,0,0,1|2,0,0]=4 2531 B14R1.26 CC/C=C/COC[C@H]1COCC(=O)N1 cba444df6258dc3a9c8ccdcd6061e255 [0,1,0,0,0,1|1,0,0]=3 2532 B14R1.26 CC/C=C\CCNC1CCCC(C1)C 65eac4e02d5e8dda3ba59e3251fb0a08 [0,1,0,0,0,1|1,0,1]=4 2533 B14R1.26 CC/C=C\CCNC1CCCC(C1)O d03a6ecd8052fd42e82e10d933c2fac9 [0,1,0,0,0,1|0,0,2]=4 2534 B14R1.26 CC/C=C\CCNC1CCCN(C1)C 24d9ae44178ff7e98288fc953c6dc50d [0,1,0,0,0,1|2,0,0]=4 2535 B14R1.26 CC/C=C\CCNC1CCNC(=O)C1 946922b3d25430f5b51199ab78684c3e [0,1,0,0,0,1|1,0,0]=3 2536 B14R1.26 CC/C=C\CCN[C@@H]1CCCN(C1)C 57a9792ba3a17a5e363f64aae8783980 [0,1,0,0,0,1|2,0,0]=4 2537 B14R1.26 CC/C=C\CCN[C@@H]1CCC[C@@H](C1)O 917d545bff9be80de9de32d07b20434b [0,1,0,0,0,1|0,0,2]=4 2538 B14R1.26 CC/C=C\CCN[C@@H]1CCC[C@H](C1)C 009dd8ba39ab7de02b5442068e27decc [0,1,0,0,0,1|1,0,1]=4 2539 B14R1.26 CC/C=C\CCN[C@@H]1CCC[C@H](C1)O 7192ad90b3a64e06a3fc42a47c64f9ea [0,1,0,0,0,1|0,0,2]=4 2540 B14R1.26 CC/C=C\CCN[C@@H]1CCNC(=O)C1 80812e5a3ff71d0bdc282593cbc54111 [0,1,0,0,0,1|1,0,0]=3 2541 B14R1.26 CC/C=C\CCN[C@H]1CCCN(C1)C 2043fdca4a0a55b53a29643014976cd1 [0,1,0,0,0,1|2,0,0]=4 2542 B14R1.26 CC/C=C\CCN[C@H]1CCC[C@@H](C1)O 40d012c57ee2e7cca84b5468e01e8e09 [0,1,0,0,0,1|0,0,2]=4 2543 B14R1.26 CC/C=C\CCN[C@H]1CCC[C@H](C1)O 4492ccbe8fb433a961d0dad7c98170d7 [0,1,0,0,0,1|0,0,2]=4 2544 B14R1.26 CC/C=C\CCN[C@H]1CCNC(=O)C1 4fba64752cccd9bcf730e8c46bbb69b1 [0,1,0,0,0,1|1,0,0]=3 2545 B14R1.26 CC/C=C\CCOC1=CC(=O)CCC1 1b59bff1f40c720eb91187a6982e71c9 [0,1,0,0,0,1|0,0,1]=3 2546 B14R1.26 CC/C=C\CCOC1C=C(CCC1)C 86fad9342016d8c16d55d2cfc891c877 [0,1,0,0,0,1|1,0,0]=3 2547 B14R1.26 CC/C=C\CCOC1C=C(COC1)Br c7b76a612f4cce710a5db043e01ba925 [0,1,0,0,0,1|2,0,0]=4 2548 B14R1.26 CC/C=C\CCOC1CCCC(=O)C1 dc4e9c4486b781f988624415d595d782 [0,1,0,0,0,1|0,0,0]=2 2549 B14R1.26 CC/C=C\CCOC1CCCC(C1)C 94a82b6287d4f7f1f7618c23cda8ccf8 [0,1,0,0,0,1|1,0,1]=4 2550 B14R1.26 CC/C=C\CCOC1CCCN(C1)C ad253cea41abb1ad9707f20ba2141d0d [0,1,0,0,0,1|2,0,0]=4 2551 B14R1.26 CC/C=C\CCOC1CCNC(=O)C1 f9375335017da9a134c33f195e7bc96e [0,1,0,0,0,1|1,0,0]=3 2552 B14R1.26 CC/C=C\CCO[C@@H]1CCCN(C1)C e9df6fc613dd2dd6a2d80217f8e774c0 [0,1,0,0,0,1|2,0,0]=4 2553 B14R1.26 CC/C=C\CCO[C@@H]1CCC[C@@H](C1)C 1775a3ccef934235c39b2410c965a645 [0,1,0,0,0,1|1,0,1]=4 2554 B14R1.26 CC/C=C\CCO[C@@H]1CCNC(=O)C1 4f6d692e31bb7b26fc587dfd89b4ce85 [0,1,0,0,0,1|1,0,0]=3 2555 B14R1.26 CC/C=C\CCO[C@H]1CCCN(C1)C c0442618662c5e59584ea511a22d3e0c [0,1,0,0,0,1|2,0,0]=4 2556 B14R1.26 CC/C=C\CCO[C@H]1CCC[C@@H](C1)C f92686e779353e625e909c5ed65e9d4a [0,1,0,0,0,1|1,0,1]=4 2557 B14R1.26 CC/C=C\CCO[C@H]1CCC[C@H](C1)C c490827265c0ece7a714d2cbbf71fc44 [0,1,0,0,0,1|1,0,1]=4 2558 B14R1.26 CC/C=C\CCO[C@H]1CCNC(=O)C1 be24f4d86a59fed98353156d4de9b6b5 [0,1,0,0,0,1|1,0,0]=3 2559 B14R1.26 CC/C=C\COCC1CCNC(=O)C1 a5391f806e3c28ee66d85d2777b47a91 [0,1,0,0,0,1|1,0,0]=3 2560 B14R1.26 CC=C=CCCOC1CCCC(=O)C1 e3bc8cc95e05a2cd8ced61fd009022a8 [0,1,0,0,0,1|0,0,2]=4 2561 B14R1.26 CC=CC=CCOC1CCCC(=O)C1 285d330b3363172abbb4bee33d844976 [0,1,0,0,0,1|0,0,2]=4 2562 B14R1.26 CC=CCCCOC1CCCC(=O)C1 93e7b744faaa9449b43908062bfd82ae [0,1,0,0,0,1|0,0,2]=4 2563 B14R1.26 CCC#CCCOC1CCCC(=O)C1 1a18ff30839449ce34db0e20cd1667f1 [0,1,0,0,0,1|0,0,2]=4 2564 B14R1.26 CCC/C=C/CNC1CCNC(=O)C1 2e058b2d9f04d3403ad5ad3e8174e7c6 [0,1,0,0,0,1|2,0,0]=4 2565 B14R1.26 CCC/C=C/CN[C@@H]1CCNC(=O)C1 aeab3a58db3d1762417969b53f7d56e4 [0,1,0,0,0,1|2,0,0]=4 2566 B14R1.26 CCC/C=C/CN[C@H]1CCNC(=O)C1 1fb233eace06e26cd3ebb562f773be79 [0,1,0,0,0,1|2,0,0]=4 2567 B14R1.26 CCC/C=C/COC1=CC(=O)CCC1 192b73fd317f554a63e15a8294633211 [0,1,0,0,0,1|1,0,1]=4 2568 B14R1.26 CCC/C=C/COC1C=C(CCC1)C 4c40261bc20a60b623b6af27913e3370 [0,1,0,0,0,1|2,0,0]=4 2569 B14R1.26 CCC/C=C/COC1CCCC(=O)C1 60e844dfebaa2027eb1d054467bee0c2 [0,1,0,0,0,1|1,0,0]=3 2570 B14R1.26 CCC/C=C/COC1CCNC(=O)C1 1bf0e908078b631b7ff3ee6339f1d07a [0,1,0,0,0,1|2,0,0]=4 2571 B14R1.26 CCC/C=C/CO[C@@H]1CCNC(=O)C1 57614a33a7811cb7322245dd10b03a87 [0,1,0,0,0,1|2,0,0]=4 2572 B14R1.26 CCC/C=C/CO[C@H]1CCNC(=O)C1 4a09dfdc24fb3e89a971a4c5d898b2de [0,1,0,0,0,1|2,0,0]=4 2573 B14R1.26 CCC/C=C\CNC1CCNC(=O)C1 8e30b9ef97ee45e611066b801dafffee [0,1,0,0,0,1|2,0,0]=4 2574 B14R1.26 CCC/C=C\CN[C@@H]1CCNC(=O)C1 4444814f65ef9fa08be406da5348322b [0,1,0,0,0,1|2,0,0]=4 2575 B14R1.26 CCC/C=C\CN[C@H]1CCNC(=O)C1 76fd031f6aea4334a96c8c7f313aba1e [0,1,0,0,0,1|2,0,0]=4 2576 B14R1.26 CCC/C=C\COC1=CC(=O)CCC1 b0ce1738b7444591fbfb2da6bcc241e0 [0,1,0,0,0,1|1,0,1]=4 2577 B14R1.26 CCC/C=C\COC1C=C(CCC1)C aec3cd4a9786784a79369c014b67c659 [0,1,0,0,0,1|2,0,0]=4 2578 B14R1.26 CCC/C=C\COC1CCCC(=O)C1 7aed324742fe102f95506f519029dc5f [0,1,0,0,0,1|1,0,0]=3 2579 B14R1.26 CCC/C=C\COC1CCNC(=O)C1 f5345ccf25d191555d4bcfbe0c7d315f [0,1,0,0,0,1|2,0,0]=4 2580 B14R1.26 CCC/C=C\CO[C@@H]1CCNC(=O)C1 4b88a845dc95e91751e4d22b54ecc9b5 [0,1,0,0,0,1|2,0,0]=4 2581 B14R1.26 CCC/C=C\CO[C@H]1CCNC(=O)C1 47811bff5d6d7d640c754f1568c971c6 [0,1,0,0,0,1|2,0,0]=4 2582 B14R1.26 CCCCCCNC1CCCC(=O)C1 5796a228969e7bba565580da42146f30 [0,1,0,0,0,1|0,0,2]=4 2583 B14R1.26 CCCCCCOC1CCCC(=O)C1 3291b3543e4eabb22a8c54c1e0517de2 [0,1,0,0,0,1|0,0,2]=4 2584 B14R1.26 CCCCCNCC1CCCC(=O)N1 a2acf4dc4b27c2a1305d027d08217e59 [0,1,0,0,0,1|0,0,2]=4 2585 B14R1.26 CCCCCOCC1CCCC(=O)C1 46154ba0377ed7f01d5ac094ca86c6de [0,1,0,0,0,1|0,0,2]=4 2586 B14R1.26 CCCCCOCC1CCCC(=O)N1 cad13b6b8afae4d79440a921bbde3394 [0,1,0,0,0,1|0,0,2]=4 2587 B14R1.26 CCCCCOC[C@@H]1CCCC(=O)N1 0f02f7a640df7654b94220b966af1248 [0,1,0,0,0,1|0,0,2]=4 2588 B14R1.26 CCCCCOC[C@H]1CCCC(=O)N1 950e905c430d231795d4d2990f1d065b [0,1,0,0,0,1|0,0,2]=4 2589 B14R1.26 CCCOCCNC1CCCC(=O)C1 7ddce8b6ab980e7fae4beeaa1797c046 [0,1,0,0,0,1|1,0,1]=4 2590 B14R1.26 CCCOCCOC1CCCC(=O)C1 2c16adbf8851f186f57fb4d61c3f983b [0,1,0,0,0,1|1,0,1]=4 2591 B14R1.26 CCCSCCOC1CCCC(=O)C1 8860e63392476688db6d648b04e5ee1c [0,1,0,0,0,1|1,0,1]=4 2592 B14R1.26 CCOCCCNC1CCCC(=O)C1 4d8793164f68abeddd4db25e87e158c0 [0,1,0,0,0,1|1,0,1]=4 2593 B14R1.26 CCOCCCOC1CCCC(=O)C1 8b375d609a146d407e8313b7538db4d6 [0,1,0,0,0,1|1,0,1]=4 2594 B14R1.26 CCOCCNCC1CCCC(=O)N1 399ed89f1f85a73c6e7bdcea0d716b24 [0,1,0,0,0,1|1,0,1]=4 2595 B14R1.26 CCOCCOCC1CCCC(=O)C1 ce94ae30e1cb80df2b7dcbeba3d0e1e2 [0,1,0,0,0,1|1,0,1]=4 2596 B14R1.26 CCOCCOCC1CCCC(=O)N1 ef6f08dcfc6ff7bd070939a8e6febed8 [0,1,0,0,0,1|1,0,1]=4 2597 B14R1.26 CCOCCOC[C@@H]1CCCC(=O)N1 0ce589a4f7b243409fdb461d6d5d8197 [0,1,0,0,0,1|1,0,1]=4 2598 B14R1.26 CCOCCOC[C@H]1CCCC(=O)N1 584858f5aa867a9438fda68fa02b3e01 [0,1,0,0,0,1|1,0,1]=4 2599 B14R1.26 CCSCCCOC1CCCC(=O)C1 29844376fbf80b006e9b35c1b613e0ff [0,1,0,0,0,1|1,0,1]=4 2600 B14R1.26 CCSCCNCC1CCCC(=O)N1 97c57083bcb4ecc94f20f15d1ae2cb6b [0,1,0,0,0,1|1,0,1]=4 2601 B14R1.26 CCSCCOCC1CCCC(=O)C1 2f8026a1e937c1f16a7b3c65874c24ad [0,1,0,0,0,1|1,0,1]=4 2602 B14R1.26 CCSCCOCC1CCCC(=O)N1 9037a2838040c9429abf6b783c32e885 [0,1,0,0,0,1|1,0,1]=4 2603 B14R1.26 CCSCCOC[C@@H]1CCCC(=O)N1 2dba2fc413f7cd51d0fc6ba7354a1c6b [0,1,0,0,0,1|1,0,1]=4 2604 B14R1.26 CCSCCOC[C@H]1CCCC(=O)N1 d929de885132f59d167f20c41fea8216 [0,1,0,0,0,1|1,0,1]=4 2605 B14R1.26 N#CC=CCNCC1CCCC(=O)N1 5ce74e2b8ecc185deaf22cef97b3d02b [0,1,0,0,0,1|1,0,1]=4 2606 B14R1.26 N#CC=CCOCC1CCCC(=O)C1 5d95b15b2d1d026d0c71a564a7ca1f9e [0,1,0,0,0,1|1,0,1]=4 2607 B14R1.26 N#CC=CCOCC1CCCC(=O)N1 b522576bd44b5698be1253431ff485fb [0,1,0,0,0,1|1,0,1]=4 2608 B14R1.26 N#CC=CCOC[C@@H]1CCCC(=O)N1 c58668c43132851492ff53de4e22df3e [0,1,0,0,0,1|1,0,1]=4 2609 B14R1.26 N#CC=CCOC[C@H]1CCCC(=O)N1 1a014ca8d6fdd61b16f682e42dea1513 [0,1,0,0,0,1|1,0,1]=4 2610 B14R1.32 C/C=C/C(=O)NCC1CCCC(=O)N1 031f27a6207ac1fb6a2bbdcd140e8154 [0,1,0,0,0,1|1,0,1]=4 2611 B14R1.32 CCCC(=O)COC1CCCC(=O)C1 a99de5cc60e0c59672be4397fb5dbbde [0,1,0,0,0,1|1,0,1]=4 2612 B14R1.32 CCCC(=O)NCC1CCCC(=O)N1 babb5b4e3c4f867094659b50f0853a84 [0,1,0,0,0,1|1,0,1]=4 2613 B14R1.32 CCNC(=O)CCN1CCCC(=O)C1 f8fb571980744de7fe380ecc32e77fb1 [0,1,0,0,0,1|2,0,0]=4 2614 B14R1.32 CCNC(=O)CNC1CCCC(=O)C1 d8cb079489c93504ef368bef9a6756a7 [0,1,0,0,0,1|2,0,0]=4 2615 B14R1.32 CCNC(=O)COC1CCCC(=O)C1 0904d9fcb39ab97614d058ad20547e6b [0,1,0,0,0,1|2,0,0]=4 2616 B14R1.32 CCOC(=O)CNC1CCCC(=O)C1 745f2cdc8373e0f2d5fbb5a055701282 [0,1,0,0,0,1|2,0,0]=4 2617 B14R1.32 CCOC(=O)COC1CCCC(=O)C1 bcfb7b274da7461727f7375bb14994f2 [0,1,0,0,0,1|2,0,0]=4 2618 B14R1.148 CC(C)/C=C/CNC1CCNC(=O)C1 93f98d811392d68d8448a6114606f695 [0,1,0,0,0,1|2,0,0]=4 2619 B14R1.148 CC(C)/C=C/CN[C@@H]1CCNC(=O)C1 c1114380a58673f4d57558ca55facd12 [0,1,0,0,0,1|2,0,0]=4 2620 B14R1.148 CC(C)/C=C/CN[C@H]1CCNC(=O)C1 63a49b0e1c0319f260f32e04be8dd339 [0,1,0,0,0,1|2,0,0]=4 2621 B14R1.148 CC(C)/C=C/COC1=CC(=O)CCC1 672382a82bef56894fffb423d070896b [0,1,0,0,0,1|1,0,1]=4 2622 B14R1.148 CC(C)/C=C/COC1CCCC(=O)C1 875e586b45092359e2c0f98ecc016cdd [0,1,0,0,0,1|1,0,0]=3 2623 B14R1.148 CC(C)/C=C/COC1CCNC(=O)C1 62d0b584403ff0fd71670af77fa016e2 [0,1,0,0,0,1|2,0,0]=4 2624 B14R1.148 CC(C)/C=C/CO[C@@H]1CCNC(=O)C1 5991f47dcc96ebcf06c915d2592af119 [0,1,0,0,0,1|2,0,0]=4 2625 B14R1.148 CC(C)/C=C/CO[C@H]1CCNC(=O)C1 f5fd1013de87512ae73558491792b32f [0,1,0,0,0,1|2,0,0]=4 2626 B14R1.148 CC1=CC(CCC1)OC/C=C/C(C)C 61ff6a8458fddb301a8550cbf914541f [0,1,0,0,0,1|2,0,0]=4 2627 B14R1.218 CC/C=C\CCN1CC(=O)NCC1C 822423811caa3bf8ef80c8ffb3af2927 [0,1,0,0,0,1|2,0,0]=4 2628 B14R1.218 CC/C=C\CCN1CC(=O)NC[C@@H]1C 53f5c11c1d7f84a8cea2dd02766a64b8 [0,1,0,0,0,1|2,0,0]=4 2629 B14R1.218 CC/C=C\CCN1CC(=O)NC[C@H]1C bb44d1d8aa756d9ca4a06ffc999cfd3a [0,1,0,0,0,1|2,0,0]=4 2630 B14R1.232 CC/C=C/CNC1CCN(C(=O)C1)C 65cffa8cecddaa2941d9a591828cd065 [0,1,0,0,0,1|2,0,0]=4 2631 B14R1.232 CC/C=C/CN[C@@H]1CCN(C(=O)C1)C 07f1f4ed236003667b45bbc2eb0dda00 [0,1,0,0,0,1|2,0,0]=4 2632 B14R1.232 CC/C=C/CN[C@H]1CCN(C(=O)C1)C 05ac83fb85eb05b68a09db15463557a7 [0,1,0,0,0,1|2,0,0]=4 2633 B14R1.232 CC/C=C/COC1=CC(=O)C(CC1)C 82f91b7c2519293613c3aa9a278842f7 [0,1,0,0,0,1|1,0,1]=4 2634 B14R1.232 CC/C=C\CCN1CCN(C(=O)C1)C 26a8196032c2e5a31134b872858896ce [0,1,0,0,0,1|2,0,0]=4 2635 B14R1.443 CC/C=C/COC1C=C(CC(C1)C)C 85bce833cb9d7cc6ab156beac6622403 [0,1,0,0,0,1|2,0,0]=4 2636 B14R1.443 CC/C=C\CCN1CC(=O)NC(C1)C 789f94d8b8c54833b54895b9de2c9557 [0,1,0,0,0,1|2,0,0]=4 2637 B14R1.443 CC/C=C\CCN1CC(=O)N[C@@H](C1)C 41a4b5e06d0f838792d5d5f73d405356 [0,1,0,0,0,1|2,0,0]=4 2638 B14R1.443 CC/C=C\CCN1CC(=O)N[C@H](C1)C 9e7e55df38d4f1a184748d8fa1076a34 [0,1,0,0,0,1|2,0,0]=4 2639 B14R1.1025 C=C(CC)CNCC1CCCC(=O)N1 3b4d53908625f3e9784078ac53b8a37b [0,1,0,0,0,1|1,0,1]=4 2640 B14R1.1025 C=C(CC)COCC1CCCC(=O)C1 8733193f590c73fd26575e83184f770c [0,1,0,0,0,1|1,0,1]=4 2641 B14R1.1025 C=C(CC)COCC1CCCC(=O)N1 6f9c33760d9e45e703deaa80afe5284e [0,1,0,0,0,1|1,0,1]=4 2642 B14R1.1025 C=C(CC)COC[C@@H]1CCCC(=O)N1 216fa034fde4b41d8ad1f46f7940c0c3 [0,1,0,0,0,1|1,0,1]=4 2643 B14R1.1025 C=C(CC)COC[C@H]1CCCC(=O)N1 f16787e49d6d3cc961e3027f48ec8e53 [0,1,0,0,0,1|1,0,1]=4 2644 B14R1.1025 CCC(=O)CNCC1CCCC(=O)N1 2c1c0d083b750f85cf59723e39e0bc57 [0,1,0,0,0,1|1,0,1]=4 2645 B14R1.1025 CCC(=O)COCC1CCCC(=O)C1 dbec129322907fe46f518f67858a675b [0,1,0,0,0,1|1,0,1]=4 2646 B14R1.1025 CCC(=O)COCC1CCCC(=O)N1 cd8f35eb6112a91a67352a7386f44b24 [0,1,0,0,0,1|1,0,1]=4 2647 B14R1.1025 CCC(=O)COC[C@@H]1CCCC(=O)N1 a5413d9d52abede792c3e16f52d86997 [0,1,0,0,0,1|1,0,1]=4 2648 B14R1.1025 CCC(=O)COC[C@H]1CCCC(=O)N1 148da3a447ff4e81d7ccf1932b9c4504 [0,1,0,0,0,1|1,0,1]=4 2649 B14R1.1025 CCC(=O)OCOC1CCCC(=O)C1 0c2fede7e3fbcd2aa887c0c0eade390c [0,1,0,0,0,1|2,0,0]=4 2650 B14R1.6694 CC/C=C/CNC1CCCS(=O)(=O)C1 f15a8ab820f2304fe1f4b8e7bfaf2432 [0,1,0,0,0,1|2,0,0]=4 2651 B14R1.6694 CC/C=C/CN[C@@H]1CCCS(=O)(=O)C1 db4c938afc4e9dda8e2574f0896b092b [0,1,0,0,0,1|2,0,0]=4 2652 B14R1.6694 CC/C=C/CN[C@H]1CCCS(=O)(=O)C1 43993fe6a1c79088f266c531cb6ee2b2 [0,1,0,0,0,1|2,0,0]=4 2653 B14R1.6694 CC/C=C/COC1CCCS(=O)(=O)C1 65e67251b4f5e1833a74868ab607fc57 [0,1,0,0,0,1|2,0,0]=4 2654 B14R1.6694 CC/C=C\COC1CCCS(=O)(=O)C1 3f5909f5c6021e0de47a78924ebae14e [0,1,0,0,0,1|2,0,0]=4 2655 B14R1.159 CC(C)/C=C/CNC1CCCNC1=O 417faec9d2ea223341da2ca07f0be129 [0,1,0,0,0,1|1,0,0]=3 2656 B14R1.159 CC(C)/C=C/CN[C@@H]1CCCNC1=O e60fc298115e8878746cb47298c0e480 [0,1,0,0,0,1|1,0,0]=3 2657 B14R1.159 CC(C)/C=C/CN[C@H]1CCCNC1=O d1790209ec3c5e68ddbb005cdb579787 [0,1,0,0,0,1|1,0,0]=3 2658 B14R1.159 CC(C)/C=C/COC1CCCC=C1Br be9b25d8bbc9c177aca38f3ce793e652 [0,1,0,0,0,1|2,0,0]=4 2659 B14R1.159 CC(C)/C=C/COC1CCCCC1=O 1a1ff842aca8747ee637e84fe4d3cbc8 [0,1,0,0,0,1|1,0,0]=3 2660 B14R1.159 CC(C)/C=C/COC1CCCNC1=O 0b9e4632427a132760eabaff5849f636 [0,1,0,0,0,1|1,0,0]=3 2661 B14R1.159 CC(C)/C=C/COC1CCCOC1=O a72419bc6673308ef28e612b4024f9e2 [0,1,0,0,0,1|1,0,0]=3 2662 B14R1.159 CC(C)/C=C/CO[C@@H]1CCCNC1=O 70044f12ced7d296d05cdf203e5a233d [0,1,0,0,0,1|1,0,0]=3 2663 B14R1.159 CC(C)/C=C/CO[C@H]1CCCNC1=O 70c272b5de668ec460bca7380410babe [0,1,0,0,0,1|1,0,0]=3 2664 B14R1.476 CC/C=C\CCN1CCCCC1C=O abb40c00aa665e0d457b2754a2660ac6 [0,1,0,0,0,1|1,0,1]=4 2665 B14R1.598 CCCC(=O)CNC1CCCNC1=O 1f8789e7c69a9698fed6bd0423e529b7 [0,1,0,0,0,1|1,0,1]=4 2666 B14R1.598 CCCC(=O)CN[C@@H]1CCCNC1=O 3e0172a9f67e08e676643a0576fc0335 [0,1,0,0,0,1|1,0,1]=4 2667 B14R1.598 CCCC(=O)CN[C@H]1CCCNC1=O 9694881831506587cd0344f40e0dcb88 [0,1,0,0,0,1|1,0,1]=4 2668 B14R1.598 CCCC(=O)COC1CCCNC1=O 1cacab44d27c8348a230ee347be9f43d [0,1,0,0,0,1|1,0,1]=4 2669 B14R1.598 CCCC(=O)CO[C@@H]1CCCNC1=O a2e0561fe0b0c733ebdafe1c0d66ee19 [0,1,0,0,0,1|1,0,1]=4 2670 B14R1.598 CCCC(=O)CO[C@H]1CCCNC1=O c135b98532f4aef49487ec4ec6d67417 [0,1,0,0,0,1|1,0,1]=4 2671 B14R1.598 CCNC(=O)CNC1CCCCC1=O 37e933c7b2eb94a862fb68d8d0180f16 [0,1,0,0,0,1|2,0,0]=4 2672 B14R1.598 CCNC(=O)CNC1CCCNC1=O 03d351a2fa713b9b2b50780207c67f1d [0,1,0,0,0,1|2,0,0]=4 2673 B14R1.598 CCNC(=O)CNC1COCCC1=O 32c6967e12f8622f29fa4e10efab53e3 [0,1,0,0,0,1|2,0,0]=4 2674 B14R1.598 CCNC(=O)CNC1SCCCC1=O 91a76c13f3eab3ae52ddde7e1bc1d17c [0,1,0,0,0,1|2,0,0]=4 2675 B14R1.598 CCNC(=O)CN[C@@H]1CCCNC1=O 4a67e6d8642bcea89b2d8ea97df5aa66 [0,1,0,0,0,1|2,0,0]=4 2676 B14R1.598 CCNC(=O)CN[C@H]1CCCNC1=O 25d546bd0599b2e292118e4d39294953 [0,1,0,0,0,1|2,0,0]=4 2677 B14R1.598 CCNC(=O)COC1CCCCC1=O a4f17fefd72e47733f5ec1d47b8199a7 [0,1,0,0,0,1|2,0,0]=4 2678 B14R1.598 CCNC(=O)COC1CCCNC1=O 49c6e7bbe5c46fda695645e0e9a2a1a7 [0,1,0,0,0,1|2,0,0]=4 2679 B14R1.598 CCNC(=O)COC1CCCOC1=O 291540f074c50b2fc8f609a1d4c128cf [0,1,0,0,0,1|2,0,0]=4 2680 B14R1.598 CCNC(=O)COC1COCCC1=O bb06a55ca42ebd6ea0460d144000697d [0,1,0,0,0,1|2,0,0]=4 2681 B14R1.598 CCNC(=O)COC1SCCCC1=O 3936865d48b83a8c53dc9b3d38420885 [0,1,0,0,0,1|2,0,0]=4 2682 B14R1.598 CCNC(=O)CO[C@@H]1CCCNC1=O e62f993b462dd3ab3aa0ba30c895c9c6 [0,1,0,0,0,1|2,0,0]=4 2683 B14R1.598 CCNC(=O)CO[C@H]1CCCNC1=O 798b0afa0ac7f78fe3633612ad46cbc9 [0,1,0,0,0,1|2,0,0]=4 2684 B14R1.598 CCOC(=O)CNC1CCCCC1=O a8d7aa3ec4c3f876f34aa56c16495f1b [0,1,0,0,0,1|2,0,0]=4 2685 B14R1.598 CCOC(=O)CNC1CCCNC1=O ec5eab6494883df32d379c8d2a49b509 [0,1,0,0,0,1|2,0,0]=4 2686 B14R1.598 CCOC(=O)CNC1SCCCC1=O c93a88ddd5ffa8d127f3be25acc93cf1 [0,1,0,0,0,1|2,0,0]=4 2687 B14R1.598 CCOC(=O)CN[C@@H]1CCCNC1=O 4b3d42bb0ff31675e87ea519c4618ed3 [0,1,0,0,0,1|2,0,0]=4 2688 B14R1.598 CCOC(=O)CN[C@H]1CCCNC1=O 7449495c26537ea188879d5b63f91961 [0,1,0,0,0,1|2,0,0]=4 2689 B14R1.598 CCOC(=O)COC1CCCCC1=O 0ce4a76dc7105d8c6477cefd5ea5917f [0,1,0,0,0,1|2,0,0]=4 2690 B14R1.598 CCOC(=O)COC1CCCNC1=O 8c3c065e56b0c3d366d237f29ffcaec7 [0,1,0,0,0,1|2,0,0]=4 2691 B14R1.598 CCOC(=O)COC1CCCOC1=O 555299bce17f58f8ad6e02b746fce49e [0,1,0,0,0,1|2,0,0]=4 2692 B14R1.598 CCOC(=O)COC1SCCCC1=O b7606e9d9480a1e146ebdf87f406096e [0,1,0,0,0,1|2,0,0]=4 2693 B14R1.598 CCOC(=O)CO[C@@H]1CCCNC1=O fa53f9f0fb344be0c844c92f999723b9 [0,1,0,0,0,1|2,0,0]=4 2694 B14R1.598 CCOC(=O)CO[C@H]1CCCNC1=O 97f2fc41fd5b39ac81384c21b41a0033 [0,1,0,0,0,1|2,0,0]=4 2695 B14R1.774 CC/C=C/CNC1CCC(=O)NC1=O 7e404a5d50d57693dc03f8bf8fa85f03 [0,1,0,0,0,1|1,0,1]=4 2696 B14R1.774 CC/C=C/CN[C@@H]1CCC(=O)NC1=O 33b61a64ffd19bd69bb6413808e7db89 [0,1,0,0,0,1|1,0,1]=4 2697 B14R1.774 CC/C=C/CN[C@H]1CCC(=O)NC1=O e8fa9766e1f53cdb104f47e1aebdcc2e [0,1,0,0,0,1|1,0,1]=4 2698 B14R1.774 CC/C=C/COC1CCC(=O)NC1=O d21fe14ea53aea3da4c4d73f024f504a [0,1,0,0,0,1|1,0,1]=4 2699 B14R1.774 CC/C=C\COC1CCC(=O)NC1=O 05b977b4db618753818e5ebf0c84235d [0,1,0,0,0,1|1,0,1]=4 2700 B14R1.837 C=C(CC)COCC1CCCCC1=O 5f5f26d356eeae03aea2861bf2bb42b4 [0,1,0,0,0,1|1,0,1]=4 2701 B14R1.837 C=C(CC)COCC1CCCNC1=O e0e67cd90f5b9a5c02273096645c3cc2 [0,1,0,0,0,1|1,0,1]=4 2702 B14R1.837 CCC(=O)COCC1CCCCC1=O ebfdc50d548917a438b156976fb17e5a [0,1,0,0,0,1|1,0,1]=4 2703 B14R1.837 CCC(=O)COCC1CCCNC1=O 8bd801e34e86df97d92c2f50a7334cc0 [0,1,0,0,0,1|1,0,1]=4 2704 B14R1.837 CCC(=O)NCCN1CCCCC1=O 61384307e1b724cf91f153e4a306392f [0,1,0,0,0,1|2,0,0]=4 2705 B14R1.837 CCC(=O)OCNC1CCCNC1=O 11273b2f42e478d50c51ea8dcb0091bd [0,1,0,0,0,1|2,0,0]=4 2706 B14R1.837 CCC(=O)OCN[C@@H]1CCCNC1=O 43858e2f07d0edecc48bfeecafb0d781 [0,1,0,0,0,1|2,0,0]=4 2707 B14R1.837 CCC(=O)OCN[C@H]1CCCNC1=O 6a0ed32269c69098d52b238b7b34d779 [0,1,0,0,0,1|2,0,0]=4 2708 B14R1.837 CCC(=O)OCOC1CCCCC1=O b2002440a22a953ccac45891362a7787 [0,1,0,0,0,1|2,0,0]=4 2709 B14R1.837 CCC(=O)OCOC1CCCNC1=O 7ce67d83460e8bb7bc64bddc40e3112f [0,1,0,0,0,1|2,0,0]=4 2710 B14R1.837 CCC(=O)OCOC1CCCOC1=O 405a024efaea2552b2e6c8640f2456bc [0,1,0,0,0,1|2,0,0]=4 2711 B14R1.837 CCC(=O)OCO[C@@H]1CCCNC1=O 4d21af60441ce0afc41f833ad2ae642c [0,1,0,0,0,1|2,0,0]=4 2712 B14R1.837 CCC(=O)OCO[C@H]1CCCNC1=O fceed1f537ee88349c2f507b7ac0aeb2 [0,1,0,0,0,1|2,0,0]=4 2713 B14R1.882 C/C=C/C=C/COC1CCCCC1=O 06b6242457a6ea8b6f5689c64b9d9582 [0,1,0,0,0,1|0,0,2]=4 2714 B14R1.882 C/C=C/C=C/COC1CCCNC1=O 1db475abb12967bef769588c53fcea04 [0,1,0,0,0,1|0,0,2]=4 2715 B14R1.882 C/C=C/C=C/COC1COCCC1=O 72191cbf138e82cd1e90bf1aac1d4107 [0,1,0,0,0,1|0,0,2]=4 2716 B14R1.882 C/C=C/C=C/COC1SCCCC1=O 0c0b9dab385730a43ce58f47f58b4d82 [0,1,0,0,0,1|0,0,2]=4 2717 B14R1.882 C/C=C/CCCOC1CCCCC1=O 02333071042d72885d625c6c57f982a7 [0,1,0,0,0,1|0,0,2]=4 2718 B14R1.882 C/C=C/CCCOC1CCCNC1=O 9412bb1bc4cf42ac77f3659c8f12b4bc [0,1,0,0,0,1|0,0,2]=4 2719 B14R1.882 C/C=C/CCCOC1COCCC1=O a61db23b81a37035f2dbb807cab8d37d [0,1,0,0,0,1|0,0,2]=4 2720 B14R1.882 C/C=C/CCCOC1SCCCC1=O 78b95946ed074302b2e70fdb7480f3dd [0,1,0,0,0,1|0,0,2]=4 2721 B14R1.882 C/C=C\CCCNC1CCCNC1=O def913d40ed5284d7458394002f6e182 [0,1,0,0,0,1|0,0,2]=4 2722 B14R1.882 C/C=C\CCCN[C@@H]1CCCNC1=O 0ff7fd117ec489a6b8ae63c0e09b742c [0,1,0,0,0,1|0,0,2]=4 2723 B14R1.882 C/C=C\CCCN[C@H]1CCCNC1=O 664e0d244c7313b37c3e933cb9c95996 [0,1,0,0,0,1|0,0,2]=4 2724 B14R1.882 C/C=C\CCCOC1CCCCC1=O 53782cc993c9f49e700246f6d63cbc00 [0,1,0,0,0,1|0,0,2]=4 2725 B14R1.882 C/C=C\CCCOC1CCCNC1=O 5d71338472e4ba326cdca53f5d829f03 [0,1,0,0,0,1|0,0,2]=4 2726 B14R1.882 C/C=C\CCCOC1CCCOC1=O cba3255cfe83a9f57a2be0225aa9c915 [0,1,0,0,0,1|0,0,2]=4 2727 B14R1.882 C/C=C\CCCOC1COCCC1=O 3f654cfdf4e51c05eabe7b753f6b6572 [0,1,0,0,0,1|0,0,2]=4 2728 B14R1.882 C/C=C\CCCOC1SCCCC1=O 2d070894377ff97a061bc47fded0869e [0,1,0,0,0,1|0,0,2]=4 2729 B14R1.882 C/C=C\CCCO[C@@H]1CCCNC1=O edc5d1c192146948c70e39b644ca7049 [0,1,0,0,0,1|0,0,2]=4 2730 B14R1.882 C/C=C\CCCO[C@H]1CCCNC1=O b451be7a5c81fd91113da9a25834fb52 [0,1,0,0,0,1|0,0,2]=4 2731 B14R1.882 C=C/C=C/CCNC1CCCCC1=O 7d246b407df83d442e6abdb8fd791e04 [0,1,0,0,0,1|0,0,2]=4 2732 B14R1.882 C=C/C=C/CCNC1CCCNC1=O df067cd3393fd142d7b08e913c26d7b4 [0,1,0,0,0,1|0,0,2]=4 2733 B14R1.882 C=C/C=C/CCNC1COCCC1=O 900aef223723f6aed551af8e8cbcfd68 [0,1,0,0,0,1|0,0,2]=4 2734 B14R1.882 C=C/C=C/CCNC1SCCCC1=O 05a6bb4a642f5d5bf15abe1c59c83fdd [0,1,0,0,0,1|0,0,2]=4 2735 B14R1.882 CC/C=C/CCOC1CCCCC1=O 8e9d5eb25116a6bfe2a9cf72a7f3c372 [0,1,0,0,0,1|0,0,0]=2 2736 B14R1.882 CC/C=C/CCOC1CCCCC1F 5c399f4c7b3a7662ec3f19421056551d [0,1,0,0,0,1|1,0,1]=4 2737 B14R1.882 CC/C=C/CCOC1CCCNC1=O f693905394dc82edb81b5249f3c5be70 [0,1,0,0,0,1|0,0,0]=2 2738 B14R1.882 CC/C=C/CCOC1COCCC1=O e3a5f6be414dbf6abd88e49ef8b10ac8 [0,1,0,0,0,1|0,0,0]=2 2739 B14R1.882 CC/C=C/CCOC1SCCCC1=O c057315849c13461fefab1d8072bfae9 [0,1,0,0,0,1|0,0,0]=2 2740 B14R1.882 CC/C=C/CCO[C@H]1CCCC[C@H]1C 3ab58e1fc8c84a6906b45fb9e82ba6cd [0,1,0,0,0,1|1,0,1]=4 2741 B14R1.882 CC/C=C/CNCC1CCCCC1C 04927c0250137c18b541e171013443fc [0,1,0,0,0,1|1,0,1]=4 2742 B14R1.882 CC/C=C/CNCC1CCCCC1O 603cc514b481bd1072ab74b4f2d3ba27 [0,1,0,0,0,1|0,0,2]=4 2743 B14R1.882 CC/C=C/CNCC1CCCCN1C da2828f6f95cc3fa6ab728fe3801ff8b [0,1,0,0,0,1|2,0,0]=4 2744 B14R1.882 CC/C=C/CNCC1COCCN1C ab8d5b62ed3b46afd27e505099d79298 [0,1,0,0,0,1|2,0,0]=4 2745 B14R1.882 CC/C=C/CNCC1CSCCC1O c42f779d8c458d7cfc57623f35f0ed62 [0,1,0,0,0,1|0,0,2]=4 2746 B14R1.882 CC/C=C/CNC[C@@H]1COCCN1C fa2d30865c861a470efc23edbffe7527 [0,1,0,0,0,1|2,0,0]=4 2747 B14R1.882 CC/C=C/COCC1=C(CCCC1)Br 56e3e9f1152cb7b07d987c43303f7999 [0,1,0,0,0,1|1,0,1]=4 2748 B14R1.882 CC/C=C/COCC1=CCCCC1=O baa802845939112a30c7ac0484d78f50 [0,1,0,0,0,1|0,0,1]=3 2749 B14R1.882 CC/C=C/COCC1CCCCC1=O 7598250aec58876887905e88c4a64cc7 [0,1,0,0,0,1|0,0,0]=2 2750 B14R1.882 CC/C=C/COCC1CCCCN1C e0a907e5df75103a6e9ee1b8dd6fd682 [0,1,0,0,0,1|2,0,0]=4 2751 B14R1.882 CC/C=C/COCC1CCCNC1=O 4b1f60c65dd179a05e75f0d74966d985 [0,1,0,0,0,1|0,0,0]=2 2752 B14R1.882 CC/C=C/COCC1COCCN1C 0bddc3512a8a50daca992961b197fa63 [0,1,0,0,0,1|2,0,0]=4 2753 B14R1.882 CC/C=C/COC[C@@H]1CCCCN1C ce2896534012d9d2946aaaec3838c496 [0,1,0,0,0,1|2,0,0]=4 2754 B14R1.882 CC/C=C/COC[C@@H]1COCCN1C 50a7697fc302e379689b77219ad09fa5 [0,1,0,0,0,1|2,0,0]=4 2755 B14R1.882 CC/C=C/COC[C@H]1CCCCN1C 280a017f43d6f9dccf1439398ca8c217 [0,1,0,0,0,1|2,0,0]=4 2756 B14R1.882 CC/C=C/COC[C@H]1COCCN1C 1e19a0d2b43136733246168c1a855030 [0,1,0,0,0,1|2,0,0]=4 2757 B14R1.882 CC/C=C\CCNC1CCCCC1C eb53d390508bb564f3addbb1679be95d [0,1,0,0,0,1|1,0,1]=4 2758 B14R1.882 CC/C=C\CCNC1CCCCC1O c3bea66b2ac8521fc50b565e81bbbe11 [0,1,0,0,0,1|0,0,2]=4 2759 B14R1.882 CC/C=C\CCNC1CCCNC1=O c56c3c389fc599d98f2ea7b186366266 [0,1,0,0,0,1|0,0,0]=2 2760 B14R1.882 CC/C=C\CCNC1CCOCC1C e404628dee666292e6adf91cf190cef8 [0,1,0,0,0,1|1,0,1]=4 2761 B14R1.882 CC/C=C\CCNC1CCOCC1O 05cef424c5645283865ede7667b426fc [0,1,0,0,0,1|0,0,2]=4 2762 B14R1.882 CC/C=C\CCN[C@@H]1CCCC[C@@H]1C 4785313006feab82807be5a6870b24ea [0,1,0,0,0,1|1,0,1]=4 2763 B14R1.882 CC/C=C\CCN[C@@H]1CCCC[C@H]1C 23706c43ed81d121738a79ff06d2407d [0,1,0,0,0,1|1,0,1]=4 2764 B14R1.882 CC/C=C\CCN[C@@H]1CCCC[C@H]1O 8548a4e29865ef48a96cf781540073c9 [0,1,0,0,0,1|0,0,2]=4 2765 B14R1.882 CC/C=C\CCN[C@@H]1CCCNC1=O 08e13a7a5d1fe50eaeb6e15a73201e07 [0,1,0,0,0,1|0,0,0]=2 2766 B14R1.882 CC/C=C\CCN[C@@H]1CCOC[C@@H]1C 028df78379a5a365b5825e9137815bd9 [0,1,0,0,0,1|1,0,1]=4 2767 B14R1.882 CC/C=C\CCN[C@@H]1CCOC[C@@H]1O 381383e2386b91ba4637a03d0b4fa809 [0,1,0,0,0,1|0,0,2]=4 2768 B14R1.882 CC/C=C\CCN[C@@H]1CCOC[C@H]1F 246d7168b87141693b48c8a7744aeefe [0,1,0,0,0,1|1,0,1]=4 2769 B14R1.882 CC/C=C\CCN[C@@H]1CCOC[C@H]1O f2c944f54531e90ae024501f65224a17 [0,1,0,0,0,1|0,0,2]=4 2770 B14R1.882 CC/C=C\CCN[C@@H]1COCC[C@@H]1O 1f0d17e6035751d0a99e746f700521dc [0,1,0,0,0,1|0,0,2]=4 2771 B14R1.882 CC/C=C\CCN[C@@H]1COCC[C@H]1O 1541d20a21fd680f9da5926ce48294ab [0,1,0,0,0,1|0,0,2]=4 2772 B14R1.882 CC/C=C\CCN[C@H]1CCCC[C@@H]1C de89ac1ec2281e2d20f1602fe0b35051 [0,1,0,0,0,1|1,0,1]=4 2773 B14R1.882 CC/C=C\CCN[C@H]1CCCC[C@@H]1O d805bd9e2e56b2b8e1f26fddfa64d17f [0,1,0,0,0,1|0,0,2]=4 2774 B14R1.882 CC/C=C\CCN[C@H]1CCCC[C@H]1C 954f8a837a68426f1c5b799e8736fb1d [0,1,0,0,0,1|1,0,1]=4 2775 B14R1.882 CC/C=C\CCN[C@H]1CCCC[C@H]1O 89daac47ada039c709b27c997e2e7e81 [0,1,0,0,0,1|0,0,2]=4 2776 B14R1.882 CC/C=C\CCN[C@H]1CCCNC1=O c13516be2f16723d0ab5be2210594a30 [0,1,0,0,0,1|0,0,0]=2 2777 B14R1.882 CC/C=C\CCN[C@H]1CCOC[C@@H]1F d18a7bc7911061cbe369d8e83990b35d [0,1,0,0,0,1|1,0,1]=4 2778 B14R1.882 CC/C=C\CCN[C@H]1CCOC[C@@H]1O fe5a4f099ae4923e87f782be51219a73 [0,1,0,0,0,1|0,0,2]=4 2779 B14R1.882 CC/C=C\CCN[C@H]1CCOC[C@H]1C 584ad1751d50fa32c58ed07160b1ca44 [0,1,0,0,0,1|1,0,1]=4 2780 B14R1.882 CC/C=C\CCN[C@H]1CCOC[C@H]1O 5ae8a52ca117cb5b110439e7ff64b42f [0,1,0,0,0,1|0,0,2]=4 2781 B14R1.882 CC/C=C\CCN[C@H]1COCC[C@@H]1O 19a6dc31fa70be5531cb79d35e52f50f [0,1,0,0,0,1|0,0,2]=4 2782 B14R1.882 CC/C=C\CCN[C@H]1COCC[C@H]1O a631acdbcb127424a1cf3b556e9db66b [0,1,0,0,0,1|0,0,2]=4 2783 B14R1.882 CC/C=C\CCOC1CCCC=C1Br 60bdaac764324a82a0cd137449d7edb2 [0,1,0,0,0,1|1,0,0]=3 2784 B14R1.882 CC/C=C\CCOC1CCCCC1=O 1b30fb3f45f64b3b6544458ebc3fde1c [0,1,0,0,0,1|0,0,0]=2 2785 B14R1.882 CC/C=C\CCOC1CCCCC1C 961ebb9c6359f52a26583990d7b1ceeb [0,1,0,0,0,1|1,0,1]=4 2786 B14R1.882 CC/C=C\CCOC1CCCCC1F 56e28985872180d4eeb1f40ef71c3239 [0,1,0,0,0,1|1,0,1]=4 2787 B14R1.882 CC/C=C\CCOC1CCCNC1=O 6931230913b42f716d457b3dbfd2dc9d [0,1,0,0,0,1|0,0,0]=2 2788 B14R1.882 CC/C=C\CCOC1CCCOC1=O b29321eb92ebdd9f257d4a23838b7f7b [0,1,0,0,0,1|0,0,0]=2 2789 B14R1.882 CC/C=C\CCOC1CCOCC1C 22774fe976df491fde1187aeeffe4f36 [0,1,0,0,0,1|1,0,1]=4 2790 B14R1.882 CC/C=C\CCOC1CCOCC1F 53cedf9f023dba60d512e8f86d6f5ce3 [0,1,0,0,0,1|1,0,1]=4 2791 B14R1.882 CC/C=C\CCOC1COCCC1=O 042e7f76fa36e894792d64cbc8ca03c8 [0,1,0,0,0,1|0,0,0]=2 2792 B14R1.882 CC/C=C\CCOC1SCCCC1=O ee64e4d757d0aee2d0b84dd830385dd1 [0,1,0,0,0,1|0,0,0]=2 2793 B14R1.882 CC/C=C\CCO[C@@H]1CCCC[C@@H]1C d3c9a82c28bd881561acb76342072f3e [0,1,0,0,0,1|1,0,1]=4 2794 B14R1.882 CC/C=C\CCO[C@@H]1CCCC[C@H]1F a9469364ee754a9d2aa2382e5237be75 [0,1,0,0,0,1|1,0,1]=4 2795 B14R1.882 CC/C=C\CCO[C@@H]1CCCNC1=O 4467d739ea185c0ce64b318f1504326c [0,1,0,0,0,1|0,0,0]=2 2796 B14R1.882 CC/C=C\CCO[C@@H]1CCOC[C@@H]1F e254cf841fecbb4ed0fe8c2fe79caf01 [0,1,0,0,0,1|1,0,1]=4 2797 B14R1.882 CC/C=C\CCO[C@H]1CCCC[C@@H]1C 8a77d4a7d74f287f240065692fb84970 [0,1,0,0,0,1|1,0,1]=4 2798 B14R1.882 CC/C=C\CCO[C@H]1CCCC[C@H]1C af75dc94b6acbcabcc81322d1d005ce5 [0,1,0,0,0,1|1,0,1]=4 2799 B14R1.882 CC/C=C\CCO[C@H]1CCCNC1=O b87f7d5aaa3eaa6a408f66a4a8d731fc [0,1,0,0,0,1|0,0,0]=2 2800 B14R1.882 CC/C=C\CCO[C@H]1CCOC[C@@H]1F 873a7995288dae7577763a1b78120644 [0,1,0,0,0,1|1,0,1]=4 2801 B14R1.882 CC/C=C\CCO[C@H]1CCOC[C@H]1F 3c54f818d7fb4320498287d27582894d [0,1,0,0,0,1|1,0,1]=4 2802 B14R1.882 CC/C=C\COCC1CCCCN1C fee5e7db61c2cc459a649b22f8d3c545 [0,1,0,0,0,1|2,0,0]=4 2803 B14R1.882 CC=C=CCCOC1CCCCC1=O 1b0d6172c28afd68c2404ee62c153c11 [0,1,0,0,0,1|0,0,2]=4 2804 B14R1.882 CC=C=CCCOC1CCCNC1=O 1f7dde408f1a4ca620313576b94f5fa4 [0,1,0,0,0,1|0,0,2]=4 2805 B14R1.882 CC=C=CCCOC1COCCC1=O 15ba67aff0df545a54d2050963f4931d [0,1,0,0,0,1|0,0,2]=4 2806 B14R1.882 CC=C=CCCOC1SCCCC1=O 5b6855ec703f0f5e51ebe446824814df [0,1,0,0,0,1|0,0,2]=4 2807 B14R1.882 CC=CC=CCOC1CCCCC1=O 7434c1826e2d4df2288a76488fb0bdf2 [0,1,0,0,0,1|0,0,2]=4 2808 B14R1.882 CC=CC=CCOC1CCCNC1=O 8e544c9c9fd59795550662abb0d573e4 [0,1,0,0,0,1|0,0,2]=4 2809 B14R1.882 CC=CC=CCOC1COCCC1=O 3637bf16aa4b4f4bd6fd50728a41f046 [0,1,0,0,0,1|0,0,2]=4 2810 B14R1.882 CC=CC=CCOC1SCCCC1=O a876e035caf6e315c92b413ab69d273f [0,1,0,0,0,1|0,0,2]=4 2811 B14R1.882 CC=CCCCOC1CCCCC1=O d2c463b4b5b2eb8504e0adb35aa67b13 [0,1,0,0,0,1|0,0,2]=4 2812 B14R1.882 CC=CCCCOC1CCCNC1=O 2e07a673f6e599988602907435d13993 [0,1,0,0,0,1|0,0,2]=4 2813 B14R1.882 CC=CCCCOC1COCCC1=O cb90d6c7c40d358b39a4ed8c4bcbc7fe [0,1,0,0,0,1|0,0,2]=4 2814 B14R1.882 CC=CCCCOC1SCCCC1=O 3d42ce5d0add0d6bf47e8d35b60c7a47 [0,1,0,0,0,1|0,0,2]=4 2815 B14R1.882 CCC#CCCOC1SCCCC1=O 6107c0f2d7fbaa30d8ea53e0d0f8d01f [0,1,0,0,0,1|0,0,2]=4 2816 B14R1.882 CCC/C=C/CNC1CCCNC1=O 7d4042bb585cda34e6fd6f60a118e8e5 [0,1,0,0,0,1|1,0,0]=3 2817 B14R1.882 CCC/C=C/CN[C@@H]1CCCNC1=O bc8883e4c801106bf5351720154d2d76 [0,1,0,0,0,1|1,0,0]=3 2818 B14R1.882 CCC/C=C/CN[C@H]1CCCNC1=O 22db8d7095271b33cda1d3bfdf102543 [0,1,0,0,0,1|1,0,0]=3 2819 B14R1.882 CCC/C=C/COC1CCCC=C1Br 705b9c0bd3503d8a8ad7f32ecff347d9 [0,1,0,0,0,1|2,0,0]=4 2820 B14R1.882 CCC/C=C/COC1CCCCC1=O 22bff3ce4aa7000e8410d145d89859de [0,1,0,0,0,1|1,0,0]=3 2821 B14R1.882 CCC/C=C/COC1CCCNC1=O d1e165faca57b14a8711fc41f7e9fd8e [0,1,0,0,0,1|1,0,0]=3 2822 B14R1.882 CCC/C=C/COC1CCCOC1=O b070d36470eb33e71c21e4af77df7542 [0,1,0,0,0,1|1,0,0]=3 2823 B14R1.882 CCC/C=C/COC1COCCC1=O d9c7667d41bcf2a95e518b57fea3ea7f [0,1,0,0,0,1|1,0,0]=3 2824 B14R1.882 CCC/C=C/COC1SCCCC1=O ee3bb811753667479fb91d0feacdb46c [0,1,0,0,0,1|1,0,0]=3 2825 B14R1.882 CCC/C=C/CO[C@@H]1CCCNC1=O d7986651b4413179e46c01e336d185e0 [0,1,0,0,0,1|1,0,0]=3 2826 B14R1.882 CCC/C=C/CO[C@H]1CCCNC1=O b855ce4cf6f1113f8d62b406748dca97 [0,1,0,0,0,1|1,0,0]=3 2827 B14R1.882 CCC/C=C\CNC1CCCNC1=O 0b1d280ff621d1e488f0f5820e89eed3 [0,1,0,0,0,1|1,0,0]=3 2828 B14R1.882 CCC/C=C\CN[C@@H]1CCCNC1=O 3af1b1eaa5cb693473f12961dfe02453 [0,1,0,0,0,1|1,0,0]=3 2829 B14R1.882 CCC/C=C\CN[C@H]1CCCNC1=O 69d773be7745868c0eeca0b3e49afc9a [0,1,0,0,0,1|1,0,0]=3 2830 B14R1.882 CCC/C=C\COC1CCCC=C1Br 32d7c3d03d84fe2e48c4964fb7b336ff [0,1,0,0,0,1|2,0,0]=4 2831 B14R1.882 CCC/C=C\COC1CCCCC1=O e4a26308db6a89eef8b851a67a82b6fc [0,1,0,0,0,1|1,0,0]=3 2832 B14R1.882 CCC/C=C\COC1CCCNC1=O a565d2196303a3260ca8273e2edd9d48 [0,1,0,0,0,1|1,0,0]=3 2833 B14R1.882 CCC/C=C\COC1CCCOC1=O 4c7e0b62a1a2238e9305eff2c7a23756 [0,1,0,0,0,1|1,0,0]=3 2834 B14R1.882 CCC/C=C\COC1COCCC1=O dd5ed77d419d000b4a03cf4c2385bdb5 [0,1,0,0,0,1|1,0,0]=3 2835 B14R1.882 CCC/C=C\COC1SCCCC1=O e6ed1a4ac6f394278fe4d2b42d1fb197 [0,1,0,0,0,1|1,0,0]=3 2836 B14R1.882 CCC/C=C\CO[C@@H]1CCCNC1=O 31289ec63b80b9e5bcee162583472267 [0,1,0,0,0,1|1,0,0]=3 2837 B14R1.882 CCC/C=C\CO[C@H]1CCCNC1=O 270fea04585c5e6f9ebed6e4f6fbfde0 [0,1,0,0,0,1|1,0,0]=3 2838 B14R1.882 CCCCCCNC1CCCCC1=O 5356b3a48b96e9bcee1ff0944cbae818 [0,1,0,0,0,1|0,0,2]=4 2839 B14R1.882 CCCCCCNC1CCCNC1=O 237dab34da23350a555c73d8492d407f [0,1,0,0,0,1|0,0,2]=4 2840 B14R1.882 CCCCCCNC1COCCC1=O 8603fc8a4d87926dcde74118dbc2ce2f [0,1,0,0,0,1|0,0,2]=4 2841 B14R1.882 CCCCCCNC1SCCCC1=O c338a144dbd53942ab02f8d9d8eb8faf [0,1,0,0,0,1|0,0,2]=4 2842 B14R1.882 CCCCCCN[C@@H]1CCCNC1=O fb59f4cc807bb3e28584f8cad90f0412 [0,1,0,0,0,1|0,0,2]=4 2843 B14R1.882 CCCCCCN[C@H]1CCCNC1=O 93a8175a8cf2599df6e31f1189e945a2 [0,1,0,0,0,1|0,0,2]=4 2844 B14R1.882 CCCCCCOC1CCCCC1=O 1040c77266405f0f28dcbb55d1012461 [0,1,0,0,0,1|0,0,2]=4 2845 B14R1.882 CCCCCCOC1CCCNC1=O 18c6662384cb5a0405ccac8b0c0eed57 [0,1,0,0,0,1|0,0,2]=4 2846 B14R1.882 CCCCCCOC1CCCOC1=O ba48b8555485cee41b5d01612d4dbc78 [0,1,0,0,0,1|0,0,2]=4 2847 B14R1.882 CCCCCCOC1COCCC1=O 6614ac9212c3ea3d0d887307d780ff00 [0,1,0,0,0,1|0,0,2]=4 2848 B14R1.882 CCCCCCOC1SCCCC1=O ec4bf0f58a8c4f01880630f53341c59b [0,1,0,0,0,1|0,0,2]=4 2849 B14R1.882 CCCCCCO[C@@H]1CCCNC1=O 97d02c1bf6df25f3f390a973e90f58e7 [0,1,0,0,0,1|0,0,2]=4 2850 B14R1.882 CCCCCCO[C@H]1CCCNC1=O cecfb7fccc31849ccaada130d563a2a2 [0,1,0,0,0,1|0,0,2]=4 2851 B14R1.882 CCCCCOCC1CCCCC1=O 336570d429b7b319ff163e3aae4781c3 [0,1,0,0,0,1|0,0,2]=4 2852 B14R1.882 CCCCCOCC1CCCNC1=O 4a8af2a423c313bc0b03cf459402efab [0,1,0,0,0,1|0,0,2]=4 2853 B14R1.882 CCCOCCNC1CCCNC1=O 406461b435c7abae94e4b7b453c5a207 [0,1,0,0,0,1|1,0,1]=4 2854 B14R1.882 CCCOCCNC1SCCCC1=O 86ce801204f1625b1f03848fa2419b62 [0,1,0,0,0,1|1,0,1]=4 2855 B14R1.882 CCCOCCN[C@@H]1CCCNC1=O 266c6ffefe1e6c442ad70d43d73db5bf [0,1,0,0,0,1|1,0,1]=4 2856 B14R1.882 CCCOCCN[C@H]1CCCNC1=O c183561ecf243b0f4cb24e6055e037c0 [0,1,0,0,0,1|1,0,1]=4 2857 B14R1.882 CCCOCCOC1CCCCC1=O 9fca03b33efc45c104ca7fae30383b9b [0,1,0,0,0,1|1,0,1]=4 2858 B14R1.882 CCCOCCOC1CCCNC1=O 8372a20a5dc57a204829a520f0eec24e [0,1,0,0,0,1|1,0,1]=4 2859 B14R1.882 CCCOCCOC1CCCOC1=O c1bee40c8583e1435d7df61920137b69 [0,1,0,0,0,1|1,0,1]=4 2860 B14R1.882 CCCOCCOC1COCCC1=O a8303392585a41bf38a5b4aa1bdea3c3 [0,1,0,0,0,1|1,0,1]=4 2861 B14R1.882 CCCOCCOC1SCCCC1=O aa6bd144cb134f2683d79613e346d174 [0,1,0,0,0,1|1,0,1]=4 2862 B14R1.882 CCCOCCO[C@@H]1CCCNC1=O b623fa1ff329fef25fef323340b18851 [0,1,0,0,0,1|1,0,1]=4 2863 B14R1.882 CCCOCCO[C@H]1CCCNC1=O b042186929ab1ef9a2ec4d138652f699 [0,1,0,0,0,1|1,0,1]=4 2864 B14R1.882 CCCSCCOC1CCCNC1=O 9c062653ef04518d177f0381349dc71c [0,1,0,0,0,1|1,0,1]=4 2865 B14R1.882 CCCSCCOC1COCCC1=O bfc08640185c332c0b7551625bed482b [0,1,0,0,0,1|1,0,1]=4 2866 B14R1.882 CCCSCCOC1SCCCC1=O 990e52a4407d46de4389b46345d60b2b [0,1,0,0,0,1|1,0,1]=4 2867 B14R1.882 CCOCCCNC1CCCCC1=O f682905dc15f1871ee11fe673c442702 [0,1,0,0,0,1|1,0,1]=4 2868 B14R1.882 CCOCCCNC1CCCNC1=O 607f8917cb1eca20980153e75056fc98 [0,1,0,0,0,1|1,0,1]=4 2869 B14R1.882 CCOCCCNC1COCCC1=O 4b7797224e0bb505ff08401be4c33f1e [0,1,0,0,0,1|1,0,1]=4 2870 B14R1.882 CCOCCCNC1SCCCC1=O 484c6b8b22e0b3df6bd377c07adac12f [0,1,0,0,0,1|1,0,1]=4 2871 B14R1.882 CCOCCCN[C@@H]1CCCNC1=O 1905a33bb17f38631d73354371c531e4 [0,1,0,0,0,1|1,0,1]=4 2872 B14R1.882 CCOCCCN[C@H]1CCCNC1=O 5b3ea68bbb3feb0fbc3040a47dc4c3d6 [0,1,0,0,0,1|1,0,1]=4 2873 B14R1.882 CCOCCCOC1CCCCC1=O cf0ecf44157f6f96dead18d8ce4033a6 [0,1,0,0,0,1|1,0,1]=4 2874 B14R1.882 CCOCCCOC1CCCNC1=O 1e4285da8afca11af9645a8716337744 [0,1,0,0,0,1|1,0,1]=4 2875 B14R1.882 CCOCCCOC1CCCOC1=O 07e1adea67ff2c83ecce59fe5846b46d [0,1,0,0,0,1|1,0,1]=4 2876 B14R1.882 CCOCCCOC1COCCC1=O 9cc1ad22aa4d8ef7153c638c27fedb1e [0,1,0,0,0,1|1,0,1]=4 2877 B14R1.882 CCOCCCOC1SCCCC1=O 7a70662621740397725ea8066d9e5e8c [0,1,0,0,0,1|1,0,1]=4 2878 B14R1.882 CCOCCCO[C@@H]1CCCNC1=O 4c39a23b6a0c903aa6cd05456c1f3bd6 [0,1,0,0,0,1|1,0,1]=4 2879 B14R1.882 CCOCCCO[C@H]1CCCNC1=O 6288b0c0a86963f33ed8288ded04941f [0,1,0,0,0,1|1,0,1]=4 2880 B14R1.882 CCOCCOCC1CCCCC1=O 7d2938e88608bb0e214d150204714225 [0,1,0,0,0,1|1,0,1]=4 2881 B14R1.882 CCOCCOCC1CCCNC1=O 0d9cd2cbc48be27d554408a5b1c7aa4a [0,1,0,0,0,1|1,0,1]=4 2882 B14R1.882 CCSCCCNC1CCCNC1=O 771121b2d44a320f0c58dc3aa9d7bcfe [0,1,0,0,0,1|1,0,1]=4 2883 B14R1.882 CCSCCCN[C@@H]1CCCNC1=O 4708f65e5740c311638ce2557d8b58f5 [0,1,0,0,0,1|1,0,1]=4 2884 B14R1.882 CCSCCCN[C@H]1CCCNC1=O a004c995083257fca86088310478bf3a [0,1,0,0,0,1|1,0,1]=4 2885 B14R1.882 CCSCCCOC1CCCNC1=O ad8cd4c2da56705a89929fbe5d2a5be7 [0,1,0,0,0,1|1,0,1]=4 2886 B14R1.882 CCSCCCOC1COCCC1=O 004cf13b37c8cc41954bcfc3b07162aa [0,1,0,0,0,1|1,0,1]=4 2887 B14R1.882 CCSCCCOC1SCCCC1=O b182fe59dd0c9049b2c0efd1b065d17d [0,1,0,0,0,1|1,0,1]=4 2888 B14R1.882 CCSCCCO[C@@H]1CCCNC1=O 048cffed8110c3ea8faf88912673c6d8 [0,1,0,0,0,1|1,0,1]=4 2889 B14R1.882 CCSCCCO[C@H]1CCCNC1=O 7234002c10da453216888eadd35e556d [0,1,0,0,0,1|1,0,1]=4 2890 B14R1.882 CCSCCOCC1CCCCC1=O 09babd621f7b6743dfe94c5d59324a3a [0,1,0,0,0,1|1,0,1]=4 2891 B14R1.882 CCSCCOCC1CCCNC1=O 9bda81cb2144f563e78a2469ceb9c0cb [0,1,0,0,0,1|1,0,1]=4 2892 B14R1.882 N#CC=CCOCC1CCCCC1=O 91b24499bf2fff37ead20fcaac630579 [0,1,0,0,0,1|1,0,1]=4 2893 B14R1.882 N#CC=CCOCC1CCCNC1=O 37d8d218d17db5030ea64e5713ccfa24 [0,1,0,0,0,1|1,0,1]=4 2894 B14R1.946 CC/C=C/C(=O)NC1CCCNC1=O 37df3d552221faa2af9889fd9e102de1 [0,1,0,0,0,1|1,0,1]=4 2895 B14R1.946 CC/C=C/C(=O)N[C@@H]1CCCNC1=O ca9f7429d55d81aea82764e8794f7dd4 [0,1,0,0,0,1|1,0,1]=4 2896 B14R1.946 CC/C=C/C(=O)N[C@H]1CCCNC1=O 08478cb8c241a2cbd77fefcb2f3efd56 [0,1,0,0,0,1|1,0,1]=4 2897 B14R1.946 CC/C=C\C(=O)NC1CCCNC1=O 849ae84ad8bba04b5b4309d909d8b26f [0,1,0,0,0,1|1,0,1]=4 2898 B14R1.946 CC/C=C\C(=O)N[C@@H]1CCCNC1=O f24b25c502e04015ad835f209540ee85 [0,1,0,0,0,1|1,0,1]=4 2899 B14R1.946 CC/C=C\C(=O)N[C@H]1CCCNC1=O 319830c7aeb8ad3d6c10f9487f584899 [0,1,0,0,0,1|1,0,1]=4 2900 B14R1.946 CCC=CC(=O)NC1CCCNC1=O 131ac3e903252ed2cbde913a28b0e129 [0,1,0,0,0,1|1,0,1]=4 2901 B14R1.946 CCC=CC(=O)N[C@@H]1CCCNC1=O a2bc06826542d575db45f6c2b99075df [0,1,0,0,0,1|1,0,1]=4 2902 B14R1.946 CCC=CC(=O)N[C@H]1CCCNC1=O e2eaa3b91e8518dc52a1a40e20109fa8 [0,1,0,0,0,1|1,0,1]=4 2903 B14R1.20339 CC/C=C/COC1C(=O)CCCC1=O 65fdead6944982cad9a2da9464d779b6 [0,1,0,0,0,1|1,0,0]=3 2904 B14R1.20339 CC/C=C\COC1C(=O)CCCC1=O 1323123365b5a69c3ae9afc1efe6e422 [0,1,0,0,0,1|1,0,0]=3 2905 B14R1.62 C#CC1CCCC1OCC/C=C\CC 779f4620a355790ed759e2b00d742453 [0,2,0,0,0,0|1,0,1]=4 2906 B14R1.62 CC/C=C/CNCC1CCCN1CC 309c5cfa2a65457e3be545bc8d1e1993 [0,2,0,0,0,0|2,0,0]=4 2907 B14R1.62 CC/C=C/CNC[C@@H]1CCCN1CC a1044f4701680167106d45b9cc9d71fa [0,2,0,0,0,0|2,0,0]=4 2908 B14R1.62 CC/C=C/CNC[C@H]1CCCN1CC 92a97ac27dc498d259dd8a0d08d48e30 [0,2,0,0,0,0|2,0,0]=4 2909 B14R1.62 CC/C=C/COCC1CCCN1CC 0842a13897499f13613b98f8a68b0cfb [0,2,0,0,0,0|2,0,0]=4 2910 B14R1.62 CC/C=C/COC[C@@H]1CCCN1C=O a017db25e7a0ce9504a85f6ddbe5845e [0,2,0,0,0,0|1,0,0]=3 2911 B14R1.62 CC/C=C/COC[C@@H]1CCCN1CC 0370e3f4dc93b8a5ba92ddb012b52d93 [0,2,0,0,0,0|2,0,0]=4 2912 B14R1.62 CC/C=C/COC[C@H]1CCCN1CC fdcb4af73b7209285835e6689a9054d9 [0,2,0,0,0,0|2,0,0]=4 2913 B14R1.62 CC/C=C\CCNC1CCCC1OC bee4b8faae7b472131fcd541a38b822a [0,2,0,0,0,0|0,0,2]=4 2914 B14R1.62 CC/C=C\CCN[C@@H]1CCC[C@H]1CC 0e46120ae5a2662e70fdee68447fe9ae [0,2,0,0,0,0|1,0,1]=4 2915 B14R1.62 CC/C=C\CCN[C@@H]1CCC[C@H]1OC c695094404150cd28909778ce114ccc4 [0,2,0,0,0,0|0,0,2]=4 2916 B14R1.62 CC/C=C\CCN[C@H]1CCC[C@@H]1OC 5c9f15f3544d748581b6d6d854df8e53 [0,2,0,0,0,0|0,0,2]=4 2917 B14R1.62 CC/C=C\CCN[C@H]1CCC[C@H]1C#N 4831564c61ff46eab50e63e0f2c85941 [0,2,0,0,0,0|1,0,1]=4 2918 B14R1.62 CC/C=C\CCN[C@H]1CCC[C@H]1CO 84e392cedef8468705df2c847a72292d [0,2,0,0,0,0|0,0,2]=4 2919 B14R1.62 CC/C=C\CCN[C@H]1CCC[C@H]1OC 8a9e8ea2f38a588f4bed2e286c82f077 [0,2,0,0,0,0|0,0,2]=4 2920 B14R1.62 CC/C=C\CCOC1=C(CCC1)C#N d4c21f7e4c472de6b7dda5afd86cf840 [0,2,0,0,0,0|1,0,1]=4 2921 B14R1.62 CC/C=C\CCOC1CCCC1C#N 00d309eb14868527b18131218370c23d [0,2,0,0,0,0|1,0,1]=4 2922 B14R1.62 CC/C=C\CCO[C@@H]1CCC[C@H]1C#N 340938c4bbfcd5219d0dff2b6d0950bb [0,2,0,0,0,0|1,0,1]=4 2923 B14R1.233 CC/C=C/CN[C@@H]1CCC[C@@H]1C(=O)O 7b53550fdaa1dfbfc6108a4408f64956 [0,2,0,0,0,0|1,0,1]=4 2924 B14R1.233 CC/C=C/CN[C@H]1CCC[C@@H]1C(=O)O 3c1a2b08d8a982cdbd76fae1eeea877b [0,2,0,0,0,0|1,0,1]=4 2925 B14R1.233 CC/C=C/CN[C@H]1CCC[C@H]1C(=O)O 885265751146536c43f6ef48f2325886 [0,2,0,0,0,0|1,0,1]=4 2926 B14R1.233 CC/C=C/COC1CCCC1C(=O)N 2c5f09064abf2d6a8a2a6883aec6fe15 [0,2,0,0,0,0|1,0,1]=4 2927 B14R1.233 CC/C=C/COC1CCCC1C(=O)O 94f5530449ddc3d689cc1b5dd3f5edd5 [0,2,0,0,0,0|1,0,1]=4 2928 B14R1.233 CC/C=C/CO[C@@H]1CCC[C@@H]1C(=O)O 6d751ebe13305219d0b810109401c6bc [0,2,0,0,0,0|1,0,1]=4 2929 B14R1.233 CC/C=C/CO[C@@H]1CCC[C@H]1C(=O)O e44c5bb71939481e6751e4f014122084 [0,2,0,0,0,0|1,0,1]=4 2930 B14R1.233 CC/C=C/CO[C@H]1CCC[C@H]1C(=O)O fe7fddb22d5a19ad448922c53c5cb353 [0,2,0,0,0,0|1,0,1]=4 2931 B14R1.233 CC/C=C\CCN1CCCC1C(=O)N 7b1d4eab2c7d58eb8e1471cf77dbce5a [0,2,0,0,0,0|1,0,1]=4 2932 B14R1.233 CC/C=C\CCN1CCCC1C(=O)O 9562170db14f1ed3ff7e7ed78d373b50 [0,2,0,0,0,0|1,0,1]=4 2933 B14R1.233 CC/C=C\CCN1CCC[C@@H]1C(=O)N f9731f8247257d0154efa79ba755d4d0 [0,2,0,0,0,0|1,0,1]=4 2934 B14R1.233 CC/C=C\CCN1CCC[C@@H]1C(=O)O 1a0bc350e48fba791421455d4511a656 [0,2,0,0,0,0|1,0,1]=4 2935 B14R1.233 CC/C=C\CCN1CCC[C@H]1C(=O)N 2ec6a17c3a5dd1e7e2d63439cf0bf00c [0,2,0,0,0,0|1,0,1]=4 2936 B14R1.233 CC/C=C\CCN1CCC[C@H]1C(=O)O 1686955cf88329daddda41215e85d32d [0,2,0,0,0,0|1,0,1]=4 2937 B14R1.167 CC(C)CC(=O)COC1CCCC1=O 418eef57009875217c0c93cfba236abc [0,2,0,0,0,0|1,0,1]=4 2938 B14R1.167 CC(C)NC(=O)COC1CCCC1=O 799bcb3f542ed8b1cc3dac7e1bc94bf8 [0,2,0,0,0,0|2,0,0]=4 2939 B14R1.167 CC(C)OC(=O)COC1CCCC1=O 1125600bffbf0b04cb1a676b805e7864 [0,2,0,0,0,0|2,0,0]=4 2940 B14R1.239 CC(C)C(=O)COCC1CCCC1=O facbe4af6406b30a9dcedbd87f7755c4 [0,2,0,0,0,0|1,0,1]=4 2941 B14R1.239 CC(C)C(=O)NCOC1CCCC1=O 9aca6bdc8a1256e19af818c5a67f6967 [0,2,0,0,0,0|2,0,0]=4 2942 B14R1.239 CC(C)C(=O)OCOC1CCCC1=O 17dc94cdc0dd3b686f14b67f5a53b790 [0,2,0,0,0,0|2,0,0]=4 2943 B14R1.239 CC(F)C(=O)NCCN1CCCC1=O 8cbe9d57d5011d7427c1f25885e4aef0 [0,2,0,0,0,0|2,0,0]=4 2944 B14R1.239 CC(O)C(=O)NCCN1CCCC1=O 4be06f2da3d9468478ffe4dcbad4c0db [0,2,0,0,0,0|2,0,0]=4 2945 B14R1.239 CC(S)C(=O)NCCN1CCCC1=O 1704e09b5f286c910f46b72be328b9fe [0,2,0,0,0,0|2,0,0]=4 2946 B14R1.239 C[C@@H](F)C(=O)NCCN1CCCC1=O d6ed5a79501d19f0ab7d512fdfd075d8 [0,2,0,0,0,0|2,0,0]=4 2947 B14R1.239 C[C@@H](O)C(=O)NCCN1CCCC1=O 491c6687dde6404144a4b0d31d9978f2 [0,2,0,0,0,0|2,0,0]=4 2948 B14R1.239 C[C@H](F)C(=O)NCCN1CCCC1=O c92ceef8cd6adf33e5b776d4f1de243f [0,2,0,0,0,0|2,0,0]=4 2949 B14R1.239 C[C@H](O)C(=O)NCCN1CCCC1=O 67930f72bc0b20dcef51b5423855e48c [0,2,0,0,0,0|2,0,0]=4 2950 B14R1.330 O=C1CCCC1OC/C=C/C(F)(F)F 696a24c8ad85e6b5ea8bb7eeacd6c2e1 [0,2,0,0,0,0|2,0,0]=4 2951 B14R1.330 O=C1CCCC1OC/C=C\C(F)(F)F 6594fc586b02891ddbae6dd1b8d01c7d [0,2,0,0,0,0|2,0,0]=4 2952 B14R1.330 O=C1CCCC1OCC=CC(F)(F)F 92138517f63bd0ff694147d1046a5a15 [0,2,0,0,0,0|2,0,0]=4 2953 B14R1.819 C=C(CC)CNCCN1CCCC1=O 0287c16ea8b37417f40f495f0d51ec15 [0,2,0,0,0,0|1,0,1]=4 2954 B14R1.819 C=C(CC)COCCC1CCNC1=O 1fd17eb6d8f9a34e0abb6f4a42b3c2b2 [0,2,0,0,0,0|1,0,1]=4 2955 B14R1.819 C=C(CC)COCCN1CCCC1=O 57a377db26b9595b89b71714c45e4a89 [0,2,0,0,0,0|1,0,1]=4 2956 B14R1.819 CCC(=O)CNCCN1CCCC1=O 33bd2c059ce4516c6b5e5e69198a2904 [0,2,0,0,0,0|1,0,1]=4 2957 B14R1.819 CCC(=O)COCCC1CCNC1=O d46f0fd71be2f33324f3ca9197b6e64a [0,2,0,0,0,0|1,0,1]=4 2958 B14R1.819 CCC(=O)COCCN1CCCC1=O 50dc98c48a86ec1589a4f2ed2c11e8ea [0,2,0,0,0,0|1,0,1]=4 2959 B14R1.819 CCC(=O)NCCCN1CCCC1=O 891850f850c4df70a363c6093173298c [0,2,0,0,0,0|1,0,1]=4 2960 B14R1.819 CCC(=O)NCCNC1CCCC1=O 38ce889ee5eb2a9a85f5c3b5d740237d [0,2,0,0,0,0|1,0,0]=3 2961 B14R1.819 CCC(=O)NCCNC1CCNC1=O cacb0c832f95957de902250f277049d8 [0,2,0,0,0,0|2,0,0]=4 2962 B14R1.819 CCC(=O)NCCOC1CCCC1=O bf26094b6a033da0dd335a843b3f5772 [0,2,0,0,0,0|1,0,0]=3 2963 B14R1.819 CCC(=O)NCCOC1CCNC1=O a3984f4a2528324dce86ca47a7357019 [0,2,0,0,0,0|2,0,0]=4 2964 B14R1.819 CCC(=O)OCCOC1CCCC1=O e2ffe56cbe24846a3c0aed5ab88f7736 [0,2,0,0,0,0|1,0,0]=3 2965 B14R1.819 CCC(=O)OCNCC1CCNC1=O b274f4a1c411f16f49abb7952fee2d2b [0,2,0,0,0,0|2,0,0]=4 2966 B14R1.819 CCC(=O)OCOCC1CCCC1=O b3f64a9018285edb80d8f969ed6fad3d [0,2,0,0,0,0|1,0,0]=3 2967 B14R1.819 CCC(=O)OCOCC1CCNC1=O 9d6f84a2e90af45b5ab210bb98830788 [0,2,0,0,0,0|2,0,0]=4 2968 B14R1.819 CCC(=O)OCOCN1CCCC1=O 649eaea0b9138c7c1e065c174dc1811b [0,2,0,0,0,0|2,0,0]=4 2969 B14R1.819 CCC(C)CCCOC1CCCC1=O 07046d33f87c81ac2a3bdffdbb91c40e [0,2,0,0,0,0|0,0,2]=4 2970 B14R1.819 CCC(C)CCOCC1CCCC1=O e9faf1c69e69be446d62039aabed99f2 [0,2,0,0,0,0|0,0,2]=4 2971 B14R1.819 CCN(C)CCCNC1CCCC1=O c087baa4f0faac96b6d99b9f5fb78de1 [0,2,0,0,0,0|1,0,1]=4 2972 B14R1.819 CCN(C)CCCOC1CCCC1=O 66c7de8c63c5a3726a1b58bfc395ad97 [0,2,0,0,0,0|1,0,1]=4 2973 B14R1.819 CC[C@H](C)CCCOC1CCCC1=O b3080680b72cdce70667016aa998241d [0,2,0,0,0,0|0,0,2]=4 2974 B14R1.819 CNC(=O)CCCOC1CCCC1=O ffa32d97e57e8ab71dd745db26a612ad [0,2,0,0,0,0|1,0,1]=4 2975 B14R1.819 CNC(=O)CCOCC1CCCC1=O dfb474081097a0942dd6d3b12bcab15c [0,2,0,0,0,0|1,0,1]=4 2976 B14R1.819 COC(=O)/C=C/COC1CCCC1=O a5e4794cb4c5d880c9de6893ed7e45e3 [0,2,0,0,0,0|1,0,1]=4 2977 B14R1.819 COC(=O)/C=C\COC1CCCC1=O 02f707ca0fb596e17d4acf88c57f74e3 [0,2,0,0,0,0|1,0,1]=4 2978 B14R1.819 COC(=O)C=CCOC1CCCC1=O 6d20e32d5ce67cdf455d0412e66a67a7 [0,2,0,0,0,0|1,0,1]=4 2979 B14R1.819 COC(=O)CCCOC1CCCC1=O fc0d5f102d75a5408adf76d6d63dfb40 [0,2,0,0,0,0|1,0,1]=4 2980 B14R1.819 COC(=O)CCOCC1CCCC1=O 503684ca43c9add8ff7c32e738764fd4 [0,2,0,0,0,0|1,0,1]=4 2981 B14R1.819 COC(=O)OCCOC1CCCC1=O 254d9081d77928b6439fe26ac51a3da4 [0,2,0,0,0,0|2,0,0]=4 2982 B14R1.819 COC(=O)OCOCC1CCCC1=O 47a15cf91f1926717f74ad2495246948 [0,2,0,0,0,0|2,0,0]=4 2983 B14R1.4379 CC(C)/C=C/CO[C@@H]1C[C@@H](NC1=O)C ef5fc16add3724cbb645380f0c473b68 [0,2,0,0,0,0|2,0,0]=4 2984 B14R1.4499 CC(C)/C=C/CNC1(CCNC1=O)C dc82348c29f02b92f2d6f201af320bb3 [0,2,0,0,0,0|2,0,0]=4 2985 B14R1.9532 CC(C)/C=C/CN[C@@H]1C(=O)NC[C@H]1O 0297017b7de11c0fdd608bf78637f1bf [0,2,0,0,0,0|2,0,0]=4 2986 B14R1.13252 CC(C)/C=C/CNC1CCN(C1=O)C e4a58c74edc61d61aede72a45a6cd30a [0,2,0,0,0,0|2,0,0]=4 2987 B14R1.13252 CC(C)/C=C/CNC1CCN(C1=O)O 02bb8d1e9a037e0603b1c41933f95dd1 [0,2,0,0,0,0|2,0,0]=4 2988 B14R1.13252 CC(C)/C=C/CN[C@@H]1CCN(C1=O)C 7f4ca73c071d694c2946cc2f58863b57 [0,2,0,0,0,0|2,0,0]=4 2989 B14R1.13252 CC(C)/C=C/CN[C@@H]1CCN(C1=O)O 12c15226e83725a2cb08222ebf2be9f5 [0,2,0,0,0,0|2,0,0]=4 2990 B14R1.13252 CC(C)/C=C/CN[C@H]1CCN(C1=O)C ef3aa2f2ff88a9248a3829db09509b7c [0,2,0,0,0,0|2,0,0]=4 2991 B14R1.13252 CC(C)/C=C/CO[C@@H]1CCN(C1=O)C 6935892d351d53737346ab0b6a90005e [0,2,0,0,0,0|2,0,0]=4 2992 B14R1.223 CC/C=C/COC1CC(CC1=O)(C)C c3bfc38743a0b4f63cccaef322883b7b [0,2,0,0,0,0|1,0,0]=3 2993 B14R1.3126 CC/C=C/CCOC1CC(OC1=O)C dff03700e4002ebc6bb96d0c1a5cb9db [0,2,0,0,0,0|1,0,0]=3 2994 B14R1.3126 CC/C=C/COC[C@@H]1C[C@@H](CN1C)F a53a5a2c4272f4c826a89ea748ac848f [0,2,0,0,0,0|2,0,0]=4 2995 B14R1.3126 CC/C=C/COC[C@@H]1C[C@H](CN1C)F 7f59608033971c7733f9a47f7f382239 [0,2,0,0,0,0|2,0,0]=4 2996 B14R1.3126 CC/C=C/COC[C@H]1C[C@@H](CN1C)F 1ddc147f3a46d60fdd3d9e7846f59edc [0,2,0,0,0,0|2,0,0]=4 2997 B14R1.3126 CC/C=C\CCNC1CC(=O)NC1=O a278b4edfbe98fe88c0691b45005927b [0,2,0,0,0,0|1,0,1]=4 2998 B14R1.3126 CC/C=C\CCN[C@@H]1CC(=O)NC1=O 2656e0031ab23e0538e5a1e9c4a3f895 [0,2,0,0,0,0|1,0,1]=4 2999 B14R1.3126 CC/C=C\CCN[C@H]1CC(=O)NC1=O 48ac0eb9ffee1cea70dc7dbc2b385ff3 [0,2,0,0,0,0|1,0,1]=4 3000 B14R1.3126 CC/C=C\CCOC1CC(OC1=O)C 07686c18171eebb1b33595b7c878c2e4 [0,2,0,0,0,0|1,0,0]=3 3001 B14R1.3126 CC/C=C\CCO[C@@H]1C[C@@H](NC1=O)C 74944f3960efecee6e5c6f2b0b650cbc [0,2,0,0,0,0|1,0,0]=3 3002 B14R1.3126 CCC/C=C/COC1CC(OC1=O)C 4bd443b83741ab006861392d56eae134 [0,2,0,0,0,0|2,0,0]=4 3003 B14R1.3126 CCC/C=C/CO[C@@H]1C[C@@H](NC1=O)C 0b617c19f306c7350ef544f4ded1f417 [0,2,0,0,0,0|2,0,0]=4 3004 B14R1.3126 CCC/C=C\COC1CC(OC1=O)C 030bacfbdcbe7952cf94bd39e5b62bf8 [0,2,0,0,0,0|2,0,0]=4 3005 B14R1.3126 CCC/C=C\CO[C@@H]1C[C@@H](NC1=O)C 92512be4e1fbd787c5d893b223297918 [0,2,0,0,0,0|2,0,0]=4 3006 B14R1.3129 CC/C=C/CCOC1CCCC1(F)F c3d95c38f6ca8713e34e82548bfdb06b [0,2,0,0,0,0|1,0,1]=4 3007 B14R1.3129 CC/C=C/COCC1CCCS1(=O)=O deb5ae160b10c66ac9ef74375637e0bb [0,2,0,0,0,0|1,0,0]=3 3008 B14R1.3129 CC/C=C\CCNC1CCCC1(C)C 8acfc8572cafdf31c266acbc281c9409 [0,2,0,0,0,0|1,0,1]=4 3009 B14R1.3129 CC/C=C\CCNC1CCCC1(C)O 72bc30b1995bda13601f5fee95a8f2d0 [0,2,0,0,0,0|0,0,2]=4 3010 B14R1.3129 CC/C=C\CCNC1CCCC1(F)F 6dd1c169fe647e5757fe212f6e9ba9e4 [0,2,0,0,0,0|1,0,1]=4 3011 B14R1.3129 CC/C=C\CCN[C@@H]1CCC[C@@]1(C)O 5a3e45fd22371aae713b9542d5076edb [0,2,0,0,0,0|0,0,2]=4 3012 B14R1.3129 CC/C=C\CCN[C@H]1CCC[C@]1(C)O cf4b06e2d890c656175efaae479e22c7 [0,2,0,0,0,0|0,0,2]=4 3013 B14R1.3129 CC/C=C\CCOC1CCCC1(C)C d5c22fc19714e609185f8196b103798d [0,2,0,0,0,0|1,0,1]=4 3014 B14R1.3129 CC/C=C\CCOC1CCCC1(F)F 6a6d051d864a23b7bb5ac9b69f4ce47e [0,2,0,0,0,0|1,0,1]=4 3015 B14R1.3129 CC/C=C\CCO[C@@H]1CCCC1(C)C fa0a74782de826612c2bdeebe7373db7 [0,2,0,0,0,0|1,0,1]=4 3016 B14R1.3129 CC/C=C\CCO[C@H]1CCCC1(C)C 65f3d2acc705a182a549ccff8ba3d3c2 [0,2,0,0,0,0|1,0,1]=4 3017 B14R1.6508 CC/C=C/COC1C(=O)NCC1(C)C 1abe98e6a8c6694701e7978a57732806 [0,2,0,0,0,0|2,0,0]=4 3018 B14R1.6508 CC/C=C/COC1C(=O)OCC1(C)C 821bdded7740d445415136fed44a77f2 [0,2,0,0,0,0|2,0,0]=4 3019 B14R1.6508 CC/C=C/CO[C@@H]1C(=O)OCC1(C)C ae9f45486aa68a6eac2b6a57eafaa41f [0,2,0,0,0,0|2,0,0]=4 3020 B14R1.6508 CC/C=C/CO[C@H]1C(=O)OCC1(C)C a24c292f532145b50aec91276d617471 [0,2,0,0,0,0|2,0,0]=4 3021 B14R1.916 CC/C=C/C(=O)NCC1CCNC1=O d6f9bc2b0d61c25d95f249d5e839abf7 [0,2,0,0,0,0|1,0,1]=4 3022 B14R1.916 CC/C=C\C(=O)NCC1CCNC1=O 312d070541619b6db896e8060a430ef1 [0,2,0,0,0,0|1,0,1]=4 3023 B14R1.916 CCC=CC(=O)NCC1CCNC1=O d8c9212a4ca9cc7dfa333c11c62ae217 [0,2,0,0,0,0|1,0,1]=4 3024 B14R1.916 CCCCC(C)OCC1CCCC1=O 1344ccf2542a3a6a6806be72a704d7ea [0,2,0,0,0,0|0,0,2]=4 3025 B14R1.916 CCCCC(O)CNC1CCCC1=O 06266af909f5206c26ea774c5ac7fcc0 [0,2,0,0,0,0|0,0,2]=4 3026 B14R1.916 CCCNC(=O)CCC1CCOC1=O 586e75e4850e0deea7bcf42f31babbb8 [0,2,0,0,0,0|1,0,1]=4 3027 B14R1.916 CCCNC(=O)CCN1CCCC1=O 7e77d21ad3b93cc1d3ceead9fb977f31 [0,2,0,0,0,0|1,0,1]=4 3028 B14R1.916 CCCNC(=O)CNC1CCCC1=O 0a5aba2d9fce4bc12d5746a9c72ec93e [0,2,0,0,0,0|1,0,1]=4 3029 B14R1.916 CCCNC(=O)COC1CCCC1=O 8477bcdddc48e3fa97bb30813e490a3e [0,2,0,0,0,0|1,0,1]=4 3030 B14R1.916 CCCOC(=O)COC1CCCC1=O bc47fc6034e17573fe0d4f096239646d [0,2,0,0,0,0|1,0,1]=4 3031 B14R1.916 CCOCC(O)CNC1CCCC1=O c24644acfd0d3a968144e6ba80cd098f [0,2,0,0,0,0|1,0,1]=4 3032 B14R1.916 O=C(CCC1CCOC1=O)NCCF a9e0947ddebc413f5dd8be3a1a280528 [0,2,0,0,0,0|2,0,0]=4 3033 B14R1.916 O=C(CCC1CCOC1=O)NCCI 0b278e8b58d978f3c6d6aca229c8e46a [0,2,0,0,0,0|2,0,0]=4 3034 B14R1.916 O=C(CCC1CCOC1=O)NCCO 1f8e58071f4dec41d210f137b9e60906 [0,2,0,0,0,0|2,0,0]=4 3035 B14R1.916 O=C(CCC1CCOC1=O)NCCS 1c06310d04a43b7802ac0cd6d0a0b05a [0,2,0,0,0,0|2,0,0]=4 3036 B14R1.916 O=C(CCN1CCCC1=O)NCCBr 54a1d541d53116f1602e12436674e69f [0,2,0,0,0,0|2,0,0]=4 3037 B14R1.916 O=C(CCN1CCCC1=O)NCCF 4c4f92c14eb5bcb5a8909ddbe52a33ba [0,2,0,0,0,0|2,0,0]=4 3038 B14R1.916 O=C(CCN1CCCC1=O)NCCI 70c610bf378cf09be773573eb38f501d [0,2,0,0,0,0|2,0,0]=4 3039 B14R1.916 O=C(CCN1CCCC1=O)NCCO bd25477ed000b754c0e33c6afead758f [0,2,0,0,0,0|2,0,0]=4 3040 B14R1.916 O=C(CCN1CCCC1=O)NCCS b6a7d172474afc9992aaec296f51c43f [0,2,0,0,0,0|2,0,0]=4 3041 B14R1.916 O=C(CNC1CCCC1=O)NCCO a63e38a69ea9450def649ca93855e1f6 [0,2,0,0,0,0|2,0,0]=4 3042 B14R1.987 C=C(CC)C(=O)NCC1CCNC1=O 8db4b6b031287980d417e3f67bee1cc7 [0,2,0,0,0,0|2,0,0]=4 3043 B14R1.987 C=C(COC1CCCC1=O)C(=O)OC 5d9a247793618b52897d0ecae4c929a6 [0,2,0,0,0,0|2,0,0]=4 3044 B14R1.987 CCC(=O)C(=O)NCC1CCNC1=O 278b47a94861f0159125f4b2b31a5515 [0,2,0,0,0,0|2,0,0]=4 3045 B14R1.987 CCC(=O)C(C)OCC1CCCC1=O 1ab38566701e9f596241d8468e2559f3 [0,2,0,0,0,0|1,0,1]=4 3046 B14R1.987 CCC(C)C(=O)COC1CCCC1=O 3719ad09f3f94a9b864274e861cf2d53 [0,2,0,0,0,0|1,0,1]=4 3047 B14R1.987 CCN(C)C(=O)CCC1CCOC1=O 0b8ab9db19af7f655f078a941335feb9 [0,2,0,0,0,0|2,0,0]=4 3048 B14R1.987 CCN(C)C(=O)CCN1CCCC1=O 4fb028de97f1b81b15e80bd9aced7f92 [0,2,0,0,0,0|2,0,0]=4 3049 B14R1.987 CCN(C)C(=O)CNC1CCCC1=O ab9101c80bbf508e7559d8fd1dc667e6 [0,2,0,0,0,0|2,0,0]=4 3050 B14R1.987 COC(=O)C(=O)COC1CCCC1=O da4207b2a7cdb389299e1a257a237ff9 [0,2,0,0,0,0|2,0,0]=4 3051 B14R1.3356 CCNC(=O)C(C)OC1CCCC1=O cd79fb14a0c7f536270af50484db2ff5 [0,2,0,0,0,0|2,0,0]=4 3052 B14R1.3356 CCNC(=O)[C@H](C)NC1CCCC1=O 50157f856f36c1420272db0100090f27 [0,2,0,0,0,0|2,0,0]=4 3053 B14R1.3356 CCOC(=O)C(C)OC1CCCC1=O 0c37995072ed1f4e655ced7d2c09e6b8 [0,2,0,0,0,0|2,0,0]=4 3054 B14R1.3356 CCOC(=O)[C@@H](C)NC1CCCC1=O 4b0d5fa40161e0563ad76e260ddd2969 [0,2,0,0,0,0|2,0,0]=4 3055 B14R1.3356 CCOC(=O)[C@@H](C)OC1CCCC1=O 3bc8183dfb63fff1ba0093d81c66e6f0 [0,2,0,0,0,0|2,0,0]=4 3056 B14R1.3356 CCOC(=O)[C@H](C)OC1CCCC1=O d7ae26471236f85b28e1ce9d882b700a [0,2,0,0,0,0|2,0,0]=4 3057 B14R1.596 CCC(=O)/C=C(\C)/OC1CCCC1=O c5b20a25ba10cfd7baee874bba164a70 [0,2,0,0,0,0|1,0,1]=4 3058 B14R1.948 C/C=C/C(=O)NCCN1CCCC1=O 6a9f395cdf1557012d55f5fcd706b7b2 [0,2,0,0,0,0|1,0,1]=4 3059 B14R1.948 CCCC(=O)CNCC1CCNC1=O 7ed9e74898b62840987a6099890e9b57 [0,2,0,0,0,0|1,0,1]=4 3060 B14R1.948 CCCC(=O)COCC1CCCC1=O 94820bce51d4e0d8b8700f31cd2c9abc [0,2,0,0,0,0|0,0,1]=3 3061 B14R1.948 CCCC(=O)COCC1CCNC1=O 4db420dfa1c32b64674279aefea206c3 [0,2,0,0,0,0|1,0,1]=4 3062 B14R1.948 CCCC(=O)COCN1CCCC1=O f7961f14a4a0cc9fa71e519d5e6659d6 [0,2,0,0,0,0|1,0,1]=4 3063 B14R1.948 CCCC(=O)NCCN1CCCC1=O 0902985b38a6828902e97deaa749735f [0,2,0,0,0,0|1,0,1]=4 3064 B14R1.948 CCCC(=S)OCCC1CCNC1=O 9389bf7c8d162ba9dee91d339e78c430 [0,2,0,0,0,0|1,0,1]=4 3065 B14R1.948 CCCC(=S)OCCN1CCCC1=O cb86268ef6ef0fed83dfae18f6db141c [0,2,0,0,0,0|1,0,1]=4 3066 B14R1.948 CCCC(C)CCOC1CCCC1=O e8af050d1b45e137f32502cc9750b82e [0,2,0,0,0,0|0,0,2]=4 3067 B14R1.948 CCCC(C)COCC1CCCC1=O f6aedc003ac27c90bcf3c20b04eb7e4e [0,2,0,0,0,0|0,0,2]=4 3068 B14R1.948 CCCC(S)CCOC1CCCC1=O dc6ff7914105e60652676c121ff6ffad [0,2,0,0,0,0|0,0,2]=4 3069 B14R1.948 CCNC(=O)CCNC1CCNC1=O 62808584c455ad7191f2207e8bf030aa [0,2,0,0,0,0|2,0,0]=4 3070 B14R1.948 CCNC(=O)CCNC1CCSC1=O 7408a85c6f8a619bfd75841717682341 [0,2,0,0,0,0|2,0,0]=4 3071 B14R1.948 CCNC(=O)CCN[C@@H]1CCNC1=O e41d5574113d9cce9d928e09c1fe1c75 [0,2,0,0,0,0|2,0,0]=4 3072 B14R1.948 CCNC(=O)CCN[C@@H]1CCOC1=O ba2eb8fdf12a0340855ebca22afec3ff [0,2,0,0,0,0|2,0,0]=4 3073 B14R1.948 CCNC(=O)CCN[C@H]1CCNC1=O 9fbb1de815eb7040929773dac59a1c75 [0,2,0,0,0,0|2,0,0]=4 3074 B14R1.948 CCNC(=O)CCN[C@H]1CCOC1=O e73b40241af5d1c90a17d63ed0cc0ec2 [0,2,0,0,0,0|2,0,0]=4 3075 B14R1.948 CCNC(=O)CCOC1CCCC1=O 19becfd2dc8fbb162a56bae39a460a2f [0,2,0,0,0,0|1,0,0]=3 3076 B14R1.948 CCNC(=O)CCOC1CCNC1=O fb4fa39a7bc0002786db225d264340fb [0,2,0,0,0,0|2,0,0]=4 3077 B14R1.948 CCNC(=O)CCOC1CCOC1=O 3b2a631a3b01cb6d3a651da06b450c98 [0,2,0,0,0,0|2,0,0]=4 3078 B14R1.948 CCNC(=O)CCO[C@@H]1CCNC1=O dd5ec34eeb67b4f5f1f020c1ead48946 [0,2,0,0,0,0|2,0,0]=4 3079 B14R1.948 CCNC(=O)CCO[C@@H]1CCOC1=O dd3b5a5f051d89263ad0020b38a99d19 [0,2,0,0,0,0|2,0,0]=4 3080 B14R1.948 CCNC(=O)CCO[C@H]1CCNC1=O b09c985128bb3d8c768e9f8f13cbb14e [0,2,0,0,0,0|2,0,0]=4 3081 B14R1.948 CCNC(=O)CCO[C@H]1CCOC1=O 77e68c65d1f396e4249608dca5ee2078 [0,2,0,0,0,0|2,0,0]=4 3082 B14R1.948 CCNC(=O)CNCC1CCNC1=O cd489731a9cd3fd9101c161e251a0848 [0,2,0,0,0,0|2,0,0]=4 3083 B14R1.948 CCNC(=O)CNCN1CCCC1=O 222079bc990c37152137600c9acbc589 [0,2,0,0,0,0|2,0,0]=4 3084 B14R1.948 CCNC(=O)COCC1CCCC1=O acb373b7f6425e2c48679b85cb0bfa25 [0,2,0,0,0,0|1,0,0]=3 3085 B14R1.948 CCNC(=O)COCC1CCNC1=O 0928e77a525c0da30ec631d3de601a7f [0,2,0,0,0,0|2,0,0]=4 3086 B14R1.948 CCNC(=O)COCN1CCCC1=O 59126634d2d3a03a5bf988660286f0b9 [0,2,0,0,0,0|2,0,0]=4 3087 B14R1.948 CCOC(=O)CCNC1CCCC1=O 85b0ba3528369b1873c1e3088b248115 [0,2,0,0,0,0|1,0,0]=3 3088 B14R1.948 CCOC(=O)CCNC1CCNC1=O 2bc9dd6bbedf94ce6b4a90ee0ec47676 [0,2,0,0,0,0|2,0,0]=4 3089 B14R1.948 CCOC(=O)CCNC1CCSC1=O 25837b4ec341ff423687dd5229175e6c [0,2,0,0,0,0|2,0,0]=4 3090 B14R1.948 CCOC(=O)CCN[C@@H]1CCNC1=O 5af6da43587641dc20820be87e04ed8a [0,2,0,0,0,0|2,0,0]=4 3091 B14R1.948 CCOC(=O)CCN[C@@H]1CCOC1=O ac9cdc7fb0ed4ac03274c08de7f82a02 [0,2,0,0,0,0|2,0,0]=4 3092 B14R1.948 CCOC(=O)CCN[C@H]1CCNC1=O d5852c71571d29bf719316fb5729b3c8 [0,2,0,0,0,0|2,0,0]=4 3093 B14R1.948 CCOC(=O)CCN[C@H]1CCOC1=O 83ad93574064bdd4c348ce15f34b2118 [0,2,0,0,0,0|2,0,0]=4 3094 B14R1.948 CCOC(=O)CCOC1CCCC1=O 3b7aa3c2a2dea5de919872b50f085d73 [0,2,0,0,0,0|1,0,0]=3 3095 B14R1.948 CCOC(=O)CNCC1CCNC1=O f0126780ed23a54620070ad393b59ee0 [0,2,0,0,0,0|2,0,0]=4 3096 B14R1.948 CCOC(=O)CNCN1CCCC1=O fe0b1bf39f32face08c9b1bd2ae7dca9 [0,2,0,0,0,0|2,0,0]=4 3097 B14R1.948 CCOC(=O)COCC1CCCC1=O 76ad45ae0317b1af281cacdc475a18ce [0,2,0,0,0,0|1,0,0]=3 3098 B14R1.948 CCOC(=O)COCC1CCNC1=O 2bde60486d3b5b364696cc6b7c51e121 [0,2,0,0,0,0|2,0,0]=4 3099 B14R1.948 CCOC(=O)COCN1CCCC1=O 9d3ca0958966a0bc2a258470572fca8e [0,2,0,0,0,0|2,0,0]=4 3100 B14R1.948 CCSC(=O)OCOC1CCCC1=O ff245d12522aee5575714fe12a1b8ca7 [0,2,0,0,0,0|2,0,0]=4 3101 B14R1.948 COCC(=O)COCC1CCCC1=O a057785aa7c3bf04681d33c768aa3b95 [0,2,0,0,0,0|1,0,1]=4 3102 B14R1.948 COCC(=O)NCCN1CCCC1=O f5f38d0c5ed947bcc15f2b53af9e22ca [0,2,0,0,0,0|2,0,0]=4 3103 B14R1.948 CSCC(=O)NCCN1CCCC1=O fa3b87949234e427fd1beb289f006a72 [0,2,0,0,0,0|2,0,0]=4 3104 B14R1.948 O=C(CCF)NCCN1CCCC1=O 1014d8c0db13245bd2af3067a0706c39 [0,2,0,0,0,0|2,0,0]=4 3105 B14R1.948 O=C(CCO)NCCN1CCCC1=O e8895ddf4cf2491c2bda884a3eacda30 [0,2,0,0,0,0|2,0,0]=4 3106 B14R1.948 O=C(CCS)NCCN1CCCC1=O 1f402344a120aa185b17c7cfce95d228 [0,2,0,0,0,0|2,0,0]=4 3107 B14R1.4389 O=C1CCCC1OCC=C(CCl)CCl 45b43b6400c71ba990963128e90ffa4e [0,2,0,0,0,0|2,0,0]=4 3108 B14R1.21061 C=C(CC)COCC1(CCCC1=O)C 6393b50826993774b1481e7a7ed0e503 [0,2,0,0,0,0|1,0,1]=4 3109 B14R1.21061 CCC(=O)COCC1(CCCC1=O)C 80d843a3ca5384ff647d5e3bb1e1f7f4 [0,2,0,0,0,0|1,0,1]=4 3110 B14R1.168 CC(=C=CCCOC1CCCC1=O)C fa87c05176e57ce2abbe1ec01b11c7f6 [0,2,0,0,0,0|0,0,2]=4 3111 B14R1.168 CC(=CCCOCC1CCCC1=O)C e41b793db0c4f7c2064a0e02e086e2d4 [0,2,0,0,0,0|0,0,2]=4 3112 B14R1.168 CC(C)/C=C/CNCC1CCCC1O acbb1f87f2289f2a949e2abbc3cabed3 [0,2,0,0,0,0|0,0,2]=4 3113 B14R1.168 CC(C)/C=C/CNCC1CCCN1C 6ba73601779d4c49a628131827acf6a5 [0,2,0,0,0,0|2,0,0]=4 3114 B14R1.168 CC(C)/C=C/CNCC1CCNC1=O da2474706caaa4859dd09d4a40b8ddc7 [0,2,0,0,0,0|1,0,0]=3 3115 B14R1.168 CC(C)/C=C/CNC[C@@H]1CCCN1C 0df7578f60a6bfac6bf153eefbb79f25 [0,2,0,0,0,0|2,0,0]=4 3116 B14R1.168 CC(C)/C=C/CNC[C@H]1CCCN1C b6eaf2cc7454e89e31a41f713c4e12c3 [0,2,0,0,0,0|2,0,0]=4 3117 B14R1.168 CC(C)/C=C/COCC1=CCCC1=O 16120b0fd37c9238a51d96e8c688b7fa [0,2,0,0,0,0|0,0,2]=4 3118 B14R1.168 CC(C)/C=C/COCC1CCCC1=O 1bf57ce171a4478d3fdf2c24e1372254 [0,2,0,0,0,0|0,0,0]=2 3119 B14R1.168 CC(C)/C=C/COCC1CCCC1C 8ab82c523e602b222d27163ab44a49b5 [0,2,0,0,0,0|1,0,1]=4 3120 B14R1.168 CC(C)/C=C/COCC1CCCN1C 6b4e7d3f1a7a15dd533d2bfa9960ae90 [0,2,0,0,0,0|2,0,0]=4 3121 B14R1.168 CC(C)/C=C/COCC1CCNC1=O 231bfe5857529aea01733ede0fa3b1b8 [0,2,0,0,0,0|1,0,0]=3 3122 B14R1.168 CC(C)/C=C/COCN1CCCC1=O 0c70022734f2ad283278be869da01562 [0,2,0,0,0,0|1,0,0]=3 3123 B14R1.168 CC(C)/C=C/COC[C@@H]1CCCN1C ec698ac25f447e1cd72555ece0abb5e3 [0,2,0,0,0,0|2,0,0]=4 3124 B14R1.168 CC(C)/C=C/COC[C@@H]1CCC[C@H]1F c81792b63f3a42ece47ca9ac221a649b [0,2,0,0,0,0|1,0,1]=4 3125 B14R1.168 CC(C)/C=C/COC[C@H]1CCCN1C 68083afb1d028970e3a817a5ed795de8 [0,2,0,0,0,0|2,0,0]=4 3126 B14R1.168 CC(C)CCCCOC1CCCC1=O 4c1e8a001c03d34d8bb0c1ba69e64669 [0,2,0,0,0,0|0,0,2]=4 3127 B14R1.168 CC(C)CCCOCC1CCCC1=O e6e8e4d40fe0a5b605ec4c3b4b1ed92a [0,2,0,0,0,0|0,0,2]=4 3128 B14R1.168 CC(C)COCCOC1CCCC1=O 0ca64bd256493127ef56b4492eca89cc [0,2,0,0,0,0|1,0,1]=4 3129 B14R1.168 CC(C)CSCCOC1CCCC1=O 3a070ea298221a82b2a783fd3e21cab7 [0,2,0,0,0,0|1,0,1]=4 3130 B14R1.168 CC(C)OCCCNC1CCCC1=O a13bb7b8f151b5ea98594ee973fa3c58 [0,2,0,0,0,0|1,0,1]=4 3131 B14R1.168 CC(C)OCCCOC1CCCC1=O ce805801bd3d055ad56fb6b4b82fd483 [0,2,0,0,0,0|1,0,1]=4 3132 B14R1.168 CC(C)OCCOCC1CCCC1=O 6d747f41bc4d6de63db2fb563fae340f [0,2,0,0,0,0|1,0,1]=4 3133 B14R1.168 CC(C)SCCCNC1CCCC1=O 7dc3d86e5c91c364f1e21869487f2b85 [0,2,0,0,0,0|1,0,1]=4 3134 B14R1.168 CC(C)SCCCOC1CCCC1=O d60df0e8793db2e9543bc199f90d4e77 [0,2,0,0,0,0|1,0,1]=4 3135 B14R1.168 CC(C)SCCOCC1CCCC1=O aa954cfd5a4d0ef1f1a7671ef56012bc [0,2,0,0,0,0|1,0,1]=4 3136 B14R1.168 O=C(O)/C=C/COCC1CCCC1=O 5aabd9bd0499bbe8a147c4921f8357fd [0,2,0,0,0,0|1,0,1]=4 3137 B14R1.168 O=C(O)C=CCOCC1CCCC1=O 63fd41be04497756e8c5c3dbcc4ff055 [0,2,0,0,0,0|1,0,1]=4 3138 B14R1.216 C/C=C/C=C/COCN1CCCC1=O 6e857d80b4a2ee5c4fbcaa48bb330870 [0,2,0,0,0,0|1,0,1]=4 3139 B14R1.216 C/C=C\CCCOCC1CCCC1=O c0cbfca5401ce1e457476b365087c0af [0,2,0,0,0,0|0,0,2]=4 3140 B14R1.216 CC/C=C/CCOCN1CCCC1=O 08f972a0a55f6d08b06e7bbb4b462c21 [0,2,0,0,0,0|1,0,0]=3 3141 B14R1.216 CC/C=C/CNCCC1CCCN1C 9a5c26e49470e36662e76f0c17826a35 [0,2,0,0,0,0|2,0,0]=4 3142 B14R1.216 CC/C=C/CNCCN1CCCC1=O 0c5200a7a12a7d707194fe5405fe7afd [0,2,0,0,0,0|1,0,0]=3 3143 B14R1.216 CC/C=C/CNCCN1CCNC1=O 5c4f8a9f51d041c330e87ed051f55c6d [0,2,0,0,0,0|2,0,0]=4 3144 B14R1.216 CC/C=C/CNCC[C@@H]1CCCN1C 748e960d718fd19794c0ca7e9cb741ae [0,2,0,0,0,0|2,0,0]=4 3145 B14R1.216 CC/C=C/CNCC[C@H]1CCCN1C 405c95cea0feb80d5cc19e8450162d3b [0,2,0,0,0,0|2,0,0]=4 3146 B14R1.216 CC/C=C/COCCC1CCCN1C 8300b1b17e65ed460d78930e5db218fe [0,2,0,0,0,0|2,0,0]=4 3147 B14R1.216 CC/C=C/COCCC1CCNC1=O e213008de293b3dbdee0e520be733f0c [0,2,0,0,0,0|1,0,0]=3 3148 B14R1.216 CC/C=C/COCCN1CCCC1=O 9fa29263c38ada3e5c627dcffd666ea2 [0,2,0,0,0,0|1,0,0]=3 3149 B14R1.216 CC/C=C/COCCN1CCNC1=O 80f50e2c43bbd24d4249bdb63abeabef [0,2,0,0,0,0|2,0,0]=4 3150 B14R1.216 CC/C=C/COCC[C@@H]1CCCN1C 1aa1517798daaf9f667ec0b63ff09e24 [0,2,0,0,0,0|2,0,0]=4 3151 B14R1.216 CC/C=C/COCC[C@H]1CCCN1C 522d2ac882486bdc4327002d17506e79 [0,2,0,0,0,0|2,0,0]=4 3152 B14R1.216 CC/C=C\CCCOC1CCCC1=O 63727e344817d5b9354fd5abc4147d32 [0,2,0,0,0,0|0,0,0]=2 3153 B14R1.216 CC/C=C\CCCOC1CCNC1=O 185215e55d36a41f58e4ff7e7260f5df [0,2,0,0,0,0|1,0,0]=3 3154 B14R1.216 CC/C=C\CCCOC1CCOC1=O 7a899db9195d8fe47e74c8d8bd2e7121 [0,2,0,0,0,0|1,0,0]=3 3155 B14R1.216 CC/C=C\CCNCC1CCCC1O ebfbf4d68bf64864be4554a1fa9c3981 [0,2,0,0,0,0|0,0,2]=4 3156 B14R1.216 CC/C=C\CCNCC1CCCN1C 681cc9406b5528bea677ea73bd650253 [0,2,0,0,0,0|2,0,0]=4 3157 B14R1.216 CC/C=C\CCNCC1CCNC1=O 770996ce07daf3b2823553a0ea4225a1 [0,2,0,0,0,0|1,0,0]=3 3158 B14R1.216 CC/C=C\CCNC[C@@H]1CCCN1C 5067a9606598c05165e05b9a913aac79 [0,2,0,0,0,0|2,0,0]=4 3159 B14R1.216 CC/C=C\CCNC[C@H]1CCCN1C 3dbb9288a64ff547cf576b874c1fd1d9 [0,2,0,0,0,0|2,0,0]=4 3160 B14R1.216 CC/C=C\CCOCC1=CCCC1=O 6d4931984772bff79818f7cc7ccea005 [0,2,0,0,0,0|0,0,2]=4 3161 B14R1.216 CC/C=C\CCOCC1CCCC1=O 01f3b026f8c0aa1a3ed70fe0e0b0ffdb [0,2,0,0,0,0|0,0,0]=2 3162 B14R1.216 CC/C=C\CCOCC1CCCC1C e6e9110d68d559e129d261d405389e27 [0,2,0,0,0,0|1,0,1]=4 3163 B14R1.216 CC/C=C\CCOCC1CCCN1C dd59fb71ded8e854d825c6f4cf4dfdb3 [0,2,0,0,0,0|2,0,0]=4 3164 B14R1.216 CC/C=C\CCOCC1CCNC1=O 5881f1b7fc27bbc44cdc120fe184739f [0,2,0,0,0,0|1,0,0]=3 3165 B14R1.216 CC/C=C\CCOCN1CCCC1=O bd963588ee23f4c4cbd0c51a8ca406f1 [0,2,0,0,0,0|1,0,0]=3 3166 B14R1.216 CC/C=C\CCOC[C@@H]1CCCN1C 6cd364a2e7d2bb3824e690800f6ecd5a [0,2,0,0,0,0|2,0,0]=4 3167 B14R1.216 CC/C=C\CCOC[C@@H]1CCC[C@H]1F bcbfec9f9ba67d458ba14b6a741da982 [0,2,0,0,0,0|1,0,1]=4 3168 B14R1.216 CC/C=C\CCOC[C@H]1CCCN1C 376aa70c698b716d3abcef8c7cfcbc0f [0,2,0,0,0,0|2,0,0]=4 3169 B14R1.216 CC/C=C\COCCC1CCCN1C 8c0279b8bd1776e9737db7b0b6f492c4 [0,2,0,0,0,0|2,0,0]=4 3170 B14R1.216 CC/C=C\COCCC1CCNC1=O 4990923ad945668b47ea63f9d311110e [0,2,0,0,0,0|1,0,0]=3 3171 B14R1.216 CC/C=C\COCCN1CCCC1=O 8d6a7ad380cc6e99aefedd2d826349f4 [0,2,0,0,0,0|1,0,0]=3 3172 B14R1.216 CC/C=C\COCCN1CCNC1=O bc386aebbd386961d6826cd73ccf7d9c [0,2,0,0,0,0|2,0,0]=4 3173 B14R1.216 CC=CC#CCCOC1CCCC1=O d6d13fbc6072f694eee25a729c7b476d [0,2,0,0,0,0|0,0,2]=4 3174 B14R1.216 CC=CC=CCOCN1CCCC1=O fdd42ee44186280d4241586f8bc90be4 [0,2,0,0,0,0|1,0,1]=4 3175 B14R1.216 CCC/C=C/CNCC1CCCC1O 11029230ab91240e2bb14a7adb59ad3e [0,2,0,0,0,0|0,0,2]=4 3176 B14R1.216 CCC/C=C/CNCC1CCCN1C 52cacaa854e89e9eddd885d7fd1ada8f [0,2,0,0,0,0|2,0,0]=4 3177 B14R1.216 CCC/C=C/CNCC1CCNC1=O c98130d7fd4e4b86751ce1841f034fed [0,2,0,0,0,0|1,0,0]=3 3178 B14R1.216 CCC/C=C/CNC[C@@H]1CCCN1C 2ad75b2661172a3e247c4b7ce1ef66a9 [0,2,0,0,0,0|2,0,0]=4 3179 B14R1.216 CCC/C=C/CNC[C@H]1CCCN1C d5e551a021b71f131d34dabcb35e873e [0,2,0,0,0,0|2,0,0]=4 3180 B14R1.216 CCC/C=C/COCC1=CCCC1=O 85414a6e211feaeb2da5d873b69862f6 [0,2,0,0,0,0|0,0,2]=4 3181 B14R1.216 CCC/C=C/COCC1CCCC1=O 69e7b0856459d45d126cad8c5dd0835d [0,2,0,0,0,0|0,0,0]=2 3182 B14R1.216 CCC/C=C/COCC1CCCC1C 5066c5b8903f260ccc65e5bb2493a005 [0,2,0,0,0,0|1,0,1]=4 3183 B14R1.216 CCC/C=C/COCC1CCCN1C fb4633837608279671839ef1a8201563 [0,2,0,0,0,0|2,0,0]=4 3184 B14R1.216 CCC/C=C/COCC1CCNC1=O aff6fd09c3f54327bb7737bf931f52ef [0,2,0,0,0,0|1,0,0]=3 3185 B14R1.216 CCC/C=C/COCN1CCCC1=O 8b2049291f1129b78bec56910ed66896 [0,2,0,0,0,0|1,0,0]=3 3186 B14R1.216 CCC/C=C/COC[C@@H]1CCCN1C e29bb8d708c5db431a8744b39a5261cb [0,2,0,0,0,0|2,0,0]=4 3187 B14R1.216 CCC/C=C/COC[C@@H]1CCC[C@H]1F 87d804e2b41b0610d171687f4f79c6a2 [0,2,0,0,0,0|1,0,1]=4 3188 B14R1.216 CCC/C=C/COC[C@H]1CCCN1C 1730e32b6fcf09f33da9f98392fc118e [0,2,0,0,0,0|2,0,0]=4 3189 B14R1.216 CCC/C=C\CCOC1CCCC1=O c31d507a8c98189415c75fe5fadde997 [0,2,0,0,0,0|0,0,0]=2 3190 B14R1.216 CCC/C=C\CCOC1CCNC1=O e2fc4240de8edb9ff0566027d1f6ae81 [0,2,0,0,0,0|1,0,0]=3 3191 B14R1.216 CCC/C=C\CCOC1CCOC1=O 6128e42839052721108fbd87af773df0 [0,2,0,0,0,0|1,0,0]=3 3192 B14R1.216 CCC/C=C\CNCC1CCCC1O 64eb03b568309824df6661890b3cbe68 [0,2,0,0,0,0|0,0,2]=4 3193 B14R1.216 CCC/C=C\CNCC1CCCN1C a69046e771e8f02e96c85c6707f749c7 [0,2,0,0,0,0|2,0,0]=4 3194 B14R1.216 CCC/C=C\CNCC1CCNC1=O 8f7e9feb2be87194ea219e7cd4936a67 [0,2,0,0,0,0|1,0,0]=3 3195 B14R1.216 CCC/C=C\CNC[C@@H]1CCCN1C 36f0fa39ae9c5fb416d2c1c12f4826f0 [0,2,0,0,0,0|2,0,0]=4 3196 B14R1.216 CCC/C=C\CNC[C@H]1CCCN1C 88a77caf89962e2bf0be428c68cd64df [0,2,0,0,0,0|2,0,0]=4 3197 B14R1.216 CCC/C=C\COCC1=CCCC1=O ceb7066468bd25a0b404fe7e55bf4b12 [0,2,0,0,0,0|0,0,2]=4 3198 B14R1.216 CCC/C=C\COCC1CCCC1=O 36c1f30ceb84321c87c179dbbee0d074 [0,2,0,0,0,0|0,0,0]=2 3199 B14R1.216 CCC/C=C\COCC1CCCC1C e7afdf6a85ef73874a80432ab0245bec [0,2,0,0,0,0|1,0,1]=4 3200 B14R1.216 CCC/C=C\COCC1CCCN1C b5a91c54ca08f1cc881d9fceab787422 [0,2,0,0,0,0|2,0,0]=4 3201 B14R1.216 CCC/C=C\COCC1CCNC1=O 95d83b50743d1fbf40a49165c793a579 [0,2,0,0,0,0|1,0,0]=3 3202 B14R1.216 CCC/C=C\COCN1CCCC1=O 7fc71658d45674dc276bbb8d6a0d8a54 [0,2,0,0,0,0|1,0,0]=3 3203 B14R1.216 CCC/C=C\COC[C@@H]1CCCN1C 5f718df55058ff4684cdcf426bf7460c [0,2,0,0,0,0|2,0,0]=4 3204 B14R1.216 CCC/C=C\COC[C@@H]1CCC[C@H]1F 5c67bac7f103dee88aebb69ee25fe23f [0,2,0,0,0,0|1,0,1]=4 3205 B14R1.216 CCC/C=C\COC[C@H]1CCCN1C ce6ebea212329f1ec7853b92dce8f6e6 [0,2,0,0,0,0|2,0,0]=4 3206 B14R1.216 CCCC#CCCOC1CCCC1=O 52b77b07696ef181f4b7243867dfbeb9 [0,2,0,0,0,0|0,0,2]=4 3207 B14R1.216 CCCC/C=C/CNC1CCNC1=O 0d033601d8d7be98e91b3de06098e45b [0,2,0,0,0,0|2,0,0]=4 3208 B14R1.216 CCCC/C=C/CNC1CCSC1=O cdb7bec99a4898f8dc21016ba625b373 [0,2,0,0,0,0|2,0,0]=4 3209 B14R1.216 CCCC/C=C/CN[C@@H]1CCNC1=O a0bcd83b41e7509235ddf10d02c67e0a [0,2,0,0,0,0|2,0,0]=4 3210 B14R1.216 CCCC/C=C/CN[C@@H]1CCOC1=O 0ea67a5a5ccfeaaa5b50c9545ae8f1a7 [0,2,0,0,0,0|2,0,0]=4 3211 B14R1.216 CCCC/C=C/CN[C@H]1CCNC1=O 179bcf583e14baa8ffd939a94c1bd4ed [0,2,0,0,0,0|2,0,0]=4 3212 B14R1.216 CCCC/C=C/CN[C@H]1CCOC1=O dab6a4e7560238d687c611c843af826a [0,2,0,0,0,0|2,0,0]=4 3213 B14R1.216 CCCC/C=C/COC1CCCC1=O 3fb2cadfc58838181fba538ae60e21d8 [0,2,0,0,0,0|1,0,0]=3 3214 B14R1.216 CCCC/C=C/COC1CCNC1=O 0ef32aedb8c2b305f14239d55ef9dd9a [0,2,0,0,0,0|2,0,0]=4 3215 B14R1.216 CCCC/C=C/COC1CCOC1=O 26845ef09a6da0db70bed4b9dd57f613 [0,2,0,0,0,0|2,0,0]=4 3216 B14R1.216 CCCC/C=C/CO[C@@H]1CCNC1=O b6bd2942fb57aeceb724002d6f033206 [0,2,0,0,0,0|2,0,0]=4 3217 B14R1.216 CCCC/C=C/CO[C@@H]1CCOC1=O c28823983b82542b1b7830b37eef6b72 [0,2,0,0,0,0|2,0,0]=4 3218 B14R1.216 CCCC/C=C/CO[C@H]1CCNC1=O 757047e39c1be64c20b17a3958f0b524 [0,2,0,0,0,0|2,0,0]=4 3219 B14R1.216 CCCC/C=C/CO[C@H]1CCOC1=O 7d812f4bdfe242c498f515cb2cf64a7f [0,2,0,0,0,0|2,0,0]=4 3220 B14R1.216 CCCC/C=C\CNC1CCNC1=O d163224d91345fea6431e8e4ce1141bf [0,2,0,0,0,0|2,0,0]=4 3221 B14R1.216 CCCC/C=C\CNC1CCSC1=O 3aa6077101530eff872d548a17e43e00 [0,2,0,0,0,0|2,0,0]=4 3222 B14R1.216 CCCC/C=C\CN[C@@H]1CCNC1=O 299f9a60377c5d2262165ae09a58b7ea [0,2,0,0,0,0|2,0,0]=4 3223 B14R1.216 CCCC/C=C\CN[C@@H]1CCOC1=O 50f8a0fca28c96bd6face3ade9a2359a [0,2,0,0,0,0|2,0,0]=4 3224 B14R1.216 CCCC/C=C\CN[C@H]1CCNC1=O 04c181ac817e551d0ece9a0a57bddb47 [0,2,0,0,0,0|2,0,0]=4 3225 B14R1.216 CCCC/C=C\CN[C@H]1CCOC1=O 2462b92cde3ff8e30985b8fd37a529c9 [0,2,0,0,0,0|2,0,0]=4 3226 B14R1.216 CCCC/C=C\COC1CCCC1=O e77b0fa95ab060168d86fcfc97b97f0d [0,2,0,0,0,0|1,0,0]=3 3227 B14R1.216 CCCC/C=C\COC1CCNC1=O 158009212d00ae01b5cfb58936b8444b [0,2,0,0,0,0|2,0,0]=4 3228 B14R1.216 CCCC/C=C\COC1CCOC1=O b728718fb2fdfeffadad1f5aebf60ced [0,2,0,0,0,0|2,0,0]=4 3229 B14R1.216 CCCC/C=C\CO[C@@H]1CCNC1=O 396c2e8ab0b0c9215c9953bf210afa11 [0,2,0,0,0,0|2,0,0]=4 3230 B14R1.216 CCCC/C=C\CO[C@@H]1CCOC1=O be08bafe3ab5ddd1608c3aa7a4c7f9ad [0,2,0,0,0,0|2,0,0]=4 3231 B14R1.216 CCCC/C=C\CO[C@H]1CCNC1=O 720f3c7b70e56048b834d30337fe0a0e [0,2,0,0,0,0|2,0,0]=4 3232 B14R1.216 CCCC/C=C\CO[C@H]1CCOC1=O 97424e14774e2c642288803c28e92502 [0,2,0,0,0,0|2,0,0]=4 3233 B14R1.216 CCCCCCCNC1CCCC1=O ac4579122147b030de7ed8e0eaeb6898 [0,2,0,0,0,0|0,0,2]=4 3234 B14R1.216 CCCCCCCOC1CCCC1=O 1577a97514e91d0220493900751151e3 [0,2,0,0,0,0|0,0,2]=4 3235 B14R1.216 CCCCCCOCC1CCCC1=O 680613243782e7415370d6ec5d9a046a [0,2,0,0,0,0|0,0,2]=4 3236 B14R1.216 CCCCOCCOC1CCCC1=O 417f95f9ebe2dd62c64ed774b51ba132 [0,2,0,0,0,0|0,0,2]=4 3237 B14R1.216 CCCCOCOCC1CCCC1=O b2b04054b77e1c51b96be0978ff7707c [0,2,0,0,0,0|0,0,2]=4 3238 B14R1.216 CCCCSCCOC1CCCC1=O 7b9d809665af3a8b737958ae5d5b7309 [0,2,0,0,0,0|0,0,2]=4 3239 B14R1.216 CCCOCCCNC1CCCC1=O d163c99baa461237970ea3e039d7c224 [0,2,0,0,0,0|0,0,2]=4 3240 B14R1.216 CCCOCCCOC1CCCC1=O e9ef4577d435b4dd15aba1de5d34df98 [0,2,0,0,0,0|0,0,2]=4 3241 B14R1.216 CCCOCCOCC1CCCC1=O 3e0e87808a90801892a6589c7b5bf42d [0,2,0,0,0,0|0,0,2]=4 3242 B14R1.216 CCOCCCOCC1CCCC1=O e64d1eabe76295cc9e3a540ca003fdfe [0,2,0,0,0,0|0,0,2]=4 3243 B14R1.216 CCSCCCCNC1CCCC1=O 43afe773f62068bda506774445c907c1 [0,2,0,0,0,0|0,0,2]=4 3244 B14R1.216 CCSCCCOCC1CCCC1=O 65962e1654ffdf8d03700514e1cddc01 [0,2,0,0,0,0|0,0,2]=4 3245 B14R1.216 COCCCCCOC1CCCC1=O 02fefec8a8f2d272712ce553c91e1da7 [0,2,0,0,0,0|0,0,2]=4 3246 B14R1.216 COCCCCOCC1CCCC1=O 9712a925fb2c5d5160deb42cb8bcba46 [0,2,0,0,0,0|0,0,2]=4 3247 B14R1.216 COCCOCCNC1CCCC1=O 73a974880099121d54637440adb17902 [0,2,0,0,0,0|1,0,1]=4 3248 B14R1.216 COCCOCCOC1CCCC1=O 912554f1ce2a13d3b55f0e48530b41aa [0,2,0,0,0,0|1,0,1]=4 3249 B14R1.216 COCCOCOCC1CCCC1=O 6d463ea56a266fcdf55447b81ca81845 [0,2,0,0,0,0|1,0,1]=4 3250 B14R1.216 COCOCCOCC1CCCC1=O 8c5a6296596089a764532cb0b2c0d29e [0,2,0,0,0,0|1,0,1]=4 3251 B14R1.216 O=C1CCCC1COCCCCCF 7056107a77df9e2059d737086649beb3 [0,2,0,0,0,0|0,0,2]=4 3252 B14R1.216 O=C1CCCC1NCCCCCCCl 27fe6f2e3e810c43c70453815997d604 [0,2,0,0,0,0|0,0,2]=4 3253 B14R1.216 O=C1CCCC1NCCCCCCO fd99d29a6dd2914c0668d0066cee9345 [0,2,0,0,0,0|0,0,2]=4 3254 B14R1.216 O=C1CCCC1NCCCOCCO 74b49a4abd9a35ea1f315025fec9c57d [0,2,0,0,0,0|1,0,1]=4 3255 B14R1.216 O=C1CCCC1NCCOCCCO 651b7c5af75708eb61847ca33ceff41d [0,2,0,0,0,0|1,0,1]=4 3256 B14R1.216 O=C1CCCC1NCCSSCCO 5bf4e3a286a4617415650f2f2fdc492a [0,2,0,0,0,0|2,0,0]=4 3257 B14R1.216 O=C1CCCC1OCCCCCCF b8c95657de30afba7bbbd25d70b5a592 [0,2,0,0,0,0|0,0,2]=4 3258 B14R1.216 O=C1CCCC1OCCCCCCS c290b6f6e7d519b73e3b769a3a83e88c [0,2,0,0,0,0|0,0,2]=4 3259 B14R1.1047 CC/C=C/CC(=O)NC1CCNC1=O 2b323b8afea5b3f7bd98572631bfa35d [0,2,0,0,0,0|1,0,1]=4 3260 B14R1.1047 CC/C=C/CC(=O)NC1CCSC1=O f603e94449ba159d2986b03ca537348a [0,2,0,0,0,0|1,0,1]=4 3261 B14R1.1047 CC/C=C/CC(=O)N[C@@H]1CCNC1=O bf0316bd2d94f3137d0a4b52d7eeadec [0,2,0,0,0,0|1,0,1]=4 3262 B14R1.1047 CC/C=C/CC(=O)N[C@@H]1CCOC1=O 3e1a3908f9761c9d413c7528efc4c81b [0,2,0,0,0,0|1,0,1]=4 3263 B14R1.1047 CC/C=C/CC(=O)N[C@H]1CCNC1=O 07616e340d6587ecfb177c26289fcf2b [0,2,0,0,0,0|1,0,1]=4 3264 B14R1.1047 CC/C=C/CC(=O)N[C@H]1CCOC1=O 0e5f3dc4bfb28b32d19e300d2e38d19d [0,2,0,0,0,0|1,0,1]=4 3265 B14R1.1047 CC/C=C/CN(C)CC1CCCN1C 0945d4aa530a5dfa176119e3ebb94dfc [0,2,0,0,0,0|2,0,0]=4 3266 B14R1.1047 CC/C=C/CN(C)C[C@@H]1CCCN1C 4e66b575e3c5dc2a4db576bfbf9790b2 [0,2,0,0,0,0|2,0,0]=4 3267 B14R1.1047 CC/C=C/CN(C)C[C@H]1CCCN1C 1fa7ea171a2e2c2fa24dda3481f298b1 [0,2,0,0,0,0|2,0,0]=4 3268 B14R1.1047 CC/C=C\CC(=O)NC1CCNC1=O 1a6dc4566c86519065269a050229e09c [0,2,0,0,0,0|1,0,1]=4 3269 B14R1.1047 CC/C=C\CC(=O)NC1CCSC1=O 495657833b49d9124da4009b86e81001 [0,2,0,0,0,0|1,0,1]=4 3270 B14R1.1047 CC/C=C\CC(=O)N[C@@H]1CCNC1=O a8428c08909317fc7e98b9ddc4f77c6a [0,2,0,0,0,0|1,0,1]=4 3271 B14R1.1047 CC/C=C\CC(=O)N[C@@H]1CCOC1=O 0cd70ff85aa6bf728b9d764dc527e234 [0,2,0,0,0,0|1,0,1]=4 3272 B14R1.1047 CC/C=C\CC(=O)N[C@H]1CCNC1=O d91f0e35ef8165935462f76f591a1b8a [0,2,0,0,0,0|1,0,1]=4 3273 B14R1.1047 CC/C=C\CC(=O)N[C@H]1CCOC1=O 04565db14b2aed40b4170495c4fb1cd7 [0,2,0,0,0,0|1,0,1]=4 3274 B14R1.1047 CCC=CCC(=O)NC1CCNC1=O 9d19f5b74d9bdb26d8a98648dbcb727a [0,2,0,0,0,0|1,0,1]=4 3275 B14R1.1047 CCC=CCC(=O)NC1CCSC1=O e7dd177289ac19618e617796132989be [0,2,0,0,0,0|1,0,1]=4 3276 B14R1.1047 CCC=CCC(=O)N[C@@H]1CCNC1=O daa7e0dc91fb5866b24ee26955f352f1 [0,2,0,0,0,0|1,0,1]=4 3277 B14R1.1047 CCC=CCC(=O)N[C@@H]1CCOC1=O 7cdce600111649731c2efa6d7f192a40 [0,2,0,0,0,0|1,0,1]=4 3278 B14R1.1047 CCC=CCC(=O)N[C@H]1CCNC1=O 25b0060bf7cd915367239d233f370ce7 [0,2,0,0,0,0|1,0,1]=4 3279 B14R1.1047 CCC=CCC(=O)N[C@H]1CCOC1=O dee20aa0323632f86a965e6c1abf77ba [0,2,0,0,0,0|1,0,1]=4 3280 B14R1.1047 CCCCCC(C)NC1CCCC1=O eea063ea952fda9fdb4de5af7e298803 [0,2,0,0,0,0|0,0,2]=4 3281 B14R1.1047 CCCCC[C@H](C)NC1CCCC1=O 29a2398c00abef820a7d494838663ba9 [0,2,0,0,0,0|0,0,2]=4 3282 B14R1.1237 CC/C=C/CCOC1C(=O)CCC1=O 43da419562977dac34179713a5df4c2e [0,2,0,0,0,0|0,0,1]=3 3283 B14R1.1237 CC/C=C/CCOC1C(=O)COC1=O 94eeb12e998e03744ad674f42438cbd4 [0,2,0,0,0,0|1,0,1]=4 3284 B14R1.1237 CC/C=C/COCN1C(=O)CCC1=O bd73a4a629d1a017690c5afc962af0e1 [0,2,0,0,0,0|1,0,1]=4 3285 B14R1.1237 CC/C=C\CCN[C@@H]1C(=O)NC[C@H]1O 17fabcee43cf25f6e40ccab7b69d3aea [0,2,0,0,0,0|1,0,0]=3 3286 B14R1.1237 CC/C=C\CCOC1=C(CCC1=O)C c7a5a9f776b7d379e91e271744eb3e51 [0,2,0,0,0,0|0,0,2]=4 3287 B14R1.1237 CC/C=C\CCOC1C(=O)CCC1=O 9744bda655986b25759e820298138540 [0,2,0,0,0,0|0,0,1]=3 3288 B14R1.1237 CC/C=C\CCOC1C(=O)COC1=O 2449b4ca9866e2d27564c74733553033 [0,2,0,0,0,0|1,0,1]=4 3289 B14R1.1237 CCC/C=C/CN[C@@H]1C(=O)NC[C@H]1O 8b22e03a1bfc11a72e354645a05daacf [0,2,0,0,0,0|2,0,0]=4 3290 B14R1.1237 CCC/C=C/COC1C(=O)CCC1=O 8369591a7aaca43a79c69e5aff226925 [0,2,0,0,0,0|1,0,1]=4 3291 B14R1.1237 CCC/C=C\CN[C@@H]1C(=O)NC[C@H]1O 120c64fed1723685a7f19ae74ed1ba71 [0,2,0,0,0,0|2,0,0]=4 3292 B14R1.1237 CCC/C=C\COC1C(=O)CCC1=O 62a315a6722546649db801da233503d8 [0,2,0,0,0,0|1,0,1]=4 3293 B14R1.3360 CC/C=C/COC(C)[C@@H]1CCCN1C b4f3b4eebcc8b645588f3989605c9ffc [0,2,0,0,0,0|2,0,0]=4 3294 B14R1.3360 CC/C=C/CO[C@@H](C)[C@@H]1CCCN1C 7c067c1a5fec4c9e1391a1c912e69a3d [0,2,0,0,0,0|2,0,0]=4 3295 B14R1.3360 CC/C=C\CCN(C)[C@@H]1CCC[C@@H]1O f61704a9084e56f64a840f05eceb4307 [0,2,0,0,0,0|0,0,2]=4 3296 B14R1.3360 CC/C=C\CCN(C)[C@@H]1CCC[C@H]1O e61b479586dc0a692f6234ebaf397a5d [0,2,0,0,0,0|0,0,2]=4 3297 B14R1.3360 CC/C=C\CCN(C)[C@H]1CCC[C@H]1O 22fc0e05aad34cdab8da1c901d721a4a [0,2,0,0,0,0|0,0,2]=4 3298 B14R1.3452 CC/C=C/CCOC1CCN(C1=O)C 08643f2069ffe0b9cebbc14f3a007740 [0,2,0,0,0,0|1,0,0]=3 3299 B14R1.3452 CC/C=C/COCC1CCN(C1=O)C 31e487122a0181375cfd6997456b27b4 [0,2,0,0,0,0|1,0,0]=3 3300 B14R1.3452 CC/C=C\CCNC1CCN(C1=O)C 2b16cb45748f5e8a04e1a0be34e2e827 [0,2,0,0,0,0|1,0,0]=3 3301 B14R1.3452 CC/C=C\CCNC1CCN(C1=O)O c00c798cb9124cab3bcb6e62c90a9329 [0,2,0,0,0,0|1,0,0]=3 3302 B14R1.3452 CC/C=C\CCN[C@@H]1CCN(C1=O)C 8e8fc0fa41966b587c508f4ed412acaa [0,2,0,0,0,0|1,0,0]=3 3303 B14R1.3452 CC/C=C\CCN[C@@H]1CCN(C1=O)O d2dc2704d38cc94284159c7ad659172d [0,2,0,0,0,0|1,0,0]=3 3304 B14R1.3452 CC/C=C\CCN[C@H]1CCN(C1=O)C 9a40a72a16c67597deb9788dcc9ab291 [0,2,0,0,0,0|1,0,0]=3 3305 B14R1.3452 CC/C=C\CCOC1CCN(C1=O)C 8500d53d8f1c9a5045830a29bbe28e8e [0,2,0,0,0,0|1,0,0]=3 3306 B14R1.3452 CC/C=C\CCO[C@@H]1CCN(C1=O)C 5d7053ecf2283d80cec507df6b0a59e5 [0,2,0,0,0,0|1,0,0]=3 3307 B14R1.3452 CC/C=C\COCC1CCN(C1=O)C d1ae889e178f457149f018b6fe12fcaf [0,2,0,0,0,0|1,0,0]=3 3308 B14R1.3452 CCC/C=C/CNC1CCN(C1=O)C bf01c31fdbe0f38426ddf4ff0d0034e1 [0,2,0,0,0,0|2,0,0]=4 3309 B14R1.3452 CCC/C=C/CNC1CCN(C1=O)O d525a9f0a85d60da7b5c77ea1c5aad1a [0,2,0,0,0,0|2,0,0]=4 3310 B14R1.3452 CCC/C=C/CN[C@@H]1CCN(C1=O)C fed14f147c6f8690921145cec3559361 [0,2,0,0,0,0|2,0,0]=4 3311 B14R1.3452 CCC/C=C/CN[C@@H]1CCN(C1=O)O dff68277456b242ac0f1ea6b9efa8a1e [0,2,0,0,0,0|2,0,0]=4 3312 B14R1.3452 CCC/C=C/CN[C@H]1CCN(C1=O)C 5425e77ce6c80b1d2edf4908044f3612 [0,2,0,0,0,0|2,0,0]=4 3313 B14R1.3452 CCC/C=C/COC1CCN(C1=O)C a2cd2c74c0e276db4d0383e027909ccb [0,2,0,0,0,0|2,0,0]=4 3314 B14R1.3452 CCC/C=C/CO[C@@H]1CCN(C1=O)C c99215c39aff22cf482dc6a12569bb94 [0,2,0,0,0,0|2,0,0]=4 3315 B14R1.3452 CCC/C=C\CNC1CCN(C1=O)C f34c77bebdb000ffc6f949d0894eb560 [0,2,0,0,0,0|2,0,0]=4 3316 B14R1.3452 CCC/C=C\CNC1CCN(C1=O)O 9470f94d2418fb67a805217fe814964d [0,2,0,0,0,0|2,0,0]=4 3317 B14R1.3452 CCC/C=C\CN[C@@H]1CCN(C1=O)C 83c672dbd5409dff04c2e76c4de3bbb0 [0,2,0,0,0,0|2,0,0]=4 3318 B14R1.3452 CCC/C=C\CN[C@@H]1CCN(C1=O)O fe469894492739801417049c0bf4cc33 [0,2,0,0,0,0|2,0,0]=4 3319 B14R1.3452 CCC/C=C\CN[C@H]1CCN(C1=O)C 304a290b2a6858164229a72174117fa5 [0,2,0,0,0,0|2,0,0]=4 3320 B14R1.3452 CCC/C=C\COC1CCN(C1=O)C cdcd63e5096c50e91e2f835ba7926c87 [0,2,0,0,0,0|2,0,0]=4 3321 B14R1.3452 CCC/C=C\CO[C@@H]1CCN(C1=O)C e5d0ceda5c9a644cea3ff782571178d1 [0,2,0,0,0,0|2,0,0]=4 3322 B14R1.8094 CC/C=C/COCC1(CCCC1=O)C c2e5502723802667de7043ca5dcd15e3 [0,2,0,0,0,0|0,0,0]=2 3323 B14R1.8094 CC/C=C/COCC1(CCNC1=O)C 3f833cb6f7dd01765e15a83784618a8f [0,2,0,0,0,0|1,0,0]=3 3324 B14R1.8094 CC/C=C/COC[C@@]1(CCCN1C)C 290da8c288526ca86349e7341a12b83e [0,2,0,0,0,0|2,0,0]=4 3325 B14R1.8094 CC/C=C\CCNC1(CCNC1=O)C 190aabef2a8afe509386b259216206d5 [0,2,0,0,0,0|1,0,0]=3 3326 B14R1.8094 CC1(CCCC1=O)COCC=CC#N 712df0503de474cdece14e0df179b954 [0,2,0,0,0,0|1,0,1]=4 3327 B14R1.8094 CCC/C=C/CNC1(CCNC1=O)C 981bddbc76fbe7d97a3a93a2cd016f74 [0,2,0,0,0,0|2,0,0]=4 3328 B14R1.8094 CCC/C=C\CNC1(CCNC1=O)C 3726bf8a8c29a3c471328543ad838465 [0,2,0,0,0,0|2,0,0]=4 3329 B14R1.8094 CCCCCOCC1(CCCC1=O)C 5e18d895d4127f496c51a268dc9a35a1 [0,2,0,0,0,0|0,0,2]=4 3330 B14R1.8094 CCOCCOCC1(CCCC1=O)C 6dd0b06f9477a5f37466106c7e89f249 [0,2,0,0,0,0|1,0,1]=4 3331 B14R1.8094 CCSCCOCC1(CCCC1=O)C f50fcf94736ad8c23e887d805b786030 [0,2,0,0,0,0|1,0,1]=4 3332 B12R1.8 C=CCCCCN1CC=CCC1 0bf10db644b84078b54cd4c37f987b5d [0,0,1,1,0,0|2,0,0]=4 3333 B12R1.8 C=CCCCOC1CC=CCC1 4eaa70fa3cb1a0a979b80e12b06c914f [0,0,1,1,0,0|2,0,0]=4 3334 B12R1.8 C=CCCNCC1CC=CCC1 2bc64ba16d4577bd512379c2d60926c8 [0,0,1,1,0,0|2,0,0]=4 3335 B12R1.8 C=CCCOCC1CC=CCC1 cad5849dab09c64f6a46e5b124d2b2b5 [0,0,1,1,0,0|2,0,0]=4 3336 B12R1.8 C=CCCOC[C@@H]1CC=CCC1 5a01d0613b7c040ca92a125d550185a9 [0,0,1,1,0,0|2,0,0]=4 3337 B12R1.8 C=CCCOC[C@H]1CC=CCC1 076958f11c4f1bec8e7e471ecab240b7 [0,0,1,1,0,0|2,0,0]=4 3338 B12R1.8 CC/C=C/CNC1C=CCCC1 ba121198c521c4746319bfd5ec83115f [0,0,1,1,0,0|2,0,0]=4 3339 B12R1.8 CC/C=C/COC1C=CCCC1 1fbf97d3511bee21673a00d1d8127b88 [0,0,1,1,0,0|2,0,0]=4 3340 B12R1.8 CC/C=C\COC1C=CCCC1 8ffffd4f238c9ddaef4a3353989ba5aa [0,0,1,1,0,0|2,0,0]=4 3341 B12R1.8 O=CCCCCN1CC=CCC1 0b295c8808ac78c2842d8ccdbe5cfb93 [0,0,1,1,0,0|1,0,0]=3 3342 B12R1.8 O=CCCCOC1CC=CCC1 dbe99349f51529855fa895f4d7a55945 [0,0,1,1,0,0|1,0,0]=3 3343 B12R1.8 O=CCCNCC1CC=CCC1 ab44f11d405a913f809651800d24bc48 [0,0,1,1,0,0|1,0,0]=3 3344 B12R1.8 O=CCCOCC1CC=CCC1 8747c30cbf7ffb2333e24c460d34ecba [0,0,1,1,0,0|1,0,0]=3 3345 B12R1.8 O=CCCOCC1CCC=CO1 a4fe34c2b9a0cd5c5fa7d289bf59fa5f [0,0,1,1,0,0|2,0,0]=4 3346 B12R1.8 O=CCCOC[C@@H]1CC=CCC1 4dffcbe9aa3ae524c09ca7c481300fab [0,0,1,1,0,0|1,0,0]=3 3347 B12R1.8 O=CCCOC[C@H]1CC=CCC1 6d9b1607458957f982c12332f62ae393 [0,0,1,1,0,0|1,0,0]=3 3348 B12R1.8 O=CCOCCN1CC=CCC1 45f12c13745f190b7837c3fa4df0d815 [0,0,1,1,0,0|2,0,0]=4 3349 B12R1.18 CCCNC1CCCCCC1=O f3f393887363398b7fbe92d37dd3e1fa [0,0,1,1,0,0|1,0,1]=4 3350 B12R1.18 CCCOC1CCCCCC1=O 4ba42e6fd237c418e07f214d26aae088 [0,0,1,1,0,0|1,0,1]=4 3351 B12R1.267 CCCOCC1CCCCC1=O 9b81379f43d6f65d7dc1849190a709dd [0,0,1,1,0,0|1,0,1]=4 3352 B12R1.271 C=C1CC1COCC/C=C\CC 134962a8a8800317fbc1b5e9c6003f3f [0,0,1,1,0,0|2,0,0]=4 3353 B12R1.272 O=CCCCCCCN1CCC1 bdf7f6605128f0bc3a603ed91b9d4c43 [0,0,1,1,0,0|1,0,1]=4 3354 B12R1.329 C=CCOC1CC/C=C/CCC1 3af04500642758c7161a97c645224107 [0,0,1,1,0,0|2,0,0]=4 3355 B12R1.329 C=CCOC1CC/C=C\CCC1 4e5c12cd7ca89c0c46f869eb29b6e86a [0,0,1,1,0,0|2,0,0]=4 3356 B12R1.329 C=CCOC1CCC=CCCC1 75751ab2a9f8c9930e85388820a1c222 [0,0,1,1,0,0|2,0,0]=4 3357 B12R1.329 C=CCO[C@@H]1CCC=CCCC1 0506c147d2d0831942a74b4378e37aad [0,0,1,1,0,0|2,0,0]=4 3358 B12R1.329 O=CCOC1CC/C=C/CCC1 0c330ecc6d9cb2adbf7446715e3a9b34 [0,0,1,1,0,0|1,0,0]=3 3359 B12R1.329 O=CCOC1CC/C=C\CCC1 c0406f9bdd391e24c6f0cb58104902f2 [0,0,1,1,0,0|1,0,0]=3 3360 B12R1.329 O=CCOC1CCC=CCCC1 f868a88fd56926199fc48ce6598bb37d [0,0,1,1,0,0|1,0,0]=3 3361 B12R1.329 O=CCO[C@@H]1CCC=CCCC1 918003b8256ea11ef03dcba71cd8dd53 [0,0,1,1,0,0|1,0,0]=3 3362 B12R1.375 C=CCCNCCCC=C1CC1 e93ce22496cd6750fdccaa19b3e3846a [0,0,1,1,0,0|2,0,0]=4 3363 B12R1.375 C=CCCOCCCC=C1CC1 b59ee07be5ae58fd6b26b36abaec132c [0,0,1,1,0,0|2,0,0]=4 3364 B12R1.375 O=CCCCCCCNC1CC1 fca59ffbec6eb25aa3d99b7fb86554e0 [0,0,1,1,0,0|1,0,1]=4 3365 B12R1.375 O=CCCCCCCOC1CC1 3970ec7453be3f7ad0b945fa6ddc8293 [0,0,1,1,0,0|1,0,1]=4 3366 B12R1.375 O=CCCOCCCC=C1CC1 712924c90ffe12e8dbb5b6d9f2e3bd5e [0,0,1,1,0,0|1,0,0]=3 3367 B12R1.454 CC/C=C/CCOC1CC1C=O a0e52042c320c27590fa1396c06973c6 [0,0,1,1,0,0|1,0,0]=3 3368 B12R1.454 CC/C=C\CCOC1CC1C=O 9cc45e69e4474bbd1c688af03358ff31 [0,0,1,1,0,0|1,0,0]=3 3369 B12R1.1414 C=CCCNC1CCC=CCC1 42d93117eda86d8166c9ea784c4f9846 [0,0,1,1,0,0|2,0,0]=4 3370 B12R1.1414 O=CCCNC1CCC=CCC1 24e3b2f3ee14706647e5383a90accc8b [0,0,1,1,0,0|1,0,0]=3 3371 B12R1.28 CC/C=C/CN1CCCC(=O)C1 ab6ba7f27b9c1721bb8000d415d741bf [0,0,1,1,0,0|1,0,0]=3 3372 B12R1.28 CC/C=C/CN1CCNC(=O)C1 e6e542650270909d2dc1197bf5fc7dec [0,0,1,1,0,0|2,0,0]=4 3373 B12R1.28 CC/C=C/CN1CCOC(=O)C1 d6adda8b0495ec2809df313fd91bc271 [0,0,1,1,0,0|2,0,0]=4 3374 B12R1.28 CCCOCC1CCCC(=O)C1 c6e6f3ef9305507b0c23e35e7961f245 [0,0,1,1,0,0|1,0,1]=4 3375 B12R1.32 CCCC(=O)CN1CC=CCC1 f32a8ba69cd95b1db8ab959ffa6ed515 [0,0,1,1,0,0|1,0,0]=3 3376 B12R1.32 CCCN(C)CC1CC=CCC1 d394c0bf5f50d5bccc3d305701fe387c [0,0,1,1,0,0|2,0,0]=4 3377 B12R1.32 CCNC(=O)CN1CC=CCC1 97a644e1d9155894f520ca051feeaf4c [0,0,1,1,0,0|2,0,0]=4 3378 B12R1.32 CCOC(=O)CN1CC=CCC1 5afbc2601051c957201bb2bf9efee672 [0,0,1,1,0,0|2,0,0]=4 3379 B12R1.69 CCCOC1CCC(=O)CC1C 89bf2ebc9c694040d723abd3742c1391 [0,0,1,1,0,0|1,0,1]=4 3380 B12R1.172 CCOC1CCCC(=O)CCC1 09769734fda33316df4cb84bd1d8e6bd [0,0,1,1,0,0|1,0,1]=4 3381 B12R1.310 CCCN(C)CCCC=C1CC1 41e05c40a1643e72deeec5be841319bc [0,0,1,1,0,0|2,0,0]=4 3382 B12R1.923 CC/C=C/COCC(=O)C1CC1 e09410851f4e6e3419534fa7138b53af [0,0,1,1,0,0|1,0,0]=3 3383 B12R1.923 CC/C=C\COCC(=O)C1CC1 30eceba5ae319b400efc8bd3faaf6d26 [0,0,1,1,0,0|1,0,0]=3 3384 B12R1.113 CCOC1CCC(CC1)C(=O)C 51a0189a73004747ff5aadb0934222e1 [0,0,1,1,0,0|1,0,1]=4 3385 B12R1.298 CCC(OC1C=CCC1)C(=O)N fcdeabf9b9229cf47db9cf23bcfdf07a [0,0,1,1,0,0|2,0,0]=4 3386 B12R1.298 CCC(OC1C=CCC1)C(=O)O ff91c6b3ccdbc861539a9a2032a4d0a4 [0,0,1,1,0,0|2,0,0]=4 3387 B12R1.298 CC[C@@H](OC1C=CCC1)C(=O)O 6aa700ad5e878d528f5b61a10d941d63 [0,0,1,1,0,0|2,0,0]=4 3388 B12R1.298 CC[C@H](OC1C=CCC1)C(=O)O 98f699efe90712f53c3dd38f336158dd [0,0,1,1,0,0|2,0,0]=4 3389 B12R1.478 CCC(C(=O)N)N1CC=CCC1 a10bdee28c33aa71861a7f9f57a8bc2c [0,0,1,1,0,0|2,0,0]=4 3390 B12R1.522 CC/C=C/CN1CCC1C(=O)N 8d31fc79a61f2b775b9a42d47778c771 [0,0,1,1,0,0|2,0,0]=4 3391 B12R1.522 CC/C=C/CN1CCC1C(=O)O a91ff38b151f43e23ce3e436c461b461 [0,0,1,1,0,0|2,0,0]=4 3392 B12R1.522 CC/C=C/CN1CC[C@@H]1C(=O)N 17ef8c1b92ea63dee96450b232f82648 [0,0,1,1,0,0|2,0,0]=4 3393 B12R1.522 CC/C=C/CN1CC[C@@H]1C(=O)O b867ecc335b4c28744febfd7c26a6db6 [0,0,1,1,0,0|2,0,0]=4 3394 B12R1.522 CC/C=C/CN1CC[C@H]1C(=O)N 194b8bf06c22f094463473a9fe656952 [0,0,1,1,0,0|2,0,0]=4 3395 B12R1.522 CC/C=C/CN1CC[C@H]1C(=O)O 282c45f041943a65d31663f70ad3d1d8 [0,0,1,1,0,0|2,0,0]=4 3396 B12R1.969 CC/C=C/CNC1(CC1)C(=O)N f5d7240d4d77b0589f997b7755890a27 [0,0,1,1,0,0|2,0,0]=4 3397 B12R1.969 CC/C=C/CNC1(CC1)C(=O)O 5111bab5fb3c9a5fe1e63378b2675bdd [0,0,1,1,0,0|2,0,0]=4 3398 B12R1.34 CCC(=O)C(C)N1CC=CCC1 d07d9cda27e5253385355bd1b64b9df5 [0,0,1,1,0,0|1,0,0]=3 3399 B12R1.34 CNC(=O)C(C)N1CC=CCC1 be1aa5b46d294fc92e5a284de5deec60 [0,0,1,1,0,0|2,0,0]=4 3400 B12R1.34 COC(=O)C(C)N1CC=CCC1 0fdfa843a1194823ac30fd2117c7526c [0,0,1,1,0,0|2,0,0]=4 3401 B12R1.34 COC(=O)[C@@H](C)N1CC=CCC1 f695444b358b3815f9993084802961c8 [0,0,1,1,0,0|2,0,0]=4 3402 B12R1.34 COC(=O)[C@H](C)N1CC=CCC1 599d0c5525cc0e7375f81554da16f3e4 [0,0,1,1,0,0|2,0,0]=4 3403 B12R1.108 CCC(=O)C(C)OC1C=CCC1 6e612edb8119ada2362568ea6efa5326 [0,0,1,1,0,0|1,0,0]=3 3404 B12R1.108 CNC(=O)C(C)OC1C=CCC1 b87a79b409749248f0396e0905e08f51 [0,0,1,1,0,0|2,0,0]=4 3405 B12R1.108 COC(=O)C(C)OC1C=CCC1 82b96a273a7994d0f8ea6f58da508b10 [0,0,1,1,0,0|2,0,0]=4 3406 B12R1.108 COC(=O)[C@@H](C)OC1C=CCC1 8dbe7eadb96ae54851d817a60dc72450 [0,0,1,1,0,0|2,0,0]=4 3407 B12R1.108 COC(=O)[C@H](C)OC1C=CCC1 f2a5dcd9776c8dd58f068426567cb9fb [0,0,1,1,0,0|2,0,0]=4 3408 B12R1.385 CCCOC1CCC(=O)C(C1)C d3f634ebf55f19a1b5154c99c19e7f51 [0,0,1,1,0,0|1,0,1]=4 3409 B12R1.435 CCC(=O)C1CCCN(C1)CC 8b4d25d350d951a836375d1fbe22a9b4 [0,0,1,1,0,0|1,0,1]=4 3410 B12R1.1412 CC/C=C/CN1CC1C(=O)OC 497e280f00cbdfcc9e62ce6bb63eaa18 [0,0,1,1,0,0|2,0,0]=4 3411 B12R1.1412 CC/C=C/CN1C[C@H]1C(=O)OC 20239950c18b712d848daacfa5726b92 [0,0,1,1,0,0|2,0,0]=4 3412 B12R1.1659 CCN(C)C1CC/C=C\CCC1 ed25f4a2ec733832a90a918791c2768b [0,0,1,1,0,0|2,0,0]=4 3413 B12R2.2 C1=CCN(CC1)C2CCCC2 ca26c8bb0b18311683259c93f686c75d [1,0,0,1,0,0|1,0,1]=4 3414 B12R2.98 C1=CC(CC1)OC2CCCC2 78d5d5433572c990f417aa2ece025719 [1,0,0,1,0,0|1,0,1]=4 3415 B12R2.1435 CC/C=C/CN1C2C1CCC2 d3c3e02ec41037479bc31145a6a3df67 [1,0,0,1,0,0|1,0,1]=4 3416 B12R2.211 CC1CC1NC2CCCC2=O b1718f56400c899a6bb903b7f48650eb [1,0,0,1,0,0|1,0,1]=4 3417 B12R2.466 O=C1CCCC1COC2CC2 26b53b3921d2fc61ed7231502e4e2b78 [1,0,0,1,0,0|1,0,1]=4 3418 B12R2.466 O=C1CCCC1NCC2CC2 af06d642c64f5a67e00da07a33cffe39 [1,0,0,1,0,0|1,0,1]=4 3419 B12R2.466 O=C1CCCC1OCC2CC2 4da69ee00cb161d0484b37b7dcf74339 [1,0,0,1,0,0|1,0,1]=4 3420 B12R2.1298 O=C1CCC1CCNC2CC2 df152a1ce0c08c90b166603ca26c9da6 [0,0,0,1,1,0|1,0,1]=4 3421 B12R2.1298 O=C1CCC1CCOC2CC2 3d4fe906ff74cda1c466b170cedaeee9 [0,0,0,1,1,0|1,0,1]=4 3422 B12R2.1310 O=C1CCC1CCN2CCC2 89c0ceee9bf60480d28bc9df415c00cf [0,0,0,1,1,0|1,0,1]=4 3423 B14R2.7 CCCN1CCC2C1CCNC2=O c53e7a789418d28752d544618d8414e9 [0,0,0,1,0,1|1,0,1]=4 3424 B14R2.24 O=C1CCCSC1N2CC=CCC2 fc5c123824112290a264a184deedd6a4 [0,0,0,1,0,1|1,0,0]=3 3425 B14R2.24 O=C1CCOCC1N2CC=CCC2 8b730d9456d93525d77f71db0a0390ab [0,0,0,1,0,1|1,0,0]=3 3426 B14R2.50 O=C1CCCSC1OC2C=CCC2 5c5d7dbb489683c8697d3fc4b005dc4a [0,0,0,1,0,1|1,0,0]=3 3427 B14R2.50 O=C1CCOCC1OC2C=CCC2 f30b9c05bf0e8b805f12045c5c719a85 [0,0,0,1,0,1|1,0,0]=3 3428 B14R2.167 CCN1CCCC12CCCNC2=O 2bec8b73dd8b2b68d6db972e651c6d74 [0,0,0,1,0,1|1,0,1]=4 3429 B14R2.170 CCC1CCCN1C2CCCC2=O e6706a9e8dd5bf1b7cc2a9fc5a53536c [0,1,0,1,0,0|0,0,2]=4 3430 B14R2.170 CC[C@@H]1CCCN1C2CCCC2=O e3f88f9c905afc182d8e74ce3797f0af [0,1,0,1,0,0|0,0,2]=4 3431 B14R2.259 O=C1CCCC1N[C@@H]2C=C[C@@H](C2)O 9c7dc2baad5c1a426bb1f08ee1ba5e02 [0,1,0,1,0,0|1,0,0]=3 3432 B14R2.259 O=C1CCCC1N[C@H]2C=C[C@H](C2)O c0950f2e2207eb451730cdd8e22fd50f [0,1,0,1,0,0|1,0,0]=3 3433 B14R2.259 O=C1NCCC1N[C@@H]2C=C[C@@H](C2)O 91482d867e58312527bb81eb14c9d071 [0,1,0,1,0,0|2,0,0]=4 3434 B14R2.259 O=C1NCCC1N[C@H]2C=C[C@H](C2)O 8c0ca8e8f0460dbb77dca8ad2de9d10d [0,1,0,1,0,0|2,0,0]=4 3435 B14R2.4734 O=C1CCCC1COCCC2CC2 52f7fbbd2fd91f1149a4b40d98701c59 [0,1,0,1,0,0|0,0,2]=4 3436 B14R2.4734 O=C1CCCC1NCCOC2CC2 643e4d7794a2fcfd892ea45e938db330 [0,1,0,1,0,0|1,0,1]=4 3437 B14R2.4734 O=C1CCCC1OC/C=C/C2CC2 7d951af879daf2f8c9889fb710fe07b2 [0,1,0,1,0,0|1,0,0]=3 3438 B14R2.4734 O=C1CCCC1OCCCC2CC2 a47591f216156a34de2e6b1996410750 [0,1,0,1,0,0|0,0,2]=4 3439 B14R2.4734 O=C1CCCC1OCCOC2CC2 b080e02de87b40845df54bee32cf0456 [0,1,0,1,0,0|1,0,1]=4 3440 B14R2.4734 O=C1NCCC1OC/C=C/C2CC2 35f7e0d95a57afed0924203de7b70c4f [0,1,0,1,0,0|2,0,0]=4 3441 B14R2.598 CC1CC(C(=O)O1)N2CC=CCC2 d8a413092c767e1e2d87e3edebb28424 [0,1,0,1,0,0|2,0,0]=4 3442 B14R2.3319 CC/C=C/CN1CC2CC1C(=O)N2 57ac93c068f72ebe5fb2eaf8816fb063 [0,1,0,1,0,0|2,0,0]=4 3443 B14R2.3319 CC/C=C/CN1C[C@@H]2C[C@H]1C(=O)N2 a341e7c20dde2fd06c5d76760f823d00 [0,1,0,1,0,0|2,0,0]=4 3444 B14R2.3319 CC/C=C/CN1C[C@H]2C[C@@H]1C(=O)N2 159d707271d220416c3f795f0547edd6 [0,1,0,1,0,0|2,0,0]=4 3445 B14R2.4458 CC1CC(C(=O)O1)OC2C=CCC2 f613afd4e840a71adbd3718d79902f66 [0,1,0,1,0,0|2,0,0]=4 3446 B14R2.309 CC1CCCC1OC2CCCC2=O 1f4f9d9c7168126a8ef14e0df016f316 [0,1,0,1,0,0|0,0,2]=4 3447 B14R2.309 CC1COCC1OC2CCCC2=O 9d5fe0097cf53a2801858e960f6067e7 [0,1,0,1,0,0|1,0,1]=4 3448 B14R2.309 C[C@@H]1CCC[C@@H]1OC2CCCC2=O 0135186b66199f8039e3a731e5dbbc64 [0,1,0,1,0,0|0,0,2]=4 3449 B14R2.309 C[C@@H]1CCC[C@H]1OC2CCCC2=O 242f2c25c2d52609a05781b4745a2365 [0,1,0,1,0,0|0,0,2]=4 3450 B14R2.309 C[C@@H]1COC[C@@H]1OC2CCCC2=O 1a70713db6a7c56ae333aa0e1f94b239 [0,1,0,1,0,0|1,0,1]=4 3451 B14R2.309 C[C@H]1CCC[C@@H]1OC2CCCC2=O 463db05006d6e0cd6808ba52db12d7b4 [0,1,0,1,0,0|0,0,2]=4 3452 B14R2.309 C[C@H]1CCC[C@H]1OC2CCCC2=O bd4e55b973227d384ab68be4bcf921f2 [0,1,0,1,0,0|0,0,2]=4 3453 B14R2.309 C[C@H]1COC[C@@H]1OC2CCCC2=O 00c0342dcdd54aa4df05329c1cd8e425 [0,1,0,1,0,0|1,0,1]=4 3454 B14R2.309 C[C@H]1COC[C@H]1OC2CCCC2=O e142768970129a1c33a3b762aa5f9be5 [0,1,0,1,0,0|1,0,1]=4 3455 B14R2.309 O=C1CCCC1NC2CCNC2=O 56d824f302147da7d44db4d0063117fa [0,1,0,1,0,0|2,0,0]=4 3456 B14R2.309 O=C1CCCC1N[C@@H]2CCNC2=O 573d7f5da31ecab432a4df18af5747b6 [0,1,0,1,0,0|2,0,0]=4 3457 B14R2.309 O=C1CCCC1N[C@H]2CCNC2=O c04f85683327c853773acdb6709e4b07 [0,1,0,1,0,0|2,0,0]=4 3458 B14R2.384 O=C1CCCC1COC2CCCC2 7c3add931d14f9d7264339fa36df8ccf [0,1,0,1,0,0|0,0,2]=4 3459 B14R2.384 O=C1CCCC1NCC2CC=CC2 5e198a1dc3ff069fa80a042edb489f19 [0,1,0,1,0,0|0,0,2]=4 3460 B14R2.384 O=C1CCCC1NCC2CCCC2 ebdd817d5123096ca43d8041131d8183 [0,1,0,1,0,0|0,0,2]=4 3461 B14R2.384 O=C1CCCC1NCC2CCCO2 8b31f064418bec0d54840aeaea5af144 [0,1,0,1,0,0|1,0,1]=4 3462 B14R2.384 O=C1CCCC1NCC2CCOC2 773895faff105ef02ad1cff5f9f8ebce [0,1,0,1,0,0|1,0,1]=4 3463 B14R2.384 O=C1CCCC1NC[C@@H]2CCCO2 0a88028d143defe5d2c7a91c83d0000d [0,1,0,1,0,0|1,0,1]=4 3464 B14R2.384 O=C1CCCC1NC[C@@H]2CCOC2 d5f6ab81995cc5dc8620649e5879273a [0,1,0,1,0,0|1,0,1]=4 3465 B14R2.384 O=C1CCCC1NC[C@H]2CCCO2 42896dc4684289395a4cdb1ef6e205c6 [0,1,0,1,0,0|1,0,1]=4 3466 B14R2.384 O=C1CCCC1NC[C@H]2CCOC2 f39332cb3566ae791c31c5b1faa64fd2 [0,1,0,1,0,0|1,0,1]=4 3467 B14R2.384 O=C1CCCC1OCC2C=CCC2 2d5c7de82b902aa284ca48e784ca2abd [0,1,0,1,0,0|0,0,0]=2 3468 B14R2.384 O=C1CCCC1OCC2CC=CC2 7dd96db5cb65b815c45239ec3ee35f2d [0,1,0,1,0,0|0,0,2]=4 3469 B14R2.384 O=C1CCCC1OCC2CCCC2 01aa4deef70c63234f33b842e1ca30c0 [0,1,0,1,0,0|0,0,2]=4 3470 B14R2.384 O=C1CCCC1OCC2CCCO2 a50af2b0a9ccbceff34a0ff3da334104 [0,1,0,1,0,0|1,0,1]=4 3471 B14R2.384 O=C1CCCC1OCC2CCOC2 e3fa6840e4fa4c4f9c3175b3be0e38ce [0,1,0,1,0,0|1,0,1]=4 3472 B14R2.384 O=C1CCCC1OC[C@@H]2CCCO2 6da10b760df0f63e2a03daa7ba018a87 [0,1,0,1,0,0|1,0,1]=4 3473 B14R2.384 O=C1CCCC1OC[C@@H]2CCOC2 336f95016dfe46a43c15a3a6a5ebfe55 [0,1,0,1,0,0|1,0,1]=4 3474 B14R2.384 O=C1CCCC1OC[C@H]2CCCO2 87fc2ea45d857eff4e1b9376e83bf09c [0,1,0,1,0,0|1,0,1]=4 3475 B14R2.384 O=C1CCCC1OC[C@H]2CCOC2 2cbc891a8c25deae396fccaaa676ddb6 [0,1,0,1,0,0|1,0,1]=4 3476 B14R2.384 O=C1CCCN1COC2C=CCC2 bd9ad8ce609d5722c4642c26614da3e5 [0,1,0,1,0,0|1,0,0]=3 3477 B14R2.384 O=C1NCCC1NCC2=CCCC2 9d4b25fb538ad308c6dca04ca00006b7 [0,1,0,1,0,0|2,0,0]=4 3478 B14R2.384 O=C1NCCC1OCC2C=CCC2 7072aadee1f10f11f599727a73669a03 [0,1,0,1,0,0|1,0,0]=3 3479 B14R2.384 O=C1NCC[C@@H]1NCC2=CCCC2 1c211066c289bbfd393c481044d13e21 [0,1,0,1,0,0|2,0,0]=4 3480 B14R2.384 O=C1NCC[C@H]1NCC2=CCCC2 43698bd6397ef1d7dec0dcb04c11cd4d [0,1,0,1,0,0|2,0,0]=4 3481 B14R2.384 O=C1OCC[C@@H]1NCC2=CCCC2 7886de5a70f094492b0355392c3ba694 [0,1,0,1,0,0|2,0,0]=4 3482 B14R2.384 O=C1OCC[C@H]1NCC2=CCCC2 fe5b165e9ce500307ddb29c03b8c2af8 [0,1,0,1,0,0|2,0,0]=4 3483 B14R2.384 O=C1SCCC1NCC2=CCCC2 5ff09a34403230830739202dc5fe6697 [0,1,0,1,0,0|2,0,0]=4 3484 B14R2.4730 O=C(COC1CCCC1=O)C2CC2 15a2126b4e102184eea6f259eda9c299 [0,1,0,1,0,0|1,0,1]=4 3485 B14R2.926 O=C1CCCC1N2CC=C(CC2)Br 50f5b28162625339830964cae0cda4e6 [0,1,0,1,0,0|1,0,0]=3 3486 B14R2.926 O=C1NCCC1N2CC=C(CC2)Br 675ec2bf0b3be718b1153af6988f27aa [0,1,0,1,0,0|2,0,0]=4 3487 B14R2.5216 O=C1CCCC1COCC2CCC2 5db58bdf3665660036ec507a404322f4 [0,1,0,1,0,0|0,0,2]=4 3488 B14R2.5216 O=C1CCCC1COCC2CCO2 81cc278dfc49757e87ff65a89b60aca5 [0,1,0,1,0,0|1,0,1]=4 3489 B14R2.5216 O=C1CCCC1COC[C@@H]2CCO2 cbf94dae3444da4765d743ee7ba0f23f [0,1,0,1,0,0|1,0,1]=4 3490 B14R2.5216 O=C1CCCC1COC[C@H]2CCO2 c23a3920a184bb715db6350987805ef7 [0,1,0,1,0,0|1,0,1]=4 3491 B14R2.5216 O=C1CCCC1NCCC2CCO2 4e7eaa87d5724edb84669da4d404169d [0,1,0,1,0,0|1,0,1]=4 3492 B14R2.5216 O=C1CCCC1NCCN2CCC2 6643e42dec61953296dc76535959c055 [0,1,0,1,0,0|1,0,1]=4 3493 B14R2.5216 O=C1CCCC1NCC[C@@H]2CCO2 8a5eb9ef5de1d3cac0ea261d53b4db67 [0,1,0,1,0,0|1,0,1]=4 3494 B14R2.5216 O=C1CCCC1OCCC2CCC2 56110e3d0fe1e61f271308ff2cff2eb3 [0,1,0,1,0,0|0,0,2]=4 3495 B14R2.5216 O=C1CCCC1OCCC2CCO2 1331ea53828f4aa7a7504b7bfc152a59 [0,1,0,1,0,0|1,0,1]=4 3496 B14R2.5216 O=C1CCCC1OCCN2CCC2 bb0fc322f91d52b888b910894f9e710c [0,1,0,1,0,0|1,0,1]=4 3497 B14R2.5216 O=C1CCCC1OCC[C@@H]2CCO2 f4259c53c28910f672a88a92a537b9fb [0,1,0,1,0,0|1,0,1]=4 3498 B14R2.5216 O=C1CCCC1OCC[C@H]2CCO2 5522f7dd32bca7856d33ec3032a49f3e [0,1,0,1,0,0|1,0,1]=4 3499 B14R2.30 O=C1CCCC1NC2C=CCCC2 af2efc800cd45736dc5229d0690fa327 [0,1,0,1,0,0|1,0,0]=3 3500 B14R2.30 O=C1CCCC1NC2CCCOC2 5082a3f51119d92159c5da7062e76994 [0,1,0,1,0,0|1,0,1]=4 3501 B14R2.30 O=C1CCCC1NC2CCOCC2 ed948b88a75a2ee28af9a5c7db8754ae [0,1,0,1,0,0|1,0,1]=4 3502 B14R2.30 O=C1CCCC1N[C@@H]2CCCOC2 0517286bf21c6b7a7a80a0541491e8f5 [0,1,0,1,0,0|1,0,1]=4 3503 B14R2.30 O=C1CCCC1N[C@H]2CCCOC2 c37de2a09a0ee420cfdfb905311c6c92 [0,1,0,1,0,0|1,0,1]=4 3504 B14R2.30 O=C1CCCC1OC2C=CCCC2 080de73dcf72bba82a24e8497cf4fd90 [0,1,0,1,0,0|1,0,0]=3 3505 B14R2.30 O=C1CCCC1OC2CCCCC2 8bc35678a7982ab9a181de1b7d6c8612 [0,1,0,1,0,0|0,0,2]=4 3506 B14R2.30 O=C1CCCN1CN2CC=CCC2 52b1a1ce44a0831f2501859646ccfc10 [0,1,0,1,0,0|1,0,0]=3 3507 B14R2.30 O=C1NCCC1NC2C=CCCC2 300889a2c43c385c81e13a5ca9f72a49 [0,1,0,1,0,0|2,0,0]=4 3508 B14R2.30 O=C1NCCC1OC2C=CCCC2 051aa1b5fed3206aa6d21e246e906766 [0,1,0,1,0,0|2,0,0]=4 3509 B14R2.30 O=C1NCCC1OC2CC=CCC2 8be299410bc60b0a03d5aaec1d973919 [0,1,0,1,0,0|1,0,0]=3 3510 B14R2.30 O=C1NCC[C@@H]1NC2C=CCCC2 cf9bca6ba7dc2912685be5721d625ac9 [0,1,0,1,0,0|2,0,0]=4 3511 B14R2.30 O=C1NCC[C@@H]1OC2C=CCCC2 875a43f2c2d7ab8995803b51a2f17627 [0,1,0,1,0,0|2,0,0]=4 3512 B14R2.30 O=C1NCC[C@H]1NC2C=CCCC2 fd001fbd4480a4af5bbed7a2c425bdbe [0,1,0,1,0,0|2,0,0]=4 3513 B14R2.30 O=C1NCC[C@H]1OC2C=CCCC2 13521273bb3ddc052965fbde9bb898d3 [0,1,0,1,0,0|2,0,0]=4 3514 B14R2.30 O=C1OCCC1OC2C=CCCC2 0298b19805bba8178df256bbcac0b6e7 [0,1,0,1,0,0|2,0,0]=4 3515 B14R2.30 O=C1OCC[C@@H]1NC2C=CCCC2 5620a3ac365f83d76fe81b5ffd359633 [0,1,0,1,0,0|2,0,0]=4 3516 B14R2.30 O=C1OCC[C@@H]1OC2C=CCCC2 5d364e3a050572576be2c434d2f938d1 [0,1,0,1,0,0|2,0,0]=4 3517 B14R2.30 O=C1OCC[C@H]1NC2C=CCCC2 68ca841829f88c17fc98f4530265ab2e [0,1,0,1,0,0|2,0,0]=4 3518 B14R2.30 O=C1OCC[C@H]1OC2C=CCCC2 af397f0004a26932b249b4ca1bbae7f0 [0,1,0,1,0,0|2,0,0]=4 3519 B14R2.30 O=C1SCCC1NC2C=CCCC2 5e15ae472e536de4aeaa30e1ea242565 [0,1,0,1,0,0|2,0,0]=4 3520 B14R2.144 CC/C=C/CN1CC2CCCC2C1 8b95667fd7e90c235cff4c684fd98e63 [0,1,0,1,0,0|1,0,1]=4 3521 B14R2.144 CC/C=C/CN1C[C@H]2CCC[C@H]2C1 92f94d3c4188794284bc1c83e53c1a69 [0,1,0,1,0,0|1,0,1]=4 3522 B14R2.3314 CC/C=C/CN1CC2CC1CC2O 376d2654676abbaa6f8c1d7fafe60ac2 [0,1,0,1,0,0|0,0,2]=4 3523 B14R2.3314 CC/C=C/CN1CC2C[C@@H]1C[C@@H]2O b0c03348557bb56a29c297f0d85bdbea [0,1,0,1,0,0|0,0,2]=4 3524 B14R2.3314 CC/C=C/CN1C[C@H]2C[C@@H]1CN2C e2dab4327b638bc8c211e82777ee4079 [0,1,0,1,0,0|2,0,0]=4 3525 B14R2.5202 O=C1CCCC1N2CCCCCC2 4b1a74bae6b80b2cc5615bf11ff99f74 [0,1,0,1,0,0|0,0,2]=4 3526 B14R2.5202 O=C1CCCC1N2CCCOCC2 37eacac9b2204a344d06e82b8823a780 [0,1,0,1,0,0|1,0,1]=4 3527 B14R2.10909 CC/C=C\CCN1CC2C1CCC2 5db7256dad5536d6ab3c67afe80fd956 [0,1,0,1,0,0|1,0,1]=4 3528 B14R2.10909 CC/C=C\CCN1C[C@H]2[C@@H]1CCC2 046afc3d41c0adee6cb2a01c7740530c [0,1,0,1,0,0|1,0,1]=4 3529 B14R2.13702 CC/C=C\CCOC1CCC2C1C2 6d7f73b6815f1602710b31c0451c7cc0 [0,1,0,1,0,0|1,0,1]=4 3530 B14R2.13702 CC/C=C\CCO[C@@H]1CC[C@@H]2[C@H]1C2 0cb50963e5410f16560064c2a43eb711 [0,1,0,1,0,0|1,0,1]=4 3531 B14R2.277 O=C1CCC(=O)C1N2CC=CCC2 be0f670996f151027bd6a1e41dc30efc [0,1,0,1,0,0|1,0,1]=4 3532 B10R1.57 CC/C=C/CNC1CCC1 647899b3f60d2c488d7d14b884b2ccde [1,0,0,0,1,0|1,0,0]=3 3533 B10R1.57 CC/C=C/CNC1COC1 967a09a20daae2e9bbd999cc363e7ef2 [1,0,0,0,1,0|2,0,0]=4 3534 B10R1.57 CC/C=C/COC1CCC1 36bd1641cd61452c2ab055ec224ed67c [1,0,0,0,1,0|1,0,0]=3 3535 B10R1.57 CC/C=C/COC1COC1 8f96e0798f28460aaec4fac3fd7c9467 [1,0,0,0,1,0|2,0,0]=4 3536 B10R1.57 CC/C=C/COC1CSC1 099655c221ac342f872e33e5cb58e342 [1,0,0,0,1,0|2,0,0]=4 3537 B10R1.57 CC/C=C\CCN1CCC1 8647b96f2eb2091e85676f9a60b280cf [1,0,0,0,1,0|1,0,0]=3 3538 B10R1.57 CC/C=C\COC1CCC1 539524658e0dd3706e704c0ee1eaf59e [1,0,0,0,1,0|1,0,0]=3 3539 B10R1.57 CC/C=C\COC1COC1 f64878263fff02014c20d54d2cfafb5d [1,0,0,0,1,0|2,0,0]=4 3540 B10R1.57 CCCNCCC1CCC1 821cbc3d0f3452bcc144b54501230d23 [1,0,0,0,1,0|1,0,1]=4 3541 B10R1.57 CCCOCCC1CCC1 27d4ec58adb426de0fb4e6f9d28b96df [1,0,0,0,1,0|1,0,1]=4 3542 B10R1.57 CCOCCCC1CCC1 d2f285fc197ea2fdbb7201ce207242e8 [1,0,0,0,1,0|1,0,1]=4 3543 B10R1.37 C/C=C/CN[C@H]1CNC1=O 0c6b0a44a3537316d2e9992e83d90d90 [1,0,0,0,1,0|2,0,0]=4 3544 B10R1.37 C/C=C/COC1CCC1=O 3d6e72a39504c63df9605e6dc59db957 [1,0,0,0,1,0|1,0,0]=3 3545 B10R1.37 C/C=C\CN[C@H]1CNC1=O 73268a16ae22e54476d092af1ebc8a52 [1,0,0,0,1,0|2,0,0]=4 3546 B10R1.37 C/C=C\COC1CCC1=O fea7d1e18eb0273c9afa140bffa70c2f [1,0,0,0,1,0|1,0,0]=3 3547 B10R1.37 CC=CCNC1CCC1=O c0e3ee94fecd37031af101847d20611f [1,0,0,0,1,0|1,0,0]=3 3548 B10R1.37 CCCCOC1CCC1=O 54fa09992c0cf82b2f331559841e5a88 [1,0,0,0,1,0|1,0,1]=4 3549 B10R1.37 CCCOCC1CCC1=O 19da4a17dced4d587116c3b122806666 [1,0,0,0,1,0|1,0,1]=4 3550 B10R1.37 CCOCCC1CCC1=O fecdaedd24e92cffd0bcb6852fce52db [1,0,0,0,1,0|1,0,0]=3 3551 B10R1.37 O=C1CCC1CCOCF eefe37d992b14a69b39d5bb922907a55 [1,0,0,0,1,0|2,0,0]=4 3552 B10R1.37 O=C1CCC1OC/C=C/Cl 78646858216d98ac55f21860bd6ea74d [1,0,0,0,1,0|2,0,0]=4 3553 B10R1.37 O=C1CCC1OC/C=C\Cl 222247de9bd329ee407a20f93b1f2061 [1,0,0,0,1,0|2,0,0]=4 3554 B12R0.113 CC/C=C/CNC(C)CC(=O)OC 952700a6062153d4963ba3a55b6824ed [0,0,1,0,0,1|2,0,0]=4 3555 B12R0.113 CC/C=C/CN[C@@H](C)CC(=O)OC 9e38e465e19bb93d526aa35db2081987 [0,0,1,0,0,1|2,0,0]=4 3556 B12R0.113 CC/C=C/CN[C@H](C)CC(=O)OC b2577fc99dd52239235eadded50ffbad [0,0,1,0,0,1|2,0,0]=4 3557 B12R0.113 CC/C=C/CO/C(=C/C(=O)CC)/C 3f08f4a5cc32aec85151a4371ab14a84 [0,0,1,0,0,1|1,0,1]=4 3558 B12R0.113 CC/C=C/COC(C)CC(=O)OC 1763923acdcdd730f5d373fc71d69bb2 [0,0,1,0,0,1|2,0,0]=4 3559 B12R0.113 CC/C=C/COC(C)OC(=O)OC 5a5470400c3e9395b4e2e8765f23fe8a [0,0,1,0,0,1|2,0,0]=4 3560 B12R0.113 CC/C=C/CO[C@@H](C)CC(=O)OC 2ccf94df0480beb0b469413ed4c9e661 [0,0,1,0,0,1|2,0,0]=4 3561 B12R0.113 CC/C=C/CO[C@H](C)CC(=O)OC 14c1b265e7b9c1cde6c01e91ec25e124 [0,0,1,0,0,1|2,0,0]=4 3562 B12R0.113 CC/C=C\CCN(C)CC(=O)NC a0dab7da1dfdc3d5fbdc2994c16c176e [0,0,1,0,0,1|2,0,0]=4 3563 B12R0.113 CC/C=C\CCN(C)CC(=O)OC 3d5f51fb054716b142bd2ae601d185ac [0,0,1,0,0,1|2,0,0]=4 3564 B12R0.113 CC/C=C\COC(C)CC(=O)OC a8c969f50d4a397bfce3a3bcfc9ad8f9 [0,0,1,0,0,1|2,0,0]=4 3565 B12R0.113 CC/C=C\COC(C)OC(=O)OC 155a7ed860943b1e7261d8b5cab83181 [0,0,1,0,0,1|2,0,0]=4 3566 B12R0.113 CC/C=C\CO[C@@H](C)CC(=O)OC 9d70e3fe70f13be18a83b881220fe5eb [0,0,1,0,0,1|2,0,0]=4 3567 B12R0.113 CCCCCCC(C)NC(=O)CC 7a9035c65767e5ae37e7e9206ed97104 [0,0,1,0,0,1|0,0,2]=4 3568 B12R0.113 CCCCCC[C@@H](C)NC(=O)CC d9d8e9dc8d62f30d87e5300c1c7c8b84 [0,0,1,0,0,1|0,0,2]=4 3569 B12R0.113 CCCCCC[C@H](C)NC(=O)CC 3f076e7a8a8156473b72acf89d536884 [0,0,1,0,0,1|0,0,2]=4 3570 B14R1.1252 CC/C=C/COC1CCCNC(=O)C1 e2ec52ad35ddf940440838e0470511d9 [0,0,0,0,0,2|1,0,0]=3 3571 B14R1.1252 CC/C=C\CCN1CCCNC(=O)C1 3ea06a1b9263ca413e4342d9454b3bb6 [0,0,0,0,0,2|1,0,0]=3 3572 B14R1.1253 CC/C=C/COC1CCCC(=O)NC1 8e6dbfb1e24f32cf1269a6e32b0f90f4 [0,0,0,0,0,2|1,0,0]=3 3573 B14R1.1253 CC/C=C\CCN1CCCC(=O)CC1 0d6776584be00c13a22f974b6873a7fa [0,0,0,0,0,2|1,0,0]=3 3574 B14R1.1253 CC/C=C\CCN1CCNC(=O)CC1 fe04273a82f06d2e0fb30ada10b744c8 [0,0,0,0,0,2|2,0,0]=4 3575 B14R1.138 CC/C=C/CNC1CCCCNC1=O 6faa669a3d83449a5a6acfde4ab8b7f4 [0,0,0,0,0,2|1,0,0]=3 3576 B14R1.138 CC/C=C/CN[C@@H]1CCCCNC1=O e6220b77ab79631a77b93a9cfb561796 [0,0,0,0,0,2|1,0,0]=3 3577 B14R1.138 CC/C=C/CN[C@H]1CCCCNC1=O 8e52c4efb308d0a80c2c9a860903e0ed [0,0,0,0,0,2|1,0,0]=3 3578 B14R1.138 CC/C=C/COC1CCCCCC1=O a8d41c0d81344f78e5bc8e7ecbc417d5 [0,0,0,0,0,2|1,0,0]=3 3579 B14R1.138 CC/C=C/COC1CCCCNC1=O 5b24e044cc765f4a795d87b0c287c646 [0,0,0,0,0,2|1,0,0]=3 3580 B14R1.138 CC/C=C\COC1CCCCCC1=O 3437fd7be7694a9021b71c7fec5a99fa [0,0,0,0,0,2|1,0,0]=3 3581 B14R1.138 CC/C=C\COC1CCCCNC1=O 88cacb779e18c0dfbbe0b57085f61ae9 [0,0,0,0,0,2|1,0,0]=3