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CCCC(O)CNCC(C)C 47f20c9bbfb361ad218218d59c54d1a3 [0,0,0,0,0,0|2,0,2]=4 129 B10R0.3 CCCC(S)CCOC(C)C 45310407b443e0af809922b6ea18317c [0,0,0,0,0,0|2,1,1]=4 130 B10R0.3 CCCN(C)CCCC(C)C 231f713b6c52f6022e12909a8f96d55f [0,0,0,0,0,0|3,0,0]=3 131 B10R0.3 CCCN(C)CCCC(C)O bcb8921018679fc023b0f411f18b9d7c [0,0,0,0,0,0|4,0,0]=4 132 B10R0.3 CCCN(C)CCCN(C)C 5b55dc3bded30773038a487e8329a6c6 [0,0,0,0,0,0|4,0,0]=4 133 B10R0.3 CCCN(C)CCOC(C)C 22e431f8aea1ea8e7e397964c3f8d6ea [0,0,0,0,0,0|4,0,0]=4 134 B10R0.3 CCCN(C)CCSC(C)C 78dbce056a5d075f2f90125942730175 [0,0,0,0,0,0|4,0,0]=4 135 B10R0.3 CCC[C@@H](C)OCC=C(C)C 645e46d2cdf27930cced2d07b4bca084 [0,0,0,0,0,0|1,0,3]=4 136 B10R0.3 CCC[C@@H](C)OCCC(=O)C b51690e8ce68e4f5d29359acf4cf0109 [0,0,0,0,0,0|2,0,2]=4 137 B10R0.3 CCC[C@@H](C)OCCC(C)C b998b137f877d71ecbf36c6f61cda26a [0,0,0,0,0,0|1,0,1]=2 138 B10R0.3 CCC[C@@H](C)OCCN(C)C 8007454e03dde6f789301ded080d0af0 [0,0,0,0,0,0|2,0,1]=3 139 B10R0.3 CCC[C@@H](C)OCCS(=O)C f9bb399bee303e684dedf50f3260f208 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CCNC(=O)CCOC(C)C 821bc8f07bf1880dd7da04556bcfbaf2 [0,0,0,0,0,0|3,0,0]=3 152 B10R0.3 CCNC(=O)CNCC(C)C 236a1dc2f39f6d2f2711bee31bfb3249 [0,0,0,0,0,0|3,0,0]=3 153 B10R0.3 CCNC(=O)CNCC(C)O e21af5259da2cfb7fc72229a4c4516b5 [0,0,0,0,0,0|4,0,0]=4 154 B10R0.3 CCNC(=O)CNCN(C)C 6eb0a8880e4b2d1b37d33af7fe5d714e [0,0,0,0,0,0|4,0,0]=4 155 B10R0.3 CCNC(=O)CNC[C@@H](C)O 04653aa517250896ac8cf6b868382bcb [0,0,0,0,0,0|4,0,0]=4 156 B10R0.3 CCNC(=O)CNC[C@H](C)O 7853dfa602206c37a162c6e10909c3d8 [0,0,0,0,0,0|4,0,0]=4 157 B10R0.3 CCNC(=O)COCC(C)C 477acbeb8cc8b25b59d08131b680a641 [0,0,0,0,0,0|3,0,0]=3 158 B10R0.3 CCNC(=O)COCC(C)F 374d7c352cb50b30398c39442f2e4485 [0,0,0,0,0,0|4,0,0]=4 159 B10R0.3 CCNC(=O)COCC(C)S 964e1b380e75a15b4fb448fe2f72c881 [0,0,0,0,0,0|4,0,0]=4 160 B10R0.3 CCNC(=O)COCN(C)C 7749a620798acfda5beb4902a8b55ba6 [0,0,0,0,0,0|4,0,0]=4 161 B10R0.3 CCNC(=O)COC[C@@H](C)F 06000575131b5913a91d77797270508c [0,0,0,0,0,0|4,0,0]=4 162 B10R0.3 CCNC(=O)COC[C@H](C)F e737da41a92e48fcf0ae5a5998cfbb86 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81abee8c0fa27e130ae9ee7dc8f00568 [0,0,0,0,0,0|3,0,1]=4 210 B10R0.3 COC[C@H](C)NCCC(C)C e22e69505d63c538145a1de2d8df3655 [0,0,0,0,0,0|3,0,1]=4 211 B10R0.3 COC[C@H](C)OCCC(C)C d600987725da0c0e20a71f2a4e4ebdfc [0,0,0,0,0,0|2,0,1]=3 212 B10R0.3 COC[C@H](C)OCCN(C)C eef6a9ef85a0099eb45623063f71b202 [0,0,0,0,0,0|3,0,1]=4 213 B10R0.3 COC[C@H](C)OCOC(C)C 00df89da00be4f1e3f8ca17f561b1c24 [0,0,0,0,0,0|3,0,1]=4 214 B10R0.3 CS(=O)CCNC(=O)CCF bef302c91022ada6129ed6b659fe278c [0,0,0,0,0,0|4,0,0]=4 215 B10R0.3 CS(=O)CCNC(=O)CCO 556ce695f88257e437c5e104644fdeca [0,0,0,0,0,0|4,0,0]=4 216 B10R0.3 CS(=O)CCNC(=O)CCS b2bff91e8abac7537fc5b1e7922d35b5 [0,0,0,0,0,0|4,0,0]=4 217 B10R0.3 CSCC(=O)NCC=C(C)C 68abdae8e9adbbbbcc499c91e10dc59a [0,0,0,0,0,0|2,0,2]=4 218 B10R0.3 CSCC(=O)NCCC(C)C db8eb9c0e0e6d2707b3ffa978d5f5b83 [0,0,0,0,0,0|2,0,0]=2 219 B10R0.3 CSCC(=O)NCCC(C)O 7848e46ae3808e0ac9d1efe18cbfd4dd [0,0,0,0,0,0|3,0,0]=3 220 B10R0.3 CSCC(=O)NCCC(F)F 03f6dc50d438d105202f18398fcf5e98 [0,0,0,0,0,0|4,0,0]=4 221 B10R0.3 CSCC(=O)NCCN(C)C 95b371de567c60a5a6c6c7d2a2372941 [0,0,0,0,0,0|3,0,0]=3 222 B10R0.3 CSCC(=O)NCCS(=O)C 330f9497ecf24e087f666bb454c1da25 [0,0,0,0,0,0|4,0,0]=4 223 B10R0.3 CSCC(=O)NCC[C@@H](C)O d57c31401e2b1b463900225e10802c2e [0,0,0,0,0,0|3,0,0]=3 224 B10R0.3 CSCC(=O)NCC[C@H](C)O a77f0322c4a11e039227a28e2626e4e3 [0,0,0,0,0,0|3,0,0]=3 225 B10R0.3 CSCC(C)OCCC(C)C 2cf087632a573edd94ef1a6d8d920410 [0,0,0,0,0,0|2,0,1]=3 226 B10R0.3 CSCC(C)OCCN(C)C 9e0e578d7c39aa26b2c3d3502108a15d [0,0,0,0,0,0|3,0,1]=4 227 B10R0.3 CSCC(C)OCOC(C)C 6869d8bd9045c4a4b42dae134e006215 [0,0,0,0,0,0|3,0,1]=4 228 B10R0.3 C[C@@H](O)CCNC(=O)CC#N 91d4eadf0bbfe4145fba99b936f239c8 [0,0,0,0,0,0|3,0,1]=4 229 B10R0.3 C[C@@H](O)CCNC(=O)CC=O 1648a8987c6dd35d352120b2de20c613 [0,0,0,0,0,0|3,0,1]=4 230 B10R0.3 C[C@@H](O)CCNC(=O)CCF 5d942b71f30ee5bb5b506a8e530c16a6 [0,0,0,0,0,0|3,0,0]=3 231 B10R0.3 C[C@@H](O)CCNC(=O)CCO 2ae5cb4a4c415b6bf6da4a8ef184c522 [0,0,0,0,0,0|3,0,0]=3 232 B10R0.3 C[C@@H](O)CCNC(=O)CCS 432196bb14ac1402e33ec9699dd4e236 [0,0,0,0,0,0|3,0,0]=3 233 B10R0.3 C[C@@H](O)CCNC(=O)CON 1cabda4f11c000adff121a6ac6c6606f [0,0,0,0,0,0|4,0,0]=4 234 B10R0.3 C[C@H](O)CCNC(=O)CC#N 7f6655d895aebd74072480894bc72a25 [0,0,0,0,0,0|3,0,1]=4 235 B10R0.3 C[C@H](O)CCNC(=O)CC=O 116d638438b4181dba6a6ed4cc387f29 [0,0,0,0,0,0|3,0,1]=4 236 B10R0.3 C[C@H](O)CCNC(=O)CCF 64b04acb93a1730976c7d1257fe03e5e [0,0,0,0,0,0|3,0,0]=3 237 B10R0.3 C[C@H](O)CCNC(=O)CCO d233aaf5f171aeb9d874c61ed6e4d942 [0,0,0,0,0,0|3,0,0]=3 238 B10R0.3 C[C@H](O)CCNC(=O)CCS c40466dd1c4f545a251381c498a9e210 [0,0,0,0,0,0|3,0,0]=3 239 B10R0.3 C[C@H](O)CCNC(=O)CON 31da3651ec0d6f7f3c200d2e28b2adf5 [0,0,0,0,0,0|4,0,0]=4 240 B10R0.3 O=C(CCF)NCCC(F)F 9aabc9619690b642374071d29a19f338 [0,0,0,0,0,0|4,0,0]=4 241 B10R0.3 O=C(CCO)NCCC(F)F e81a3b49952cbf92fa8f0a0f43163791 [0,0,0,0,0,0|4,0,0]=4 242 B10R0.3 O=C(CCS)NCCC(F)F 25fd784e62b5d420bf801e557716b2c8 [0,0,0,0,0,0|4,0,0]=4 243 B9R0.1 C#CC(=O)NCCC(C)C ab400f6b7166fed0666f6daf0c7c788f [1,0,0,0,0,0|1,0,2]=4 244 B9R0.1 C=C(C)CCNC(=O)CC c0849ae324a4527830c5955e89b51c09 [1,0,0,0,0,0|1,0,2]=4 245 B9R0.1 C=C(C=O)OCCC(C)C 993d6c44e913d202317615362ca5bde2 [1,0,0,0,0,0|2,0,1]=4 246 B9R0.1 C=C(CC)CNCC(C)C 70e2d15e6a6ad9de05cec0c1a87983c3 [1,0,0,0,0,0|3,0,0]=4 247 B9R0.1 C=C(CC)COCC(C)C 0cc98b8b2f556725175a011e62258e27 [1,0,0,0,0,0|3,0,0]=4 248 B9R0.1 C=CC(=O)NCCC(C)C 3eac58699bc526229809032762dcd7ee [1,0,0,0,0,0|1,0,2]=4 249 B9R0.1 CC(C)CCNC(=O)C=O 3e18bda81d0213cfda084da64572a73c [1,0,0,0,0,0|2,0,1]=4 250 B9R0.1 CC(C)CCNC(=O)CF ae30f120fb51a70967c828ddab28084f [1,0,0,0,0,0|2,0,0]=3 251 B9R0.1 CC(C)CCNC(=O)CO fccf2f1416923531307bedc30f22484d [1,0,0,0,0,0|2,0,0]=3 252 B9R0.1 CC(C)CCNC(=O)CS 9b985f09b4180fe941275afc381f1265 [1,0,0,0,0,0|2,0,0]=3 253 B9R0.1 CC(C)CCOC(C)CF 15a51ebc2fe54421e1cbae3749791711 [1,0,0,0,0,0|2,0,1]=4 254 B9R0.1 CC(C)CCOC(C)CS ca0338d0fbe5de79fa40b649ba054b3c [1,0,0,0,0,0|2,0,1]=4 255 B9R0.1 CC(C)CCO[C@H](C)CS f04d2e77c5253d6099a1c503e54a2d8d [1,0,0,0,0,0|2,0,1]=4 256 B9R0.1 CC(C)CNCC(=O)CO ee418b1e31d09b89331f9ca774457c43 [1,0,0,0,0,0|3,0,0]=4 257 B9R0.1 CC(O)CCNC(=O)CF 7c4df54bb4c03e0cfed039993eb83c4a [1,0,0,0,0,0|3,0,0]=4 258 B9R0.1 CC(O)CCNC(=O)CO bea318e52af2faf0abfc14754050cafc [1,0,0,0,0,0|3,0,0]=4 259 B9R0.1 CC(O)CCNC(=O)CS c0d269a5f96db7c36bd65f277c5f2e77 [1,0,0,0,0,0|3,0,0]=4 260 B9R0.1 CCC(=O)CNCC(C)C f89eb8c1da421bdd2c2a0f52a3227e7b [1,0,0,0,0,0|2,0,0]=3 261 B9R0.1 CCC(=O)CNCC(C)O a20b1e849513a8941047bd9c440c4344 [1,0,0,0,0,0|3,0,0]=4 262 B9R0.1 CCC(=O)CNC[C@@H](C)O 2e3fedb1efa9f0f66bc486911a9f8e3a [1,0,0,0,0,0|3,0,0]=4 263 B9R0.1 CCC(=O)CNC[C@H](C)O 61f52c4a5ade0238ce10614525e75211 [1,0,0,0,0,0|3,0,0]=4 264 B9R0.1 CCC(=O)COCC(C)C 1c45ddeeaf5a279e0fccbc8ffb25aed9 [1,0,0,0,0,0|2,0,0]=3 265 B9R0.1 CCC(=O)COCC(C)F 91df8a377e9f937cdf7b9a4dbc1d8ea9 [1,0,0,0,0,0|3,0,0]=4 266 B9R0.1 CCC(=O)COCC(C)S d1be480c334d894200d3e9bbcc1d4bf5 [1,0,0,0,0,0|3,0,0]=4 267 B9R0.1 CCC(=O)COCN(C)C dd8de0eeed69111efd83350139ed50fc [1,0,0,0,0,0|3,0,0]=4 268 B9R0.1 CCC(=O)COC[C@@H](C)F caad4436b920c8b328478f7df99675f5 [1,0,0,0,0,0|3,0,0]=4 269 B9R0.1 CCC(=O)COC[C@H](C)F afd400ebd46039e71d2dcae521490671 [1,0,0,0,0,0|3,0,0]=4 270 B9R0.1 CCC(=O)NCC=C(C)C c2665bdc8bcdfc26f7fdadaaa40a72a8 [1,0,0,0,0,0|1,0,2]=4 271 B9R0.1 CCC(=O)NCCC(C)C 15f0ff154b73608d9b867dc114dba5c0 [1,0,0,0,0,0|1,0,0]=2 272 B9R0.1 CCC(=O)NCCC(C)O 2aec2e6bb9fbc54ce13f19b2630a008a [1,0,0,0,0,0|2,0,0]=3 273 B9R0.1 CCC(=O)NCCC(F)F a661ae0ff1bde5e4e25bfaa09812b815 [1,0,0,0,0,0|3,0,0]=4 274 B9R0.1 CCC(=O)NCCN(C)C 3fd654a68244f1306eb040b308a88ab5 [1,0,0,0,0,0|2,0,0]=3 275 B9R0.1 CCC(=O)NCCS(=O)C 0a43abd0c9593f06f1b54bc82efd02c1 [1,0,0,0,0,0|3,0,0]=4 276 B9R0.1 CCC(=O)NCC[C@@H](C)O dc1da85b4b434a8327a030b4b9c29cc5 [1,0,0,0,0,0|2,0,0]=3 277 B9R0.1 CCC(=O)NCC[C@H](C)O e060f68859aae796ceb23995e0446069 [1,0,0,0,0,0|2,0,0]=3 278 B9R0.1 CCC(=O)OCOC(C)C d2041b130de2bcfd6163156695ed2b3c [1,0,0,0,0,0|1,0,0]=2 279 B9R0.1 CCC(C)NCCC(C)C 237b74bb8f3ac96e63644aaf6885a312 [1,0,0,0,0,0|2,0,1]=4 280 B9R0.1 CCC(C)OCCC(C)C ecabe412cdca600dcd92abc88ba6fc3b [1,0,0,0,0,0|1,0,1]=3 281 B9R0.1 CCC(C)OCCN(C)C 2c34236cfc09dc27ca2b71263a05aec6 [1,0,0,0,0,0|2,0,1]=4 282 B9R0.1 CCC(C)OCOC(C)C 17ca65f144a7475031fffff42375f583 [1,0,0,0,0,0|2,0,1]=4 283 B9R0.1 CCN(C)CCCC(C)C b23f0e35078e778ace5030dbc968cf57 [1,0,0,0,0,0|3,0,0]=4 284 B9R0.1 CCS(=O)CCOC(C)C 7f20e4e9980affd6bc73c9352927640f [1,0,0,0,0,0|3,0,0]=4 285 B9R0.1 CC[C@@H](C)NCCC(C)C d11d0748dfe468c717dc13a70caaa389 [1,0,0,0,0,0|2,0,1]=4 286 B9R0.1 CC[C@@H](C)OCCC(C)C 5e526274912eb5b83acbe56b998005ec [1,0,0,0,0,0|1,0,1]=3 287 B9R0.1 CC[C@@H](C)OCCN(C)C 630dd475e680542a430b360fc4872775 [1,0,0,0,0,0|2,0,1]=4 288 B9R0.1 CC[C@@H](C)OCOC(C)C f896873c7817a713d12e595ce9e72462 [1,0,0,0,0,0|2,0,1]=4 289 B9R0.1 CC[C@H](C)NCCC(C)C 968c312d0d0d1e42fbc93983e612e83d [1,0,0,0,0,0|2,0,1]=4 290 B9R0.1 CC[C@H](C)OCCC(C)C 56bb245514a6dc3ef9381d0b1123e92c [1,0,0,0,0,0|1,0,1]=3 291 B9R0.1 CC[C@H](C)OCCN(C)C 4bf1d26e4a9577e108b054e917169fe6 [1,0,0,0,0,0|2,0,1]=4 292 B9R0.1 CC[C@H](C)OCOC(C)C 69a07cbc994c3a1e24f215fd3ceea6e2 [1,0,0,0,0,0|2,0,1]=4 293 B9R0.1 CN(C)CCNC(=O)CF f1e626ee6a191f90f8bdc9089bd94f7d [1,0,0,0,0,0|3,0,0]=4 294 B9R0.1 CN(C)CCNC(=O)CO dea4c98f6a4d3fbcbf88cdb0e163e84f [1,0,0,0,0,0|3,0,0]=4 295 B9R0.1 CN(C)CCNC(=O)CS 739f64b4520f33214b510a14f21f5bab [1,0,0,0,0,0|3,0,0]=4 296 B9R0.1 CNC(=O)CCNC(C)C 855f87f986c161aee85af79de8272fed [1,0,0,0,0,0|3,0,0]=4 297 B9R0.1 CNC(=O)CCOC(C)C 6a47444c5a2c07745f4f7dfd64d3b1d6 [1,0,0,0,0,0|3,0,0]=4 298 B9R0.1 CNC(=O)CNCC(C)C 3221640b219bd78ec2bb8c18ad769fcf [1,0,0,0,0,0|3,0,0]=4 299 B9R0.1 CNC(=O)COCC(C)C 40c9e5555ca7067c1b75a79085d9227e [1,0,0,0,0,0|3,0,0]=4 300 B9R0.1 COC(=O)CCNC(C)C cca84c56a4f78d735d44ac567d8c7043 [1,0,0,0,0,0|3,0,0]=4 301 B9R0.1 COC(=O)CCOC(C)C 60b3b0e4ed197bd9b785527450b784a6 [1,0,0,0,0,0|3,0,0]=4 302 B9R0.1 COC(=O)CNCC(C)C f4529cfb679f9748b0c64270201236cc [1,0,0,0,0,0|3,0,0]=4 303 B9R0.1 COC(=O)COCC(C)C 4b1318611fb3f76585445eae1c414e70 [1,0,0,0,0,0|3,0,0]=4 304 B9R0.1 COC(=O)OCOC(C)C 251eb519e02d8d49a94916f622d830be [1,0,0,0,0,0|2,0,0]=3 305 B9R0.1 C[C@@H](O)CCNC(=O)CF 9cc194dd6bae57ed21d1c6a3807cb763 [1,0,0,0,0,0|3,0,0]=4 306 B9R0.1 C[C@@H](O)CCNC(=O)CO 0f403648615901397e48f6d9f0579495 [1,0,0,0,0,0|3,0,0]=4 307 B9R0.1 C[C@@H](O)CCNC(=O)CS 5041dae96f818c0eb7fcd213a28aa8a7 [1,0,0,0,0,0|3,0,0]=4 308 B9R0.1 C[C@H](O)CCNC(=O)CF dccbd1b5eb2b603c877a00069e3b10a6 [1,0,0,0,0,0|3,0,0]=4 309 B9R0.1 C[C@H](O)CCNC(=O)CO c73ce75cfe06fe5a627e4cd5009891c1 [1,0,0,0,0,0|3,0,0]=4 310 B9R0.1 C[C@H](O)CCNC(=O)CS c3c8ad3bd970fc3ad723d2f4eede6a9b [1,0,0,0,0,0|3,0,0]=4 311 B9R0.2 C#CCCOCCC(C)C f9f2b45824a5d8c42bb6eded3900c820 [1,0,0,0,0,0|0,0,3]=4 312 B9R0.2 C/C=C/COCCC(C)C d70bf3413b611544a4afaa244a184a93 [1,0,0,0,0,0|0,0,3]=4 313 B9R0.2 C/C=C\COCCC(C)C 009e3b7c7e2987e5c250113058fc0d2b [1,0,0,0,0,0|0,0,3]=4 314 B9R0.2 C=C(C)CCOCCCC 43e61bb8669727040bdbd33fc265d7ab [1,0,0,0,0,0|0,0,3]=4 315 B9R0.2 C=CCCOCCC(C)C 792c9a1755bacca74235abb3c322c011 [1,0,0,0,0,0|0,0,3]=4 316 B9R0.2 CC#CCOCCC(C)C cdff65922272a9cba01c90af8f2dd55f [1,0,0,0,0,0|0,0,3]=4 317 B9R0.2 CC(C)CCCNCCBr b7d6416d41a8d8b043114eb9d25fd084 [1,0,0,0,0,0|3,0,0]=4 318 B9R0.2 CC(C)CCCNCCF cae69e3d43f52e964c9ca30c89572657 [1,0,0,0,0,0|3,0,0]=4 319 B9R0.2 CC(C)CCCNCCI 90c8ce226d0260d0967afa2e501e2135 [1,0,0,0,0,0|3,0,0]=4 320 B9R0.2 CC(C)CCCNCCO 792143707f2bda6c4365b4fdbb4b413c [1,0,0,0,0,0|3,0,0]=4 321 B9R0.2 CC(C)CCCNCCS 1447d71bb66626d0b32a83f48256250f [1,0,0,0,0,0|3,0,0]=4 322 B9R0.2 CC(C)CCCOCCF 28b58f2b3681d1d6fee121e2a302200f [1,0,0,0,0,0|3,0,0]=4 323 B9R0.2 CC(C)CCCOCCS b10e3a2d8503d5801319565b78445a81 [1,0,0,0,0,0|3,0,0]=4 324 B9R0.2 CC(C)CCNCCCCl 6b9795fdcd9da3d8230813c028ca1ec2 [1,0,0,0,0,0|2,0,1]=4 325 B9R0.2 CC(C)CCNCCCF 854a9911ee43659052fd5caa66875a1b [1,0,0,0,0,0|2,0,1]=4 326 B9R0.2 CC(C)CCNCCCO eca7ad0d2c54b51c5aaeb877cb5ad346 [1,0,0,0,0,0|2,0,1]=4 327 B9R0.2 CC(C)CCNCCCS d0e9b2be9c31cc9392ea5d1d479cedc9 [1,0,0,0,0,0|2,0,1]=4 328 B9R0.2 CC(C)CCOCCC#N cba9363079b4448bc2de1026c400eed1 [1,0,0,0,0,0|1,0,2]=4 329 B9R0.2 CC(C)CCOCCC=O 35e5fe09d7f172e01a3fc9fb57f41a74 [1,0,0,0,0,0|1,0,2]=4 330 B9R0.2 CC(C)CCOCCCF a4554d12916afd4836094e430ac63586 [1,0,0,0,0,0|1,0,1]=3 331 B9R0.2 CC(C)CCOCCCS 35237afc9f97d012e4f412033cf35c90 [1,0,0,0,0,0|1,0,1]=3 332 B9R0.2 CC(C)OCOCCCF 0090d7df25ce61777757ca891b9c1b0a [1,0,0,0,0,0|2,0,1]=4 333 B9R0.2 CC(C)OCOCCCS cbb8b07b7bc0acb7668239370aceae5f [1,0,0,0,0,0|2,0,1]=4 334 B9R0.2 CC/C=C/CCOC(C)C ef00627bff77b325217a906a5597bbd9 [1,0,0,0,0,0|2,0,1]=4 335 B9R0.2 CC/C=C/CNCC(C)C b25757dbfde58bbb1d05e9157ca1aec6 [1,0,0,0,0,0|2,0,1]=4 336 B9R0.2 CC/C=C/COCC(C)C c9460f35b70c31b83a5819b1169bb38b [1,0,0,0,0,0|2,0,1]=4 337 B9R0.2 CC/C=C\CCOC(C)C 4692840deafd8699b89a7fcb39f78d25 [1,0,0,0,0,0|2,0,1]=4 338 B9R0.2 CC/C=C\COCC(C)C 023c589a61e57ea137047af369f5362e [1,0,0,0,0,0|2,0,1]=4 339 B9R0.2 CC=CCOCCC(C)C 6a4ac7fe69724da0bd8975ee85d858c6 [1,0,0,0,0,0|0,0,3]=4 340 B9R0.2 CCC/C=C/COC(C)C c7f6dce9a9b6f04fa1a4ee48b4332bb5 [1,0,0,0,0,0|2,0,0]=3 341 B9R0.2 CCC/C=C\COC(C)C 7e38665cf9eba01730817707e8d36b75 [1,0,0,0,0,0|2,0,0]=3 342 B9R0.2 CCCC#CCOC(C)C e9d584af9b7826dd47f727bc81150c01 [1,0,0,0,0,0|2,0,1]=4 343 B9R0.2 CCCCCCNC(C)C b4470bdb41ca94cf2ace2a9a22274307 [1,0,0,0,0,0|2,0,1]=4 344 B9R0.2 CCCCCCOC(C)C 7177762ff96f664d7658fbf17ddec082 [1,0,0,0,0,0|2,0,1]=4 345 B9R0.2 CCCCCNCC(C)C 2a266c7fc85c9a2097a02175858c3e33 [1,0,0,0,0,0|2,0,1]=4 346 B9R0.2 CCCCCOCC(C)C a6db06e9998ef0b98995e61e46447184 [1,0,0,0,0,0|2,0,1]=4 347 B9R0.2 CCCCNCCC(C)C 44a9470711d30a7f4f911ef0e5708bda [1,0,0,0,0,0|1,0,1]=3 348 B9R0.2 CCCCNCCC(C)O a3707e567169e0cb89818b82dd0db2ad [1,0,0,0,0,0|2,0,1]=4 349 B9R0.2 CCCCNCCN(C)C 276e58670905c90d29cab37bd4cde7f0 [1,0,0,0,0,0|2,0,1]=4 350 B9R0.2 CCCCNCC[C@@H](C)O b4194f7259d3966751a8302ac0afc5f6 [1,0,0,0,0,0|2,0,1]=4 351 B9R0.2 CCCCNCC[C@H](C)O 2bd9e0d91881457396737c14485be5ce [1,0,0,0,0,0|2,0,1]=4 352 B9R0.2 CCCCNCOC(C)C 32a6bb964d8d43a916c6ff2488841278 [1,0,0,0,0,0|2,0,1]=4 353 B9R0.2 CCCCOCC=C(C)C 761455161b359ecdf381fb2c7e2674d3 [1,0,0,0,0,0|0,0,3]=4 354 B9R0.2 CCCCOCCC(=O)C 6113a5294b2f420804d815edd80f0f40 [1,0,0,0,0,0|1,0,2]=4 355 B9R0.2 CCCCOCCC(C)C 957ebfe7946e25745350d003aae73b70 [1,0,0,0,0,0|0,0,1]=2 356 B9R0.2 CCCCOCCC(F)F e0eb329f82786f9e804b9c4e3afd51ae [1,0,0,0,0,0|2,0,1]=4 357 B9R0.2 CCCCOCCN(C)C ff1cbc5eb8ee420c66fac7f9df7f979c [1,0,0,0,0,0|1,0,1]=3 358 B9R0.2 CCCCOCCS(=O)C c23ab1353236b7d3fb5d5b7810b75cb1 [1,0,0,0,0,0|2,0,1]=4 359 B9R0.2 CCCCOCOC(C)C 1a657fac5692c1c4dd3717de120d3c93 [1,0,0,0,0,0|1,0,1]=3 360 B9R0.2 CCCNCCCC(C)C 56db38ca7131898df70223675d651c95 [1,0,0,0,0,0|2,0,0]=3 361 B9R0.2 CCCNCCCC(C)O 6371182df2267961651c217c5a9d8ec2 [1,0,0,0,0,0|3,0,0]=4 362 B9R0.2 CCCNCCCN(C)C 565fce1d806476fa729807ee12ce30bc [1,0,0,0,0,0|3,0,0]=4 363 B9R0.2 CCCNCCOC(C)C a36201cd1faa30cc90dfa4534e111392 [1,0,0,0,0,0|3,0,0]=4 364 B9R0.2 CCCNCCSC(C)C a872a112cc2ac280d6e9a6471fc205b7 [1,0,0,0,0,0|3,0,0]=4 365 B9R0.2 CCCOCCCC(C)C c11f5e919ab6207bf876cd919599bef7 [1,0,0,0,0,0|2,0,0]=3 366 B9R0.2 CCCOCCCN(C)C a5a11dc7f53dac0e7d443525259da51c [1,0,0,0,0,0|3,0,0]=4 367 B9R0.2 CCCOCCNC(C)C 7aefc36312fbf4532ce181795209f5a8 [1,0,0,0,0,0|3,0,0]=4 368 B9R0.2 CCCOCCOC(C)C bab68f481c98df0f765c595bef6a5e4a [1,0,0,0,0,0|3,0,0]=4 369 B9R0.2 CCCOCCSC(C)C 0d579bdcea82cf2a4acdb4f347d812d6 [1,0,0,0,0,0|3,0,0]=4 370 B9R0.2 CCCSCCOC(C)C 8e6bb888e1203bd9af5e8ced33d33d2f [1,0,0,0,0,0|3,0,0]=4 371 B9R0.2 CCOCCCCC(C)C 342635d8f7fe78b6b1c62374e4a1ad34 [1,0,0,0,0,0|2,0,1]=4 372 B9R0.2 CCOCNCCC(C)C 9873351f853c3c87377269228f45c34b [1,0,0,0,0,0|2,0,1]=4 373 B9R0.2 CCOCOCCC(C)C f454c6a8aefdf374dd25a8036b00280e [1,0,0,0,0,0|1,0,1]=3 374 B9R0.2 CCOCOCCN(C)C de966222b2737106a1751302194d1266 [1,0,0,0,0,0|2,0,1]=4 375 B9R0.2 CN(C)CCOCCCF f595570429aaee01af560f651a899838 [1,0,0,0,0,0|2,0,1]=4 376 B9R0.2 CN(C)CCOCCCS 5bd31e992404b2c72d057532a8c36ac4 [1,0,0,0,0,0|2,0,1]=4 377 B9R0.2 COCCNCCC(C)C 4155c1515ea713609c1b589b2eb003e2 [1,0,0,0,0,0|2,0,1]=4 378 B9R0.2 COCCOCCC(C)C c37823bd4133695864346194e978635d [1,0,0,0,0,0|1,0,1]=3 379 B9R0.2 COCCOCCN(C)C b752482c43e8088686246e63a6b59a80 [1,0,0,0,0,0|2,0,1]=4 380 B9R0.2 COCCOCOC(C)C 4d694a6db0f056e220542047e9e2f5b8 [1,0,0,0,0,0|2,0,1]=4 381 B9R0.2 COCNCCCC(C)C bbbf765fc3f4b35e132dc40fc1ce89d5 [1,0,0,0,0,0|3,0,0]=4 382 B9R0.2 COCOCCCC(C)C b6376f7988031ced242015bf9ea6e16c [1,0,0,0,0,0|3,0,0]=4 383 B9R0.2 CSCCNCCC(C)C cf166809875f8d45beee49bb4be24b4d [1,0,0,0,0,0|2,0,1]=4 384 B9R0.2 CSCCOCCC(C)C b19dbbca3d7d14ce50c61b7cd3faaa35 [1,0,0,0,0,0|1,0,1]=3 385 B9R0.2 CSCCOCCN(C)C 969ed6821457fe6bfffdb86e444e4022 [1,0,0,0,0,0|2,0,1]=4 386 B9R0.2 CSCCOCOC(C)C b39e85898cd110593f95136e4452c100 [1,0,0,0,0,0|2,0,1]=4 387 B9R0.2 CSCNCCCC(C)C 379e4d8d4775e747da63f781d2dc7221 [1,0,0,0,0,0|3,0,0]=4 388 B9R0.2 CSCOCCCC(C)C ed6187b45ed6496b8f876fb1e5cbbc93 [1,0,0,0,0,0|3,0,0]=4 389 B9R0.5 C#CCC(=O)NCCCC ba93a74075d3af473d0ae40cb1c8a7e9 [1,0,0,0,0,0|1,0,2]=4 390 B9R0.5 C#CCCNC(=O)CCC 010ec079c645d74cd5f900edc483ff97 [1,0,0,0,0,0|1,0,2]=4 391 B9R0.5 C#CCCOC(=S)CCC d5e3e5bf11ed3e0160f0cb8e507cdb3d [1,0,0,0,0,0|0,1,2]=4 392 B9R0.5 C/C=C/C(=O)NCCCC 44c051192513db47c1c826c71178c208 [1,0,0,0,0,0|1,0,2]=4 393 B9R0.5 C/C=C/COC(=S)CCC e7cad298ccba9104c0d980de29f137f4 [1,0,0,0,0,0|0,1,2]=4 394 B9R0.5 C/C=C\COC(=S)CCC d856881e8d482988bbba7c3bfef6df70 [1,0,0,0,0,0|0,1,2]=4 395 B9R0.5 C=CCC(=O)NCCCC aa4e9cc01c944a911bc93657ec8591fa [1,0,0,0,0,0|1,0,2]=4 396 B9R0.5 C=CCCNC(=O)CCC cf53a2db9c6b8bf112b423fceb3e3e88 [1,0,0,0,0,0|1,0,2]=4 397 B9R0.5 C=CCCOC(=S)CCC 2692822e92b8218c0255dd67b3275aa5 [1,0,0,0,0,0|0,1,2]=4 398 B9R0.5 CC#CC(=O)NCCCC 41434018c71b7cd84c9c1094b4f5059d [1,0,0,0,0,0|1,0,2]=4 399 B9R0.5 CC#CCNC(=O)CCC 48984c428da435490cd648d1556c7272 [1,0,0,0,0,0|1,0,2]=4 400 B9R0.5 CC=CCNC(=O)CCC a2189c9a5e101c26f476080a5e98ae2b [1,0,0,0,0,0|1,0,2]=4 401 B9R0.5 CCCC(=O)CNCCBr 580d9097d971fedfdfa14df158dde72d [1,0,0,0,0,0|3,0,0]=4 402 B9R0.5 CCCC(=O)CNCCF 90b6a3d4e2b646692ac2f8be60f35cfc [1,0,0,0,0,0|3,0,0]=4 403 B9R0.5 CCCC(=O)CNCCI e6c431c6a36f932e7e7bd540be83f7d4 [1,0,0,0,0,0|3,0,0]=4 404 B9R0.5 CCCC(=O)CNCCO 19eaae24439cf65d8d2d752c6a63c8d7 [1,0,0,0,0,0|3,0,0]=4 405 B9R0.5 CCCC(=O)CNCCS 1dd21d52255aa998e3f67c462a833edf [1,0,0,0,0,0|3,0,0]=4 406 B9R0.5 CCCC(=O)COCCF 51c78131a5436c656772daa28f0121d0 [1,0,0,0,0,0|3,0,0]=4 407 B9R0.5 CCCC(=O)COCCS 77d185d452b3bc72588d0bc7dfa35de5 [1,0,0,0,0,0|3,0,0]=4 408 B9R0.5 CCCC(=O)COCOC 2e9034a32d4ad47f72112a5c4899eca9 [1,0,0,0,0,0|3,0,0]=4 409 B9R0.5 CCCC(=O)NCCC#N df36b052b03aa9feb90916eec413467f [1,0,0,0,0,0|2,0,1]=4 410 B9R0.5 CCCC(=O)NCCCCl f1d9e9d02a2632caa1296262930794c7 [1,0,0,0,0,0|2,0,0]=3 411 B9R0.5 CCCC(=O)NCCCO 592c3668cf1954e32eae53f9d9310fe4 [1,0,0,0,0,0|2,0,0]=3 412 B9R0.5 CCCC(=O)NCCOC d85beb1e2ae7c191540a491c38a5bdee [1,0,0,0,0,0|2,0,0]=3 413 B9R0.5 CCCC(=O)NCCON 2667b617ce33939f360a2d9f69c758c4 [1,0,0,0,0,0|3,0,0]=4 414 B9R0.5 CCCC(=O)NCCSC a7f90a8bca211f42c79fa85f13ca66c5 [1,0,0,0,0,0|2,0,0]=3 415 B9R0.5 CCCC(=O)OCNC#N a51c4831c20ad7913670407ec9a058f2 [1,0,0,0,0,0|2,0,1]=4 416 B9R0.5 CCCC(=S)OCCC#N 4d59f3d5d598722c51a17a6ae837b460 [1,0,0,0,0,0|1,1,1]=4 417 B9R0.5 CCCC(=S)OCCC=O 141f60b34558e8dbf5ffba7be4ff80f9 [1,0,0,0,0,0|1,1,1]=4 418 B9R0.5 CCCC(=S)OCCCF 656dc88ae36c655edad34b161382f41a [1,0,0,0,0,0|1,1,0]=3 419 B9R0.5 CCCC(=S)OCCCS 23b64448f461e9f987487e187aec0d4a [1,0,0,0,0,0|1,1,0]=3 420 B9R0.5 CCCC(=S)OCCOC d3db63e9a9ba0e487e0033504dd762c1 [1,0,0,0,0,0|1,1,0]=3 421 B9R0.5 CCCC(=S)OCCSC ea004ea4cab93907812e5d91a99ec056 [1,0,0,0,0,0|1,1,0]=3 422 B9R0.5 CCCC(=S)OCOCC adf12bc5807344f3b284867173cde60b [1,0,0,0,0,0|1,1,0]=3 423 B9R0.5 CCCC(C)OCCCF 4e9747e2d6b2c5386230800523638aa2 [1,0,0,0,0,0|2,0,1]=4 424 B9R0.5 CCCC(C)OCCCS 31bb2609b5394c7a115342253a9a46b7 [1,0,0,0,0,0|2,0,1]=4 425 B9R0.5 CCCC(C)OCCOC c2e6ce8981bbd0e5e7a872140ce09c7e [1,0,0,0,0,0|2,0,1]=4 426 B9R0.5 CCCC(C)OCCSC b02b2d120691841f6ce9a1d734fc587b [1,0,0,0,0,0|2,0,1]=4 427 B9R0.5 CCCCCN(C)CCC b853278094c2f82fca4e6dd3977c6a67 [1,0,0,0,0,0|3,0,0]=4 428 B9R0.5 CCCCNC(=O)CC#N 053d3ec5d1d045be31522ff85b2cf2ec [1,0,0,0,0,0|2,0,1]=4 429 B9R0.5 CCCCNC(=O)CC=O 836473a80945117a02207b121e995b64 [1,0,0,0,0,0|2,0,1]=4 430 B9R0.5 CCCCNC(=O)CCC 2cce597b848ae107def59bee54a0a0bb [1,0,0,0,0,0|1,0,0]=2 431 B9R0.5 CCCCNC(=O)CCF 53b9813d116057ff8c4b15658e94e51c [1,0,0,0,0,0|2,0,0]=3 432 B9R0.5 CCCCNC(=O)CCO 0298cd2468e4d9499261be651df2adcd [1,0,0,0,0,0|2,0,0]=3 433 B9R0.5 CCCCNC(=O)CCS 1641ac5db70e3fc675ef1771e3defee2 [1,0,0,0,0,0|2,0,0]=3 434 B9R0.5 CCCCNC(=O)COC 36ff378b0254a17f19e8bd23cda67723 [1,0,0,0,0,0|2,0,0]=3 435 B9R0.5 CCCCNC(=O)CON ff8aaf07597bc421ccecffa926ce5e77 [1,0,0,0,0,0|3,0,0]=4 436 B9R0.5 CCCCNC(=O)CSC fd9e07d4285a6169aceb5bd025ecd890 [1,0,0,0,0,0|2,0,0]=3 437 B9R0.5 CCCCNC(C)CCC 06cd3d4eadb838cea410097bf17bae5e [1,0,0,0,0,0|2,0,1]=4 438 B9R0.5 CCCCN[C@@H](C)CCC ab2be22024a2e965b1370aa5fe48dbdb [1,0,0,0,0,0|2,0,1]=4 439 B9R0.5 CCCCOC(=S)CCC f1235a4363bf9e2174e43a15f0090624 [1,0,0,0,0,0|0,1,0]=2 440 B9R0.5 CCCCOC(C)CCC 92f21439e18e4a0212372a80f0159639 [1,0,0,0,0,0|1,0,1]=3 441 B9R0.5 CCCCOC(C)COC ba4e551fe4b685878d8e23a8545ffdea [1,0,0,0,0,0|2,0,1]=4 442 B9R0.5 CCCCOC(C)CSC a8cdef8b35f4519dea5c9afc41578fcb [1,0,0,0,0,0|2,0,1]=4 443 B9R0.5 CCCCO[C@@H](C)CCC 5b752837ff25253bec29faef567e59b2 [1,0,0,0,0,0|1,0,1]=3 444 B9R0.5 CCCCO[C@@H](C)COC fdc2da5dba6e3d0a9e63de45ba95a113 [1,0,0,0,0,0|2,0,1]=4 445 B9R0.5 CCCCO[C@H](C)CCC 5384ca464c5bc70cb67ae7c0e1b63cd2 [1,0,0,0,0,0|1,0,1]=3 446 B9R0.5 CCCCO[C@H](C)COC 15bbc144a56a666747dad75b1789a610 [1,0,0,0,0,0|2,0,1]=4 447 B9R0.5 CCCNCC(=O)CCC 3eec0edc7aa18c3c159d3b72b32db52a [1,0,0,0,0,0|2,0,0]=3 448 B9R0.5 CCCNCC(=O)COC 9c76efdc9995e8503c8a81dc87078b10 [1,0,0,0,0,0|3,0,0]=4 449 B9R0.5 CCCNCC(=O)NCC ce07571aa3fa6f7b572f45c714e29f13 [1,0,0,0,0,0|3,0,0]=4 450 B9R0.5 CCCNCC(=O)OCC 96e18210e8c47913fa01fa11b9b136be [1,0,0,0,0,0|3,0,0]=4 451 B9R0.5 CCCOCC(=O)CCC 74c3c5e5bd02e359466cf1cc878b65e0 [1,0,0,0,0,0|2,0,0]=3 452 B9R0.5 CCCOCC(=O)COC 3d7dfb506e9c0757447f18e9df05797b [1,0,0,0,0,0|3,0,0]=4 453 B9R0.5 CCCOCC(=O)NCC 76f4c6de17f53497034323fd5e6ef599 [1,0,0,0,0,0|3,0,0]=4 454 B9R0.5 CCCOCC(=O)OCC 0b34840e3da522061b00dd308581ea5c [1,0,0,0,0,0|3,0,0]=4 455 B9R0.5 CCC[C@@H](C)OCCCF b78bfe38684aeafd56cb91d1a9a8a01b [1,0,0,0,0,0|2,0,1]=4 456 B9R0.5 CCC[C@@H](C)OCCCS 24372301ed9c92789ef5ed79f335e943 [1,0,0,0,0,0|2,0,1]=4 457 B9R0.5 CCC[C@@H](C)OCCOC 004b950db0a41fee3b95494fd30abe99 [1,0,0,0,0,0|2,0,1]=4 458 B9R0.5 CCC[C@@H](C)OCCSC 43e6641b50af016cd80a01869d7ad946 [1,0,0,0,0,0|2,0,1]=4 459 B9R0.5 CCC[C@H](C)OCCCF 6c166b3b2e9a49f3214d1221aa05a7b9 [1,0,0,0,0,0|2,0,1]=4 460 B9R0.5 CCC[C@H](C)OCCCS 185072ad1451feb386e475848ae0f455 [1,0,0,0,0,0|2,0,1]=4 461 B9R0.5 CCC[C@H](C)OCCOC 35df3d9129885ef4f47846403feb0737 [1,0,0,0,0,0|2,0,1]=4 462 B9R0.5 CCC[C@H](C)OCCSC 1b7c51f97c66b74c463df2639602e625 [1,0,0,0,0,0|2,0,1]=4 463 B9R0.5 CCNCCC(=O)OCC 2335a4402c7edabd02b888af3e7ee79f [1,0,0,0,0,0|3,0,0]=4 464 B9R0.5 CCOCCC(=O)OCC 09e1caf8e51242de5bdcbf4174bb2e9c [1,0,0,0,0,0|3,0,0]=4 465 B9R0.5 COCC(=O)NCCCCl 9b8e00a91bd11b43b2cced22d7f8490f [1,0,0,0,0,0|3,0,0]=4 466 B9R0.5 COCC(=O)NCCCO 8066d497a25e88f2387cdf27e9376a33 [1,0,0,0,0,0|3,0,0]=4 467 B9R0.5 COCC(=O)NCCSC ae9802b73da9588e64754d62c956dbe2 [1,0,0,0,0,0|3,0,0]=4 468 B9R0.5 COCCNC(=O)CCF 703c6442db6e4c16b32cf0385fe1f071 [1,0,0,0,0,0|3,0,0]=4 469 B9R0.5 COCCNC(=O)CCO da506b7eb06569e31b2bdbe6c4e1e62a [1,0,0,0,0,0|3,0,0]=4 470 B9R0.5 COCCNC(=O)CCS b8ee435c0e502f7ec824944f584c26af [1,0,0,0,0,0|3,0,0]=4 471 B9R0.5 COCCNC(=O)COC b53dbf929afbe9b06300c313013c1089 [1,0,0,0,0,0|3,0,0]=4 472 B9R0.5 COCCNC(=O)CSC 3a940bbcc690a26481b40d716f51d75b [1,0,0,0,0,0|3,0,0]=4 473 B9R0.5 CSCC(=O)NCCCCl f8e5807b04533e1f0294eb15b05b589e [1,0,0,0,0,0|3,0,0]=4 474 B9R0.5 CSCC(=O)NCCCO 5640a773b24a2079e88c1538d74a13f3 [1,0,0,0,0,0|3,0,0]=4 475 B9R0.5 CSCCNC(=O)CCF 976855bf6bbc92279851c6db72b3fe06 [1,0,0,0,0,0|3,0,0]=4 476 B9R0.5 CSCCNC(=O)CCO 43f57de6b29a2d1d41363767bdf0c9f1 [1,0,0,0,0,0|3,0,0]=4 477 B9R0.5 CSCCNC(=O)CCS cc2a240397388430a40e2a34c43c5050 [1,0,0,0,0,0|3,0,0]=4 478 B9R0.5 CSCCNC(=O)CSC 2dbace4ea8ec9c7a8b0a6a20b93d81ea [1,0,0,0,0,0|3,0,0]=4 479 B9R0.5 O=C(CCF)NCCCCl 450f9e397437565bfe33b39b053c4245 [1,0,0,0,0,0|3,0,0]=4 480 B9R0.5 O=C(CCF)NCCCO 3c99316c0047228a6d04ddef64744a30 [1,0,0,0,0,0|3,0,0]=4 481 B9R0.5 O=C(CCO)NCCCCl abeaa24b07e6d3bdfe3ff6d05860a8be [1,0,0,0,0,0|3,0,0]=4 482 B9R0.5 O=C(CCO)NCCCO 2d4903d2493c9af6a68704182db4d55c [1,0,0,0,0,0|3,0,0]=4 483 B9R0.5 O=C(CCS)NCCCCl 5d4cbf1d3f8d26cc0fcfe1598b77ca0e [1,0,0,0,0,0|3,0,0]=4 484 B9R0.5 O=C(CCS)NCCCO d39ac9fd8653d19eae81484da48b1f73 [1,0,0,0,0,0|3,0,0]=4 485 B11R0.1 C#CCC(=O)NC(C)CC(C)C 8a00ed305c3faeecdb59059a9b438300 [0,1,0,0,0,0|1,0,2]=4 486 B11R0.1 C/C=C/C(=O)NC(C)CC(C)C 5bccf92694e9b47385781b8849dd2b6c [0,1,0,0,0,0|1,0,2]=4 487 B11R0.1 C=CCC(=O)NC(C)CC(C)C d8dbeab11b2c4dbe7d20d98fb0f3bc4a [0,1,0,0,0,0|1,0,2]=4 488 B11R0.1 CC#CC(=O)NC(C)CC(C)C 457a7470c430089b07b5d2446f5a20a3 [0,1,0,0,0,0|1,0,2]=4 489 B11R0.1 CC(C)CC(C)NC(=O)CC#N 34cbceb0e81efb83a7013f8ec98e2ce5 [0,1,0,0,0,0|2,0,1]=4 490 B11R0.1 CC(C)CC(C)NC(=O)CC=O dcdf72c948c988d9fb02712cc9cbda46 [0,1,0,0,0,0|2,0,1]=4 491 B11R0.1 CC(C)CC(C)NC(=O)CCF 48ac2ba8ff1075e9eca35442c4ca1880 [0,1,0,0,0,0|2,0,0]=3 492 B11R0.1 CC(C)CC(C)NC(=O)CCO bd8b19db7f1b6d5eb8acd8d77755090d [0,1,0,0,0,0|2,0,0]=3 493 B11R0.1 CC(C)CC(C)NC(=O)CCS 65ed87a4bf473b9f70f0bf6b20362a89 [0,1,0,0,0,0|2,0,0]=3 494 B11R0.1 CC(C)CC(C)NC(=O)CON 643135f08f0ff42d085f4b4034374405 [0,1,0,0,0,0|3,0,0]=4 495 B11R0.1 CC(CN(C)C)NC(=O)CCF 25a57ca8249108ad8b558c97ec788526 [0,1,0,0,0,0|3,0,0]=4 496 B11R0.1 CC(CN(C)C)NC(=O)CCO e9b426a245fe9c7778fddfdd09c3b528 [0,1,0,0,0,0|3,0,0]=4 497 B11R0.1 CC(CN(C)C)NC(=O)CCS 5377af8c457049f319fcf2f55f4957ac [0,1,0,0,0,0|3,0,0]=4 498 B11R0.1 CC(O)CC(C)NC(=O)CCF 43db7dcd9441e74e34f40ff4200bd092 [0,1,0,0,0,0|3,0,0]=4 499 B11R0.1 CC(O)CC(C)NC(=O)CCO a4e47fc03291225283f8d5eec8f23e66 [0,1,0,0,0,0|3,0,0]=4 500 B11R0.1 CC(O)CC(C)NC(=O)CCS e3c89d8a7750fc1f1fe5f763222720f4 [0,1,0,0,0,0|3,0,0]=4 501 B11R0.1 CCCC(=O)CN(C)CC(C)C be659606dfa817da47b60ecb5b3ee021 [0,1,0,0,0,0|2,0,0]=3 502 B11R0.1 CCCC(=O)CN(C)CC(C)O 000283b1dfd5f26c9bf1653281c42791 [0,1,0,0,0,0|3,0,0]=4 503 B11R0.1 CCCC(=O)CN(C)C[C@H](C)O eb9007c427ab78f13d5526f7fced70b5 [0,1,0,0,0,0|3,0,0]=4 504 B11R0.1 CCCC(=O)NC(C)CC(C)C 4c2fb87952b2391d460843f34f3f4d22 [0,1,0,0,0,0|1,0,0]=2 505 B11R0.1 CCCC(=O)NC(C)CC(C)O da5c64ddf0ab9dd3656f1000386ae98f [0,1,0,0,0,0|2,0,0]=3 506 B11R0.1 CCCC(=O)NC(C)CN(C)C 43ca6311275d242256736b1719fee729 [0,1,0,0,0,0|2,0,0]=3 507 B11R0.1 CCCC(=O)N[C@@H](C)CN(C)C db08466673e0b842c42a4683e8c019d0 [0,1,0,0,0,0|2,0,0]=3 508 B11R0.1 CCCC(=O)N[C@H](C)CN(C)C 881f902061bda24000687f374d552928 [0,1,0,0,0,0|2,0,0]=3 509 B11R0.1 CCCC(=S)OC(C)CC(C)C a2f635aabd122178511e77a0b067e3cd [0,1,0,0,0,0|0,1,0]=2 510 B11R0.1 CCCC(C)NC(C)CC(C)C b8ccdbdcf962b5112f8fd5381c1c5516 [0,1,0,0,0,0|2,0,1]=4 511 B11R0.1 CCCC(C)OC(C)CC(C)C 45f96d85dd45d2e3c3c52b2052ef5fb1 [0,1,0,0,0,0|1,0,1]=3 512 B11R0.1 CCCC(C)OC(C)CN(C)C d739a9ce3d079028ed823e83b72e7250 [0,1,0,0,0,0|2,0,1]=4 513 B11R0.1 CCCC(C)O[C@@H](C)CC(C)C a9563f5391943eb639a04b5d46bc0d97 [0,1,0,0,0,0|1,0,1]=3 514 B11R0.1 CCCC(C)O[C@@H](C)CN(C)C 0475522bc681d6e0d7282491bc536af2 [0,1,0,0,0,0|2,0,1]=4 515 B11R0.1 CCCC(C)O[C@H](C)CC(C)C 94b53d3ce002a11c12c20f2a1dbbeea1 [0,1,0,0,0,0|1,0,1]=3 516 B11R0.1 CCCC(C)O[C@H](C)CN(C)C 357419798b8b9a14107be4559830cda3 [0,1,0,0,0,0|2,0,1]=4 517 B11R0.1 CCC[C@@H](C)OC(C)CC(C)C 23f85ea0395218283d680f8202b94523 [0,1,0,0,0,0|1,0,1]=3 518 B11R0.1 CCC[C@H](C)NC(C)CC(C)C 6a497ddbf121e1b3c8c603c2bab61088 [0,1,0,0,0,0|2,0,1]=4 519 B11R0.1 CCC[C@H](C)OC(C)CC(C)C 5cee17a2a8fef2bc02f9aca57cf820b6 [0,1,0,0,0,0|1,0,1]=3 520 B11R0.1 CCNC(=O)CN(C)CC(C)C 689ed188845fc9528bd4ce68d27550fe [0,1,0,0,0,0|3,0,0]=4 521 B11R0.1 CCOC(=O)CC(C)NC(C)C 87967f1bcc82d607b266013e672ee945 [0,1,0,0,0,0|3,0,0]=4 522 B11R0.1 CCOC(=O)CC(C)OC(C)C ed6d41e6a600bcd65ce8de3f212ce8cf [0,1,0,0,0,0|3,0,0]=4 523 B11R0.1 CCOC(=O)CN(C)CC(C)C db0377608e977c9764f9e6a0cce393c0 [0,1,0,0,0,0|3,0,0]=4 524 B11R0.1 CCOC(=O)C[C@@H](C)OC(C)C 7347bb1aae1a40c717e2d690d05124a8 [0,1,0,0,0,0|3,0,0]=4 525 B11R0.1 CCOC(=O)C[C@H](C)OC(C)C 4fe157ab2d9270c56c979a21c9ab0817 [0,1,0,0,0,0|3,0,0]=4 526 B11R0.1 CCOC(=O)OC(C)OC(C)C 52cb26f7ca471e00899a464874a15843 [0,1,0,0,0,0|2,0,0]=3 527 B11R0.1 COCC(=O)CN(C)CC(C)C 19d7cfcdde60c86cf58414964ab30a7a [0,1,0,0,0,0|3,0,0]=4 528 B11R0.1 COCC(=O)NC(C)CC(C)C 2bd3a7d3b6a6554d22466bde762ad427 [0,1,0,0,0,0|2,0,0]=3 529 B11R0.1 COCC(=O)NC(C)CC(C)O 5273b0193790c97398bae8c762011931 [0,1,0,0,0,0|3,0,0]=4 530 B11R0.1 COCC(=O)NC(C)CN(C)C f45187e4b0406aecef24e196e2a8e93d [0,1,0,0,0,0|3,0,0]=4 531 B11R0.1 COCC(=O)N[C@@H](C)CN(C)C d7d48c99de55c73b462aa0580079bcad [0,1,0,0,0,0|3,0,0]=4 532 B11R0.1 COCC(=O)N[C@H](C)CN(C)C 9e4a1578e24333787d99da35e9597bc2 [0,1,0,0,0,0|3,0,0]=4 533 B11R0.1 COCC(C)OC(C)CC(C)C 42916e5f9f199eece87c1375fc73e8dc [0,1,0,0,0,0|2,0,1]=4 534 B11R0.1 COCC(C)O[C@@H](C)CC(C)C 873fc4ace772d6e8dd181259f06a4315 [0,1,0,0,0,0|2,0,1]=4 535 B11R0.1 COCC(C)O[C@H](C)CC(C)C 1949ff52fd178ec562e1cca960f80cbc [0,1,0,0,0,0|2,0,1]=4 536 B11R0.1 COC[C@@H](C)OC(C)CC(C)C 9c0ce35ea09b7ab8b8e722452cde9f11 [0,1,0,0,0,0|2,0,1]=4 537 B11R0.1 COC[C@H](C)OC(C)CC(C)C 287947cd97c4ccb1f918830f255c5d90 [0,1,0,0,0,0|2,0,1]=4 538 B11R0.1 CSCC(=O)NC(C)CC(C)C 9bf0b8f03bdcebcca6607185e57a9867 [0,1,0,0,0,0|2,0,0]=3 539 B11R0.1 CSCC(=O)NC(C)CC(C)O d2133a491f5203dbfb07d560a7f0fd31 [0,1,0,0,0,0|3,0,0]=4 540 B11R0.1 CSCC(=O)NC(C)CN(C)C 03e7b318f890514153baf62c8ec3487d [0,1,0,0,0,0|3,0,0]=4 541 B11R0.1 CSCC(=O)N[C@@H](C)CN(C)C 77d913049a6aa344b99ed5788afe366e [0,1,0,0,0,0|3,0,0]=4 542 B11R0.1 CSCC(=O)N[C@H](C)CN(C)C 7b0d61a037a10170f2e363be9f898c39 [0,1,0,0,0,0|3,0,0]=4 543 B11R0.1 CSCC(C)OC(C)CC(C)C 5b75dbf979979a303ef9ce8713e7bc9e [0,1,0,0,0,0|2,0,1]=4 544 B11R0.1 C[C@@H](CN(C)C)NC(=O)CCF f127abe6859b36c59a194d456c3e7ade [0,1,0,0,0,0|3,0,0]=4 545 B11R0.1 C[C@@H](CN(C)C)NC(=O)CCO fc57eb8e501783e2289bbf110ef7af9f [0,1,0,0,0,0|3,0,0]=4 546 B11R0.1 C[C@@H](CN(C)C)NC(=O)CCS 9a804477e706b77e8e956073525f69fa [0,1,0,0,0,0|3,0,0]=4 547 B11R0.1 C[C@H](CN(C)C)NC(=O)CCF baafeb4f6d0f9847b23f459d62de0954 [0,1,0,0,0,0|3,0,0]=4 548 B11R0.1 C[C@H](CN(C)C)NC(=O)CCO 6393e4c93e3658f3e4cc8c697213e69e [0,1,0,0,0,0|3,0,0]=4 549 B11R0.1 C[C@H](CN(C)C)NC(=O)CCS 58efde9d43729ac83144f3c805cd4cbf [0,1,0,0,0,0|3,0,0]=4 550 B11R0.6 C/C(=C/C(=O)NCCC(C)C)/Cl 2e9c0a2859f44cfebd2275db686e18de [0,1,0,0,0,0|1,0,2]=4 551 B11R0.6 C/C(=C/C(=O)NCCC(C)C)/I 15d43a10bb45df89884bc54ecbf8161c [0,1,0,0,0,0|1,0,2]=4 552 B11R0.6 C/C(=C\C(=O)NCCC(C)C)/Cl adf9c5411308e85e3954d3a43b7159ca [0,1,0,0,0,0|1,0,2]=4 553 B11R0.6 C=C(C)CC(=O)NCCC(C)C bab245f3e155a07d5f01c573e9b757ea [0,1,0,0,0,0|1,0,1]=3 554 B11R0.6 C=C(C)CC(=O)NCCC(C)O 2c502d7b4cc2cd4eab0e141e9ddf1750 [0,1,0,0,0,0|2,0,1]=4 555 B11R0.6 C=C(C)CC(=O)NCCN(C)C 2048467dd8ab3c4328b016d5ed3a7381 [0,1,0,0,0,0|2,0,1]=4 556 B11R0.6 C=C(C)CC(=O)NCC[C@@H](C)O 29d96ae7880d27042f90ad1cf7478c95 [0,1,0,0,0,0|2,0,1]=4 557 B11R0.6 C=C(C)CC(=O)NCC[C@H](C)O 8e4f7aa60d92c043bb6b06ea13dcf1db [0,1,0,0,0,0|2,0,1]=4 558 B11R0.6 C=C(C)CCNC(=O)CC(C)C 943f91b737273dfa6921f9fa6a7d8472 [0,1,0,0,0,0|1,0,2]=4 559 B11R0.6 C=C(C)CCNC(=O)CC(C)O ff94bd0f9d644576dad4bac036329ab3 [0,1,0,0,0,0|1,0,2]=4 560 B11R0.6 C=C(C)CCNC(=O)C[C@@H](C)O 6daeefde9723b37c2e773238b5db4def [0,1,0,0,0,0|1,0,2]=4 561 B11R0.6 C=C(C)CCNC(=O)C[C@H](C)O 96ff33c2a7d2404233ed4b85a64d6025 [0,1,0,0,0,0|1,0,2]=4 562 B11R0.6 CC(=CC(=O)NCCC(C)C)C 13f49bb076ebb483b7b751c41a046f9a [0,1,0,0,0,0|1,0,2]=4 563 B11R0.6 CC(=CC(=O)NCCC(C)C)I 117cf12deff4c52c2d1c5ac771bd81dc [0,1,0,0,0,0|1,0,2]=4 564 B11R0.6 CC(=CCNC(=O)CC(C)C)C 9e1a17e89b7a3263f622c42fda90d495 [0,1,0,0,0,0|1,0,2]=4 565 B11R0.6 CC(=CCNC(=O)CC(C)O)C 9f074d5b2a5bb51819dc4ae4afa3fa13 [0,1,0,0,0,0|1,0,2]=4 566 B11R0.6 CC(=CCNC(=O)C[C@@H](C)O)C fe3b9600e3d1005103c0830668037081 [0,1,0,0,0,0|1,0,2]=4 567 B11R0.6 CC(=CCNC(=O)C[C@H](C)O)C 2976f327d175feee18e3f03cd52e47f8 [0,1,0,0,0,0|1,0,2]=4 568 B11R0.6 CC(=O)CC(=O)NCCC(C)C 53e00e5cd85132f6eca47d4b0d055255 [0,1,0,0,0,0|1,0,1]=3 569 B11R0.6 CC(=O)CC(=O)NCCC(C)O aa6c935746154991a70ca5f2ba4ee792 [0,1,0,0,0,0|2,0,1]=4 570 B11R0.6 CC(=O)CC(=O)NCCN(C)C 1559e61a79fab4dbe2e777120df0d000 [0,1,0,0,0,0|2,0,1]=4 571 B11R0.6 CC(=O)CC(=O)NCC[C@@H](C)O 21fdd4092010e51812f0348366399bb2 [0,1,0,0,0,0|2,0,1]=4 572 B11R0.6 CC(=O)CC(=O)NCC[C@H](C)O 62aa392ce88ad75114329d7ff310e47d [0,1,0,0,0,0|2,0,1]=4 573 B11R0.6 CC(C)CC(=O)CNCC(C)O aa05582e1c3de0ecd280d004420d75c9 [0,1,0,0,0,0|3,0,0]=4 574 B11R0.6 CC(C)CC(=O)CNC[C@@H](C)O edb52a5c01f01d49121e36dc731020d1 [0,1,0,0,0,0|3,0,0]=4 575 B11R0.6 CC(C)CC(=O)CNC[C@H](C)O ed27fe83448d952a63a5b224078d3e0c [0,1,0,0,0,0|3,0,0]=4 576 B11R0.6 CC(C)CC(=O)COCC(C)F 8b44c4bcbf57981207a3ff5e29bdf5ea [0,1,0,0,0,0|3,0,0]=4 577 B11R0.6 CC(C)CC(=O)COCC(C)S d24f8dbb341dca6c41e8194d7cb71eb5 [0,1,0,0,0,0|3,0,0]=4 578 B11R0.6 CC(C)CC(=O)COC[C@@H](C)F 8bbacd9cb38388b9d2caad7f65c0cb4c [0,1,0,0,0,0|3,0,0]=4 579 B11R0.6 CC(C)CC(=O)COC[C@H](C)F 7849f9ce2ab856ee3730df1271021acd [0,1,0,0,0,0|3,0,0]=4 580 B11R0.6 CC(C)CC(=O)NCCC(C)O 26be34f13946ea92a8c9f4f1eb0c7b39 [0,1,0,0,0,0|2,0,0]=3 581 B11R0.6 CC(C)CC(=O)NCCC(F)F 2c0eb5f13ab17c771ee664b563622af6 [0,1,0,0,0,0|3,0,0]=4 582 B11R0.6 CC(C)CC(=O)NCCN(C)C 510e43e7de1c9742aefc8ada8f1670e9 [0,1,0,0,0,0|2,0,0]=3 583 B11R0.6 CC(C)CC(=O)NCCS(=O)C d483f3b1be8286968c68f4b755cadcbc [0,1,0,0,0,0|3,0,0]=4 584 B11R0.6 CC(C)CC(=O)NCC[C@@H](C)O 3fda0e9dfb428e372c5ef6c1a3c4e9db [0,1,0,0,0,0|2,0,0]=3 585 B11R0.6 CC(C)CC(=O)NCC[C@H](C)O 9427d701f3614a3e60bcd69d44f1e3c5 [0,1,0,0,0,0|2,0,0]=3 586 B11R0.6 CC(C)CC(=O)OCOC(C)C d84a8c9d4098906a28dbc221d53f7da3 [0,1,0,0,0,0|1,0,0]=2 587 B11R0.6 CC(C)CC(C)OCCN(C)C 967acd314764205e36e8c5af3c594a4c [0,1,0,0,0,0|2,0,1]=4 588 B11R0.6 CC(C)CC(C)OCOC(C)C 1360a48c104cca589c83ae0dc58e73ca [0,1,0,0,0,0|2,0,1]=4 589 B11R0.6 CC(C)CCCN(C)CC(C)C f3860619b1ac786ce801ebecd6300362 [0,1,0,0,0,0|3,0,0]=4 590 B11R0.6 CC(C)CCCN(C)CC(C)O 9419573cb0c0ef404fed976ebe675d4e [0,1,0,0,0,0|3,0,0]=4 591 B11R0.6 CC(C)CCCN(C)C[C@H](C)O 0415054830bd38fb38bcb5cafdeee576 [0,1,0,0,0,0|3,0,0]=4 592 B11R0.6 CC(C)CCNC(=O)CC(=O)N 735973fa89de237c49bfc638f6334d5f [0,1,0,0,0,0|2,0,1]=4 593 B11R0.6 CC(C)CCNC(=O)CC(C)C bae70861bb3d983ea6d4b92fd0717836 [0,1,0,0,0,0|1,0,0]=2 594 B11R0.6 CC(C)CCNC(=O)CC(C)O 759ecc64fbfc75697e582228335e27d6 [0,1,0,0,0,0|1,0,0]=2 595 B11R0.6 CC(C)CCNC(=O)CC(F)F 0cae7cf66fb9888e3c2c443d23de1f47 [0,1,0,0,0,0|2,0,0]=3 596 B11R0.6 CC(C)CCNC(=O)CN(C)C 73d93dd59ebcd717cb6bef83f7f9aaf7 [0,1,0,0,0,0|2,0,0]=3 597 B11R0.6 CC(C)CCNC(=O)C[C@@H](C)O 0e077192d6d18493c84c5d156d0db962 [0,1,0,0,0,0|1,0,0]=2 598 B11R0.6 CC(C)CCNC(=O)C[C@H](C)O a728338201e00417f0173a0fe4b2bf3b [0,1,0,0,0,0|1,0,0]=2 599 B11R0.6 CC(C)CCNC(C)CC(C)C 2fe5eb12012349464c2e276238af3216 [0,1,0,0,0,0|2,0,1]=4 600 B11R0.6 CC(C)CCNC(C)CC(C)O 26c46873ed14866ea0da88e1b1afe8f0 [0,1,0,0,0,0|2,0,1]=4 601 B11R0.6 CC(C)CCOC(C)CC(C)C 22c9fa37f02754572937cd210e2a9653 [0,1,0,0,0,0|1,0,1]=3 602 B11R0.6 CC(C)CCOC(C)CN(C)C 9629f047410a1d9baf5f995d43ade31a [0,1,0,0,0,0|2,0,1]=4 603 B11R0.6 CC(C)CCO[C@@H](C)CC(C)C 234ed5a5ae6c7c86b0884970bfca4f61 [0,1,0,0,0,0|1,0,1]=3 604 B11R0.6 CC(C)CCO[C@@H](C)CN(C)C 5a47c8dc10e9e0ff5cb276023d7bbaaa [0,1,0,0,0,0|2,0,1]=4 605 B11R0.6 CC(C)CCO[C@H](C)CC(C)C ff25de0819ace2633494e371a5a70852 [0,1,0,0,0,0|1,0,1]=3 606 B11R0.6 CC(C)CCO[C@H](C)CN(C)C 4ede87d0e4177922ac4772d080f86139 [0,1,0,0,0,0|2,0,1]=4 607 B11R0.6 CC(C)CNCC(=O)CC(C)C fb0ff36760a4c7aba0485e3fc85ee7de [0,1,0,0,0,0|2,0,0]=3 608 B11R0.6 CC(C)CNCC(=O)NC(C)C 8e6835917d3ee08d06842a2f7a9f9a3f [0,1,0,0,0,0|3,0,0]=4 609 B11R0.6 CC(C)CNCC(=O)OC(C)C df8f05106dd919535c01953401463f39 [0,1,0,0,0,0|3,0,0]=4 610 B11R0.6 CC(C)COCC(=O)CC(C)C 71730b1ed4f0e46c7a8617758835495b [0,1,0,0,0,0|2,0,0]=3 611 B11R0.6 CC(C)COCC(=O)NC(C)C b8c3a50ad2dc434c5aa1f0a18c0ecdae [0,1,0,0,0,0|3,0,0]=4 612 B11R0.6 CC(C)COCC(=O)OC(C)C 04d7d2a44157144ababd597b5d38b5f2 [0,1,0,0,0,0|3,0,0]=4 613 B11R0.6 CC(C)C[C@@H](C)OCCN(C)C e77c490ef21bb2e33c5be693d1528323 [0,1,0,0,0,0|2,0,1]=4 614 B11R0.6 CC(C)C[C@@H](C)OCOC(C)C 7dda9257cf06f21e60877cd940e7d507 [0,1,0,0,0,0|2,0,1]=4 615 B11R0.6 CC(C)C[C@H](C)OCCN(C)C fdb095751d4bdb0d49f846f7485f5e34 [0,1,0,0,0,0|2,0,1]=4 616 B11R0.6 CC(C)C[C@H](C)OCOC(C)C 2ecc02beb539ead40c8481e837f9aaaa [0,1,0,0,0,0|2,0,1]=4 617 B11R0.6 CC(C)NC(=O)CCOC(C)C 3933910c638455f124ba54ded05a12d7 [0,1,0,0,0,0|3,0,0]=4 618 B11R0.6 CC(C)OCCC(=O)OC(C)C 09b385d2f40c5c589553219134de2e1e [0,1,0,0,0,0|3,0,0]=4 619 B11R0.6 CC(C)OCOC(=O)OC(C)C a6a075bc52c6221c2da82baa5d8a3497 [0,1,0,0,0,0|2,0,0]=3 620 B11R0.6 CC(O)CC(=O)NCCC(F)F be274fedea2730011a0a3c24300c1216 [0,1,0,0,0,0|3,0,0]=4 621 B11R0.6 CC(O)CC(=O)NCCN(C)C 66be2f383702f2c723b9371bb23a5103 [0,1,0,0,0,0|2,0,0]=3 622 B11R0.6 CC(O)CC(=O)NCCS(=O)C 0ff1c94b788af60049d7e0e4c9fdc5e2 [0,1,0,0,0,0|3,0,0]=4 623 B11R0.6 CC(O)CC(=O)NCC[C@@H](C)O e138df825a9ce740ced64b99f34056d0 [0,1,0,0,0,0|2,0,0]=3 624 B11R0.6 CC(O)CC(=O)NCC[C@H](C)O ca7d3764b8473fb8890eaf063fc68e95 [0,1,0,0,0,0|2,0,0]=3 625 B11R0.6 CC(O)CCNC(=O)CC(C)O 0e5bee4d97dd286d0acec3dd9f06f7fc [0,1,0,0,0,0|2,0,0]=3 626 B11R0.6 CC(O)CCNC(=O)CC(F)F 539b1948fde11b0e9d1203673fba62c9 [0,1,0,0,0,0|3,0,0]=4 627 B11R0.6 CC(O)CCNC(=O)CN(C)C 0c2f5ab9c1dfbe3e27cd863f7bd335f7 [0,1,0,0,0,0|3,0,0]=4 628 B11R0.6 CC(O)CCNC(=O)C[C@@H](C)O b875c8b4ff80e7782e3ff2081f58f2ce [0,1,0,0,0,0|2,0,0]=3 629 B11R0.6 CC(O)CCNC(=O)C[C@H](C)O 0883593d21bf9d73927c7be7b207ce3b [0,1,0,0,0,0|2,0,0]=3 630 B11R0.6 CN(C)CCNC(=O)CC(F)F de28288a825bb3198d52b637d687a9ef [0,1,0,0,0,0|3,0,0]=4 631 B11R0.6 CN(C)CCNC(=O)CN(C)C dab6662aa7314e8e9dc3b63edfdfc261 [0,1,0,0,0,0|3,0,0]=4 632 B11R0.6 C[C@@H](O)CC(=O)NCCC(F)F da8a16c73b67ac24bb98a4b9146bea88 [0,1,0,0,0,0|3,0,0]=4 633 B11R0.6 C[C@@H](O)CC(=O)NCCN(C)C 8e2063cfd8d62b23bcb6bc3cec0770f1 [0,1,0,0,0,0|2,0,0]=3 634 B11R0.6 C[C@@H](O)CC(=O)NCCS(=O)C 3065e7ce49aef98028555612579d0ea8 [0,1,0,0,0,0|3,0,0]=4 635 B11R0.6 C[C@@H](O)CCNC(=O)CC(F)F 17081b4d16dcbff49fbf8db80298abab [0,1,0,0,0,0|3,0,0]=4 636 B11R0.6 C[C@@H](O)CCNC(=O)CN(C)C 7d9793a479d3cbeffd740c381fe8bb30 [0,1,0,0,0,0|3,0,0]=4 637 B11R0.6 C[C@@H](O)CCNC(=O)C[C@@H](C)O d7a308abcf1d943cc99de838d21b0e49 [0,1,0,0,0,0|2,0,0]=3 638 B11R0.6 C[C@H](O)CC(=O)NCCC(F)F bd0188230acee2fe0c803401f8e5f863 [0,1,0,0,0,0|3,0,0]=4 639 B11R0.6 C[C@H](O)CC(=O)NCCN(C)C c458c6994b5c15b7984d614100b7a92a [0,1,0,0,0,0|2,0,0]=3 640 B11R0.6 C[C@H](O)CC(=O)NCCS(=O)C 34583117b81d2af750da30df06c48051 [0,1,0,0,0,0|3,0,0]=4 641 B11R0.6 C[C@H](O)CC(=O)NCC[C@@H](C)O e3015a4adde934ed116ca2210892f76e [0,1,0,0,0,0|2,0,0]=3 642 B11R0.6 C[C@H](O)CCNC(=O)CC(F)F 1167df4a2ae9effcbe220146c7c696e4 [0,1,0,0,0,0|3,0,0]=4 643 B11R0.6 C[C@H](O)CCNC(=O)CN(C)C 4161e5595ceb07c16880ce7ae585fe13 [0,1,0,0,0,0|3,0,0]=4 644 B11R0.6 C[C@H](O)CCNC(=O)C[C@@H](C)O 2db8fd12c4d5e7632e4266b31c2e2b8b [0,1,0,0,0,0|2,0,0]=3 645 B11R0.6 C[C@H](O)CCNC(=O)C[C@H](C)O 4885875aaa065d77f016dd67ebda4422 [0,1,0,0,0,0|2,0,0]=3 646 B11R0.45 C#CC(CCC)OCCC(C)C a55357efcce905e7514249352f179cb6 [0,1,0,0,0,0|1,0,1]=3 647 B11R0.45 C#CC(CCC)OCCN(C)C 49eda9ac835ef35141fc86910f8e17ea [0,1,0,0,0,0|2,0,1]=4 648 B11R0.45 C#CC(CCC)OCOC(C)C d7e0dfbde8bdad1b9bdef5e764ce95c3 [0,1,0,0,0,0|2,0,1]=4 649 B11R0.45 C=CC(CCC)OCCC(C)C f25e9e6158d3205076e0c7a1d0153c30 [0,1,0,0,0,0|1,0,1]=3 650 B11R0.45 C=CC(CCC)OCCN(C)C d58ee5d8e496516fb6ae4d42a94daac4 [0,1,0,0,0,0|2,0,1]=4 651 B11R0.45 C=CC(CCC)OCOC(C)C 3513ebedc4a9f7d2fb416a3abf405a16 [0,1,0,0,0,0|2,0,1]=4 652 B11R0.45 CC(C)CCOC(CBr)CCBr 76cb76049a48e4239a337c2a7ffc7532 [0,1,0,0,0,0|2,0,1]=4 653 B11R0.45 CC(C)CCOC(CCl)CCCl 15ca888201a84b905eb88be944125702 [0,1,0,0,0,0|2,0,1]=4 654 B11R0.45 CC(C)CCO[C@@H](CO)CCO 3f5804de983d35b03621cbcdca02bead [0,1,0,0,0,0|1,0,2]=4 655 B11R0.45 CCC(COC)OCCC(C)C c68d78ee4447eeefd4b02df26765665b [0,1,0,0,0,0|2,0,1]=4 656 B11R0.45 CCC(CSC)OCCC(C)C c6d0e3f4cdf8ddf459db533dcd8ca64d [0,1,0,0,0,0|2,0,1]=4 657 B11R0.45 CCCC(C#N)OCCC(C)C 3174231ac24254bb9aa28134302c775f [0,1,0,0,0,0|1,0,1]=3 658 B11R0.45 CCCC(C#N)OCCN(C)C 711a9c395316a59f46c699d4cb9abf3c [0,1,0,0,0,0|2,0,1]=4 659 B11R0.45 CCCC(C#N)OCOC(C)C 775fd4abf64dd6b22f287508cb501f3b [0,1,0,0,0,0|2,0,1]=4 660 B11R0.45 CCCC(CC)NCCC(C)C 821d3c161e914de07a5f91ffa9934f4f [0,1,0,0,0,0|2,0,1]=4 661 B11R0.45 CCCC(CC)OCCC(C)C e18c53d5076ab1943dc0c524212d898b [0,1,0,0,0,0|1,0,1]=3 662 B11R0.45 CCCC(CC)OCCN(C)C 6f097d4bdc3517eb1c7b1a09442e7713 [0,1,0,0,0,0|2,0,1]=4 663 B11R0.45 CCCC(CC)OCOC(C)C cb1221c566522481b2498f3eae1339ee [0,1,0,0,0,0|2,0,1]=4 664 B11R0.45 CCCC(CO)NCCC(C)C d21c0b7081cad2192a2dba3d1d3c6e42 [0,1,0,0,0,0|1,0,2]=4 665 B11R0.45 CCCN(C=O)CCCN(C)C de07fc4d23da10b8544a573bac7bb910 [0,1,0,0,0,0|3,0,0]=4 666 B11R0.45 CCCN(CC)CCCC(C)C 4cafd9319a2ee7fa2d3226314d70b6bf [0,1,0,0,0,0|3,0,0]=4 667 B11R0.45 CCC[C@@H](CC)OCCC(C)C 59f9bfa67cba20fed5643a4676abf934 [0,1,0,0,0,0|1,0,1]=3 668 B11R0.45 CCC[C@@H](CC)OCCN(C)C 8f5ace66cf031bdb7f5307095b26bbe3 [0,1,0,0,0,0|2,0,1]=4 669 B11R0.45 CCC[C@@H](CC)OCOC(C)C c4c2a61f65bfa403395ed64282927e78 [0,1,0,0,0,0|2,0,1]=4 670 B11R0.45 CCC[C@@H](CO)NCCC(C)C fdca7f9b5d563f2576fe080f13b9a713 [0,1,0,0,0,0|1,0,2]=4 671 B11R0.45 CCC[C@H](CO)NCCC(C)C 2b278f88ef34eca50f1c55f1820f1fd1 [0,1,0,0,0,0|1,0,2]=4 672 B11R0.59 C#CCC(=O)N(C)CCC(C)C 37dfd9c7b74dc0e88773c4a132a52751 [0,1,0,0,0,0|1,0,2]=4 673 B11R0.59 C/C=C/C(=O)N(C)CCC(C)C e014c6b323416291dd8069a57e5790e1 [0,1,0,0,0,0|1,0,2]=4 674 B11R0.59 C=C(CCC)C(=O)NCC(C)C cc1d9986997c6525412f8b8122254d70 [0,1,0,0,0,0|3,0,0]=4 675 B11R0.59 C=C(COC(C)C)C(=O)OCC 78338dd125943d7d95c10f10361682ee [0,1,0,0,0,0|3,0,0]=4 676 B11R0.59 C=CCC(=O)N(C)CCC(C)C 8b2bb56761fb3ec8069f622ad10490a2 [0,1,0,0,0,0|1,0,2]=4 677 B11R0.59 CC#CC(=O)N(C)CCC(C)C 4fb79f8f5fc57f6658bc076b605387ba [0,1,0,0,0,0|1,0,2]=4 678 B11R0.59 CC(C)CCN(C)C(=O)CC#N 4ba2ab7483db52cf4c17cf12d55f582c [0,1,0,0,0,0|2,0,1]=4 679 B11R0.59 CC(C)CCN(C)C(=O)CC=O e612a8377bf3f351bdac373ebb6d5c99 [0,1,0,0,0,0|2,0,1]=4 680 B11R0.59 CC(C)CCN(C)C(=O)CCF 191a302e0c8270d772e99517a6cc1887 [0,1,0,0,0,0|2,0,0]=3 681 B11R0.59 CC(C)CCN(C)C(=O)CCO a6f60d72f0eaac4512054b44cbc73857 [0,1,0,0,0,0|2,0,0]=3 682 B11R0.59 CC(C)CCN(C)C(=O)CCS 1f414f9b624c61097cbb5624c5b6c10c [0,1,0,0,0,0|2,0,0]=3 683 B11R0.59 CC(C)CCN(C)C(=O)CON a93a834f7188e44fc4b42d8018611a65 [0,1,0,0,0,0|3,0,0]=4 684 B11R0.59 CC(O)CCN(C)C(=O)CCF 63df06d7a3a4409a4a98d33f6d0541c0 [0,1,0,0,0,0|3,0,0]=4 685 B11R0.59 CC(O)CCN(C)C(=O)CCO 574b0be243b84076ee85f1a30201abc1 [0,1,0,0,0,0|3,0,0]=4 686 B11R0.59 CC(O)CCN(C)C(=O)CCS 1659b7eaf6caffbf3d82b9a0b385cad2 [0,1,0,0,0,0|3,0,0]=4 687 B11R0.59 CCCC(=O)C(=O)NCC(C)C 750f70eb48855c8aae4c76d8798ee559 [0,1,0,0,0,0|2,0,0]=3 688 B11R0.59 CCCC(=O)C(=O)NCC(C)O 5833a75f6e6fecf559de17ede7defbf7 [0,1,0,0,0,0|3,0,0]=4 689 B11R0.59 CCCC(=O)C(=O)NC[C@@H](C)O 806115f9374abf6a69117286b6918771 [0,1,0,0,0,0|3,0,0]=4 690 B11R0.59 CCCC(=O)C(=O)NC[C@H](C)O 639753712442340f5ea2ac743f81eac3 [0,1,0,0,0,0|3,0,0]=4 691 B11R0.59 CCCC(=O)N(C)CCC(C)C d0748a90e32b2c2f38887403fad9758b [0,1,0,0,0,0|1,0,0]=2 692 B11R0.59 CCCC(=O)N(C)CCC(C)O eb55f08247fa4c04fa71079c1953e8b7 [0,1,0,0,0,0|2,0,0]=3 693 B11R0.59 CCCC(=O)N(C)CCC(F)F 6e1d5ad551d8daff09f137906c1c22b9 [0,1,0,0,0,0|3,0,0]=4 694 B11R0.59 CCCC(=O)N(C)CCN(C)C a8a188599734c7a48a9f1bc495033b38 [0,1,0,0,0,0|2,0,0]=3 695 B11R0.59 CCCC(C)N(C)CCC(C)C 41b393947da8c14cd9d44a76f76440f9 [0,1,0,0,0,0|2,0,1]=4 696 B11R0.59 CCCN(C)C(=O)CCC(C)C 4ab213d09088a7e52edbf05d9136c68b [0,1,0,0,0,0|3,0,0]=4 697 B11R0.59 CCCN(C)C(C)CCC(C)C 9f0185c7b670826803f6c3e1968f57c4 [0,1,0,0,0,0|3,0,0]=4 698 B11R0.59 CCNC(=O)C(=O)NCC(C)C 2a8ff276e9c989232659218b02da0279 [0,1,0,0,0,0|3,0,0]=4 699 B11R0.59 CCNC(=O)C(C)NCC(C)C 314860dd8f43ced386dfb2ce288589f0 [0,1,0,0,0,0|3,0,0]=4 700 B11R0.59 CCNC(=O)C(C)OCC(C)C 1ab6d1427c238c6b7f939125f027a1a4 [0,1,0,0,0,0|3,0,0]=4 701 B11R0.59 CCNC(=O)[C@H](C)NCC(C)C ed279a16ec9b87f7808047984006f3dd [0,1,0,0,0,0|3,0,0]=4 702 B11R0.59 CCOC(=O)C(=O)NCC(C)C 0362ae8d0deaaba77818b0fbb05e7cae [0,1,0,0,0,0|3,0,0]=4 703 B11R0.59 CCOC(=O)C(C)CNC(C)C bc7a142ea044e32f1cee641cd4e6dac3 [0,1,0,0,0,0|3,0,0]=4 704 B11R0.59 CCOC(=O)C(C)COC(C)C ccc25f570d0d7ec27bdce118125e7c34 [0,1,0,0,0,0|3,0,0]=4 705 B11R0.59 CCOC(=O)C(C)NCC(C)C 9c2f852d5042ee55b615db5a3640da77 [0,1,0,0,0,0|3,0,0]=4 706 B11R0.59 CCOC(=O)C(C)OCC(C)C 465cae5bf31618dba1e615cc4f122cfb [0,1,0,0,0,0|3,0,0]=4 707 B11R0.59 CCOC(=O)C(F)NCC(C)C 1ab7f201439a17ecc8673a2a527873f2 [0,1,0,0,0,0|3,0,0]=4 708 B11R0.59 CCOC(=O)C(F)OCC(C)C d21d24693337a3213aa906498cf57290 [0,1,0,0,0,0|3,0,0]=4 709 B11R0.59 CCOC(=O)[C@@H](C)NCC(C)C 5e81311f4d4aa2695b3824b525fed593 [0,1,0,0,0,0|3,0,0]=4 710 B11R0.59 CCOC(=O)[C@@H](C)OCC(C)C 6a66ec71edf3e8fd42a76bcd9c3c8053 [0,1,0,0,0,0|3,0,0]=4 711 B11R0.59 CCOC(=O)[C@H](C)NCC(C)C 4dc6f31d1786317dc0b8e9bd12ddab39 [0,1,0,0,0,0|3,0,0]=4 712 B11R0.59 CCOC(=O)[C@H](C)OCC(C)C e3de72b10176763f0431820a9896f443 [0,1,0,0,0,0|3,0,0]=4 713 B11R0.59 CN(C)CCN(C)C(=O)CCF 4905a819f6c8f2ce7c62873e8ee01799 [0,1,0,0,0,0|3,0,0]=4 714 B11R0.59 CN(C)CCN(C)C(=O)CCO a3013261c75efbb616d0b30d0f302f04 [0,1,0,0,0,0|3,0,0]=4 715 B11R0.59 CN(C)CCN(C)C(=O)CCS 5546079ae240c44084b125512cb56438 [0,1,0,0,0,0|3,0,0]=4 716 B11R0.59 COCC(=O)N(C)CCC(C)C bba041e23937b7234df16f845a9195b7 [0,1,0,0,0,0|2,0,0]=3 717 B11R0.59 COCC(=O)N(C)CCC(C)O 1bf99d90a9b257f88da38ecbce9bbe32 [0,1,0,0,0,0|3,0,0]=4 718 B11R0.59 COCC(=O)N(C)CCN(C)C 434315e7275ebb9397f55202b3a4204f [0,1,0,0,0,0|3,0,0]=4 719 B11R0.59 CSCC(=O)N(C)CCC(C)C 4c13e64035bf28f5084ec9f5a1a20e9b [0,1,0,0,0,0|2,0,0]=3 720 B11R0.59 CSCC(=O)N(C)CCC(C)O 51fd49a7785eba77b4a61f4fb52ad55a [0,1,0,0,0,0|3,0,0]=4 721 B11R0.59 CSCC(=O)N(C)CCN(C)C aa26fabb6f1e06285629b4b6896e4573 [0,1,0,0,0,0|3,0,0]=4 722 B11R0.141 C#CCC(=O)NCC(O)C(C)C 0a4f2bb91f2f480f929d5044f8f562e5 [0,1,0,0,0,0|1,0,2]=4 723 B11R0.141 C/C=C/C(=O)NCC(O)C(C)C a44160ef685cea9f04746cf99019b525 [0,1,0,0,0,0|1,0,2]=4 724 B11R0.141 C=CCC(=O)NCC(O)C(C)C 422b0f3635a18c2b1f6ff6e427d7a16a [0,1,0,0,0,0|1,0,2]=4 725 B11R0.141 CC#CC(=O)NCC(O)C(C)C 47be9aabcd122c6371b2aa1d3086473f [0,1,0,0,0,0|1,0,2]=4 726 B11R0.141 CC(C)C(O)CNC(=O)CC#N 6d09dfbc406d1e17c476626a2f6f2d4f [0,1,0,0,0,0|2,0,1]=4 727 B11R0.141 CC(C)C(O)CNC(=O)CC=O 31e2220aa6642a508cb4c7fd133cf139 [0,1,0,0,0,0|2,0,1]=4 728 B11R0.141 CC(C)C(O)CNC(=O)CCF 7465dd68191f61a1a4031ab308426f2e [0,1,0,0,0,0|2,0,0]=3 729 B11R0.141 CC(C)C(O)CNC(=O)CCO b395020c3b6bacba01d282368d3199c4 [0,1,0,0,0,0|2,0,0]=3 730 B11R0.141 CC(C)C(O)CNC(=O)CCS a973eda8a85ffa74242b189aceb3c07b [0,1,0,0,0,0|2,0,0]=3 731 B11R0.141 CC(C)C(O)CNC(=O)CON 704d1d4a3bf822557c7f132e474dae8f [0,1,0,0,0,0|3,0,0]=4 732 B11R0.141 CC(CNC(=O)CCF)N(C)C 48638f049938d3a660e0820b2a6dd0a6 [0,1,0,0,0,0|3,0,0]=4 733 B11R0.141 CC(CNC(=O)CCO)N(C)C 576126489e37ecf63b811d574d4db7c2 [0,1,0,0,0,0|3,0,0]=4 734 B11R0.141 CC(CNC(=O)CCS)N(C)C 345096acb6c7c6fb22ab7269bb525e5d [0,1,0,0,0,0|3,0,0]=4 735 B11R0.141 CCCC(=O)CNC(C)C(C)C 454c1fbbfb71e3eb94b670c64a9633ff [0,1,0,0,0,0|2,0,0]=3 736 B11R0.141 CCCC(=O)CNC(C)C(C)O 1597fa8d82e87edc8e25887c32a45a3a [0,1,0,0,0,0|3,0,0]=4 737 B11R0.141 CCCC(=O)CN[C@@H](C)C(C)C 5202d672f5559eb955088e9de66d9c9a [0,1,0,0,0,0|2,0,0]=3 738 B11R0.141 CCCC(=O)CN[C@H](C)C(C)C ae9e19a95fcd574fa2417f3ef175b8ee [0,1,0,0,0,0|2,0,0]=3 739 B11R0.141 CCCC(=O)COC(C)C(C)C d58852e5cfb515b7bb15eaaf1d9965b3 [0,1,0,0,0,0|2,0,0]=3 740 B11R0.141 CCCC(=O)COC(C)C(C)S 366939f59f1ae3f4682409cda2839311 [0,1,0,0,0,0|3,0,0]=4 741 B11R0.141 CCCC(=O)CO[C@@H](C)C(C)C 7f73d9c7158da273a45ce2ba84e98b5d [0,1,0,0,0,0|2,0,0]=3 742 B11R0.141 CCCC(=O)CO[C@H](C)C(C)C 21fb952273b166afebe649a1661a9f36 [0,1,0,0,0,0|2,0,0]=3 743 B11R0.141 CCCC(=O)NCC(=O)N(C)C d59f33e242e9af9443b6efbb8e78019e [0,1,0,0,0,0|2,0,1]=4 744 B11R0.141 CCCC(=O)NCC(C)N(C)C b10198691bb560e88f8669e3cc90590d [0,1,0,0,0,0|2,0,0]=3 745 B11R0.141 CCCC(=O)NCC(O)C(C)C a3a5fbc7d676842cbc150048af52e717 [0,1,0,0,0,0|1,0,0]=2 746 B11R0.141 CCCC(=O)NCC(O)C(F)F d35a689b18a3c8d7b7d3453a3c0a9e5a [0,1,0,0,0,0|3,0,0]=4 747 B11R0.141 CCCC(=S)OCC(=O)C(C)C 362448127067c62b4881f848673651fb [0,1,0,0,0,0|0,1,1]=3 748 B11R0.141 CCCC(=S)OCC(=O)N(C)C dcfbfd99a2007310c3c4d105be60c44a [0,1,0,0,0,0|1,1,1]=4 749 B11R0.141 CCCC(=S)OCC(C)C(C)C 2d79cdfeb02897c64444aadc26cfb303 [0,1,0,0,0,0|0,1,0]=2 750 B11R0.141 CCCC(C)NCC(C)C(C)C 0bb6155416332b6f8021effd02100989 [0,1,0,0,0,0|2,0,1]=4 751 B11R0.141 CCCC(C)NCC(O)C(C)C 35e69aec06589af34d8ab1a8a8c78674 [0,1,0,0,0,0|2,0,1]=4 752 B11R0.141 CCCC(C)OCC(=O)C(C)C c1fe67d0e91dba3474cf259b77a54939 [0,1,0,0,0,0|1,0,2]=4 753 B11R0.141 CCCC(C)OCC(C)C(C)C 7e52e774d061e84c39dd5016c89d6a6f [0,1,0,0,0,0|1,0,1]=3 754 B11R0.141 CCCC(C)OCC(C)N(C)C 6d16dfa763ec239fd3c0b57dee51133f [0,1,0,0,0,0|2,0,1]=4 755 B11R0.141 CCCC(C)OC[C@@H](C)N(C)C 7ed8d431730d07c8a31de964f4acce33 [0,1,0,0,0,0|2,0,1]=4 756 B11R0.141 CCCC(C)OC[C@H](C)N(C)C 7190fff74816541b09efccb231d7e13d [0,1,0,0,0,0|2,0,1]=4 757 B11R0.141 CCC[C@@H](C)OCC(=O)C(C)C af3087de289b8248cb3826bad4838885 [0,1,0,0,0,0|1,0,2]=4 758 B11R0.141 CCC[C@@H](C)OCC(C)C(C)C cb03073a0afdac8115af776b23a77080 [0,1,0,0,0,0|1,0,1]=3 759 B11R0.141 CCC[C@H](C)NCC(C)C(C)C ca4694caea853db1e7be848e8f6109d6 [0,1,0,0,0,0|2,0,1]=4 760 B11R0.141 CCC[C@H](C)OCC(=O)C(C)C 23bfce1cf89b5fe80ad3855c59e63d60 [0,1,0,0,0,0|1,0,2]=4 761 B11R0.141 CCC[C@H](C)OCC(C)C(C)C 6287d546cf7620b941df7fed430e27c9 [0,1,0,0,0,0|1,0,1]=3 762 B11R0.141 CCNC(=O)CCN(C)C(C)C 4510723fb248ccd85235dff5e1508234 [0,1,0,0,0,0|3,0,0]=4 763 B11R0.141 CCNC(=O)CNC(C)C(C)C aed1e1da789ffd5f1d20060d96d2f1b2 [0,1,0,0,0,0|3,0,0]=4 764 B11R0.141 CCNC(=O)CN[C@@H](C)C(C)C 0cf23e8490dd7f6c3e935f3c6949ae54 [0,1,0,0,0,0|3,0,0]=4 765 B11R0.141 CCNC(=O)CN[C@H](C)C(C)C 8700ad1bfd69939103d85cdd61f008c8 [0,1,0,0,0,0|3,0,0]=4 766 B11R0.141 CCNC(=O)COC(C)C(C)C 732d7ec439415ea3c59915720a1b8c56 [0,1,0,0,0,0|3,0,0]=4 767 B11R0.141 CCNC(=O)CO[C@@H](C)C(C)C 9a81892dbddbf5ddd03ad18c67f9c0bf [0,1,0,0,0,0|3,0,0]=4 768 B11R0.141 CCNC(=O)CO[C@H](C)C(C)C be5bbc857b659ce08fa884a22479665b [0,1,0,0,0,0|3,0,0]=4 769 B11R0.141 CCOC(=O)CCN(C)C(C)C b7d7ea1f5e1751ea3dfe531ceb571ad4 [0,1,0,0,0,0|3,0,0]=4 770 B11R0.141 CCOC(=O)CNC(C)C(C)C 235eeebd56c3369dc79b95d6202319a0 [0,1,0,0,0,0|3,0,0]=4 771 B11R0.141 CCOC(=O)CN[C@@H](C)C(C)C 5643dc2e51f29943157253456a19c68d [0,1,0,0,0,0|3,0,0]=4 772 B11R0.141 CCOC(=O)CN[C@H](C)C(C)C 7560d3a1ad507c07a2e6c9be884141a1 [0,1,0,0,0,0|3,0,0]=4 773 B11R0.141 CCOC(=O)COC(C)C(C)C b3f1e7be6ab9788bfabccab78a016013 [0,1,0,0,0,0|3,0,0]=4 774 B11R0.141 CCOC(=O)CO[C@@H](C)C(C)C 8663f35fa23b9393738317d3933ff2c8 [0,1,0,0,0,0|3,0,0]=4 775 B11R0.141 CCOC(=O)CO[C@H](C)C(C)C e3b5a6cef786da91f7178e304439f60c [0,1,0,0,0,0|3,0,0]=4 776 B11R0.141 CCSC(=O)OCN(C)C(C)C 96bf7b62c634ade2482d1d059af211ed [0,1,0,0,0,0|2,0,0]=3 777 B11R0.141 COCC(=O)COC(C)C(C)C 394b140f685a55a87941940828ff673d [0,1,0,0,0,0|3,0,0]=4 778 B11R0.141 COCC(=O)CO[C@@H](C)C(C)C 5589d11001826465fecd75c09c2a2204 [0,1,0,0,0,0|3,0,0]=4 779 B11R0.141 COCC(=O)CO[C@H](C)C(C)C e66cc006b8c091b117ea2b55c88b1df1 [0,1,0,0,0,0|3,0,0]=4 780 B11R0.141 COCC(=O)NCC(C)N(C)C b1baf0975cb0bc85f825585a460a74bd [0,1,0,0,0,0|3,0,0]=4 781 B11R0.141 COCC(=O)NCC(O)C(C)C 87dba3048003c9942aee6d0f83075d6a [0,1,0,0,0,0|2,0,0]=3 782 B11R0.141 COCC(C)OCC(C)C(C)C 3dd85402f26e400a43993c8fd0cc2bc1 [0,1,0,0,0,0|2,0,1]=4 783 B11R0.141 COC[C@@H](C)OCC(C)C(C)C ab5b5a97b743307fc58074819c45e470 [0,1,0,0,0,0|2,0,1]=4 784 B11R0.141 COC[C@H](C)OCC(C)C(C)C 3650ea2c86d36abee977aee2b5fda5ef [0,1,0,0,0,0|2,0,1]=4 785 B11R0.141 CSCC(=O)NCC(C)N(C)C a245e1bcdc9a8de4aab9378974914a5e [0,1,0,0,0,0|3,0,0]=4 786 B11R0.141 CSCC(=O)NCC(O)C(C)C 0761b2868803dacf9b61a4c290bc5835 [0,1,0,0,0,0|2,0,0]=3 787 B11R0.141 CSCC(C)OCC(C)C(C)C 3e71ab6a0b0bfb330a2b9ce8e39984ff [0,1,0,0,0,0|2,0,1]=4 788 B11R0.145 C#CC(O)C(=O)NCCC(C)C bc24bae739db48ad142a9189c4eafae7 [0,1,0,0,0,0|1,0,2]=4 789 B11R0.145 C/C=C(/C)\C(=O)NCCC(C)C f3e6a8e1e9ae674884f15dc464ded276 [0,1,0,0,0,0|1,0,2]=4 790 B11R0.145 C/C=C(\Br)/C(=O)NCCC(C)C bca484e97326c75d08d75ded801020ec [0,1,0,0,0,0|1,0,2]=4 791 B11R0.145 C/C=C(\C)/C(=O)NCCC(C)C b1925fe967b60ab23544be42e4b2809f [0,1,0,0,0,0|1,0,2]=4 792 B11R0.145 C/C=C(\Cl)/C(=O)NCCC(C)C d54c9976aebe06f64977a18a01e383cb [0,1,0,0,0,0|1,0,2]=4 793 B11R0.145 C/C=C(\O)/C(=O)NCCC(C)C 35b7c929852de819464f493a697d5dc5 [0,1,0,0,0,0|1,0,2]=4 794 B11R0.145 C=C(C)CCNC(=O)C(O)CC c146b242abfa21ccf0b91906ca6d7472 [0,1,0,0,0,0|1,0,2]=4 795 B11R0.145 C=C(C)CCNC(=O)[C@@H](O)CC 589c1bcf2f5ec8876f808d16c4428009 [0,1,0,0,0,0|1,0,2]=4 796 B11R0.145 C=C(C)CCNC(=O)[C@@H](S)CC 738aaa01a7e5a9705a49770661fa38c6 [0,1,0,0,0,0|1,0,2]=4 797 B11R0.145 C=C(C)CCNC(=O)[C@H](O)CC d5c31225e3e85afaa6cdf651cd5cbbb0 [0,1,0,0,0,0|1,0,2]=4 798 B11R0.145 C=C(CC)C(=O)NCCC(C)C 71bf5899f7e0abd6ed0bc400f7801c65 [0,1,0,0,0,0|1,0,1]=3 799 B11R0.145 C=C(CC)C(=O)NCCC(C)O af679f911e26aed80dfa8824bbdc3a4b [0,1,0,0,0,0|2,0,1]=4 800 B11R0.145 C=C(CC)C(=O)NCCN(C)C ba8fb5dd23ed4485a8d4c5bbfac9fa68 [0,1,0,0,0,0|2,0,1]=4 801 B11R0.145 C=C(CC)C(=O)NCC[C@@H](C)O 1396e0fd16a7946e88bf807aa217d842 [0,1,0,0,0,0|2,0,1]=4 802 B11R0.145 C=C(CC)C(=O)NCC[C@H](C)O 8b151872399a8ce3541db587df3f1556 [0,1,0,0,0,0|2,0,1]=4 803 B11R0.145 C=C(CO)C(=O)NCCC(C)C 14fb3747f8d06bc9901ca428f57faee9 [0,1,0,0,0,0|2,0,1]=4 804 B11R0.145 CC(C)CCNC(=O)C(=O)CS 8f29ee7571d973696b84269141d5212e [0,1,0,0,0,0|2,0,1]=4 805 B11R0.145 CC(C)CCNC(=O)C(O)CO a87093941cf8e685af55528dcb3a25c6 [0,1,0,0,0,0|2,0,0]=3 806 B11R0.145 CC(C)CCNC(=O)[C@@H](O)CO 9e565d4c4785df099b20e67668a6d9a7 [0,1,0,0,0,0|2,0,0]=3 807 B11R0.145 CC(C)CCNC(=O)[C@H](O)CF 9ca84c2110ac3ca994c474ab6beb3229 [0,1,0,0,0,0|2,0,0]=3 808 B11R0.145 CC(O)CCNC(=O)C(O)CO 9ad7fc6f36daa66025ca8ece1002be29 [0,1,0,0,0,0|3,0,0]=4 809 B11R0.145 CC(O)CCNC(=O)[C@@H](O)CO 554e9179548077fabda20ce17e3a15a3 [0,1,0,0,0,0|3,0,0]=4 810 B11R0.145 CC(O)CCNC(=O)[C@H](O)CF 38de716aba897a4c8188d5177d3de6ec [0,1,0,0,0,0|3,0,0]=4 811 B11R0.145 CC=C(C)C(=O)NCCC(C)C 3ac8fe903bd7b02cca8146bf1c4b2713 [0,1,0,0,0,0|1,0,2]=4 812 B11R0.145 CCC(=O)C(=O)NCCC(C)C 901632a406f3b2a8b5c7434b8228acc0 [0,1,0,0,0,0|1,0,1]=3 813 B11R0.145 CCC(=O)C(=O)NCCC(C)O 204705e468884c612b153df1160e5434 [0,1,0,0,0,0|2,0,1]=4 814 B11R0.145 CCC(=O)C(=O)NCCN(C)C 525d0d19fcdcd8d8483d3848b398caba [0,1,0,0,0,0|2,0,1]=4 815 B11R0.145 CCC(=O)C(=O)NCC[C@@H](C)O 81c5b4d7f9da0f147e8de8d76868cb88 [0,1,0,0,0,0|2,0,1]=4 816 B11R0.145 CCC(=O)C(=O)NCC[C@H](C)O 9027769d9fc27f12f289962659f97d15 [0,1,0,0,0,0|2,0,1]=4 817 B11R0.145 CCC(=O)C(C)OCCC(C)C fe3316800785e695155214b221494dba [0,1,0,0,0,0|1,0,2]=4 818 B11R0.145 CCC(C)C(=O)CNCC(C)C 788a71e44b1421964f0d6efdcf54d668 [0,1,0,0,0,0|2,0,0]=3 819 B11R0.145 CCC(C)C(=O)CNCC(C)O 0799453b91a7c0bfa83a180af727ba7b [0,1,0,0,0,0|3,0,0]=4 820 B11R0.145 CCC(C)C(=O)CNC[C@@H](C)O 40f58f1cd63f4637ca17f478e0597b4e [0,1,0,0,0,0|3,0,0]=4 821 B11R0.145 CCC(C)C(=O)CNC[C@H](C)O 9984c9fba66fe790dd13ad203d4c5145 [0,1,0,0,0,0|3,0,0]=4 822 B11R0.145 CCC(C)C(=O)COCC(C)C 5a8e039ac7ff10e399b428c18c36d1ae [0,1,0,0,0,0|2,0,0]=3 823 B11R0.145 CCC(C)C(=O)COCC(C)F 4b382200645658acd301c60f84a1f90a [0,1,0,0,0,0|3,0,0]=4 824 B11R0.145 CCC(C)C(=O)COCC(C)S 3e18ea1617081d1d1fe957961cc1c371 [0,1,0,0,0,0|3,0,0]=4 825 B11R0.145 CCC(C)C(=O)COC[C@@H](C)F f3e7c170da1f9ed6c4fe9bc985a74541 [0,1,0,0,0,0|3,0,0]=4 826 B11R0.145 CCC(C)C(=O)COC[C@H](C)F e37f77614e9568e7d98d66f4fadb00d0 [0,1,0,0,0,0|3,0,0]=4 827 B11R0.145 CCC(C)C(C)NCCC(C)C 9059b218dba52314af36391d4075bbec [0,1,0,0,0,0|2,0,1]=4 828 B11R0.145 CCC(C)C(C)OCCC(C)C 1230452f8ab0073052b4830478e66009 [0,1,0,0,0,0|1,0,1]=3 829 B11R0.145 CCC(C)C(C)OCCN(C)C a1143e2d7b45b9629c11c3c3b46f4849 [0,1,0,0,0,0|2,0,1]=4 830 B11R0.145 CCC(C)C(C)OCOC(C)C f8b057d409ec8f460f1a5d87271a5272 [0,1,0,0,0,0|2,0,1]=4 831 B11R0.145 CCC(C)N(C)CCCC(C)C d29bd48f4367c39e60bdee9429d41bcf [0,1,0,0,0,0|3,0,0]=4 832 B11R0.145 CCC(O)C(=O)NCC=C(C)C cd7d6221574a19a4397582f5050ce659 [0,1,0,0,0,0|1,0,2]=4 833 B11R0.145 CCC(O)C(=O)NCCC(C)C 64ec4d64c0939b45d8ee75c926155ad2 [0,1,0,0,0,0|1,0,0]=2 834 B11R0.145 CCC(O)C(=O)NCCC(C)O 75d6042334f437a4015378d410b34599 [0,1,0,0,0,0|2,0,0]=3 835 B11R0.145 CCC(O)C(=O)NCCC(F)F d8b8a9b9d4929096eed873a441bc4bba [0,1,0,0,0,0|3,0,0]=4 836 B11R0.145 CCC(O)C(=O)NCCN(C)C 47a8bbccb89189cace8400fdc44be26b [0,1,0,0,0,0|2,0,0]=3 837 B11R0.145 CCC(O)C(=O)NCCS(=O)C 59e1692b16bb76d881c40a86e5eddfe3 [0,1,0,0,0,0|3,0,0]=4 838 B11R0.145 CCC(O)C(=O)NCC[C@@H](C)O e30b6efc1dc714d4f726b7c100e3fd7a [0,1,0,0,0,0|2,0,0]=3 839 B11R0.145 CCC(O)C(=O)NCC[C@H](C)O ad9000194f1f578e3c3f0ecd316f50f1 [0,1,0,0,0,0|2,0,0]=3 840 B11R0.145 CCN(C)C(=O)/C=C/CC(C)C c7a4550ef524177679fd2533dc17723c [0,1,0,0,0,0|2,0,1]=4 841 B11R0.145 CCN(C)C(=O)CCCC(C)C 9d06ba54961a5ccf16b5fad02437b077 [0,1,0,0,0,0|2,0,0]=3 842 B11R0.145 CCN(C)C(=O)CCCN(C)C 945c66886debdd8d8cfb417ea8daa20d [0,1,0,0,0,0|3,0,0]=4 843 B11R0.145 CCN(C)C(=O)CCOC(C)C bebb4f05ac8e104e901fb9fa88eb914f [0,1,0,0,0,0|3,0,0]=4 844 B11R0.145 CCN(C)C(=O)CCSC(C)C 0e1bcff633238285564e3c574d29b3d8 [0,1,0,0,0,0|3,0,0]=4 845 B11R0.145 CCN(C)C(=O)CNCC(C)C 68ae82fde708b3d094039dd5ac1a0bff [0,1,0,0,0,0|3,0,0]=4 846 B11R0.145 CCN(C)C(=O)COCC(C)C fc3cc02311e7e62300ba61bea2815b3f [0,1,0,0,0,0|3,0,0]=4 847 B11R0.145 CCN(C)C(=O)NCCC(C)C da467c09957caaf63cecff01f890331c [0,1,0,0,0,0|2,0,0]=3 848 B11R0.145 CCN(C)C(=O)NCCC(C)O 07488fd2685a0972d07befa38a601554 [0,1,0,0,0,0|3,0,0]=4 849 B11R0.145 CCN(C)C(=O)NCCN(C)C 94eba19a364b1bbccd339964dfac8249 [0,1,0,0,0,0|3,0,0]=4 850 B11R0.145 CCN(C)C(=O)NCC[C@@H](C)O 509e29cc7e0cdfc3b134af19ccd5ce58 [0,1,0,0,0,0|3,0,0]=4 851 B11R0.145 CCN(C)C(=O)NCC[C@H](C)O da5acc38cf0e7520fb9419d3891228bb [0,1,0,0,0,0|3,0,0]=4 852 B11R0.145 CCN(C)C(=S)NCCC(C)C d9cfb3ffa2c0ca0c7777992b391eea16 [0,1,0,0,0,0|2,1,0]=4 853 B11R0.145 CC[C@@H](O)C(=O)NCC=C(C)C a77ed1c9592115484567eb762f21a870 [0,1,0,0,0,0|1,0,2]=4 854 B11R0.145 CC[C@@H](O)C(=O)NCCC(C)C c7eb0b70533dbb4e8cd676fb60e80f1d [0,1,0,0,0,0|1,0,0]=2 855 B11R0.145 CC[C@@H](O)C(=O)NCCC(C)O 94e07e4086d53b057676f31b14a002aa [0,1,0,0,0,0|2,0,0]=3 856 B11R0.145 CC[C@@H](O)C(=O)NCCC(F)F eccdee1084ab6d8ca67cb399135c9141 [0,1,0,0,0,0|3,0,0]=4 857 B11R0.145 CC[C@@H](O)C(=O)NCCN(C)C d89209c5031990d85d401f259b7fa414 [0,1,0,0,0,0|2,0,0]=3 858 B11R0.145 CC[C@@H](O)C(=O)NCCS(=O)C 62c4d432feef7efde7988b4128f804ea [0,1,0,0,0,0|3,0,0]=4 859 B11R0.145 CC[C@@H](O)C(=O)NCC[C@@H](C)O b7c85f8a1b4677e9bda15b34ea886a28 [0,1,0,0,0,0|2,0,0]=3 860 B11R0.145 CC[C@@H](O)C(=O)NCC[C@H](C)O 2a7c79533747a42c99c60b44f83d7601 [0,1,0,0,0,0|2,0,0]=3 861 B11R0.145 CC[C@H](O)C(=O)NCC=C(C)C 9eb0bf4a1f12dd236467db0efa060d3a [0,1,0,0,0,0|1,0,2]=4 862 B11R0.145 CC[C@H](O)C(=O)NCCC(C)C 9f2550496298501bc9279f35d4ddccbf [0,1,0,0,0,0|1,0,0]=2 863 B11R0.145 CC[C@H](O)C(=O)NCCC(C)O abb5c3468f8a6786d990e2508ed120f5 [0,1,0,0,0,0|2,0,0]=3 864 B11R0.145 CC[C@H](O)C(=O)NCCC(F)F 2a16136e42d5ac2fe3a7ba3d56fb887b [0,1,0,0,0,0|3,0,0]=4 865 B11R0.145 CC[C@H](O)C(=O)NCCN(C)C 5b9268e7c94add65d2a997817ab9bc29 [0,1,0,0,0,0|2,0,0]=3 866 B11R0.145 CC[C@H](O)C(=O)NCCS(=O)C aceb16120df5c52ab3f98faaa7a0c275 [0,1,0,0,0,0|3,0,0]=4 867 B11R0.145 CC[C@H](O)C(=O)NCC[C@@H](C)O 5a0aeb69a9ffdb156dc4cf78254ff5a9 [0,1,0,0,0,0|2,0,0]=3 868 B11R0.145 CC[C@H](O)C(=O)NCC[C@H](C)O f941bf73ad8e45ce452d3aa88d40f369 [0,1,0,0,0,0|2,0,0]=3 869 B11R0.145 CC[C@H](S)C(=O)NCC=C(C)C ac717b739fd296efdcda024f7f4657ff [0,1,0,0,0,0|1,0,2]=4 870 B11R0.145 CC[C@H](S)C(=O)NCCC(C)C 462dc4a4dfb33b943fb40923cea629da [0,1,0,0,0,0|1,0,0]=2 871 B11R0.145 CC[C@H](S)C(=O)NCCC(C)O db3a994714338fd99b21b89270066ee1 [0,1,0,0,0,0|2,0,0]=3 872 B11R0.145 CC[C@H](S)C(=O)NCCC(F)F 7c183bdb9734004b368a6c6779ca62dd [0,1,0,0,0,0|3,0,0]=4 873 B11R0.145 CC[C@H](S)C(=O)NCCN(C)C 67b986a9d96253daa751a4a76d101afc [0,1,0,0,0,0|2,0,0]=3 874 B11R0.145 CC[C@H](S)C(=O)NCCS(=O)C 59e9762479b3d4f2dff49c1e947f2796 [0,1,0,0,0,0|3,0,0]=4 875 B11R0.145 CC[C@H](S)C(=O)NCC[C@@H](C)O 2c4524870053bd47f51651115c3d5ae9 [0,1,0,0,0,0|2,0,0]=3 876 B11R0.145 CC[C@H](S)C(=O)NCC[C@H](C)O 39d104c13a89d707227c7723fdb692d4 [0,1,0,0,0,0|2,0,0]=3 877 B11R0.145 CN(C)CCNC(=O)C(O)CO 4a1fc8209e6602dc915bd2cf5b19ac12 [0,1,0,0,0,0|3,0,0]=4 878 B11R0.145 CN(C)CCNC(=O)[C@@H](O)CO e00319f2fe9021f673fb1d67af16376f [0,1,0,0,0,0|3,0,0]=4 879 B11R0.145 CN(C)CCNC(=O)[C@H](O)CF 546b2fab728ba65d25c71460410ef1ed [0,1,0,0,0,0|3,0,0]=4 880 B11R0.145 CNC(=O)C(=O)NCCC(C)C ddb0cdcbfb4b57165da26e3020fa65e3 [0,1,0,0,0,0|2,0,1]=4 881 B11R0.145 COC(=O)C(=O)NCCC(C)C fa26464e7c359687640f298615685efa [0,1,0,0,0,0|2,0,1]=4 882 B11R0.145 COC(C)C(=O)NCCC(C)C ea3a2b403da06df8ddde3234379c6ecc [0,1,0,0,0,0|2,0,0]=3 883 B11R0.145 COC(C)C(=O)NCCC(C)O de2d351b4485618ae05cee6d8cdb27ea [0,1,0,0,0,0|3,0,0]=4 884 B11R0.145 COC(C)C(=O)NCCN(C)C 743e00ceaaa1ed337efe77950c498bdc [0,1,0,0,0,0|3,0,0]=4 885 B11R0.145 COC(C)C(=O)NCC[C@@H](C)O 6bec47a5866321ca79e5bf5872a199a6 [0,1,0,0,0,0|3,0,0]=4 886 B11R0.145 COC(C)C(=O)NCC[C@H](C)O 037672656c9e8e8e6280b5f9670aefa5 [0,1,0,0,0,0|3,0,0]=4 887 B11R0.145 COC(C)C(C)OCCC(C)C 369b7320f281de60d42d43f052f1309c [0,1,0,0,0,0|2,0,1]=4 888 B11R0.145 CO[C@@H](C)C(=O)NCCC(C)C 73bc08716219575dde0872f54839f3e5 [0,1,0,0,0,0|2,0,0]=3 889 B11R0.145 CO[C@@H](C)C(=O)NCCC(C)O 68e283d5f462b103994db36217f316f9 [0,1,0,0,0,0|3,0,0]=4 890 B11R0.145 CO[C@@H](C)C(=O)NCCN(C)C 42df486dd2056e8d05d8d2c2c1239ada [0,1,0,0,0,0|3,0,0]=4 891 B11R0.145 CO[C@@H](C)C(=O)NCC[C@@H](C)O 33e02e6468ff973404e54bf3e908b0a0 [0,1,0,0,0,0|3,0,0]=4 892 B11R0.145 CO[C@@H](C)C(=O)NCC[C@H](C)O 772557d6f7debf236d971ed147c84645 [0,1,0,0,0,0|3,0,0]=4 893 B11R0.145 CO[C@H](C)C(=O)NCCC(C)C 056990aa0130e05e5b74ff9aa93feb45 [0,1,0,0,0,0|2,0,0]=3 894 B11R0.145 CO[C@H](C)C(=O)NCCC(C)O 9963b3c0d7b663c532abe82c8054945c [0,1,0,0,0,0|3,0,0]=4 895 B11R0.145 CO[C@H](C)C(=O)NCCN(C)C 2ca1b1ee02ab3cb315d41e631cbd3d9a [0,1,0,0,0,0|3,0,0]=4 896 B11R0.145 CO[C@H](C)C(=O)NCC[C@@H](C)O 2d10110c117da687aedd787c7a226fec [0,1,0,0,0,0|3,0,0]=4 897 B11R0.145 CO[C@H](C)C(=O)NCC[C@H](C)O e1cef52456abecbfb0362743fe576da8 [0,1,0,0,0,0|3,0,0]=4 898 B11R0.145 CSC(C)C(=O)NCCC(C)C f9ae97429984248b2108f22d455847bf [0,1,0,0,0,0|2,0,0]=3 899 B11R0.145 CSC(C)C(=O)NCCC(C)O db45d8b84ef4746ac61f089568aea7d2 [0,1,0,0,0,0|3,0,0]=4 900 B11R0.145 CSC(C)C(=O)NCCN(C)C 2797b9ce57ffa073ef74d7f5133324db [0,1,0,0,0,0|3,0,0]=4 901 B11R0.145 CSC(C)C(=O)NCC[C@@H](C)O 0c766a24c8722a68179c35fa8edc65d7 [0,1,0,0,0,0|3,0,0]=4 902 B11R0.145 CSC(C)C(=O)NCC[C@H](C)O 991622670bcfb424e4217786b25391ad [0,1,0,0,0,0|3,0,0]=4 903 B11R0.145 C[C@@H](O)CCNC(=O)C(O)CO 5f1c32ec8a03239e05195c0fed1e58a9 [0,1,0,0,0,0|3,0,0]=4 904 B11R0.145 C[C@@H](O)CCNC(=O)[C@@H](O)CO 8b4863a0d8446bd3cd6ded8c6791eecd [0,1,0,0,0,0|3,0,0]=4 905 B11R0.145 C[C@@H](O)CCNC(=O)[C@H](O)CF deaabed6f552b2c4d02c3561cda9eca8 [0,1,0,0,0,0|3,0,0]=4 906 B11R0.145 C[C@H](O)CCNC(=O)C(O)CO eaf66706f90508a5f91d7901a9c9f757 [0,1,0,0,0,0|3,0,0]=4 907 B11R0.145 C[C@H](O)CCNC(=O)[C@@H](O)CO 45a2c48c1e70109cef96cf557bc6bdf6 [0,1,0,0,0,0|3,0,0]=4 908 B11R0.145 C[C@H](O)CCNC(=O)[C@H](O)CF 63c423e257de95001eb2372a486b95ac [0,1,0,0,0,0|3,0,0]=4 909 B11R0.147 C#CCCC(=O)CCOC(C)C 3bdc718e7b08d2ae0aac99b8cc6132d0 [0,1,0,0,0,0|2,0,1]=4 910 B11R0.147 C#CCCC(=O)NCCC(C)C ea613feed2902f7699937adb5db73b88 [0,1,0,0,0,0|1,0,1]=3 911 B11R0.147 C#CCCC(=O)NCCC(C)O ede7e9a62c947fa3570a3e22add870f3 [0,1,0,0,0,0|2,0,1]=4 912 B11R0.147 C#CCCC(=O)NCCN(C)C c0199d3c48234b3ae7da5585ba5bd52e [0,1,0,0,0,0|2,0,1]=4 913 B11R0.147 C#CCCC(=O)NCC[C@@H](C)O 04c2adea34aee8489bd002b2e0889569 [0,1,0,0,0,0|2,0,1]=4 914 B11R0.147 C#CCCC(=O)NCC[C@H](C)O ccaeea6a5f8f1fda73b32357c553e767 [0,1,0,0,0,0|2,0,1]=4 915 B11R0.147 C#CCNC(=O)CCCC(C)C 17bdb30cf8a7b0dcce922f02064f33b8 [0,1,0,0,0,0|1,0,2]=4 916 B11R0.147 C#CCNC(=O)NCCC(C)C 23e352efbd485fa6760c383caa50abe6 [0,1,0,0,0,0|1,0,2]=4 917 B11R0.147 C/C=C/CC(=O)NCCC(C)C abafd1d656297f31d02fc4c45c54b7b4 [0,1,0,0,0,0|1,0,1]=3 918 B11R0.147 C/C=C/CC(=O)NCCC(C)O b90f2b23211aab339257568770dff907 [0,1,0,0,0,0|2,0,1]=4 919 B11R0.147 C/C=C/CC(=O)NCCN(C)C 7d0f3ababd63a38c9c692de2fd8c777a [0,1,0,0,0,0|2,0,1]=4 920 B11R0.147 C/C=C/CC(=O)NCC[C@@H](C)O 9d4471df7ada7841f4da1ff415c6f6cb [0,1,0,0,0,0|2,0,1]=4 921 B11R0.147 C/C=C/CC(=O)NCC[C@H](C)O 97eccd493aa0beb6e4d55cf287a50b23 [0,1,0,0,0,0|2,0,1]=4 922 B11R0.147 C=C(C)CCCC(=O)NCCC 29fb072ff8a59f4e9c43b684e2b50a2d [0,1,0,0,0,0|1,0,2]=4 923 B11R0.147 C=C(C)CCNC(=O)CCCC db1c8374a33b9f39bd7ce4d4faa0e8b3 [0,1,0,0,0,0|1,0,2]=4 924 B11R0.147 C=C(C)CCNC(=O)CCCF 4964ed620441983256b9b8b6b0e9bc22 [0,1,0,0,0,0|1,0,2]=4 925 B11R0.147 C=C(C)CCNC(=O)CCCS c17d3bfa5f9fe540d2f2acb26f90f889 [0,1,0,0,0,0|1,0,2]=4 926 B11R0.147 C=C(C)CCNC(=O)CCOC 3cedfd4fc9e4a45e067a6462c8c31994 [0,1,0,0,0,0|1,0,2]=4 927 B11R0.147 C=C(C)CCNC(=O)CCSC bb326dd51e91dd8446cb76149e2dced7 [0,1,0,0,0,0|1,0,2]=4 928 B11R0.147 C=C(C)CCNC(=O)COCC e34bb8edc4d1feb6a6e4df27de479a5a [0,1,0,0,0,0|1,0,2]=4 929 B11R0.147 C=C(C)CCNC(=O)CSCC 8c689211992922f2d51971f55748e87a [0,1,0,0,0,0|1,0,2]=4 930 B11R0.147 C=C(C)CCNC(=O)NCCC f3cb81e65ccc884c9b00dde212584270 [0,1,0,0,0,0|1,0,2]=4 931 B11R0.147 C=CCCC(=O)NCCC(C)C b09615f436431e8522128794e34cf0cd [0,1,0,0,0,0|1,0,1]=3 932 B11R0.147 C=CCCC(=O)NCCC(C)O 62b6772b606169a8b0831bc96d79310a [0,1,0,0,0,0|2,0,1]=4 933 B11R0.147 C=CCCC(=O)NCCN(C)C 67a56f33c6a3634c77a377883f4c2aa4 [0,1,0,0,0,0|2,0,1]=4 934 B11R0.147 C=CCCC(=O)NCC[C@@H](C)O 7e680854fd0b8bb1b8208af0e6dafca5 [0,1,0,0,0,0|2,0,1]=4 935 B11R0.147 C=CCCC(=O)NCC[C@H](C)O 3603441d4ea3977f99b0e6d8b6b243b0 [0,1,0,0,0,0|2,0,1]=4 936 B11R0.147 C=CCCC(C)OCCC(C)C 8258c2f519c21baf7eb0d6b7193bba77 [0,1,0,0,0,0|1,0,2]=4 937 B11R0.147 C=CCC[C@@H](C)OCCC(C)C ceefcc80f1679fd37a2b5c118997f47f [0,1,0,0,0,0|1,0,2]=4 938 B11R0.147 CC#CCC(=O)NCCC(C)C 5066925a65921c5c9a201d11ed9fe73f [0,1,0,0,0,0|1,0,1]=3 939 B11R0.147 CC#CCC(=O)NCCC(C)O 8b9a74614f4d355cfef3b3a10783a57b [0,1,0,0,0,0|2,0,1]=4 940 B11R0.147 CC#CCC(=O)NCCN(C)C 228f553970c991996e5c190cff2cd8b1 [0,1,0,0,0,0|2,0,1]=4 941 B11R0.147 CC#CCC(=O)NCC[C@@H](C)O a2a535e4f940bc0ed6b47a3e5690a495 [0,1,0,0,0,0|2,0,1]=4 942 B11R0.147 CC#CCC(=O)NCC[C@H](C)O 4c316092eda1a8810c0f8c713b566404 [0,1,0,0,0,0|2,0,1]=4 943 B11R0.147 CC(=CCNC(=O)CCCF)C 05ec8f76a4f6f77f8da1772520091156 [0,1,0,0,0,0|1,0,2]=4 944 B11R0.147 CC(=CCNC(=O)CCCS)C c0b13e93b0722c61b2829dfff955aa6e [0,1,0,0,0,0|1,0,2]=4 945 B11R0.147 CC(C)C/C=C/C(=O)NCCBr 1a0f291180d122697f250d882009c2c0 [0,1,0,0,0,0|2,0,1]=4 946 B11R0.147 CC(C)C/C=C/C(=O)NCCF 9eb8a1020ed0d06e348dec02541d0312 [0,1,0,0,0,0|2,0,1]=4 947 B11R0.147 CC(C)C/C=C/C(=O)NCCI 1cae720d9c537cd81c2df4d3010a9f8c [0,1,0,0,0,0|2,0,1]=4 948 B11R0.147 CC(C)C/C=C/C(=O)NCCO 2a6f679ec295f0ff1a99a820fcfddad4 [0,1,0,0,0,0|2,0,1]=4 949 B11R0.147 CC(C)C/C=C/C(=O)NCCS d88987c90fea5e5f520a9addca0134c7 [0,1,0,0,0,0|2,0,1]=4 950 B11R0.147 CC(C)CCCC(=O)NCC#N 439dd9d5aa5e1f53a76aa67ec8bbdedb [0,1,0,0,0,0|2,0,1]=4 951 B11R0.147 CC(C)CCCC(=O)NCCBr 2357aa376235027d3da817e523374be0 [0,1,0,0,0,0|2,0,0]=3 952 B11R0.147 CC(C)CCCC(=O)NCCF 702f54c9fa75aff1a65d6db05fa003bd [0,1,0,0,0,0|2,0,0]=3 953 B11R0.147 CC(C)CCCC(=O)NCCI 088e0c52e59f2ac17d3a6a7bb887e3de [0,1,0,0,0,0|2,0,0]=3 954 B11R0.147 CC(C)CCCC(=O)NCCO 62b168a809c093e605280f39b615f5b0 [0,1,0,0,0,0|2,0,0]=3 955 B11R0.147 CC(C)CCCC(=O)NCCS 647987f001b737c98c6056bf6fd1e1c0 [0,1,0,0,0,0|2,0,0]=3 956 B11R0.147 CC(C)CCCN(C)CCCO 47f5593fb833a7d6ea607a3cf2678cf2 [0,1,0,0,0,0|3,0,0]=4 957 B11R0.147 CC(C)CCNC(=O)/C=C/CF ebf93ed33889a6856d36808d86afb77d [0,1,0,0,0,0|1,0,2]=4 958 B11R0.147 CC(C)CCNC(=O)/C=C/CO 27836e61050f106341f0f0668015682e [0,1,0,0,0,0|1,0,2]=4 959 B11R0.147 CC(C)CCNC(=O)C#CCO 94732ab28f3fbde467167e1e658bdf60 [0,1,0,0,0,0|1,0,2]=4 960 B11R0.147 CC(C)CCNC(=O)C=CCO 2ccfff7e414623eb8cc509fd413fd4f0 [0,1,0,0,0,0|1,0,2]=4 961 B11R0.147 CC(C)CCNC(=O)CCC#N 24b8cc96bd9ec4913c8689d30be2baab [0,1,0,0,0,0|1,0,1]=3 962 B11R0.147 CC(C)CCNC(=O)CCC=O aa2a714b166fb52873e46cebd64c04aa [0,1,0,0,0,0|1,0,1]=3 963 B11R0.147 CC(C)CCNC(=O)CCCF 551ba5c158f1277ee137c80a67ed7658 [0,1,0,0,0,0|1,0,0]=2 964 B11R0.147 CC(C)CCNC(=O)CCCS d1a1d1c3d28b8088d28a341e1b02a503 [0,1,0,0,0,0|1,0,0]=2 965 B11R0.147 CC(C)CCNC(=O)CNC#N a0ad9a6b3ddbc514eec75a65119d8831 [0,1,0,0,0,0|2,0,1]=4 966 B11R0.147 CC(C)CCNC(=O)CNC=O ca0c7c8c8fd24cbd84562739951e4eb1 [0,1,0,0,0,0|2,0,1]=4 967 B11R0.147 CC(C)CCNC(=O)NCC#N bcb816710891da377f133616770f3215 [0,1,0,0,0,0|2,0,1]=4 968 B11R0.147 CC(C)CCNC(=O)NCCF b571db7160c285d891f3d6b30834ec59 [0,1,0,0,0,0|2,0,0]=3 969 B11R0.147 CC(C)CCNC(=O)NCCN cc67a794286ed06f988783d536efc47c [0,1,0,0,0,0|2,0,0]=3 970 B11R0.147 CC(C)CCNC(=O)NCCO 88492deed7a1de274df5512b64bb11c6 [0,1,0,0,0,0|2,0,0]=3 971 B11R0.147 CC(C)CCNC(=O)NCCS 4824ea7423a9312a00dd49d1d35862df [0,1,0,0,0,0|2,0,0]=3 972 B11R0.147 CC(C)CCNC(=S)NCCF b9da3c42513b02814c951b266f31ca55 [0,1,0,0,0,0|2,1,0]=4 973 B11R0.147 CC(C)CCNC(=S)NCCN 1de04dcb5a85062ab5c8be68a369b8c8 [0,1,0,0,0,0|2,1,0]=4 974 B11R0.147 CC(C)CCNC(=S)NCCO 1a31316d30d5d3a4c12f07b3ca1d3edd [0,1,0,0,0,0|2,1,0]=4 975 B11R0.147 CC(C)CCNC(=S)NCCS d8af3c43b4177567bff0d756f89e4bb3 [0,1,0,0,0,0|2,1,0]=4 976 B11R0.147 CC(C)CCNC(C)CCCO e93077d8582af3922944e5f5d7bcfffb [0,1,0,0,0,0|2,0,1]=4 977 B11R0.147 CC(C)CCN[C@H](C)CCCO 26595fef2a31d11d6cef1c3336887973 [0,1,0,0,0,0|2,0,1]=4 978 B11R0.147 CC(C)CCOC(C)CCC#N b12cc75f954fda1b90f57b2280ef1cab [0,1,0,0,0,0|1,0,2]=4 979 B11R0.147 CC(C)CNCC(=O)NCCO 468246a402b29c26a441e82d0c0137a3 [0,1,0,0,0,0|3,0,0]=4 980 B11R0.147 CC(C)COCC(=O)NCCBr 8a5f4dcfd32d1cd226afd80c09cba19a [0,1,0,0,0,0|3,0,0]=4 981 B11R0.147 CC(C)COCC(=O)NCCF 924e847fb0ba2afe2f9931dbfdadc9fb [0,1,0,0,0,0|3,0,0]=4 982 B11R0.147 CC(C)COCC(=O)NCCI 8961f5a45ff2204fb291f653164a0c68 [0,1,0,0,0,0|3,0,0]=4 983 B11R0.147 CC(C)COCC(=O)NCCO faeb8585c436d7f6a36b8bcafed9c50e [0,1,0,0,0,0|3,0,0]=4 984 B11R0.147 CC(C)COCC(=O)NCCS 34c70b9daebb69fbc60c08d7691d5d19 [0,1,0,0,0,0|3,0,0]=4 985 B11R0.147 CC(C)OCCC(=O)NCCBr b794b4a94530df5ae874384751c75335 [0,1,0,0,0,0|3,0,0]=4 986 B11R0.147 CC(C)OCCC(=O)NCCF 38efd7fb4be6bfdc903af131bb473799 [0,1,0,0,0,0|3,0,0]=4 987 B11R0.147 CC(C)OCCC(=O)NCCI 147877276603aaf668e04d3219bc2254 [0,1,0,0,0,0|3,0,0]=4 988 B11R0.147 CC(C)OCCC(=O)NCCO 3587c2f6df17553510f7d66fda72e795 [0,1,0,0,0,0|3,0,0]=4 989 B11R0.147 CC(C)OCCC(=O)NCCS c62e0660297abc77e76eb01b371cfd15 [0,1,0,0,0,0|3,0,0]=4 990 B11R0.147 CC(C)SCCC(=O)NCCI e203196e0836adbf63915d25250fb27f [0,1,0,0,0,0|3,0,0]=4 991 B11R0.147 CC(C)SCCC(=O)NCCO 7713a2a5abf69e2bd7e84626343c7ac6 [0,1,0,0,0,0|3,0,0]=4 992 B11R0.147 CC(C)SCCC(=O)NCCS bde02c5b64a8884d06a43b6ac7d04c3d [0,1,0,0,0,0|3,0,0]=4 993 B11R0.147 CC(O)CCNC(=O)CCC#N 3d5c0f85b60b7a7da8832c3dcd4d064d [0,1,0,0,0,0|2,0,1]=4 994 B11R0.147 CC(O)CCNC(=O)CCC=O acc70e4f6d882cca2e552e169af8b969 [0,1,0,0,0,0|2,0,1]=4 995 B11R0.147 CC(O)CCNC(=O)CCCF ee4269ec6bc8e7fe80a5949ebcbfbeac [0,1,0,0,0,0|2,0,0]=3 996 B11R0.147 CC(O)CCNC(=O)CCCS a97be48e6eeb190c1e010420379609f0 [0,1,0,0,0,0|2,0,0]=3 997 B11R0.147 CC(O)CCNC(=O)NCCF 989f476cbba5be3c3eb82892da110b79 [0,1,0,0,0,0|3,0,0]=4 998 B11R0.147 CC(O)CCNC(=O)NCCN fea06b7e3ae2492414b0996bc4aa5a6a [0,1,0,0,0,0|3,0,0]=4 999 B11R0.147 CC(O)CCNC(=O)NCCO 1e496a03e5412ad1bf9727a3efb9a52d [0,1,0,0,0,0|3,0,0]=4 1000 B11R0.147 CC(O)CCNC(=O)NCCS 265c27129a0330ce1a66d79d581b5cf6 [0,1,0,0,0,0|3,0,0]=4 1001 B11R0.147 CC/C=C/C(=O)NCCC(C)C 92ef9b699a155ca12a1eb561d1a5c0de [0,1,0,0,0,0|1,0,1]=3 1002 B11R0.147 CC/C=C/C(=O)NCCC(C)O 78e189d1ad76daf5623ebbf20175ba81 [0,1,0,0,0,0|2,0,1]=4 1003 B11R0.147 CC/C=C/C(=O)NCCN(C)C 71b73011cd60fa61a82efecb42b7cb22 [0,1,0,0,0,0|2,0,1]=4 1004 B11R0.147 CC/C=C/C(=O)NCC[C@@H](C)O a35688614dbc606d195a0517bde3f76b [0,1,0,0,0,0|2,0,1]=4 1005 B11R0.147 CC/C=C/C(=O)NCC[C@H](C)O 95334fa42d44f1a47887f3589349c5c7 [0,1,0,0,0,0|2,0,1]=4 1006 B11R0.147 CC/C=C\C(=O)NCCC(C)C 92475d3fa6576752150b3cf13ac3766e [0,1,0,0,0,0|1,0,1]=3 1007 B11R0.147 CC/C=C\C(=O)NCCC(C)O 2fe375c510ee290b943689f65a0cf396 [0,1,0,0,0,0|2,0,1]=4 1008 B11R0.147 CC/C=C\C(=O)NCCN(C)C a26085d7cf54bdff80c56dce5e4e5e2b [0,1,0,0,0,0|2,0,1]=4 1009 B11R0.147 CC/C=C\C(=O)NCC[C@@H](C)O ee5aa6b4c06a7142aae0de16b226eb0a [0,1,0,0,0,0|2,0,1]=4 1010 B11R0.147 CC/C=C\C(=O)NCC[C@H](C)O 5656c5ec0cfd158501b727cff183236b [0,1,0,0,0,0|2,0,1]=4 1011 B11R0.147 CCC#CC(=O)NCCC(C)C c93961cba54096bcf2546d0d432774f9 [0,1,0,0,0,0|1,0,1]=3 1012 B11R0.147 CCC#CC(=O)NCCC(C)O a1760363481d9a0854fd515c9d84e3e3 [0,1,0,0,0,0|2,0,1]=4 1013 B11R0.147 CCC#CC(=O)NCCN(C)C 3cf02088057331e4072d86e3c414dabd [0,1,0,0,0,0|2,0,1]=4 1014 B11R0.147 CCC#CC(=O)NCC[C@@H](C)O c390d794177da94812e659afc4ddd5fb [0,1,0,0,0,0|2,0,1]=4 1015 B11R0.147 CCC#CC(=O)NCC[C@H](C)O 9101e1fd00e3961615269ae3d81b2f08 [0,1,0,0,0,0|2,0,1]=4 1016 B11R0.147 CCC#CC(C)OCCC(C)C 6bdfb962badd4913e5313a58e51d7e22 [0,1,0,0,0,0|1,0,2]=4 1017 B11R0.147 CCC=CC(=O)NCCC(C)C 93e5e3dbcff7aa1e723aa20bf08f29be [0,1,0,0,0,0|1,0,1]=3 1018 B11R0.147 CCC=CC(=O)NCCC(C)O 13ac3dd4460b2a393d06cb37343b41c8 [0,1,0,0,0,0|2,0,1]=4 1019 B11R0.147 CCC=CC(=O)NCCN(C)C 815192c23d50173624f33dda3bdd765c [0,1,0,0,0,0|2,0,1]=4 1020 B11R0.147 CCC=CC(=O)NCC[C@@H](C)O 5680d0ab302f1a0eec5a4d36d31e4b75 [0,1,0,0,0,0|2,0,1]=4 1021 B11R0.147 CCC=CC(=O)NCC[C@H](C)O 9bd717e4d887ead29090fe05df87c5ea [0,1,0,0,0,0|2,0,1]=4 1022 B11R0.147 CCCCC(=O)NCC=C(C)C 942f567d9a4742bf6cc222b245765149 [0,1,0,0,0,0|1,0,2]=4 1023 B11R0.147 CCCCC(=O)NCCC(C)C 5a478b47b8f1203204005e80f7ff412d [0,1,0,0,0,0|1,0,0]=2 1024 B11R0.147 CCCCC(=O)NCCC(C)O 7aaca4f02466a48e7b0e77dd77bcf92e [0,1,0,0,0,0|2,0,0]=3 1025 B11R0.147 CCCCC(=O)NCCC(F)F 275bc9bf8b5fbd65b35f2d2ffe2eac42 [0,1,0,0,0,0|3,0,0]=4 1026 B11R0.147 CCCCC(=O)NCCN(C)C 698484bc307647d2f61d65b42efa88f6 [0,1,0,0,0,0|2,0,0]=3 1027 B11R0.147 CCCCC(=O)NCCS(=O)C f3e5d923df128154ce783b550c263138 [0,1,0,0,0,0|3,0,0]=4 1028 B11R0.147 CCCCC(=O)NCC[C@@H](C)O 51765c4fe546002974c228bb17f8fe5f [0,1,0,0,0,0|2,0,0]=3 1029 B11R0.147 CCCCC(=O)NCC[C@H](C)O 7915b6c716e2dba7440a7863ffd54996 [0,1,0,0,0,0|2,0,0]=3 1030 B11R0.147 CCCCC(=O)OCOC(C)C 8695377532205c6785bd90c0a96a2b3c [0,1,0,0,0,0|1,0,0]=2 1031 B11R0.147 CCCCC(C)NCCC(C)C 553f480f7211b9851c219b9bd5554852 [0,1,0,0,0,0|2,0,1]=4 1032 B11R0.147 CCCCC(C)OCCC(C)C 232938eef9823a6670830c64bdfa9437 [0,1,0,0,0,0|1,0,1]=3 1033 B11R0.147 CCCCC(C)OCCN(C)C 4776e4288af2de1769e4c515c7f4bafc [0,1,0,0,0,0|2,0,1]=4 1034 B11R0.147 CCCCN(C)CCCC(C)C 63408163e7ea1897f163ad5c4903bcc8 [0,1,0,0,0,0|3,0,0]=4 1035 B11R0.147 CCCC[C@@H](C)NCCC(C)C 36d1207dc6a3c88d6f784cdddc1bb741 [0,1,0,0,0,0|2,0,1]=4 1036 B11R0.147 CCCC[C@@H](C)OCCC(C)C 4e58f774b5c466c6d629d5b3ea57a940 [0,1,0,0,0,0|1,0,1]=3 1037 B11R0.147 CCCC[C@@H](C)OCCN(C)C 3ef9c20e2dc8c9713329fd483a8e3267 [0,1,0,0,0,0|2,0,1]=4 1038 B11R0.147 CCCC[C@H](C)OCCC(C)C c3a7296c30ca74d65380df99877139c4 [0,1,0,0,0,0|1,0,1]=3 1039 B11R0.147 CCCC[C@H](C)OCCN(C)C 9ccb35186af4102466d139d446850361 [0,1,0,0,0,0|2,0,1]=4 1040 B11R0.147 CCCNC(=O)/C=C/CC(C)C 5fcf0c1c8ffa02f58b0f0fc06a8e03e5 [0,1,0,0,0,0|1,0,1]=3 1041 B11R0.147 CCCNC(=O)/C=C/CN(C)C a898b300878d96f066a063a3f27ad61f [0,1,0,0,0,0|2,0,1]=4 1042 B11R0.147 CCCNC(=O)/C=C\CN(C)C c94abbf924f1db99f7c4cd3bc13cdef5 [0,1,0,0,0,0|2,0,1]=4 1043 B11R0.147 CCCNC(=O)C#CCN(C)C fb937441985e132c49e1cfa95fa5aa46 [0,1,0,0,0,0|2,0,1]=4 1044 B11R0.147 CCCNC(=O)C/C=C/C(C)C cdaf24a83b0a1ccd64c4e8b9ee2e08ae [0,1,0,0,0,0|1,0,2]=4 1045 B11R0.147 CCCNC(=O)CC=CC(C)C 05fa581762ede96f0c0d987f47b10756 [0,1,0,0,0,0|1,0,2]=4 1046 B11R0.147 CCCNC(=O)CCC=C(C)C 8d6145ea5c674ecc023b1f9edcc9edf4 [0,1,0,0,0,0|1,0,2]=4 1047 B11R0.147 CCCNC(=O)CCCC(=O)C c5a6c1fa0c374636854f24398695434a [0,1,0,0,0,0|2,0,1]=4 1048 B11R0.147 CCCNC(=O)CCCC(C)C d3c99083648aa796f29a4eb47f90bce2 [0,1,0,0,0,0|1,0,0]=2 1049 B11R0.147 CCCNC(=O)CCCN(C)C 55180a9f1b219057ff323cceb44c36d0 [0,1,0,0,0,0|2,0,0]=3 1050 B11R0.147 CCCNC(=O)CCOC(C)C cc4a83a0641e2d794fa3f9fbb8be4941 [0,1,0,0,0,0|2,0,0]=3 1051 B11R0.147 CCCNC(=O)CCSC(C)C 0defbebd2001d801842786ec29dd3428 [0,1,0,0,0,0|2,0,0]=3 1052 B11R0.147 CCCNC(=O)CNCC(C)C 05b1aff3c2e34fccfe9f6c081c013bbd [0,1,0,0,0,0|2,0,0]=3 1053 B11R0.147 CCCNC(=O)CNCC(C)O 8aca8fbe7fd1fdcb992b70c0b2a2734b [0,1,0,0,0,0|3,0,0]=4 1054 B11R0.147 CCCNC(=O)CNCN(C)C 073fbc0b0659240844f8c5b4999c4108 [0,1,0,0,0,0|3,0,0]=4 1055 B11R0.147 CCCNC(=O)CNC[C@@H](C)O c8d2b53bcecaa64882dc40884b2241dc [0,1,0,0,0,0|3,0,0]=4 1056 B11R0.147 CCCNC(=O)CNC[C@H](C)O af8e66958ca835b54397144e66ef4e81 [0,1,0,0,0,0|3,0,0]=4 1057 B11R0.147 CCCNC(=O)COCC(C)C 779619f024f50340c9682178f1a40d53 [0,1,0,0,0,0|2,0,0]=3 1058 B11R0.147 CCCNC(=O)COCC(C)F 279f17a993278781a5f4097a5a79063a [0,1,0,0,0,0|3,0,0]=4 1059 B11R0.147 CCCNC(=O)COCC(C)S 7550eadeb07391b5f6e632728e9cbf34 [0,1,0,0,0,0|3,0,0]=4 1060 B11R0.147 CCCNC(=O)COC[C@@H](C)F 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B11R0.174 COCC(=O)CNC[C@H](C)CO 332479c23a0fddfc58ec8dea65729f05 [0,1,0,0,0,0|3,0,0]=4 1368 B11R0.174 COCC(=O)NCCC(C)CO 949dc422ec0d349a5c2225540ab4aeac [0,1,0,0,0,0|2,0,0]=3 1369 B11R0.174 COCC(=O)NCCC(O)CO d4d2fadacf27429bcba419d244719420 [0,1,0,0,0,0|3,0,0]=4 1370 B11R0.174 COCC(=O)NCC[C@@H](C)CO e11988f3e226c4bfd946883629edf710 [0,1,0,0,0,0|2,0,0]=3 1371 B11R0.174 COCC(C)OCCC(C)OC cccb78345263a3e4135f3d2c6ee78153 [0,1,0,0,0,0|2,0,1]=4 1372 B11R0.174 CSCC(=O)NCCC(C)CO 01c557b717a23b89dc5f2b53e6fe3214 [0,1,0,0,0,0|2,0,0]=3 1373 B11R0.174 CSCC(=O)NCCC(O)CO 320c5b3a6f640d2b6892ed69c00eb5cf [0,1,0,0,0,0|3,0,0]=4 1374 B11R0.174 CSCC(=O)NCC[C@@H](C)CO c0fed3b4ca3b5d89a840b6c267be6014 [0,1,0,0,0,0|2,0,0]=3 1375 B11R0.174 C[C@@H](CO)CCNC(=O)CC#N 2368cc754d7c0838010d5a8b0a2740de [0,1,0,0,0,0|2,0,1]=4 1376 B11R0.174 C[C@@H](CO)CCNC(=O)CC=O 6469318d0af67cf69ce180c262e3315e [0,1,0,0,0,0|2,0,1]=4 1377 B11R0.174 C[C@@H](CO)CCNC(=O)CCF b1ee8c80e7ff52d25891debd6eb4186d [0,1,0,0,0,0|2,0,0]=3 1378 B11R0.174 C[C@@H](CO)CCNC(=O)CCO da9dfeda8f415c868885df05f2dd5d9f [0,1,0,0,0,0|2,0,0]=3 1379 B11R0.174 C[C@@H](CO)CCNC(=O)CCS 799f2febc6a0ca25f86320f643d7851a [0,1,0,0,0,0|2,0,0]=3 1380 B11R0.174 C[C@@H](CO)CCNC(=O)CON 413336132bc201c69a2bc0f850ce6381 [0,1,0,0,0,0|3,0,0]=4 1381 B11R0.174 O=C(CCF)NCCC(O)CO ff37ae949cd065633dd898bb7ab9d2ef [0,1,0,0,0,0|3,0,0]=4 1382 B11R0.174 O=C(CCO)NCCC(O)CO c03e8612925dd9323a4a63418769cf67 [0,1,0,0,0,0|3,0,0]=4 1383 B11R0.174 O=C(CCS)NCCC(O)CO a3d5bb259ea6a10e980c426cbb6aa045 [0,1,0,0,0,0|3,0,0]=4 1384 B11R0.180 C#CCC(=O)NCCC(C)(C)C b876b51dca9b09c5d9cb2353d42bb7cd [0,1,0,0,0,0|1,0,2]=4 1385 B11R0.180 C#CCC(=O)NCCC(C)(C)F ab86468bb8e0cfcae12737635db550b7 [0,1,0,0,0,0|1,0,2]=4 1386 B11R0.180 C#CCC(=O)NCCC(C)(C)O 389100cef1a2e6507b17a1551972460e [0,1,0,0,0,0|1,0,2]=4 1387 B11R0.180 C/C=C/C(=O)NCCC(C)(C)C 205bd0ef54d17ca0f8bee8b09b1473ee [0,1,0,0,0,0|1,0,2]=4 1388 B11R0.180 C/C=C/C(=O)NCCC(C)(C)F 61b07147a5d935eebef9cae3720e8e06 [0,1,0,0,0,0|1,0,2]=4 1389 B11R0.180 C/C=C/C(=O)NCCC(C)(C)O 378b8be315be5330b79f1989062acd51 [0,1,0,0,0,0|1,0,2]=4 1390 B11R0.180 C=CCC(=O)NCCC(C)(C)C b02d52f675d336cdcfb5b5b3d28d9c22 [0,1,0,0,0,0|1,0,2]=4 1391 B11R0.180 C=CCC(=O)NCCC(C)(C)F b09813ba20508f150e13b62272694a32 [0,1,0,0,0,0|1,0,2]=4 1392 B11R0.180 C=CCC(=O)NCCC(C)(C)O e4b6d8ac53b8863dfc1d5ed24411c323 [0,1,0,0,0,0|1,0,2]=4 1393 B11R0.180 CC#CC(=O)NCCC(C)(C)C ec74f29e5c5f5e6cca93bd3e0523cc82 [0,1,0,0,0,0|1,0,2]=4 1394 B11R0.180 CC#CC(=O)NCCC(C)(C)F 58c95a579acb6efa3e05fda0f9301e2f [0,1,0,0,0,0|1,0,2]=4 1395 B11R0.180 CC#CC(=O)NCCC(C)(C)O 7ba313b579e99d0a7f6ea3b5889c5978 [0,1,0,0,0,0|1,0,2]=4 1396 B11R0.180 CC(C)(C)CCNC(=O)CC#N a614bb33cab9c0089a78ad207e938cc2 [0,1,0,0,0,0|2,0,1]=4 1397 B11R0.180 CC(C)(C)CCNC(=O)CC=O 83366119e32d180ea87623c20cd153cb [0,1,0,0,0,0|2,0,1]=4 1398 B11R0.180 CC(C)(C)CCNC(=O)CCF e3ec0c2052f09bac5026366a95257a14 [0,1,0,0,0,0|2,0,0]=3 1399 B11R0.180 CC(C)(C)CCNC(=O)CCO a5ba763be9ed686535b52c08a06db8a8 [0,1,0,0,0,0|2,0,0]=3 1400 B11R0.180 CC(C)(C)CCNC(=O)CCS 72bc58e3a282328505905f71aebeac60 [0,1,0,0,0,0|2,0,0]=3 1401 B11R0.180 CC(C)(C)CCNC(=O)CON bbbe48824ae3dd0edd73fdc940ad8605 [0,1,0,0,0,0|3,0,0]=4 1402 B11R0.180 CC(C)(F)CCNC(=O)CC#N 5c3b8e4967c627a7577b3366fee33a80 [0,1,0,0,0,0|2,0,1]=4 1403 B11R0.180 CC(C)(F)CCNC(=O)CC=O 6f1962c5b0caa0b6f79be010c45ed3a7 [0,1,0,0,0,0|2,0,1]=4 1404 B11R0.180 CC(C)(F)CCNC(=O)CCF 7113c39f23c5580456cdb9bbe6a6d51a [0,1,0,0,0,0|2,0,0]=3 1405 B11R0.180 CC(C)(F)CCNC(=O)CCO 06a899ab688dfe0b3105d62e492743b0 [0,1,0,0,0,0|2,0,0]=3 1406 B11R0.180 CC(C)(F)CCNC(=O)CCS 4a3e6ede1feea3834d66034ae604b0a5 [0,1,0,0,0,0|2,0,0]=3 1407 B11R0.180 CC(C)(F)CCNC(=O)CON ea8aa069c60fc1d6e8a11e6f4e379bfc [0,1,0,0,0,0|3,0,0]=4 1408 B11R0.180 CC(C)(O)CCNC(=O)CC#N bb05c63a5216841dd0db046fa1c1d331 [0,1,0,0,0,0|2,0,1]=4 1409 B11R0.180 CC(C)(O)CCNC(=O)CC=O 9929ecbc049bff007573830cf95c5c5e [0,1,0,0,0,0|2,0,1]=4 1410 B11R0.180 CC(C)(O)CCNC(=O)CCF 4dd697fb5b9901b1f5f640e4924c63c7 [0,1,0,0,0,0|2,0,0]=3 1411 B11R0.180 CC(C)(O)CCNC(=O)CCO b04ae487b582e19bb0fa228ae859ba62 [0,1,0,0,0,0|2,0,0]=3 1412 B11R0.180 CC(C)(O)CCNC(=O)CCS 740122494d90a4788e3598a350b60fed [0,1,0,0,0,0|2,0,0]=3 1413 B11R0.180 CC(C)(O)CCNC(=O)CON 26af680dcdf5d88ca1441f101c5baeee [0,1,0,0,0,0|3,0,0]=4 1414 B11R0.180 CCCC(=O)CNCC(C)(C)C 6a0d92d4588367a031cfeb0ef19abab9 [0,1,0,0,0,0|2,0,0]=3 1415 B11R0.180 CCCC(=O)CNCC(C)(C)O 1fe310610611fa58967f44c643d28c34 [0,1,0,0,0,0|2,0,0]=3 1416 B11R0.180 CCCC(=O)CNCC(C)(F)F f14557cfcf79c17b9216e7c21d8e45e7 [0,1,0,0,0,0|3,0,0]=4 1417 B11R0.180 CCCC(=O)COCC(C)(C)Br ae98d05b851dfa5ed356caa82d461f15 [0,1,0,0,0,0|2,0,0]=3 1418 B11R0.180 CCCC(=O)COCC(C)(C)C 7dd66b447222d2fa9488163c3194651f [0,1,0,0,0,0|2,0,0]=3 1419 B11R0.180 CCCC(=O)COCC(C)(C)F 7607e5c8d80f474980fb3cb647435e50 [0,1,0,0,0,0|2,0,0]=3 1420 B11R0.180 CCCC(=O)COCC(C)(C)S 780fd78a265e72a17397833a01dfab1e [0,1,0,0,0,0|2,0,0]=3 1421 B11R0.180 CCCC(=O)COCC(C)(F)F eb7d9a5ff8b946f581d5b4b987b08107 [0,1,0,0,0,0|3,0,0]=4 1422 B11R0.180 CCCC(=O)NCCC(C)(C)C 60c4d5b21bc6484ef3a4849f1e5490fd [0,1,0,0,0,0|1,0,0]=2 1423 B11R0.180 CCCC(=O)NCCC(C)(C)F 5636bdfc68898e25e26cd1758a3343a9 [0,1,0,0,0,0|1,0,0]=2 1424 B11R0.180 CCCC(=O)NCCC(C)(C)O 830c71261052c1ee87c83166084eeafa [0,1,0,0,0,0|1,0,0]=2 1425 B11R0.180 CCCC(=O)NCCC(F)(F)F 28cbc5dc2a5458a78468d7857b363f0e [0,1,0,0,0,0|3,0,0]=4 1426 B11R0.180 CCCC(=O)NCCS(=O)(=O)C 610f69b85717b9d24ac5177b2da5529e [0,1,0,0,0,0|3,0,0]=4 1427 B11R0.180 CCCC(=O)OCNC(C)(C)C 6d4be96d7d99ac7647f0776c58539db6 [0,1,0,0,0,0|1,0,0]=2 1428 B11R0.180 CCCC(=S)OCCC(C)(C)C fc855160f404445904fe07030e0c981a [0,1,0,0,0,0|0,1,0]=2 1429 B11R0.180 CCCC(=S)OCCC(C)(C)O 4a36996e484644c5ba90fd100f543ac1 [0,1,0,0,0,0|0,1,0]=2 1430 B11R0.180 CCCC(=S)OCCC(C)(F)F 33277314a79d3c8d805f4d90e0a485fe [0,1,0,0,0,0|1,1,0]=3 1431 B11R0.180 CCCC(=S)OCCC(F)(F)F d512804fa715cb59a817ed1dff44936c [0,1,0,0,0,0|2,1,0]=4 1432 B11R0.180 CCCC(=S)OCCS(=O)(=O)C 191443413de67bcf41b82f027b26cd24 [0,1,0,0,0,0|2,1,0]=4 1433 B11R0.180 CCCC(C)NCCC(C)(C)C c5bd06fbda16546453c695063fc34359 [0,1,0,0,0,0|2,0,1]=4 1434 B11R0.180 CCCC(C)NCCC(C)(C)F 79963c71cd7cbf33b5a4f70f5bb7cd19 [0,1,0,0,0,0|2,0,1]=4 1435 B11R0.180 CCCC(C)NCCC(C)(C)O db8c3ee60a5c6e4832921a58c96bd0ce [0,1,0,0,0,0|2,0,1]=4 1436 B11R0.180 CCCC(C)OCCC(C)(C)C af7451902675e96d579f9406eace46c0 [0,1,0,0,0,0|1,0,1]=3 1437 B11R0.180 CCCC(C)OCCC(C)(C)O 2985c0218e2b392adca0db20cf05a654 [0,1,0,0,0,0|1,0,1]=3 1438 B11R0.180 CCCC(C)OCCC(C)(C)S 1fed4ee44d05bfe99a6ed496832189e4 [0,1,0,0,0,0|1,0,1]=3 1439 B11R0.180 CCCC(C)OCCC(C)(F)F c4040e434e3605589e34000e61d48b47 [0,1,0,0,0,0|2,0,1]=4 1440 B11R0.180 CCCN(C)CCCC(C)(C)O 8cd3b935f96c9a7cdd76c420094666a4 [0,1,0,0,0,0|3,0,0]=4 1441 B11R0.180 CCC[C@@H](C)OCCC(C)(C)C 3ad15d2e4be370e9249be3f9c36a7bcf [0,1,0,0,0,0|1,0,1]=3 1442 B11R0.180 CCC[C@@H](C)OCCC(C)(C)O 097a566f8d8a9dd0066e5e16e36f6ce0 [0,1,0,0,0,0|1,0,1]=3 1443 B11R0.180 CCC[C@@H](C)OCCC(C)(F)F 400492fb85642de26e9399c176bcf0e6 [0,1,0,0,0,0|2,0,1]=4 1444 B11R0.180 CCC[C@H](C)NCCC(C)(C)C f3329478bfc0377f3e99cb797a50ba4b [0,1,0,0,0,0|2,0,1]=4 1445 B11R0.180 CCC[C@H](C)NCCC(C)(C)O 352e383a71878573bc65beed819dd183 [0,1,0,0,0,0|2,0,1]=4 1446 B11R0.180 CCC[C@H](C)OCCC(C)(C)C 1048f6d8b80be23c0e9132f64ffd35a4 [0,1,0,0,0,0|1,0,1]=3 1447 B11R0.180 CCC[C@H](C)OCCC(C)(C)O 8db8d03e21fa159d8e4fd69e9f6b581a [0,1,0,0,0,0|1,0,1]=3 1448 B11R0.180 CCC[C@H](C)OCCC(C)(F)F 8cb312b76c4e03bebd003828328c529c [0,1,0,0,0,0|2,0,1]=4 1449 B11R0.180 CCNC(=O)CCNC(C)(C)C 003d9de4c29a7da4ff8238a91ad7719e [0,1,0,0,0,0|3,0,0]=4 1450 B11R0.180 CCNC(=O)CNCC(C)(C)C 38855826502fd5c0d759f8cd5312ac5a [0,1,0,0,0,0|3,0,0]=4 1451 B11R0.180 CCNC(=O)CNCC(C)(C)F dbda3efafdba539cc94e35890cf91e2f [0,1,0,0,0,0|3,0,0]=4 1452 B11R0.180 CCNC(=O)CNCC(C)(C)O e055a5542580a7bf6040c92f7dc16c0c [0,1,0,0,0,0|3,0,0]=4 1453 B11R0.180 CCNC(=O)COCC(C)(C)Br cd9a5890e8f1832c71413c0267637fac [0,1,0,0,0,0|3,0,0]=4 1454 B11R0.180 CCNC(=O)COCC(C)(C)C 7037cbb3bd24de7572bdbd518672a8ba [0,1,0,0,0,0|3,0,0]=4 1455 B11R0.180 CCNC(=O)COCC(C)(C)F c598c44d37a6f34118b7160b845af2cb [0,1,0,0,0,0|3,0,0]=4 1456 B11R0.180 CCNC(=O)COCC(C)(C)O 7e182c25be56fdf80405593dfa9b3b01 [0,1,0,0,0,0|3,0,0]=4 1457 B11R0.180 CCNC(=O)COCC(C)(C)S 018fae953723fb41a65dced558f72085 [0,1,0,0,0,0|3,0,0]=4 1458 B11R0.180 CCOC(=O)CCNC(C)(C)C 63b80d73212d95a045c722fc44bb33dc [0,1,0,0,0,0|3,0,0]=4 1459 B11R0.180 CCOC(=O)CNCC(C)(C)C ac45ea5f1c2703f6c2e703e2b7c5e04f [0,1,0,0,0,0|3,0,0]=4 1460 B11R0.180 CCOC(=O)CNCC(C)(C)F b984c172b2ebc600f6e4db479fa1891f [0,1,0,0,0,0|3,0,0]=4 1461 B11R0.180 CCOC(=O)CNCC(C)(C)O aada50c460ac10a60a85692fb54e2374 [0,1,0,0,0,0|3,0,0]=4 1462 B11R0.180 CCOC(=O)COCC(C)(C)Br 3b9c0f753ae463cfcf32db589f31e02f [0,1,0,0,0,0|3,0,0]=4 1463 B11R0.180 CCOC(=O)COCC(C)(C)C 11e38dd1b8cfa94bfb70e2db24d84ed3 [0,1,0,0,0,0|3,0,0]=4 1464 B11R0.180 CCOC(=O)COCC(C)(C)F b05a7ca6e905c4bd147c959dd404cd30 [0,1,0,0,0,0|3,0,0]=4 1465 B11R0.180 CCOC(=O)COCC(C)(C)O 74e71b0313c349a47cc00c4e237bab7b [0,1,0,0,0,0|3,0,0]=4 1466 B11R0.180 CCOC(=O)COCC(C)(C)S 77f94c277076bf95e8be8b196206e2c9 [0,1,0,0,0,0|3,0,0]=4 1467 B11R0.180 CCOC(=O)OCNC(C)(C)C 0124c4650bee621199297872b32e4916 [0,1,0,0,0,0|2,0,0]=3 1468 B11R0.180 CCSC(=O)OCNC(C)(C)C 34adcf52d063e0dadaccb3022e99d7c8 [0,1,0,0,0,0|2,0,0]=3 1469 B11R0.180 COCC(=O)CNCC(C)(C)C ae1739990bb537f347e68aa383dca333 [0,1,0,0,0,0|3,0,0]=4 1470 B11R0.180 COCC(=O)CNCC(C)(C)O ca8cbe2b6a65343abec3ad486508d628 [0,1,0,0,0,0|3,0,0]=4 1471 B11R0.180 COCC(=O)COCC(C)(C)Br 7510f8456ed6f6d9684cfe32fdc2218a [0,1,0,0,0,0|3,0,0]=4 1472 B11R0.180 COCC(=O)COCC(C)(C)C dacace31015b78139ac8fee879020391 [0,1,0,0,0,0|3,0,0]=4 1473 B11R0.180 COCC(=O)COCC(C)(C)S 3d4286eac96068417b17c545fb8ce539 [0,1,0,0,0,0|3,0,0]=4 1474 B11R0.180 COCC(=O)NCCC(C)(C)C 5e0e0e3ca88e76d9d7ebcc3642bfb021 [0,1,0,0,0,0|2,0,0]=3 1475 B11R0.180 COCC(=O)NCCC(C)(C)F 1c10229fb9d87cc1b19f7928f3e80203 [0,1,0,0,0,0|2,0,0]=3 1476 B11R0.180 COCC(=O)NCCC(C)(C)O 4965e7851e1fc88a4a5e69f995b93571 [0,1,0,0,0,0|2,0,0]=3 1477 B11R0.180 COCC(C)OCCC(C)(C)C 0b68e720d4ef093b8e6576ca86b9823d [0,1,0,0,0,0|2,0,1]=4 1478 B11R0.180 COCC(C)OCCC(C)(C)O 1f0c8b9185465cb2097f91b09f339e49 [0,1,0,0,0,0|2,0,1]=4 1479 B11R0.180 COCC(C)OCCC(C)(C)S eab8983f95e76f40db2b9d4eb8d84603 [0,1,0,0,0,0|2,0,1]=4 1480 B11R0.180 COC[C@@H](C)OCCC(C)(C)C 13dac006caf4447653584dc823a74a18 [0,1,0,0,0,0|2,0,1]=4 1481 B11R0.180 COC[C@@H](C)OCCC(C)(C)O 6674e26ac6d66103969841380ccd9b37 [0,1,0,0,0,0|2,0,1]=4 1482 B11R0.180 COC[C@H](C)OCCC(C)(C)C afd1bcebdf97aecf1f41863945032fec [0,1,0,0,0,0|2,0,1]=4 1483 B11R0.180 COC[C@H](C)OCCC(C)(C)O b2933516bea7844b725f32ba09daba21 [0,1,0,0,0,0|2,0,1]=4 1484 B11R0.180 CSCC(=O)NCCC(C)(C)C 8d4ec1ee826e62702182262981ad4c31 [0,1,0,0,0,0|2,0,0]=3 1485 B11R0.180 CSCC(=O)NCCC(C)(C)F 90e185e4d27db4cd5ac07a44cadaaee4 [0,1,0,0,0,0|2,0,0]=3 1486 B11R0.180 CSCC(=O)NCCC(C)(C)O 76e5772ffab32dba1415f6b28e5c171d [0,1,0,0,0,0|2,0,0]=3 1487 B11R0.180 CSCC(C)OCCC(C)(C)C 426fe4adee1edc53f2240a5f8c53a65d [0,1,0,0,0,0|2,0,1]=4 1488 B11R0.180 CSCC(C)OCCC(C)(C)O 39056e25bd2fbf3df57c14cb5a4b00aa [0,1,0,0,0,0|2,0,1]=4 1489 B11R1.15 C#CCC(=O)N1CCC(C1)C ca3d958aadc5817ef2c318e00d0c7e0b [0,0,0,1,0,0|1,0,2]=4 1490 B11R1.15 C/C=C/C(=O)N1CCC(C1)C 783a076453fd2683be1b10b1b2ae2126 [0,0,0,1,0,0|1,0,2]=4 1491 B11R1.15 C=CCC(=O)N1CCC(C1)C 8fdd326d7654064d024d93b994f35e5e [0,0,0,1,0,0|1,0,2]=4 1492 B11R1.15 CC#CC(=O)N1CCC(C1)C 6b80af3fa3b569980c3e88dc1d796e3c [0,0,0,1,0,0|1,0,2]=4 1493 B11R1.15 CC1CCN(C1)C(=O)CC#N de42c4342e86692ab508c1b2359b58a4 [0,0,0,1,0,0|2,0,1]=4 1494 B11R1.15 CC1CCN(C1)C(=O)CC=O 5e84ebbf09ac06c32cea85cd765ec4f6 [0,0,0,1,0,0|2,0,1]=4 1495 B11R1.15 CC1CCN(C1)C(=O)CCF 8498fa460d7dfaa3785b3fbe462e8bb5 [0,0,0,1,0,0|2,0,0]=3 1496 B11R1.15 CC1CCN(C1)C(=O)CCO 529a26c822c3b47cb129ce3f895eda66 [0,0,0,1,0,0|2,0,0]=3 1497 B11R1.15 CC1CCN(C1)C(=O)CCS b61e298dee40900904769d955e9b20bb [0,0,0,1,0,0|2,0,0]=3 1498 B11R1.15 CC1CCN(C1)C(=O)CON 21862c59fd9c298059341cbc4054112d [0,0,0,1,0,0|3,0,0]=4 1499 B11R1.15 CCCC(=O)N1CCC(C1)C 08648b218ef50b96e9b556d775fff5e5 [0,0,0,1,0,0|1,0,0]=2 1500 B11R1.15 CCCC(=O)N1CCC(C1)F c3e698780f0f601a30f654e250feaa48 [0,0,0,1,0,0|2,0,0]=3 1501 B11R1.15 CCCC(=O)N1CCC(C1)O cd92adf77310ec2054d0dc79a16bbc14 [0,0,0,1,0,0|2,0,0]=3 1502 B11R1.15 CCCC(=O)N1CCN(C1)C ed901b299221afc6914a0af97a0a11f3 [0,0,0,1,0,0|2,0,0]=3 1503 B11R1.15 CCCC(=O)N1CC[C@@H](C1)F 4911a18ef3bce47ffeb6035a33dccbbf [0,0,0,1,0,0|2,0,0]=3 1504 B11R1.15 CCCC(=O)N1CC[C@@H](C1)O b2e939387ebb5ebbae9272c71b27e0f9 [0,0,0,1,0,0|2,0,0]=3 1505 B11R1.15 CCCC(=O)N1CC[C@H](C1)F 91bd4f40ee96024766212a106fd4bce4 [0,0,0,1,0,0|2,0,0]=3 1506 B11R1.15 CCCC(=O)N1CC[C@H](C1)O 018a9de52dc8f47ad4c18032b60599b8 [0,0,0,1,0,0|2,0,0]=3 1507 B11R1.15 CCCC(C)N1CCC(C1)C 956518dad9ff3089824655bff74fe6db [0,0,0,1,0,0|2,0,1]=4 1508 B11R1.15 CN1CCN(C1)C(=O)CCF 6442bb197640cd4f4c0f8222fdb808dc [0,0,0,1,0,0|3,0,0]=4 1509 B11R1.15 CN1CCN(C1)C(=O)CCO f7b8c6fef93bdc16ee10f7603fda0132 [0,0,0,1,0,0|3,0,0]=4 1510 B11R1.15 CN1CCN(C1)C(=O)CCS d04337c0189d78b19535f7f2dcf6f375 [0,0,0,1,0,0|3,0,0]=4 1511 B11R1.15 COCC(=O)N1CCC(C1)C 0a356ee2af73a2ed44e6ac3f07a3bfe6 [0,0,0,1,0,0|2,0,0]=3 1512 B11R1.15 COCC(=O)N1CCC(C1)F c6e23ea380b229e0c889a7b05efaf328 [0,0,0,1,0,0|3,0,0]=4 1513 B11R1.15 COCC(=O)N1CCC(C1)O ceb034ec7701bf6cb9e6acd32be5fd08 [0,0,0,1,0,0|3,0,0]=4 1514 B11R1.15 COCC(=O)N1CCN(C1)C 448ef34148651f3a329812c647a96710 [0,0,0,1,0,0|3,0,0]=4 1515 B11R1.15 COCC(=O)N1CC[C@@H](C1)F dcf7aac684a791cedcaa378e26f9be5e [0,0,0,1,0,0|3,0,0]=4 1516 B11R1.15 COCC(=O)N1CC[C@@H](C1)O 83de01add421142acb5f5334849f46ab [0,0,0,1,0,0|3,0,0]=4 1517 B11R1.15 COCC(=O)N1CC[C@H](C1)F fe2d872bdd50cdd69ff50f1c6ee94267 [0,0,0,1,0,0|3,0,0]=4 1518 B11R1.15 COCC(=O)N1CC[C@H](C1)O f17e182506202858642027287a79cf83 [0,0,0,1,0,0|3,0,0]=4 1519 B11R1.15 CSCC(=O)N1CCC(C1)C 0faa90f464bed09034fd2edbf0a27495 [0,0,0,1,0,0|2,0,0]=3 1520 B11R1.15 CSCC(=O)N1CCC(C1)F b84e79707cf10e201425c879ce412147 [0,0,0,1,0,0|3,0,0]=4 1521 B11R1.15 CSCC(=O)N1CCC(C1)O c2df0bbd417bdf2ab42df301247e89b0 [0,0,0,1,0,0|3,0,0]=4 1522 B11R1.15 CSCC(=O)N1CCN(C1)C a81f50806a55f5e98a5c3bdab4b16f04 [0,0,0,1,0,0|3,0,0]=4 1523 B11R1.15 CSCC(=O)N1CC[C@@H](C1)F 6c7939e51e5b9ad52d3b70c337ad8f87 [0,0,0,1,0,0|3,0,0]=4 1524 B11R1.15 CSCC(=O)N1CC[C@@H](C1)O 6374b70039142da7985cf8f5a1102754 [0,0,0,1,0,0|3,0,0]=4 1525 B11R1.15 CSCC(=O)N1CC[C@H](C1)F 6aab6cc4e6ff94cbdb84071f32be2891 [0,0,0,1,0,0|3,0,0]=4 1526 B11R1.15 CSCC(=O)N1CC[C@H](C1)O 5232a18c74049f8e425882c3e7ab7e22 [0,0,0,1,0,0|3,0,0]=4 1527 B11R1.15 O=C(CCF)N1CCC(C1)F 4c4f4d060ec333fc6e69a597051a67b0 [0,0,0,1,0,0|3,0,0]=4 1528 B11R1.15 O=C(CCF)N1CCC(C1)O b1954fb16086ed933f4255a7fd30edce [0,0,0,1,0,0|3,0,0]=4 1529 B11R1.15 O=C(CCF)N1CC[C@@H](C1)F 30a1fad523e2b235fc32f45bf443de1b [0,0,0,1,0,0|3,0,0]=4 1530 B11R1.15 O=C(CCF)N1CC[C@@H](C1)O 4bf6a6baf4da3e1fbdc7aa9fa67f3be9 [0,0,0,1,0,0|3,0,0]=4 1531 B11R1.15 O=C(CCF)N1CC[C@H](C1)F 4effa67fe6c2fb90e18255bce8985e12 [0,0,0,1,0,0|3,0,0]=4 1532 B11R1.15 O=C(CCF)N1CC[C@H](C1)O 76e0bd771635439fc1007886a41dac4e [0,0,0,1,0,0|3,0,0]=4 1533 B11R1.15 O=C(CCO)N1CCC(C1)F d4ab10c477ff6fdbe136002efa980615 [0,0,0,1,0,0|3,0,0]=4 1534 B11R1.15 O=C(CCO)N1CCC(C1)O 1fd9527eb7292c604898c549c1b8b5bc [0,0,0,1,0,0|3,0,0]=4 1535 B11R1.15 O=C(CCO)N1CC[C@@H](C1)F 67a589c6d62eb4cd2214bc6c6a4c2f7e [0,0,0,1,0,0|3,0,0]=4 1536 B11R1.15 O=C(CCO)N1CC[C@@H](C1)O a555b7b54ce0ca4a4ecb8e1bd4021a24 [0,0,0,1,0,0|3,0,0]=4 1537 B11R1.15 O=C(CCO)N1CC[C@H](C1)F 6b4567ecbc067cbaa7a8f0f59aaa3604 [0,0,0,1,0,0|3,0,0]=4 1538 B11R1.15 O=C(CCO)N1CC[C@H](C1)O 60746db14e34786236bb5bfccf6e5882 [0,0,0,1,0,0|3,0,0]=4 1539 B11R1.15 O=C(CCS)N1CCC(C1)F d635cf98ba2d4bc40c84d2a9e107dea0 [0,0,0,1,0,0|3,0,0]=4 1540 B11R1.15 O=C(CCS)N1CCC(C1)O 6f61ba2f7ceb8d4f99d8066c6cec061e [0,0,0,1,0,0|3,0,0]=4 1541 B11R1.15 O=C(CCS)N1CC[C@@H](C1)F 21fdd4feb0ed84e9dd9a6f2c6b0598aa [0,0,0,1,0,0|3,0,0]=4 1542 B11R1.15 O=C(CCS)N1CC[C@@H](C1)O 838a7e2dc64a215cd90793b3a4f45d38 [0,0,0,1,0,0|3,0,0]=4 1543 B11R1.15 O=C(CCS)N1CC[C@H](C1)F 76186e83ebc0b4b3c25160109876be1f [0,0,0,1,0,0|3,0,0]=4 1544 B11R1.15 O=C(CCS)N1CC[C@H](C1)O 3cd783faf0c240b599184d3725c7ab70 [0,0,0,1,0,0|3,0,0]=4 1545 B11R1.90 CC(C)CCN1CCCC1C 6d7f21807177c897eebf743c338f5f78 [0,0,0,1,0,0|2,0,1]=4 1546 B11R1.90 CC(C)CCN1CCCC1O a7c1e248c9a39e94aa9ebfa18b460cb1 [0,0,0,1,0,0|1,0,2]=4 1547 B11R1.90 CC(C)CCN1CCC[C@@H]1C d20b498e428f0de8f13f47699a61bc3a [0,0,0,1,0,0|2,0,1]=4 1548 B11R1.90 CC(C)CCN1CCC[C@H]1C 97c280483f2161912a4bcc726de0ee18 [0,0,0,1,0,0|2,0,1]=4 1549 B11R1.90 CC(C)CNC1CCCC1=O eb0c429eebc52e4c0efc082ac09befed [0,0,0,1,0,0|2,0,0]=3 1550 B11R1.90 CC(C)CNC1CCNC1=O 2d0aa504a7736f0a2596836e8cba6327 [0,0,0,1,0,0|3,0,0]=4 1551 B11R1.90 CC(C)CNC1CCSC1=O 397faac7f0fd0f3b6c86aca97c520b79 [0,0,0,1,0,0|3,0,0]=4 1552 B11R1.90 CC(C)CN[C@@H]1CCNC1=O 5ddbfa80addc343140ae72e1273364f6 [0,0,0,1,0,0|3,0,0]=4 1553 B11R1.90 CC(C)CN[C@@H]1CCOC1=O 6844e13772b964bf5cc3305a05c9f966 [0,0,0,1,0,0|3,0,0]=4 1554 B11R1.90 CC(C)CN[C@H]1CCNC1=O 177523a357fb16402ed322d9b05514aa [0,0,0,1,0,0|3,0,0]=4 1555 B11R1.90 CC(C)CN[C@H]1CCOC1=O 8b0b0d0cb1e212cc8595f28131824aaa [0,0,0,1,0,0|3,0,0]=4 1556 B11R1.90 CC(C)COC1=CCCC1=O eddcf6fcace84a60857cd8a7b77287e4 [0,0,0,1,0,0|2,0,1]=4 1557 B11R1.90 CC(C)COC1CCCC1=O bebb20b3a241b386a509b0f9cee5120a [0,0,0,1,0,0|2,0,0]=3 1558 B11R1.90 CC(C)COC1CCNC1=O 14d505b102cac10f73400e01837581cd [0,0,0,1,0,0|3,0,0]=4 1559 B11R1.90 CC(C)COC1CCOC1=O 8d9aa25366ecca26733c8d0976769dcf [0,0,0,1,0,0|3,0,0]=4 1560 B11R1.90 CC(C)CO[C@@H]1CCNC1=O 7c5818e1658219ee565ca784153c7793 [0,0,0,1,0,0|3,0,0]=4 1561 B11R1.90 CC(C)CO[C@@H]1CCOC1=O 16bd030659c135d14e77556bb42ee351 [0,0,0,1,0,0|3,0,0]=4 1562 B11R1.90 CC(C)CO[C@H]1CCNC1=O f312dbb618957c847a885f0feb58ba28 [0,0,0,1,0,0|3,0,0]=4 1563 B11R1.90 CC(C)CO[C@H]1CCOC1=O f30c63bd65a8d9ffed481dadb7176c88 [0,0,0,1,0,0|3,0,0]=4 1564 B11R1.90 CC(C)NCC1CCNC1=O 374991e6977bcd69395f6dfe3d6d5039 [0,0,0,1,0,0|3,0,0]=4 1565 B11R1.90 CC(C)OCC1=CCCC1=O 7755118c9cb81b8ff4d8449004c09a5e [0,0,0,1,0,0|2,0,1]=4 1566 B11R1.90 CC(C)OCC1CCCC1=O 1603dae6a60bda93d30e6e7d4cf9c013 [0,0,0,1,0,0|2,0,0]=3 1567 B11R1.90 CC(C)OCC1CCNC1=O 4ae360ab7d120ddeb485c6a239e1714b [0,0,0,1,0,0|3,0,0]=4 1568 B11R1.90 CC(C)OCN1CCCC1=O 83e70b5415f160f46a434890a20f5b22 [0,0,0,1,0,0|2,0,0]=3 1569 B11R1.90 CC(O)CNC1CCCC1=O ea66dba85abbb29a4f9f5479afa5a9b6 [0,0,0,1,0,0|3,0,0]=4 1570 B11R1.90 CN(C)COC1CCCC1=O fb0d5149dc60c63941ff7b7303c84a96 [0,0,0,1,0,0|3,0,0]=4 1571 B11R1.90 C[C@@H](O)CNC1CCCC1=O 616a498507d74c3a6c5d1b105ef66945 [0,0,0,1,0,0|3,0,0]=4 1572 B11R1.90 C[C@H](O)CNC1CCCC1=O ee128eaf0b76a604c3c1d527550c553b [0,0,0,1,0,0|3,0,0]=4 1573 B11R1.135 CCCN1CCCC(CC1)C 663566a23b74426417d12aabf45b9bfa [0,0,0,1,0,0|3,0,0]=4 1574 B11R1.154 CC(C)CCOC1CC(C1)C 4e5280d85caad988a1513d81f6d5b1e8 [0,0,0,1,0,0|1,0,1]=3 1575 B11R1.154 CC(C)CCOC1CC(C1)F 8aee788ff0c7aabad4688ec0c92a8f75 [0,0,0,1,0,0|2,0,1]=4 1576 B11R1.154 CC(C)CCOC1CN(C1)C ea801b234c4eda01b954ab76e496f052 [0,0,0,1,0,0|2,0,1]=4 1577 B11R1.154 CC(C)CCO[C@H]1C[C@@H](C1)F 4f105fc4b36a52f32e9b6a6ab3419728 [0,0,0,1,0,0|2,0,1]=4 1578 B11R1.154 CC(C)CCO[C@H]1C[C@H](C1)F 0543290b81505dc4ee89264991138af4 [0,0,0,1,0,0|2,0,1]=4 1579 B11R1.154 CC1CC(C1)OCCN(C)C 3d83124273f179994f47b19225c9cfea [0,0,0,1,0,0|2,0,1]=4 1580 B11R1.154 CC1CC(C1)OCOC(C)C b7dc33d7bbd9cca245bfa34bb5aebd1b [0,0,0,1,0,0|2,0,1]=4 1581 B11R1.157 CC(C)CN1CCCC(=O)C1 01feab4c741a21af025610bc47778f29 [0,0,0,1,0,0|2,0,0]=3 1582 B11R1.157 CC(C)CN1CCNC(=O)C1 a5f01926f4a3be43165324dd0291874e [0,0,0,1,0,0|3,0,0]=4 1583 B11R1.157 CC(C)CN1CCOC(=O)C1 77654fadb339f5eee58037fbaab8075f [0,0,0,1,0,0|3,0,0]=4 1584 B11R1.157 CC(C)NC1CCNC(=O)C1 1c39fbbce927725b3a5b8b78d1781419 [0,0,0,1,0,0|3,0,0]=4 1585 B11R1.157 CC(C)N[C@@H]1CCNC(=O)C1 4e5b583f9f9000ba054d8d426dc497b8 [0,0,0,1,0,0|3,0,0]=4 1586 B11R1.157 CC(C)N[C@H]1CCNC(=O)C1 4a9ac27eb55b698632d629689f7a15fa [0,0,0,1,0,0|3,0,0]=4 1587 B11R1.157 CC(C)OC1CCCC(=O)C1 3e286e7df846184fe088cd1d6507ef33 [0,0,0,1,0,0|2,0,0]=3 1588 B11R1.157 CC(C)OC1CCNC(=O)C1 76362673bb0dd6a09e0decab4f68435e [0,0,0,1,0,0|3,0,0]=4 1589 B11R1.157 CC(C)O[C@@H]1CCNC(=O)C1 20dacc4d3ec9ae314b919e05b54f5468 [0,0,0,1,0,0|3,0,0]=4 1590 B11R1.157 CC(C)O[C@H]1CCNC(=O)C1 19256d9fa01b7fd20c7e4649280a1ad5 [0,0,0,1,0,0|3,0,0]=4 1591 B11R1.157 CC(O)CN1CCCC(=O)C1 917247992a9e78f9855dc807edfc4687 [0,0,0,1,0,0|3,0,0]=4 1592 B11R1.157 CC1=CC(CCC1)OC(C)C 25913641fb8c24f16d586633c35da5e3 [0,0,0,1,0,0|3,0,0]=4 1593 B11R1.157 CN(C)CN1CCCC(=O)C1 80f3bb1809bd76e4fc58294de03fb597 [0,0,0,1,0,0|3,0,0]=4 1594 B11R1.157 C[C@H](O)CN1CCCC(=O)C1 58da09957614f4f4beda4c0c527016c6 [0,0,0,1,0,0|3,0,0]=4 1595 B11R1.172 CC(C)CCNC1CCCC1 dfcd7e6b60b22ea15f28ca5d27824949 [0,0,0,1,0,0|2,0,1]=4 1596 B11R1.172 CC(C)CCOC1C=CCC1 8ce2501be0487e0f725462b080c994a7 [0,0,0,1,0,0|1,0,2]=4 1597 B11R1.172 CC(C)CCOC1CCCC1 cc9eb0b7726c3f7f3a4dc04c99338791 [0,0,0,1,0,0|1,0,1]=3 1598 B11R1.172 CC(C)CCOC1CCCO1 1f9fe8272dbf8e944cc7dd642bc82dff [0,0,0,1,0,0|0,0,2]=3 1599 B11R1.172 CC(C)CCOC1CCOC1 a842f1de436d7310b6be6f016dbe7cd6 [0,0,0,1,0,0|2,0,1]=4 1600 B11R1.172 CC(C)CCOC1CCSC1 b5ece22fb620b8fd9f2ff375b32c5a4b [0,0,0,1,0,0|2,0,1]=4 1601 B11R1.172 CC(C)CCO[C@@H]1CCOC1 6c8fb7ff64408d4da9d494c19929ee79 [0,0,0,1,0,0|2,0,1]=4 1602 B11R1.172 CC(C)CCO[C@@H]1CCSC1 d841ce90cf99b31e2be7dfb9639d7743 [0,0,0,1,0,0|2,0,1]=4 1603 B11R1.172 CC(C)CCO[C@H]1CCOC1 0f83d85a482be0bf741bd9d00fb24aad [0,0,0,1,0,0|2,0,1]=4 1604 B11R1.172 CC(C)CCO[C@H]1CCSC1 2b35826e00bbb934ba132bcba252f903 [0,0,0,1,0,0|2,0,1]=4 1605 B11R1.172 CC(C)CNCC1=CCCC1 d0d6c9e8ec16084fe6459429de573ac1 [0,0,0,1,0,0|3,0,0]=4 1606 B11R1.172 CC(C)OCC=C1CCCC1 19c6aab44702d9e70435e4a7b4a7a5a2 [0,0,0,1,0,0|3,0,0]=4 1607 B11R1.172 CC(C)OCOC1CCCC1 d71bac0110fe3392bc4a4c570d22770b [0,0,0,1,0,0|2,0,1]=4 1608 B11R1.172 CC(C)OCOC1CCCO1 6f28bfb76a3d3041dadbd8bff8a3334e [0,0,0,1,0,0|1,0,2]=4 1609 B11R1.172 CN(C)CCOC1CCCC1 7c4c3a6b69cadd58dc449417d7779808 [0,0,0,1,0,0|2,0,1]=4 1610 B11R1.172 CN(C)CCOC1CCCO1 2c31c7939ed169a24a175bd20c0abd60 [0,0,0,1,0,0|1,0,2]=4 1611 B11R1.201 CCCC(=O)CN1CC(C1)F f1ebdd6dd2849231c9515b2367ab2f76 [0,0,0,1,0,0|3,0,0]=4 1612 B11R1.201 CCCC(=O)CN1CC(C1)O ec5adc55c9fac82d19a7a370c4a509ec [0,0,0,1,0,0|3,0,0]=4 1613 B11R1.201 CCCC(=O)NC1CC(C1)F 9bd52dc7688d7b98a913375cdc9068fd [0,0,0,1,0,0|2,0,0]=3 1614 B11R1.201 CCCC(=O)NC1CC(C1)O c04d95e4e38d944deaaf8eb8314a6814 [0,0,0,1,0,0|2,0,0]=3 1615 B11R1.201 CCCC(=O)NC1CN(C1)C 1c40c4cd6103841ba8b0a2d5d24cebd8 [0,0,0,1,0,0|2,0,0]=3 1616 B11R1.201 CCCC(=O)N[C@H]1C[C@@H](C1)F 8da955740fe8a68bee1fe642cc1a3c3b [0,0,0,1,0,0|2,0,0]=3 1617 B11R1.201 CCCC(=O)N[C@H]1C[C@@H](C1)O b7c7f769fc0259dbcf52be1475a158c6 [0,0,0,1,0,0|2,0,0]=3 1618 B11R1.201 CCCC(=O)N[C@H]1C[C@H](C1)F dea009dc03025e49fc12911a347c4309 [0,0,0,1,0,0|2,0,0]=3 1619 B11R1.201 CCCC(=O)N[C@H]1C[C@H](C1)O 1a7d1e1fb58f5988bb18e1e72b605b77 [0,0,0,1,0,0|2,0,0]=3 1620 B11R1.201 CCCC(=S)OC1CC(=O)C1 b9286336862f6041cf2d17cc09756802 [0,0,0,1,0,0|1,1,1]=4 1621 B11R1.201 CCCC(C)OC1CC(C1)C 6b8335c6b3f4683142836fb5f763d9cf [0,0,0,1,0,0|1,0,1]=3 1622 B11R1.201 CCCC(C)OC1CC(C1)F 46dd730f29f35da720aba4cdfcfa5c2e [0,0,0,1,0,0|2,0,1]=4 1623 B11R1.201 CCCC(C)OC1CN(C1)C 16c645005c8e9941d25ec49003ad2756 [0,0,0,1,0,0|2,0,1]=4 1624 B11R1.201 CCCC(C)O[C@H]1C[C@@H](C1)F 595170efd04860577ee205089af9b142 [0,0,0,1,0,0|2,0,1]=4 1625 B11R1.201 CCCC(C)O[C@H]1C[C@H](C1)F 8458720d93bc32139a7e1f7e1b221427 [0,0,0,1,0,0|2,0,1]=4 1626 B11R1.201 CCCN(C)CC1CC(C1)C 561c98c767f959a4d1b88255b1785ab7 [0,0,0,1,0,0|3,0,0]=4 1627 B11R1.201 CN1CC(C1)NC(=O)CCF 4076cda8203dae33d09d0b8d5eb4a485 [0,0,0,1,0,0|3,0,0]=4 1628 B11R1.201 CN1CC(C1)NC(=O)CCO a24c5da5ab3b4f861b39579ff437e704 [0,0,0,1,0,0|3,0,0]=4 1629 B11R1.201 CN1CC(C1)NC(=O)CCS 522f3744a1434b76df8ed144e75c50e3 [0,0,0,1,0,0|3,0,0]=4 1630 B11R1.201 COCC(=O)NC1CC(C1)F ff60c18e2acaeca00488572bb70e640a [0,0,0,1,0,0|3,0,0]=4 1631 B11R1.201 COCC(=O)NC1CC(C1)O 09caac084826545ac0e8ba906b1e8856 [0,0,0,1,0,0|3,0,0]=4 1632 B11R1.201 COCC(=O)NC1CN(C1)C 22a77b2e85161fe288aed5a48eb919b9 [0,0,0,1,0,0|3,0,0]=4 1633 B11R1.201 COCC(=O)N[C@H]1C[C@@H](C1)F 7f9a939d9f88c045e1243cf53f7f64b7 [0,0,0,1,0,0|3,0,0]=4 1634 B11R1.201 COCC(=O)N[C@H]1C[C@@H](C1)O d8f1a6119538369e6f2713c33920aaba [0,0,0,1,0,0|3,0,0]=4 1635 B11R1.201 COCC(=O)N[C@H]1C[C@H](C1)F e0a24c8e4f3e1eed54c40ce15e929c0f [0,0,0,1,0,0|3,0,0]=4 1636 B11R1.201 COCC(=O)N[C@H]1C[C@H](C1)O 7c97c9191cf33a373461ec7627029579 [0,0,0,1,0,0|3,0,0]=4 1637 B11R1.201 COCC(C)OC1CC(C1)C c195da85795f9d3bba734e9daf561641 [0,0,0,1,0,0|2,0,1]=4 1638 B11R1.201 CSCC(=O)NC1CC(C1)O 36f83f6e67c7d84bfdc3066dae860d5e [0,0,0,1,0,0|3,0,0]=4 1639 B11R1.201 CSCC(=O)NC1CN(C1)C e86ac352aff81a118b4e7dbfe8277869 [0,0,0,1,0,0|3,0,0]=4 1640 B11R1.201 CSCC(=O)N[C@H]1C[C@@H](C1)O f49b4231d0fa72e7bbdd64281452b892 [0,0,0,1,0,0|3,0,0]=4 1641 B11R1.201 CSCC(=O)N[C@H]1C[C@H](C1)O 7128dfdc769484f7350b23e209e16349 [0,0,0,1,0,0|3,0,0]=4 1642 B11R1.201 O=C(CCF)NC1CC(C1)F 65b6ab4e111be3f184ba9952d0ae01d8 [0,0,0,1,0,0|3,0,0]=4 1643 B11R1.201 O=C(CCF)NC1CC(C1)O dacd0f56b184a2b932642241e0baad61 [0,0,0,1,0,0|3,0,0]=4 1644 B11R1.201 O=C(CCF)N[C@H]1C[C@@H](C1)F e729a26e74d8bd51d1a8eab0230281e0 [0,0,0,1,0,0|3,0,0]=4 1645 B11R1.201 O=C(CCF)N[C@H]1C[C@@H](C1)O 3347a5e229ccd1fc855875da3e9e0d48 [0,0,0,1,0,0|3,0,0]=4 1646 B11R1.201 O=C(CCF)N[C@H]1C[C@H](C1)F ed379cc8004e7a7b32dc92f8072a5ed0 [0,0,0,1,0,0|3,0,0]=4 1647 B11R1.201 O=C(CCF)N[C@H]1C[C@H](C1)O b6472907561e70585459064123ea22cc [0,0,0,1,0,0|3,0,0]=4 1648 B11R1.201 O=C(CCO)NC1CC(C1)O 11a97f4f049b4680c476d1ba827f2099 [0,0,0,1,0,0|3,0,0]=4 1649 B11R1.201 O=C(CCO)N[C@H]1C[C@@H](C1)O 0488ceb969d14be5e0230b5153230f94 [0,0,0,1,0,0|3,0,0]=4 1650 B11R1.201 O=C(CCO)N[C@H]1C[C@H](C1)O 2a947233659639216163cf8af6654bfa [0,0,0,1,0,0|3,0,0]=4 1651 B11R1.201 O=C(CCS)NC1CC(C1)F 2b1b85c5c3aec2674e8c86c8e9cdd012 [0,0,0,1,0,0|3,0,0]=4 1652 B11R1.201 O=C(CCS)NC1CC(C1)O 5933d76a48da315eed832b552612b853 [0,0,0,1,0,0|3,0,0]=4 1653 B11R1.201 O=C(CCS)N[C@H]1C[C@@H](C1)F 456d98eb1b1e362b03b16c76f9e4aa1c [0,0,0,1,0,0|3,0,0]=4 1654 B11R1.201 O=C(CCS)N[C@H]1C[C@@H](C1)O 15f4aad6a905dc331ad76b9468263467 [0,0,0,1,0,0|3,0,0]=4 1655 B11R1.201 O=C(CCS)N[C@H]1C[C@H](C1)F 7a27f38271bfeb89d333c80d197e5052 [0,0,0,1,0,0|3,0,0]=4 1656 B11R1.201 O=C(CCS)N[C@H]1C[C@H](C1)O b00673f4002febb498dc6e4b166b10f7 [0,0,0,1,0,0|3,0,0]=4 1657 B11R1.288 CCCC(=O)CNC1CC1C d954e2b207b1ef78587a602b0d1ee90f [0,0,0,1,0,0|2,0,0]=3 1658 B11R1.288 CCCC(=O)CN[C@@H]1C[C@H]1F 7e8349922730550a38630d344f1893e3 [0,0,0,1,0,0|3,0,0]=4 1659 B11R1.288 CCCC(=O)CN[C@H]1C[C@@H]1F a239e36245d8fce58d6a8f5966821a22 [0,0,0,1,0,0|3,0,0]=4 1660 B11R1.288 CCCC(=O)CN[C@H]1C[C@H]1F 1868a725d2bc40eb8793180b67b77eef [0,0,0,1,0,0|3,0,0]=4 1661 B11R1.288 CCCC(C)OCC1CC1C b7d6be90d0fd80a395dff94ee002ad53 [0,0,0,1,0,0|1,0,1]=3 1662 B11R1.288 CCCC(C)OC[C@@H]1C[C@@H]1C 35939abaf7804555fbdf71cee6d425d2 [0,0,0,1,0,0|1,0,1]=3 1663 B11R1.288 CCCC(C)OC[C@@H]1C[C@@H]1F be1ca1a42945e63a8e0673109cc680cb [0,0,0,1,0,0|2,0,1]=4 1664 B11R1.288 CCCC(C)OC[C@@H]1C[C@H]1C 60e6e9e76d277c9ae35a1651b7b06f90 [0,0,0,1,0,0|1,0,1]=3 1665 B11R1.288 CCCC(C)OC[C@@H]1C[C@H]1F d46475e65f7b6600ecb4617ec51cf846 [0,0,0,1,0,0|2,0,1]=4 1666 B11R1.288 CCCC(C)OC[C@H]1C[C@@H]1C b256b9f5c4cf829cbf2282649c33bbcd [0,0,0,1,0,0|1,0,1]=3 1667 B11R1.288 CCCC(C)OC[C@H]1C[C@@H]1F faae4f56ad82b326fb3675147bf5163d [0,0,0,1,0,0|2,0,1]=4 1668 B11R1.288 CCCC(C)OC[C@H]1C[C@H]1F a0fad2bce76603119d58ed0186bfb7d3 [0,0,0,1,0,0|2,0,1]=4 1669 B11R1.288 CCNC(=O)CNC1CC1C a172f2d344a2f072a18873a2d5e03621 [0,0,0,1,0,0|3,0,0]=4 1670 B11R1.288 CCOC(=O)CNC1CC1C 22d926c339c99ce24ba81845aa6f8d65 [0,0,0,1,0,0|3,0,0]=4 1671 B11R1.288 COCC(=O)CNC1CC1C a59fea765789c12f9cc32ee143fa7afe [0,0,0,1,0,0|3,0,0]=4 1672 B11R1.288 COCC(C)OCC1CC1C d07c8617dfabbc4d8db99ae318a73d6d [0,0,0,1,0,0|2,0,1]=4 1673 B11R1.288 COCC(C)OC[C@@H]1C[C@@H]1C ec53c82737099c98194143473d0f1f93 [0,0,0,1,0,0|2,0,1]=4 1674 B11R1.288 COCC(C)OC[C@@H]1C[C@H]1C ce8168b02174219c981f90e849d399a4 [0,0,0,1,0,0|2,0,1]=4 1675 B11R1.288 COCC(C)OC[C@H]1C[C@@H]1C e99b721dd1bd8714f1e829d9645d2a84 [0,0,0,1,0,0|2,0,1]=4 1676 B11R1.290 C#CCC(=O)NCCC1CC1 2c58e03e9d28f2dcfadc6d9583d858d9 [0,0,0,1,0,0|1,0,2]=4 1677 B11R1.290 C/C=C/C(=O)NCCC1CC1 60e52067b036c59087ab93101f7520a6 [0,0,0,1,0,0|1,0,2]=4 1678 B11R1.290 C=CCC(=O)NCCC1CC1 2ddb47d0acdc1dbfe456564b2558136e [0,0,0,1,0,0|1,0,2]=4 1679 B11R1.290 CC#CC(=O)NCCC1CC1 2661b8f36b82830e647fd919668cc883 [0,0,0,1,0,0|1,0,2]=4 1680 B11R1.290 CCCC(=O)CNCC1CC1 6af81ad12afd538d9fdc8f756ba3946d [0,0,0,1,0,0|2,0,0]=3 1681 B11R1.290 CCCC(=O)COCC1CC1 c36fc0342e9c020aa8512dfa45b81e70 [0,0,0,1,0,0|2,0,0]=3 1682 B11R1.290 CCCC(=O)NCCC1CC1 c432eda3bdde520848213d9a422afe00 [0,0,0,1,0,0|1,0,0]=2 1683 B11R1.290 CCCC(=O)NCCN1CC1 f67979bc0ed19ec538b5db02d3ec2712 [0,0,0,1,0,0|2,0,0]=3 1684 B11R1.290 CCCC(=O)OCNC1CC1 43fcec24fbfef50b224d0e27d37f28b1 [0,0,0,1,0,0|1,0,0]=2 1685 B11R1.290 CCCC(=O)OCOC1CC1 c2019d33dbebb658ce4dcad4e0c27779 [0,0,0,1,0,0|1,0,0]=2 1686 B11R1.290 CCCC(=S)OCCC1CC1 0fd9250a483414aeb9c9fab23588cdf9 [0,0,0,1,0,0|0,1,0]=2 1687 B11R1.290 CCCC(C)NCCC1CC1 a82a857453b87974d1a963efbbe8b6f4 [0,0,0,1,0,0|2,0,1]=4 1688 B11R1.290 CCCC(C)OCCC1CC1 399fd5a95cac2db30ed09cdf67c183f5 [0,0,0,1,0,0|1,0,1]=3 1689 B11R1.290 CCCC(C)OCCN1CC1 a1953632df84b31693bf9209b487cedf [0,0,0,1,0,0|2,0,1]=4 1690 B11R1.290 CCC[C@@H](C)OCCC1CC1 594941d080d8074ccdbfbc5fd73c9d01 [0,0,0,1,0,0|1,0,1]=3 1691 B11R1.290 CCC[C@H](C)NCCC1CC1 629b035fc30a3a6b0fdc5a5fc60e86f7 [0,0,0,1,0,0|2,0,1]=4 1692 B11R1.290 CCC[C@H](C)OCCC1CC1 0cde0ecda1427c9a121febef46c72481 [0,0,0,1,0,0|1,0,1]=3 1693 B11R1.290 CCNC(=O)CCNC1CC1 30239c8c8e9768f8be23a01bace5e494 [0,0,0,1,0,0|3,0,0]=4 1694 B11R1.290 CCNC(=O)CCOC1CC1 d6419b71a0cedc410718a606c23d8709 [0,0,0,1,0,0|3,0,0]=4 1695 B11R1.290 CCNC(=O)CNCC1CC1 f037e2264483c7b40986b3ecb037bc99 [0,0,0,1,0,0|3,0,0]=4 1696 B11R1.290 CCNC(=O)COCC1CC1 992243b156555a035d355dceeef79ae4 [0,0,0,1,0,0|3,0,0]=4 1697 B11R1.290 CCOC(=O)CCNC1CC1 7ae5e275187e0c18246e66f2bc7a753a [0,0,0,1,0,0|3,0,0]=4 1698 B11R1.290 CCOC(=O)CCOC1CC1 af8bebc034c959f0e8580db2fdba9e76 [0,0,0,1,0,0|3,0,0]=4 1699 B11R1.290 CCOC(=O)CNCC1CC1 79d5db5ae52ac1e153ab3beb3e8f393d [0,0,0,1,0,0|3,0,0]=4 1700 B11R1.290 CCOC(=O)COCC1CC1 7982bcf3144c0e34c33add663bbf7f17 [0,0,0,1,0,0|3,0,0]=4 1701 B11R1.290 CCOC(=O)OCNC1CC1 ef53ecb73156aa2eb7ca96ec650039f9 [0,0,0,1,0,0|2,0,0]=3 1702 B11R1.290 CCOC(=O)OCOC1CC1 778b92d3efd30382ac17d2660ddf3511 [0,0,0,1,0,0|2,0,0]=3 1703 B11R1.290 CCSC(=O)OCNC1CC1 5780f36062089e1d3894d650e5f65877 [0,0,0,1,0,0|2,0,0]=3 1704 B11R1.290 CCSC(=O)OCOC1CC1 b2c3e1ace4113f8ec4910ddf9997011c [0,0,0,1,0,0|2,0,0]=3 1705 B11R1.290 COCC(=O)CNCC1CC1 872d9964d0adbf4085efb8e847d5def0 [0,0,0,1,0,0|3,0,0]=4 1706 B11R1.290 COCC(=O)COCC1CC1 a141c8067f3f8d8b08ae447d01abfba0 [0,0,0,1,0,0|3,0,0]=4 1707 B11R1.290 COCC(=O)NCCC1CC1 a31e129b1bcd3bd9764c3d12f8a17dc1 [0,0,0,1,0,0|2,0,0]=3 1708 B11R1.290 COCC(=O)NCCN1CC1 f9eeda3a9c5598e6fcf8672921028526 [0,0,0,1,0,0|3,0,0]=4 1709 B11R1.290 COCC(C)OCCC1CC1 af26c31faa4cb8e724c0230d9b82f0f0 [0,0,0,1,0,0|2,0,1]=4 1710 B11R1.290 COC[C@@H](C)OCCC1CC1 079e834d642b6201641dd6b8cde5a8b2 [0,0,0,1,0,0|2,0,1]=4 1711 B11R1.290 COC[C@H](C)OCCC1CC1 6e505ec687c5044ed9a361b3f9d03ecd [0,0,0,1,0,0|2,0,1]=4 1712 B11R1.290 CSCC(=O)NCCC1CC1 7a223ba63aa7ca21b60387f73678eaee [0,0,0,1,0,0|2,0,0]=3 1713 B11R1.290 CSCC(=O)NCCN1CC1 d381e7274c7defe46166c7e6794981fc [0,0,0,1,0,0|3,0,0]=4 1714 B11R1.290 CSCC(C)OCCC1CC1 a675c32dc903c0f3130f5cffda5f9e49 [0,0,0,1,0,0|2,0,1]=4 1715 B11R1.290 N#CCC(=O)NCCC1CC1 515c3b52ddc84c8155a6482e859a82ee [0,0,0,1,0,0|2,0,1]=4 1716 B11R1.290 NOCC(=O)NCCC1CC1 9c658376c97b803aabe9fae79b3b3710 [0,0,0,1,0,0|3,0,0]=4 1717 B11R1.290 O=C(CCF)NCCC1CC1 cdad2acab660246f82228783b360da84 [0,0,0,1,0,0|2,0,0]=3 1718 B11R1.290 O=C(CCF)NCCN1CC1 6d726b13c710a85a2aa528de5c98bcbc [0,0,0,1,0,0|3,0,0]=4 1719 B11R1.290 O=C(CCO)NCCC1CC1 7a47c985998f460f8ea5c0507f196d21 [0,0,0,1,0,0|2,0,0]=3 1720 B11R1.290 O=C(CCO)NCCN1CC1 5ffb7ba37343e1742e3e5a0809e61217 [0,0,0,1,0,0|3,0,0]=4 1721 B11R1.290 O=C(CCS)NCCC1CC1 c80c80365dc6ddc217c7319e269c0707 [0,0,0,1,0,0|2,0,0]=3 1722 B11R1.290 O=C(CCS)NCCN1CC1 4d037c5cd7bbf0b3eda3bcf4c4ed6fc1 [0,0,0,1,0,0|3,0,0]=4 1723 B11R1.290 O=CCC(=O)NCCC1CC1 7e71c9aaad855582bc3442521f4ece77 [0,0,0,1,0,0|2,0,1]=4 1724 B11R1.342 CCCN1CCCC(C1)(C)C da8d8a6e6fb979612ab48564dff49869 [0,0,0,1,0,0|3,0,0]=4 1725 B11R1.565 CC(C)N1CCCC(=O)CC1 ffd26b97d8be0f334396ef3cc27e2250 [0,0,0,1,0,0|2,0,0]=3 1726 B11R1.565 CC(C)N1CCNC(=O)CC1 95e19f3c7a6fa08a224bbf0bcd373323 [0,0,0,1,0,0|3,0,0]=4 1727 B11R1.645 CC(C)OC1CC(=O)NC1C c30cbc6ec4a2f608cff3831d67060934 [0,0,0,1,0,0|3,0,0]=4 1728 B11R1.645 CC(C)OC1OC(=O)CC1C c567292cf0c0814b08032b6fce2de557 [0,0,0,1,0,0|1,0,0]=2 1729 B11R1.645 CC(C)O[C@H]1CC(=O)N[C@H]1C 8e517375008cac18e2f0f8fe6218076b [0,0,0,1,0,0|3,0,0]=4 1730 B11R1.645 CC1=CC(=O)OC1OC(C)C 815dede990b436c3416d97c50ea807ce [0,0,0,1,0,0|1,0,2]=4 1731 B11R1.674 CC(C)CCN1C(CC1C)C e6b8325a0f0516608e816450d8edfa6e [0,0,0,1,0,0|2,0,1]=4 1732 B11R1.674 CC(C)CCN1[C@@H](C[C@@H]1C)C ffad52fb56845c302fa9e401f449d9d7 [0,0,0,1,0,0|2,0,1]=4 1733 B11R1.674 CC(C)CCN1[C@@H](C[C@H]1C)C a74c863de57a06ae5cdf98d296dd720b [0,0,0,1,0,0|2,0,1]=4 1734 B11R1.674 CC(C)CCN1[C@H](C[C@@H]1C)C 1b7e43176980796100da8c5d57d0609b [0,0,0,1,0,0|2,0,1]=4 1735 B11R1.720 CC(C)CCCN(C)C1CC1 bac10d326d2f13ee1b4bccff851c3362 [0,0,0,1,0,0|3,0,0]=4 1736 B11R1.720 CC(C)CCNC(C)C1CC1 1a884a720090066f14e460afa3e4aeff [0,0,0,1,0,0|2,0,1]=4 1737 B11R1.720 CC(C)CCN[C@@H](C)C1CC1 6a835910a1fda33d1717fc391ff4156c [0,0,0,1,0,0|2,0,1]=4 1738 B11R1.720 CC(C)CCN[C@H](C)C1CC1 1fdf5e99c224a74c851865835e3b79f7 [0,0,0,1,0,0|2,0,1]=4 1739 B11R1.720 CC(C)CCOC(C)C1CC1 4144fd8df9f84373a9cdac8484b99885 [0,0,0,1,0,0|1,0,1]=3 1740 B11R1.720 CC(C)CCO[C@@H](C)C1CC1 5b89ee5ae2b38843e429b04fedc44c4b [0,0,0,1,0,0|1,0,1]=3 1741 B11R1.720 CC(C)CCO[C@H](C)C1CC1 009d9f9df777d0bba9c841c80246fcf8 [0,0,0,1,0,0|1,0,1]=3 1742 B11R1.720 CC(C)CNCC(=O)C1CC1 5b7a89b57bed2866409a40bc45c34697 [0,0,0,1,0,0|2,0,0]=3 1743 B11R1.720 CC(C)COCC(=O)C1CC1 8c7c9ca3dd8dedd2de56986cfd7e3c95 [0,0,0,1,0,0|2,0,0]=3 1744 B11R1.720 CC(C)OCOC(=O)C1CC1 2a95804f15d0c01bde4ecdad04eb112f [0,0,0,1,0,0|1,0,0]=2 1745 B11R1.720 CC(C)OCOC(C)C1CC1 ea370cb4164ff98fa7a2ab20f498abf9 [0,0,0,1,0,0|2,0,1]=4 1746 B11R1.720 CC(C)OCO[C@@H](C)C1CC1 1e865bd9f189b41d660c795ecc8a17c0 [0,0,0,1,0,0|2,0,1]=4 1747 B11R1.720 CC(C)OCO[C@H](C)C1CC1 00b5de56ae880a8b6b92a63011851654 [0,0,0,1,0,0|2,0,1]=4 1748 B11R1.720 CC(F)COCC(=O)C1CC1 d82c4ed9da238b63beeb12a1f53f4d52 [0,0,0,1,0,0|3,0,0]=4 1749 B11R1.720 CC(O)CNCC(=O)C1CC1 984740d4fc980399a5e3a8fafc60520b [0,0,0,1,0,0|3,0,0]=4 1750 B11R1.720 CC(OCCN(C)C)C1CC1 5ca497a15d03354706a138abf4dd4529 [0,0,0,1,0,0|2,0,1]=4 1751 B11R1.720 CC(S)COCC(=O)C1CC1 97f1dd1f546b079b588159a83856fccf [0,0,0,1,0,0|3,0,0]=4 1752 B11R1.720 CN(C)COCC(=O)C1CC1 cbb46d433a9ce3a29f5623b5c553aced [0,0,0,1,0,0|3,0,0]=4 1753 B11R1.720 C[C@@H](F)COCC(=O)C1CC1 077725e515a0f0223b09f39d77df92ca [0,0,0,1,0,0|3,0,0]=4 1754 B11R1.720 C[C@@H](O)CNCC(=O)C1CC1 35aa70045f98b0dc3540ac0150e27dd9 [0,0,0,1,0,0|3,0,0]=4 1755 B11R1.720 C[C@@H](OCCN(C)C)C1CC1 9c3956d01ad918e6d7f9023fb3a8c7f8 [0,0,0,1,0,0|2,0,1]=4 1756 B11R1.720 C[C@H](F)COCC(=O)C1CC1 a7f93ca7bed17f2f79622ee66c69b3b8 [0,0,0,1,0,0|3,0,0]=4 1757 B11R1.720 C[C@H](O)CNCC(=O)C1CC1 cd9eeab0bc7acfb13f59c6c8bc0b2af4 [0,0,0,1,0,0|3,0,0]=4 1758 B11R1.720 C[C@H](OCCN(C)C)C1CC1 dcc17f4fc8b626fa9f5ee7e2422e3392 [0,0,0,1,0,0|2,0,1]=4 1759 B11R1.839 C#CCC(=O)NC1CC1(C)C 940895fe8bd21421bad64ba87dbb20aa [0,0,0,1,0,0|1,0,2]=4 1760 B11R1.839 C#CCC(=O)N[C@@H]1CC1(C)C 5299db9bc46895e85e52deb7f8c6224f [0,0,0,1,0,0|1,0,2]=4 1761 B11R1.839 C#CCC(=O)N[C@H]1CC1(C)C 7e409336f42c97b63fdc1b242f988ed5 [0,0,0,1,0,0|1,0,2]=4 1762 B11R1.839 C/C=C/C(=O)NC1CC1(C)C ec712a835d4101fb5220bd1bdab55cfb [0,0,0,1,0,0|1,0,2]=4 1763 B11R1.839 C/C=C/C(=O)N[C@@H]1CC1(C)C 38ed27afe7a82424dc5bff891cf9e234 [0,0,0,1,0,0|1,0,2]=4 1764 B11R1.839 C/C=C/C(=O)N[C@H]1CC1(C)C 3ebcfe5a74d42656d0a7f9000007f838 [0,0,0,1,0,0|1,0,2]=4 1765 B11R1.839 C=CCC(=O)NC1CC1(C)C 52e8f2e8830748755c7bbd8e577bc00e [0,0,0,1,0,0|1,0,2]=4 1766 B11R1.839 C=CCC(=O)N[C@@H]1CC1(C)C c5a936e275e26e9818e2226293de7e89 [0,0,0,1,0,0|1,0,2]=4 1767 B11R1.839 C=CCC(=O)N[C@H]1CC1(C)C 23f43545ac628c4360334c4684d6f369 [0,0,0,1,0,0|1,0,2]=4 1768 B11R1.839 CC#CC(=O)NC1CC1(C)C 952f2c48e2c5636c870b967a50613dca [0,0,0,1,0,0|1,0,2]=4 1769 B11R1.839 CC#CC(=O)N[C@@H]1CC1(C)C 81da63d9431f463f27bc7907c9df8e2c [0,0,0,1,0,0|1,0,2]=4 1770 B11R1.839 CC#CC(=O)N[C@H]1CC1(C)C 7cc827aa3b2e858154685efc432f1e57 [0,0,0,1,0,0|1,0,2]=4 1771 B11R1.839 CC1(CC1NC(=O)CC#N)C b3c12ac0113b6d761df8cc10b807bb02 [0,0,0,1,0,0|2,0,1]=4 1772 B11R1.839 CC1(CC1NC(=O)CC=O)C 23aeaff066c039ceabac4629c292a383 [0,0,0,1,0,0|2,0,1]=4 1773 B11R1.839 CC1(CC1NC(=O)CCF)C 04728e2e0cd69c6972f56568c7305359 [0,0,0,1,0,0|2,0,0]=3 1774 B11R1.839 CC1(CC1NC(=O)CCO)C 4158d376102bba59cdc8cbea6581278b [0,0,0,1,0,0|2,0,0]=3 1775 B11R1.839 CC1(CC1NC(=O)CCS)C 644050e3ea2dc55f89332db6435d9dec [0,0,0,1,0,0|2,0,0]=3 1776 B11R1.839 CC1(CC1NC(=O)CON)C 42117b1976a29e3ac4d1e25a48807c38 [0,0,0,1,0,0|3,0,0]=4 1777 B11R1.839 CC1(C[C@@H]1NC(=O)CC#N)C 5bd169a8a746ab0fdbcef0c0681933d2 [0,0,0,1,0,0|2,0,1]=4 1778 B11R1.839 CC1(C[C@@H]1NC(=O)CC=O)C dc1d79cd5c766a5112088d63215a40d5 [0,0,0,1,0,0|2,0,1]=4 1779 B11R1.839 CC1(C[C@@H]1NC(=O)CCF)C c7486fa65880776042bc1d0eb8c1b099 [0,0,0,1,0,0|2,0,0]=3 1780 B11R1.839 CC1(C[C@@H]1NC(=O)CCO)C f07dd6d32118ecce53e866d73d1245ea [0,0,0,1,0,0|2,0,0]=3 1781 B11R1.839 CC1(C[C@@H]1NC(=O)CCS)C bca83ab427f867031c51e4114af8da74 [0,0,0,1,0,0|2,0,0]=3 1782 B11R1.839 CC1(C[C@@H]1NC(=O)CON)C a3642385cf181dd660aea90aec532bf8 [0,0,0,1,0,0|3,0,0]=4 1783 B11R1.839 CC1(C[C@H]1NC(=O)CC#N)C 6a0de01dfd6bfecf5e345da664a83db9 [0,0,0,1,0,0|2,0,1]=4 1784 B11R1.839 CC1(C[C@H]1NC(=O)CC=O)C 66e8196a99bede759a316eae74101cda [0,0,0,1,0,0|2,0,1]=4 1785 B11R1.839 CC1(C[C@H]1NC(=O)CCF)C fa84cf2f1cd10b2c982d0a00928fd392 [0,0,0,1,0,0|2,0,0]=3 1786 B11R1.839 CC1(C[C@H]1NC(=O)CCO)C 701eaf33cd7da8010a11265e72755f19 [0,0,0,1,0,0|2,0,0]=3 1787 B11R1.839 CC1(C[C@H]1NC(=O)CCS)C a7adfb28af8cb96d623091d2823720b4 [0,0,0,1,0,0|2,0,0]=3 1788 B11R1.839 CC1(C[C@H]1NC(=O)CON)C 08e635a4a6b6b44c885c1423e7c9840d [0,0,0,1,0,0|3,0,0]=4 1789 B11R1.839 CCCC(=O)CN1CC1(C)C 2f69bcdd9cf3b8267f678dbc405e151c [0,0,0,1,0,0|2,0,0]=3 1790 B11R1.839 CCCC(=O)NC1CC1(C)C 5ac2082fbd3ff8bca583880b1b1bd9b1 [0,0,0,1,0,0|1,0,0]=2 1791 B11R1.839 CCCC(=O)NC1CC1(F)F c5210d8e6edf80cb998c258118090bee [0,0,0,1,0,0|3,0,0]=4 1792 B11R1.839 CCCC(=O)N[C@@H]1CC1(C)C 83c96d1ad2a9adf3f1e8daf68a0e6cb2 [0,0,0,1,0,0|1,0,0]=2 1793 B11R1.839 CCCC(=O)N[C@H]1CC1(C)C 4e2ee60eb81af8f7e1ff5d14daaf30c5 [0,0,0,1,0,0|1,0,0]=2 1794 B11R1.839 CCCC(=S)OC1CC1(C)C 383e33bc5939c79f0ae07d1ce5adda12 [0,0,0,1,0,0|0,1,0]=2 1795 B11R1.839 CCCC(=S)OC1CC1(F)F 833eb18f4f656e4d9bf84a6d63ed9a09 [0,0,0,1,0,0|2,1,0]=4 1796 B11R1.839 CCCC(C)NC1CC1(C)C 8d0542850715d4c57a2db10c04f2317e [0,0,0,1,0,0|2,0,1]=4 1797 B11R1.839 CCCC(C)N[C@@H]1CC1(C)C c6da6fa06e2bea98b3bd8b79963f2505 [0,0,0,1,0,0|2,0,1]=4 1798 B11R1.839 CCCC(C)N[C@H]1CC1(C)C 9b02bf4d752ce0a6269f17b5ee6da12d [0,0,0,1,0,0|2,0,1]=4 1799 B11R1.839 CCCC(C)OC1CC1(C)C 9bd7d67bceed441682c5421027a0c0fa [0,0,0,1,0,0|1,0,1]=3 1800 B11R1.839 CCC[C@@H](C)OC1CC1(C)C c808fa653e1ee9a6772bca1d87fd437c [0,0,0,1,0,0|1,0,1]=3 1801 B11R1.839 CCC[C@H](C)NC1CC1(C)C 31b5210b1f6e9ef22a9bbeef4dae14c7 [0,0,0,1,0,0|2,0,1]=4 1802 B11R1.839 CCC[C@H](C)OC1CC1(C)C f9a261098025cad6547bd25b3e768025 [0,0,0,1,0,0|1,0,1]=3 1803 B11R1.839 CCNC(=O)CN1CC1(C)C c3520c5f05216af0c984a607f18b540a [0,0,0,1,0,0|3,0,0]=4 1804 B11R1.839 CCOC(=O)CN1CC1(C)C e39f3c532f8c7d93f5b0fcb8e2f88993 [0,0,0,1,0,0|3,0,0]=4 1805 B11R1.839 COCC(=O)CN1CC1(C)C 892f7c11ebd9f282702179327172e3e2 [0,0,0,1,0,0|3,0,0]=4 1806 B11R1.839 COCC(=O)NC1CC1(C)C d0f47666418e8a6f44d415ecbdc267eb [0,0,0,1,0,0|2,0,0]=3 1807 B11R1.839 COCC(=O)N[C@@H]1CC1(C)C a6b6371222d58528d83a67e244149671 [0,0,0,1,0,0|2,0,0]=3 1808 B11R1.839 COCC(=O)N[C@H]1CC1(C)C d68f8f3c74e7bb34f816f0b7f05d5a5f [0,0,0,1,0,0|2,0,0]=3 1809 B11R1.839 COCC(C)OC1CC1(C)C f18d5b98953aa9ace2befea7a8d3ef49 [0,0,0,1,0,0|2,0,1]=4 1810 B11R1.839 COC[C@@H](C)OC1CC1(C)C a659b4a8fe81876dcaf737838a0ff145 [0,0,0,1,0,0|2,0,1]=4 1811 B11R1.839 COC[C@H](C)OC1CC1(C)C ad7062e6e694a6ba72e19ffc4098d559 [0,0,0,1,0,0|2,0,1]=4 1812 B11R1.839 CSCC(=O)NC1CC1(C)C 7e336538c687a77a3fc09e2d4c8be310 [0,0,0,1,0,0|2,0,0]=3 1813 B11R1.839 CSCC(=O)N[C@@H]1CC1(C)C 2a2390b52a83ac29eba66363ca45b8cc [0,0,0,1,0,0|2,0,0]=3 1814 B11R1.839 CSCC(=O)N[C@H]1CC1(C)C c2d1bbecf7b8daf111fca1d7ed7314a4 [0,0,0,1,0,0|2,0,0]=3 1815 B11R1.839 CSCC(C)OC1CC1(C)C 8ff440f54ddd7e765fd72449ccea5f8f [0,0,0,1,0,0|2,0,1]=4 1816 B11R1.924 CC(C)CCNC1(CCC1)C f75602ac4f052303d3a133d4b17c9605 [0,0,0,1,0,0|2,0,1]=4 1817 B9R0.48 C#CCC(=O)NCC(C)C 2b539c134b604ef80f6922fbe76e6c9e [0,0,0,0,1,0|1,0,2]=4 1818 B9R0.48 C/C=C/C(=O)NCC(C)C 1bc11c358e801c48de2ee29a286f4bd5 [0,0,0,0,1,0|1,0,2]=4 1819 B9R0.48 C=C(C)CNC(=O)CCC 8798d18f5f118779f2ebf2a6aa1a07ee [0,0,0,0,1,0|1,0,2]=4 1820 B9R0.48 C=C(C)COC(=S)CCC 062bee5a1931dceb7a99ac6754c8a6e0 [0,0,0,0,1,0|0,1,2]=4 1821 B9R0.48 C=CCC(=O)NCC(C)C 7ec6a94fdaa5e3ae98cbb3f64b8e60bc [0,0,0,0,1,0|1,0,2]=4 1822 B9R0.48 CC#CC(=O)NCC(C)C e82bcca2c749485b82eed7abb95b4ed1 [0,0,0,0,1,0|1,0,2]=4 1823 B9R0.48 CC(C)CCC(=O)NC#N 38f6aba8841dc8c8acc89fa79a371a14 [0,0,0,0,1,0|2,0,1]=4 1824 B9R0.48 CC(C)CCN(C)CCF 7aff48f765c5fb868e5dec98540267d4 [0,0,0,0,1,0|3,0,0]=4 1825 B9R0.48 CC(C)CCN(C)CCO 750487784accfe76b036aed3cc288c06 [0,0,0,0,1,0|3,0,0]=4 1826 B9R0.48 CC(C)CCN(C)CCS 37cf0fc5ada71edf7ec5195ccf133b7b [0,0,0,0,1,0|3,0,0]=4 1827 B9R0.48 CC(C)CNC(=O)CC#N da719fabe8759ec5e2c0aae8a67b1c3f [0,0,0,0,1,0|2,0,1]=4 1828 B9R0.48 CC(C)CNC(=O)CC=O eded3f924384a847332929ab66da76a7 [0,0,0,0,1,0|2,0,1]=4 1829 B9R0.48 CC(C)CNC(=O)CCF 826700e367231bc545e19b99db141768 [0,0,0,0,1,0|2,0,0]=3 1830 B9R0.48 CC(C)CNC(=O)CCO 08f3d4ee1660e29d5ac3dec2e1de53b3 [0,0,0,0,1,0|2,0,0]=3 1831 B9R0.48 CC(C)CNC(=O)CCS 86fefd6d585490fd9e35b853263eb718 [0,0,0,0,1,0|2,0,0]=3 1832 B9R0.48 CC(C)CNC(=O)CON 0ea6d69697f2be664daf427d8f7b7ee0 [0,0,0,0,1,0|3,0,0]=4 1833 B9R0.48 CC(O)CNC(=O)CCF 7757526ea6f90212ff828df92a81524c [0,0,0,0,1,0|3,0,0]=4 1834 B9R0.48 CC(O)CNC(=O)CCO b1635c07c3f511f2b77001a38f892231 [0,0,0,0,1,0|3,0,0]=4 1835 B9R0.48 CC(O)CNC(=O)CCS dab7482190fb8fba11ac4545e829c43e [0,0,0,0,1,0|3,0,0]=4 1836 B9R0.48 CCCC(=O)COC(C)C bda6e210e89c477f850b0ed2f7c35c92 [0,0,0,0,1,0|1,0,0]=2 1837 B9R0.48 CCCC(=O)NCC(=O)C 2da9b0181737be2a6f0a306a2b6bdda4 [0,0,0,0,1,0|2,0,1]=4 1838 B9R0.48 CCCC(=O)NCC(C)C 7be62da310536c4ced65314ef5418719 [0,0,0,0,1,0|1,0,0]=2 1839 B9R0.48 CCCC(=O)NCC(C)O ba53379307f7ae08a2b5b3adca0ac823 [0,0,0,0,1,0|2,0,0]=3 1840 B9R0.48 CCCC(=O)NCC(F)F b25dac1762974bb69abf8a625d0f8c67 [0,0,0,0,1,0|3,0,0]=4 1841 B9R0.48 CCCC(=O)NC[C@@H](C)O 2eea508114803a331a902914666075a1 [0,0,0,0,1,0|2,0,0]=3 1842 B9R0.48 CCCC(=O)NC[C@H](C)O b4f7691f264345400cd9717008b17039 [0,0,0,0,1,0|2,0,0]=3 1843 B9R0.48 CCCC(=S)OCC(C)C c4d61142d19f3b95bf6fc47b82091ab4 [0,0,0,0,1,0|0,1,0]=2 1844 B9R0.48 CCCC(=S)OCC(F)F 4e5a23488e59d510c25f82807faa17ca [0,0,0,0,1,0|2,1,0]=4 1845 B9R0.48 CCCC(=S)OCN(C)C 90268128f593c656a899cd1aeed8f1e4 [0,0,0,0,1,0|1,1,0]=3 1846 B9R0.48 CCCC(C)COC(C)C 6f61b5f138dfbd6067084ccc576d7217 [0,0,0,0,1,0|2,0,1]=4 1847 B9R0.48 CCCC(C)NCC(C)C d538efe78cc88c3696f838d8453a97c3 [0,0,0,0,1,0|2,0,1]=4 1848 B9R0.48 CCCC(C)OCC(C)C 5be224d9722cec7f07e97282baf3a2b2 [0,0,0,0,1,0|1,0,1]=3 1849 B9R0.48 CCCC(C)OCC(C)F b3a225377e32d1b250f9262699c6f119 [0,0,0,0,1,0|2,0,1]=4 1850 B9R0.48 CCCC(C)OCC(C)S d3034c5e31db5713dbe6f459423f94d7 [0,0,0,0,1,0|2,0,1]=4 1851 B9R0.48 CCCC(C)OCN(C)C 23396ff1ddbf942ed77c3695a4bc97fc [0,0,0,0,1,0|2,0,1]=4 1852 B9R0.48 CCCC(C)OC[C@@H](C)F 9bd1fd92723fed4710945b5373a22940 [0,0,0,0,1,0|2,0,1]=4 1853 B9R0.48 CCCC(C)OC[C@H](C)F d026e085ff493f00380d10ee8bd7fa5f [0,0,0,0,1,0|2,0,1]=4 1854 B9R0.48 CCCC(O)CNC(C)C 653f89e414ebf2a141be02a7c24ee341 [0,0,0,0,1,0|1,0,2]=4 1855 B9R0.48 CCCN(C)CCC(C)C 26a8b47e2812a3bdeefc657f75633267 [0,0,0,0,1,0|2,0,0]=3 1856 B9R0.48 CCCN(C)CCC(C)O d548c004046fcb4cac04a11fffe2a92b [0,0,0,0,1,0|3,0,0]=4 1857 B9R0.48 CCCN(C)CCN(C)C dac7c02e59882321caa9c219e115d593 [0,0,0,0,1,0|3,0,0]=4 1858 B9R0.48 CCCN(C)COC(C)C 959e04c5ddd931b823e5b3358a95cdd6 [0,0,0,0,1,0|3,0,0]=4 1859 B9R0.48 CCC[C@@H](C)OCC(C)C ebec32e182b28eaf84b2474f2392075c [0,0,0,0,1,0|1,0,1]=3 1860 B9R0.48 CCC[C@@H](C)OCN(C)C a0eefd7db826843f7801fef1f228f163 [0,0,0,0,1,0|2,0,1]=4 1861 B9R0.48 CCC[C@H](C)NCC(C)C b8b299d83fd0f93134fe590e4a562be9 [0,0,0,0,1,0|2,0,1]=4 1862 B9R0.48 CCC[C@H](C)OCC(C)C 2682183614895a777d22e8d5943637b5 [0,0,0,0,1,0|1,0,1]=3 1863 B9R0.48 CCC[C@H](C)OCN(C)C 33b94e7259cad056584de2305a4601a1 [0,0,0,0,1,0|2,0,1]=4 1864 B9R0.48 CCNC(=O)CNC(C)C e4859b939cf74625a255ec0cb59c0de7 [0,0,0,0,1,0|2,0,0]=3 1865 B9R0.48 CCNC(=O)COC(C)C c828d8acf61877ee15690716396e9a0a [0,0,0,0,1,0|2,0,0]=3 1866 B9R0.48 CCNC(C)CCC(C)C 6642fd36aa55d925398181b4d6ed89d5 [0,0,0,0,1,0|2,0,1]=4 1867 B9R0.48 CCOC(=O)CNC(C)C 80d7999aed865ea280b457aaf3d32f53 [0,0,0,0,1,0|2,0,0]=3 1868 B9R0.48 CCOC(=O)COC(C)C 228e90334048907c42f17a3b8b5d3d98 [0,0,0,0,1,0|2,0,0]=3 1869 B9R0.48 CCOC(C)CCC(C)C 238b79e992f85c5e82c5f29d7dc01557 [0,0,0,0,1,0|2,0,1]=4 1870 B9R0.48 COCC(=O)COC(C)C 8939b2d2f657a9aa8b5fe020856934ec [0,0,0,0,1,0|2,0,0]=3 1871 B9R0.48 COCC(=O)NCC(C)C c4daec739ffacc829175580449ce011a [0,0,0,0,1,0|2,0,0]=3 1872 B9R0.48 COCC(=O)NCC(C)O f8b1886d725f96091277fd4292d75f7c [0,0,0,0,1,0|3,0,0]=4 1873 B9R0.48 COCC(=O)NC[C@@H](C)O 38cd21dd85798a5a788972e72e7b27b4 [0,0,0,0,1,0|3,0,0]=4 1874 B9R0.48 COCC(=O)NC[C@H](C)O 7b1079842e2b577308d40cc0f954db1a [0,0,0,0,1,0|3,0,0]=4 1875 B9R0.48 COCC(C)OCC(C)C 897ae5cd59a872ba0cf3df10dab20d2d [0,0,0,0,1,0|2,0,1]=4 1876 B9R0.48 COCN(C)CCC(C)C e96d91813b80a051709cd86e0eba9943 [0,0,0,0,1,0|3,0,0]=4 1877 B9R0.48 COC[C@@H](C)OCC(C)C 5b5fad6ccd96f6768a42d911f03ef030 [0,0,0,0,1,0|2,0,1]=4 1878 B9R0.48 COC[C@H](C)OCC(C)C 4b3681d55e36bc149b23f34bc2c251dd [0,0,0,0,1,0|2,0,1]=4 1879 B9R0.48 CSCC(=O)NCC(C)C a69af075b2a8cbccacb76cdf22bda7bc [0,0,0,0,1,0|2,0,0]=3 1880 B9R0.48 CSCC(=O)NCC(C)O 5ddd4615c40d13f813df67061386bd0f [0,0,0,0,1,0|3,0,0]=4 1881 B9R0.48 CSCC(=O)NC[C@@H](C)O 59b3f010bc95e38c2da99c17ace4d5e4 [0,0,0,0,1,0|3,0,0]=4 1882 B9R0.48 CSCC(=O)NC[C@H](C)O 00ee44d7d8459039c0f9f6a7fae87b9b [0,0,0,0,1,0|3,0,0]=4 1883 B9R0.48 CSCC(C)OCC(C)C a697430b7387ef54e43f4d719f65a66f [0,0,0,0,1,0|2,0,1]=4 1884 B9R0.48 CSCN(C)CCC(C)C c7b7424cc524d609dac023be0bf5fbc2 [0,0,0,0,1,0|3,0,0]=4 1885 B9R0.48 C[C@@H](O)CNC(=O)CCF 2b7488dccbe633938ac10d081588a52a [0,0,0,0,1,0|3,0,0]=4 1886 B9R0.48 C[C@@H](O)CNC(=O)CCO 01b1ffada3c2f0f23e1dce4445c2104f [0,0,0,0,1,0|3,0,0]=4 1887 B9R0.48 C[C@@H](O)CNC(=O)CCS 211c2eb3fab7240e8f12677b13139a27 [0,0,0,0,1,0|3,0,0]=4 1888 B9R0.48 C[C@H](O)CNC(=O)CCF d3bafacfa081196fcd8a7ab00ec7ca7e [0,0,0,0,1,0|3,0,0]=4 1889 B9R0.48 C[C@H](O)CNC(=O)CCO e03a4db8a40c5ae1a7bd3001f9c12be5 [0,0,0,0,1,0|3,0,0]=4 1890 B9R0.48 C[C@H](O)CNC(=O)CCS 1ae07cce24e7953421707524a017a693 [0,0,0,0,1,0|3,0,0]=4 1891 B11R0.176 C#CCC(=O)NCCCC(C)C efea248dd4eb82a41b7c303e7e738c18 [0,0,0,0,0,1|1,0,2]=4 1892 B11R0.176 C#CCC(=O)NCCOC(C)C 732ee71e0b7affbeef0941018013258a [0,0,0,0,0,1|1,0,2]=4 1893 B11R0.176 C/C=C/C(=O)NCCCC(C)C 3d89c134843465b1c2b7598c90f3df65 [0,0,0,0,0,1|1,0,2]=4 1894 B11R0.176 C/C=C/C(=O)NCCOC(C)C 1299b0c986a65cb8363d418e8ebcd1c7 [0,0,0,0,0,1|1,0,2]=4 1895 B11R0.176 C=C(Br)CCOCC(=O)CCC 0d042f20227c1eae142691da887567ab [0,0,0,0,0,1|1,0,2]=4 1896 B11R0.176 C=C(Br)CNCOC(=O)CCC 78597947459243f3b288902de7e3b312 [0,0,0,0,0,1|1,0,2]=4 1897 B11R0.176 C=C(Br)COCOC(=O)CCC 97ebe49d30429fa3e4416d94d6f4291d [0,0,0,0,0,1|1,0,2]=4 1898 B11R0.176 C=C(C)CCCOC(=S)CCC 06f0d2133543f9c78504c69a8dcd99b6 [0,0,0,0,0,1|0,1,2]=4 1899 B11R0.176 C=C(C)CCNCC(=O)CCC 6a606e2e8db15771fc2f5abcf75b1f37 [0,0,0,0,0,1|1,0,2]=4 1900 B11R0.176 C=C(C)CCOCC(=O)CCC 9c44c524c3a3249e5de2ed263344d68f [0,0,0,0,0,1|0,0,2]=3 1901 B11R0.176 C=C(C)CCOCC(=O)NCC 5b74072f07b6969e0381e78bf6ccfc78 [0,0,0,0,0,1|1,0,2]=4 1902 B11R0.176 C=C(C)CCOCC(=O)OCC 660e815b6c9b770398b6d1691d85d844 [0,0,0,0,0,1|1,0,2]=4 1903 B11R0.176 C=C(C)CNCOC(=O)CCC 2c571cde0834552be7ace0df261bed5e [0,0,0,0,0,1|0,0,2]=3 1904 B11R0.176 C=C(C)CNCOC(=O)OCC 999c5e097b54e8479cd3a807fb438a91 [0,0,0,0,0,1|1,0,2]=4 1905 B11R0.176 C=C(C)CNCOC(=O)SCC f36c35930314f9fd2c488ca16f33d0af [0,0,0,0,0,1|1,0,2]=4 1906 B11R0.176 C=C(C)COCOC(=O)CCC 703e5b52959455f5f84dfadfe1e3f05c [0,0,0,0,0,1|0,0,2]=3 1907 B11R0.176 C=C(C)COCOC(=O)OCC 6094d31ebb728ef3aa4c0a5c61622e6f [0,0,0,0,0,1|1,0,2]=4 1908 B11R0.176 C=C(C)COCOC(=O)SCC 1bb6a7b54a3b344a35d4b78e8d6dcbbe [0,0,0,0,0,1|1,0,2]=4 1909 B11R0.176 C=C(Cl)COCOC(=O)CCC 69b4f9e8cd129dbf2e853d218508631f [0,0,0,0,0,1|1,0,2]=4 1910 B11R0.176 C=C(I)COCOC(=O)CCC eae6b477397ffe4e05a8a569deaf1f70 [0,0,0,0,0,1|1,0,2]=4 1911 B11R0.176 C=CCC(=O)NCCCC(C)C 1dcea6a71ddfa8c9060a797915a26460 [0,0,0,0,0,1|1,0,2]=4 1912 B11R0.176 C=CCC(=O)NCCOC(C)C 7a10c2c7cbfab2712afe033c7922726f [0,0,0,0,0,1|1,0,2]=4 1913 B11R0.176 C=COC(=O)COCCC(C)C 001457797fc8a5e8d9468a4a4359634a [0,0,0,0,0,1|1,0,2]=4 1914 B11R0.176 CC#CC(=O)NCCCC(C)C 4b169220ee10fcf71910c91aa509ce39 [0,0,0,0,0,1|1,0,2]=4 1915 B11R0.176 CC#CC(=O)NCCOC(C)C 3722d048ef7c8c2c4ea038c4cb64d989 [0,0,0,0,0,1|1,0,2]=4 1916 B11R0.176 CC(C)CCCNC(=O)CC#N df2129595942044bc8715fc725ec0496 [0,0,0,0,0,1|2,0,1]=4 1917 B11R0.176 CC(C)CCCNC(=O)CC=O 193ec567d5a6df0438b824f7cad0f246 [0,0,0,0,0,1|2,0,1]=4 1918 B11R0.176 CC(C)CCCNC(=O)CCF 7cd6c42913b1c06ce9150402c063b0d8 [0,0,0,0,0,1|2,0,0]=3 1919 B11R0.176 CC(C)CCCNC(=O)CCO 6acd407b4da45db97c355e27d0572b93 [0,0,0,0,0,1|2,0,0]=3 1920 B11R0.176 CC(C)CCCNC(=O)CCS 442e6cb2b25c081cd1cb0fd03ac702da [0,0,0,0,0,1|2,0,0]=3 1921 B11R0.176 CC(C)CCCNC(=O)CON b201613f1e4a974fefd64c648e286ce8 [0,0,0,0,0,1|3,0,0]=4 1922 B11R0.176 CC(C)CCNCC(=O)NCO c023e20a2beac7ac8fc06af360276c4f [0,0,0,0,0,1|3,0,0]=4 1923 B11R0.176 CC(C)CCOC[C@@H](O)CCO 81c44fb426df76ea93c76505c87fd5ea [0,0,0,0,0,1|1,0,2]=4 1924 B11R0.176 CC(C)OCCNC(=O)CC#N 7974faaade7491db9ee9453290db6f62 [0,0,0,0,0,1|2,0,1]=4 1925 B11R0.176 CC(C)OCCNC(=O)CC=O 23fdf6cc40336f695ce28514506368cd [0,0,0,0,0,1|2,0,1]=4 1926 B11R0.176 CC(C)OCCNC(=O)CCF 6a805954dd972bc9f336cc2a79ffae44 [0,0,0,0,0,1|2,0,0]=3 1927 B11R0.176 CC(C)OCCNC(=O)CCO 611b3438ffa646a4d2579e8a4d971723 [0,0,0,0,0,1|2,0,0]=3 1928 B11R0.176 CC(C)OCCNC(=O)CCS a5ee2a54cca999d0b46dc31610904295 [0,0,0,0,0,1|2,0,0]=3 1929 B11R0.176 CC(C)OCCNC(=O)CON c9aea4c838e4bbf17e22d9167b3eeb3e [0,0,0,0,0,1|3,0,0]=4 1930 B11R0.176 CCCC(=O)CNCC=C(C)C 8ab97d76a02b4d4571871d2ce955ad30 [0,0,0,0,0,1|1,0,2]=4 1931 B11R0.176 CCCC(=O)CNCCC(C)C 311c7bb78e0d041c14f5cbc9da42948d [0,0,0,0,0,1|1,0,0]=2 1932 B11R0.176 CCCC(=O)CNCCC(C)O b72f56b2f314d16d6202ad997932347b [0,0,0,0,0,1|2,0,0]=3 1933 B11R0.176 CCCC(=O)CNCCC(F)F 3423cf7e71dd8fe3354aa8a5c92861c0 [0,0,0,0,0,1|3,0,0]=4 1934 B11R0.176 CCCC(=O)CNCCN(C)C 00240278f85182e7e2684d63d9e7538c [0,0,0,0,0,1|2,0,0]=3 1935 B11R0.176 CCCC(=O)CNCCS(=O)C 18aed2c7aaa0ee74e25c6bd637749a42 [0,0,0,0,0,1|3,0,0]=4 1936 B11R0.176 CCCC(=O)CNCC[C@@H](C)O f4aa6314f056fc60d53d32325c6560d9 [0,0,0,0,0,1|2,0,0]=3 1937 B11R0.176 CCCC(=O)CNCC[C@H](C)O 4eb7668ba9255a3390da70d90c5df24b [0,0,0,0,0,1|2,0,0]=3 1938 B11R0.176 CCCC(=O)COC/C=C(/C)\Cl 772a3befa2bd492825d2151639a613df [0,0,0,0,0,1|1,0,2]=4 1939 B11R0.176 CCCC(=O)COC/C=C(/C)\I 583bc40c01ae96ff62a33eb87f03f4e2 [0,0,0,0,0,1|1,0,2]=4 1940 B11R0.176 CCCC(=O)COCC=C(C)C e6cb437c8d0e95c570cab34b02b069e0 [0,0,0,0,0,1|0,0,2]=3 1941 B11R0.176 CCCC(=O)COCC=C(C)I 0583d230250676c9fc3cc8c62b576b73 [0,0,0,0,0,1|1,0,2]=4 1942 B11R0.176 CCCC(=O)COCCC(=O)C 30d1f070029befa3b0666b78064dd252 [0,0,0,0,0,1|1,0,1]=3 1943 B11R0.176 CCCC(=O)COCCC(=O)N 2ff9311c22dacffbc1f1917183bc0253 [0,0,0,0,0,1|2,0,1]=4 1944 B11R0.176 CCCC(=O)COCCC(=O)O 70af2b31f7f8df2828edd15acf112909 [0,0,0,0,0,1|2,0,1]=4 1945 B11R0.176 CCCC(=O)COCCC(C)C fafcf3956ddfaf9fda8bcce367641fd0 [0,0,0,0,0,1|0,0,0]=1 1946 B11R0.176 CCCC(=O)COCCC(F)F dcd99da61cae5a75e55c884aa36902c0 [0,0,0,0,0,1|2,0,0]=3 1947 B11R0.176 CCCC(=O)COCCN(C)C 629ddddc14b4b1ccea1cb881ae7d0e74 [0,0,0,0,0,1|1,0,0]=2 1948 B11R0.176 CCCC(=O)COCCS(=O)C 5672df53a9563d296bdc63de60ead129 [0,0,0,0,0,1|2,0,0]=3 1949 B11R0.176 CCCC(=O)COCC[N+](=O)[O-] 62d5f2c536e6755460cef0dcef54b806 [0,0,0,0,0,1|3,0,0]=4 1950 B11R0.176 CCCC(=O)COCNC(=O)C 255c3c644b4ac96e934b38e676fb189b [0,0,0,0,0,1|2,0,1]=4 1951 B11R0.176 CCCC(=O)NCCCC(C)C 0addf1beaad564b615d19ab8a52af8fd [0,0,0,0,0,1|1,0,0]=2 1952 B11R0.176 CCCC(=O)NCCCN(C)C cf751259f6afbee38b97b33068a09f33 [0,0,0,0,0,1|2,0,0]=3 1953 B11R0.176 CCCC(=O)NCCCS(=O)C 670ba425e8076bffbcb725fbdc89baff [0,0,0,0,0,1|3,0,0]=4 1954 B11R0.176 CCCC(=O)NCCNC(=O)C fdf56c8b8f95ea88b4cd5b93357b35e6 [0,0,0,0,0,1|2,0,1]=4 1955 B11R0.176 CCCC(=O)NCCOC(C)C 8e1bc54ad65925ded434d7161bb4da8d [0,0,0,0,0,1|1,0,0]=2 1956 B11R0.176 CCCC(=O)NCCOC(F)F 048ce3182dfc419e743331e9d830b024 [0,0,0,0,0,1|3,0,0]=4 1957 B11R0.176 CCCC(=O)OCCOC(C)C d6fb9d55c8594e21b596cb2208cfae4e [0,0,0,0,0,1|0,0,0]=1 1958 B11R0.176 CCCC(=O)OCNCC(=O)C b5673b9cd851f7367e2fa76dc814d144 [0,0,0,0,0,1|1,0,1]=3 1959 B11R0.176 CCCC(=O)OCNCC(=O)N 328dae47b1454767a0a019c8036acabb [0,0,0,0,0,1|2,0,1]=4 1960 B11R0.176 CCCC(=O)OCNCC(C)C 462175424f431d5efe3005b98c3393e4 [0,0,0,0,0,1|0,0,0]=1 1961 B11R0.176 CCCC(=O)OCNCC(C)O b304759118d7c52a7f930f37e90b9124 [0,0,0,0,0,1|1,0,0]=2 1962 B11R0.176 CCCC(=O)OCNCC(F)F 92344a18ed33fbc042be1f41ca45162e [0,0,0,0,0,1|2,0,0]=3 1963 B11R0.176 CCCC(=O)OCNC[C@@H](C)O 0787f3e46adef2052e68a66bfd8172d2 [0,0,0,0,0,1|1,0,0]=2 1964 B11R0.176 CCCC(=O)OCNC[C@H](C)O 5ce52f7828f664ce01404fd1978aef6f [0,0,0,0,0,1|1,0,0]=2 1965 B11R0.176 CCCC(=O)OCOCC(=O)C 0cac0d6e16ed0d347915ddf8df507054 [0,0,0,0,0,1|1,0,1]=3 1966 B11R0.176 CCCC(=O)OCOCC(=O)N 32dc44a603d5555b535fae8ccf18bb39 [0,0,0,0,0,1|2,0,1]=4 1967 B11R0.176 CCCC(=O)OCOCC(=O)O 10cb912603c94c204284279a18b3d390 [0,0,0,0,0,1|2,0,1]=4 1968 B11R0.176 CCCC(=O)OCOCC(=S)N 00a5d61be93b96f2e3fa70b410cc14ef [0,0,0,0,0,1|2,0,1]=4 1969 B11R0.176 CCCC(=O)OCOCC(C)C 9d6081c835bc8424ad8872c9637ba9b8 [0,0,0,0,0,1|0,0,0]=1 1970 B11R0.176 CCCC(=O)OCOCC(C)F 95a6308264889399aeb20497624f246a [0,0,0,0,0,1|1,0,0]=2 1971 B11R0.176 CCCC(=O)OCOCC(C)S f505a3385959087b173f866d932faed1 [0,0,0,0,0,1|1,0,0]=2 1972 B11R0.176 CCCC(=O)OCOCC(F)F b598fdab7b7b930a2c4f9bc9d1ec0edc [0,0,0,0,0,1|2,0,0]=3 1973 B11R0.176 CCCC(=O)OCOCS(=O)O 81226620f999eb92fad587c7e85d4982 [0,0,0,0,0,1|3,0,0]=4 1974 B11R0.176 CCCC(=O)OCOC[C@@H](C)F f5a607bf0a321f8665b4338b4b2e95ba [0,0,0,0,0,1|1,0,0]=2 1975 B11R0.176 CCCC(=O)OCOC[C@H](C)F 059a603dece5a36f772994b06679f618 [0,0,0,0,0,1|1,0,0]=2 1976 B11R0.176 CCCC(=S)OC/C=C/C(C)C 612e6401099c5564ea000cc248a17431 [0,0,0,0,0,1|0,1,1]=3 1977 B11R0.176 CCCC(=S)OCCC=C(C)C 38284e115eab0ddc4aaad1f7731e77ed [0,0,0,0,0,1|0,1,1]=3 1978 B11R0.176 CCCC(=S)OCCCC(=O)C ff8c32e800cfc46d63e45dc82c5e6201 [0,0,0,0,0,1|1,1,1]=4 1979 B11R0.176 CCCC(=S)OCCCC(C)C 0022d3acc9a321b5b7157c3dd124934e [0,0,0,0,0,1|0,1,0]=2 1980 B11R0.176 CCCC(=S)OCCCN(C)C b2bcc3558a7c6b44b33cc2707518645f [0,0,0,0,0,1|1,1,0]=3 1981 B11R0.176 CCCC(=S)OCCNC(=O)C cc2665946396f075cc7bf5e63c2955bb [0,0,0,0,0,1|1,1,1]=4 1982 B11R0.176 CCCC(=S)OCCOC(=O)C ae069b6cbcfcd18a36157920621bff1f [0,0,0,0,0,1|1,1,1]=4 1983 B11R0.176 CCCC(=S)OCCOC(C)C 83ae0a38e2e7a1397a1ad203d1a72a47 [0,0,0,0,0,1|0,1,0]=2 1984 B11R0.176 CCCC(=S)OCCOC(F)F 79ea38f6f01a5970ec67158ca739dec0 [0,0,0,0,0,1|2,1,0]=4 1985 B11R0.176 CCCC(=S)OCCSC(=O)C 69852cfae80e84a25ad632eb466e80ef [0,0,0,0,0,1|1,1,1]=4 1986 B11R0.176 CCCC(=S)OCCSC(C)C 1b2e3e0bc770d0a913575700f740552a [0,0,0,0,0,1|0,1,0]=2 1987 B11R0.176 CCCC(C)CCCOC(C)C 4e67ae063fe600322af6e7b5cb499c37 [0,0,0,0,0,1|2,0,1]=4 1988 B11R0.176 CCCC(C)CCOCC(C)C 24b9b43e7ec029c4bd58d608f2baafb7 [0,0,0,0,0,1|2,0,1]=4 1989 B11R0.176 CCCC(C)CNCCC(C)C 22d9c31b764614257e5c7b451810e48f [0,0,0,0,0,1|2,0,1]=4 1990 B11R0.176 CCCC(C)COCCC(C)C 642c71fb9d9145d111051a747da01b73 [0,0,0,0,0,1|1,0,1]=3 1991 B11R0.176 CCCC(C)COCCN(C)C c2b253b73b998100586fc8fff28897b1 [0,0,0,0,0,1|2,0,1]=4 1992 B11R0.176 CCCC(C)COCOC(C)C aea6c13a47128a3c7f3afddafbf8f421 [0,0,0,0,0,1|2,0,1]=4 1993 B11R0.176 CCCC(C)NCCCC(C)C f04bfc19f42e9a7285570ee0ba396bbb [0,0,0,0,0,1|2,0,1]=4 1994 B11R0.176 CCCC(C)NCCOC(C)C 6677b643d59a2486a78723750018db0c [0,0,0,0,0,1|2,0,1]=4 1995 B11R0.176 CCCC(C)NCCSC(C)C 744fb5105e5f16b133b151865a7c8cc4 [0,0,0,0,0,1|2,0,1]=4 1996 B11R0.176 CCCC(C)OC/C=C/C(C)C 166c798843657b78d88676bd1a3e14e2 [0,0,0,0,0,1|1,0,2]=4 1997 B11R0.176 CCCC(C)OCCC=C(C)C 9511b5ed2303b3f367dff911bcb93f8d [0,0,0,0,0,1|1,0,2]=4 1998 B11R0.176 CCCC(C)OCCCC(C)C e3bb3c4c8fbb375bcd15bfb88c1609db [0,0,0,0,0,1|1,0,1]=3 1999 B11R0.176 CCCC(C)OCCCN(C)C f4df3e1a23461a921010976580ea2900 [0,0,0,0,0,1|2,0,1]=4 2000 B11R0.176 CCCC(C)OCCOC(C)C 956b3c7e04804815539604d8b7a5ce99 [0,0,0,0,0,1|1,0,1]=3 2001 B11R0.176 CCCC(C)OCCSC(C)C 579ac3a2d13873cc7b4bbf45ffdd65f4 [0,0,0,0,0,1|1,0,1]=3 2002 B11R0.176 CCCC(O)CNCCC(C)C 19b6c3ce40b58c37073a9cd0360bae4f [0,0,0,0,0,1|1,0,2]=4 2003 B11R0.176 CCCC(S)CCOCC(C)C 19b9eec575fab99591951cb0fcf1223b [0,0,0,0,0,1|1,1,1]=4 2004 B11R0.176 CCCN(C)CCCCC(C)C 64b7040b645e04f5cd9237794a649b32 [0,0,0,0,0,1|3,0,0]=4 2005 B11R0.176 CCCN(C)CCOCC(C)C 96598e562efa02e94f8e21d8c49dac34 [0,0,0,0,0,1|3,0,0]=4 2006 B11R0.176 CCC[C@@H](C)OC/C=C/C(C)C fba119e0be35016870228ebaeafe0e10 [0,0,0,0,0,1|1,0,2]=4 2007 B11R0.176 CCC[C@@H](C)OCCC=C(C)C 557a757e72b91089c17d060683377757 [0,0,0,0,0,1|1,0,2]=4 2008 B11R0.176 CCC[C@@H](C)OCCCC(C)C 0b786c8e8da7f8b561a35fef44b01d3d [0,0,0,0,0,1|1,0,1]=3 2009 B11R0.176 CCC[C@@H](C)OCCCN(C)C 2c0c62dd7c589c6b8e40d642d313f777 [0,0,0,0,0,1|2,0,1]=4 2010 B11R0.176 CCC[C@@H](C)OCCOC(C)C c74586a1b12b1f11fac30a110009d770 [0,0,0,0,0,1|1,0,1]=3 2011 B11R0.176 CCC[C@@H](C)OCCSC(C)C 682586fc4d4110bd113f61a936b3fcaa [0,0,0,0,0,1|1,0,1]=3 2012 B11R0.176 CCC[C@H](C)NCCCC(C)C 139f65992f072b653f78a5c203bdf2cc [0,0,0,0,0,1|2,0,1]=4 2013 B11R0.176 CCC[C@H](C)NCCOC(C)C d85bc5bbd228d0d690371ea182ba57e2 [0,0,0,0,0,1|2,0,1]=4 2014 B11R0.176 CCC[C@H](C)NCCSC(C)C 1f3926bea87c4ae6c3b3076aa5ff62f4 [0,0,0,0,0,1|2,0,1]=4 2015 B11R0.176 CCC[C@H](C)OC/C=C/C(C)C 4f6cbf8e927288a6038da28f0185d2da [0,0,0,0,0,1|1,0,2]=4 2016 B11R0.176 CCC[C@H](C)OCCC=C(C)C 294caa694905787103e452dd5e386229 [0,0,0,0,0,1|1,0,2]=4 2017 B11R0.176 CCC[C@H](C)OCCCC(C)C 15284732fe8408fe58ec6d13ea3db5d1 [0,0,0,0,0,1|1,0,1]=3 2018 B11R0.176 CCC[C@H](C)OCCCN(C)C 8f6ed8c68dd9295126532f92194cd81e [0,0,0,0,0,1|2,0,1]=4 2019 B11R0.176 CCC[C@H](C)OCCOC(C)C 6fc53a884ab8dfbb931ca9ed3d5baf6f [0,0,0,0,0,1|1,0,1]=3 2020 B11R0.176 CCC[C@H](C)OCCSC(C)C 8b2676b0841a9803d999d2f96d138b56 [0,0,0,0,0,1|1,0,1]=3 2021 B11R0.176 CCNC(=O)CCNCC(C)C aeb65625e53a512f22c6b7f93568809a [0,0,0,0,0,1|2,0,0]=3 2022 B11R0.176 CCNC(=O)CCNCC(C)O 4a8b29fb50ccaeaf9df6638fa7118bd0 [0,0,0,0,0,1|3,0,0]=4 2023 B11R0.176 CCNC(=O)CCNC[C@@H](C)O 7f474bf0f2b43e34d27da1fb09634ce2 [0,0,0,0,0,1|3,0,0]=4 2024 B11R0.176 CCNC(=O)CCNC[C@H](C)O b7e2f0dad4355c6beb52667516d70c51 [0,0,0,0,0,1|3,0,0]=4 2025 B11R0.176 CCNC(=O)CCOCC(C)C 6902ec025b5bf930b5ecb4ea83563a35 [0,0,0,0,0,1|2,0,0]=3 2026 B11R0.176 CCNC(=O)CCOCC(C)F 10f0a950b88f20c9bb2ee36258e0e2e2 [0,0,0,0,0,1|3,0,0]=4 2027 B11R0.176 CCNC(=O)CCOCC(C)S f59756427233f3c404ed386708baf58f [0,0,0,0,0,1|3,0,0]=4 2028 B11R0.176 CCNC(=O)CCOC[C@@H](C)F b8004b91a14a2069e8f2035d007549b7 [0,0,0,0,0,1|3,0,0]=4 2029 B11R0.176 CCNC(=O)CCOC[C@H](C)F 1242563167f435b3ae464475292c5b8f [0,0,0,0,0,1|3,0,0]=4 2030 B11R0.176 CCNC(=O)CNCCC(C)C ff3c5585e61abd52cf08c4c91845d65a 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CCSC(=O)OCNCC(=O)C 5fe33686118c30462487f997981af2ad [0,0,0,0,0,1|2,0,1]=4 2087 B11R0.176 CCSC(=O)OCNCC(C)C bad2c47562f870b1f54be17e6f43cb94 [0,0,0,0,0,1|1,0,0]=2 2088 B11R0.176 CCSC(=O)OCNCC(C)O 8ffd02c032bfa69db71089baf4bae9ac [0,0,0,0,0,1|2,0,0]=3 2089 B11R0.176 CCSC(=O)OCNCC(F)F 5a8e67b81eba4b9a25cdba255ba48f3e [0,0,0,0,0,1|3,0,0]=4 2090 B11R0.176 CCSC(=O)OCNC[C@@H](C)O 0fa0160e4f062e0f114d3f0483ba0cf8 [0,0,0,0,0,1|2,0,0]=3 2091 B11R0.176 CCSC(=O)OCNC[C@H](C)O 5aadb4bbf74d34fe17e36e33580fa3fd [0,0,0,0,0,1|2,0,0]=3 2092 B11R0.176 CCSC(=O)OCOCC(=O)C ebf1b15e09895bebcd1fe92b1c335d20 [0,0,0,0,0,1|2,0,1]=4 2093 B11R0.176 CCSC(=O)OCOCC(C)C e69f5a2ab33439bafe404f67eb93b86a [0,0,0,0,0,1|1,0,0]=2 2094 B11R0.176 CCSC(=O)OCOCC(C)F aae8bd1b55f518225401946075c9481a [0,0,0,0,0,1|2,0,0]=3 2095 B11R0.176 CCSC(=O)OCOCC(C)S d24bb0a1f1d6aa2cf32587c78736a429 [0,0,0,0,0,1|2,0,0]=3 2096 B11R0.176 CCSC(=O)OCOCC(F)F 9b7acdb1c8984823d92ef01ed532b2af [0,0,0,0,0,1|3,0,0]=4 2097 B11R0.176 CCSC(=O)OCOC[C@@H](C)F 5a9b773f5eb716b377e9090de283e338 [0,0,0,0,0,1|2,0,0]=3 2098 B11R0.176 CCSC(=O)OCOC[C@H](C)F b04c7f8e3c10cb7070bd05281f10d796 [0,0,0,0,0,1|2,0,0]=3 2099 B11R0.176 CN(C)CCCNC(=O)CCF 7c7005dbe3b7e9ff39adef9581c028bc [0,0,0,0,0,1|3,0,0]=4 2100 B11R0.176 CN(C)CCCNC(=O)CCO eb50bc8c04942a0f3d1aa8a87ffa547e [0,0,0,0,0,1|3,0,0]=4 2101 B11R0.176 CN(C)CCCNC(=O)CCS d8972f0a4af9794a83f81bcc10afb1b4 [0,0,0,0,0,1|3,0,0]=4 2102 B11R0.176 COCC(=O)CNCCC(C)C e3bc5b07cc1e7de2d0e2028ce201760a [0,0,0,0,0,1|2,0,0]=3 2103 B11R0.176 COCC(=O)CNCCC(C)O 6ff5e49e8efaeb4910d519fd67ae3b94 [0,0,0,0,0,1|3,0,0]=4 2104 B11R0.176 COCC(=O)CNCC[C@@H](C)O 9e89a7bb8a1bf4b2ea04ee5a8d208bae [0,0,0,0,0,1|3,0,0]=4 2105 B11R0.176 COCC(=O)CNCC[C@H](C)O 6aeff9b18d1eba9f8145e78c0240a6f3 [0,0,0,0,0,1|3,0,0]=4 2106 B11R0.176 COCC(=O)COCC=C(C)C 76dd0d0d3722f9cdb1423b2d304a5163 [0,0,0,0,0,1|1,0,2]=4 2107 B11R0.176 COCC(=O)COCCC(C)C 125b7cd292a5c827315afa4ac4d7ade3 [0,0,0,0,0,1|1,0,0]=2 2108 B11R0.176 COCC(=O)COCCC(F)F 60511da67ecc94d6127cab4e3573c155 [0,0,0,0,0,1|3,0,0]=4 2109 B11R0.176 COCC(=O)NCCCC(C)C 49137af88bbef6692207e2445a5b2868 [0,0,0,0,0,1|2,0,0]=3 2110 B11R0.176 COCC(=O)NCCCN(C)C c2aed22140e2b4b36f06728fad4c28d5 [0,0,0,0,0,1|3,0,0]=4 2111 B11R0.176 COCC(=O)NCCOC(C)C 0fcea29ff630b18ac2d0fd3addff4b7c [0,0,0,0,0,1|2,0,0]=3 2112 B11R0.176 COCC(C)COCCC(C)C 2b2ffca473ae3834a1364518c5b14ef1 [0,0,0,0,0,1|2,0,1]=4 2113 B11R0.176 COCC(C)OCCCC(C)C 6cde69930856067e191de77a9c1379d4 [0,0,0,0,0,1|2,0,1]=4 2114 B11R0.176 COCC(C)OCCOC(C)C 51042473644df947394c3431f238d34f [0,0,0,0,0,1|2,0,1]=4 2115 B11R0.176 COCC(C)OCCSC(C)C 1e275a1c6a50b84a64bf8c4ebc7bc0db [0,0,0,0,0,1|2,0,1]=4 2116 B11R0.176 COC[C@@H](C)OCCCC(C)C 9f422459cb133fe87c760e3d899e76c5 [0,0,0,0,0,1|2,0,1]=4 2117 B11R0.176 COC[C@@H](C)OCCOC(C)C e763d61138a7dd37b51548ee3f711dba [0,0,0,0,0,1|2,0,1]=4 2118 B11R0.176 COC[C@@H](C)OCCSC(C)C c40b2c73b8b1ead668cd27d523bb7aef [0,0,0,0,0,1|2,0,1]=4 2119 B11R0.176 COC[C@H](C)COCCC(C)C cd97c0f72afa8df456cca783aaa9d9c5 [0,0,0,0,0,1|2,0,1]=4 2120 B11R0.176 COC[C@H](C)OCCCC(C)C f6db9e1d68bca5b6c580f6e9994a5007 [0,0,0,0,0,1|2,0,1]=4 2121 B11R0.176 COC[C@H](C)OCCOC(C)C 078c897f9bc51d96eb5f3097b569b6dd [0,0,0,0,0,1|2,0,1]=4 2122 B11R0.176 COC[C@H](C)OCCSC(C)C a76b1d1e05b8f792aaad7f8301555edc [0,0,0,0,0,1|2,0,1]=4 2123 B11R0.176 CSCC(=O)NCCCC(C)C 0230d751d3287cc6d73dbba97df23bb3 [0,0,0,0,0,1|2,0,0]=3 2124 B11R0.176 CSCC(=O)NCCCN(C)C 8c3cba4e1fdc20235ec29ff2e68496ed [0,0,0,0,0,1|3,0,0]=4 2125 B11R0.176 CSCC(=O)NCCOC(C)C 405815c796d2370e7b23524533d7b890 [0,0,0,0,0,1|2,0,0]=3 2126 B11R0.176 CSCC(C)OCCCC(C)C dc8ddf62544f1c21365dadd6c65519b0 [0,0,0,0,0,1|2,0,1]=4 2127 B11R0.176 CSCC(C)OCCOC(C)C 3ebfb0d8593ca7c06f29904dd7f06f3c [0,0,0,0,0,1|2,0,1]=4 2128 B11R0.176 CSCC(C)OCCSC(C)C 0def09a0da348569536509cf05a7f1f4 [0,0,0,0,0,1|2,0,1]=4 2129 B8R0.6 CCC(=O)NCCCCl 8c01153ec31ae9cc62389708147e768e [2,0,0,0,0,0|2,0,0]=4 2130 B8R0.6 CCC(=O)NCCCO f98fa75986b7788f9e80577d0f4b70ab [2,0,0,0,0,0|2,0,0]=4 2131 B8R0.6 CCC(=O)NCCOC 23e877e020a2c5b2736fc6a95b7c4f02 [2,0,0,0,0,0|2,0,0]=4 2132 B8R0.6 CCC(=O)NCCSC c0f9bf4f85b22a82daaa8b7807daec1c [2,0,0,0,0,0|2,0,0]=4 2133 B8R0.6 CCCCNC(=O)CC 285e0c69f0d3b13983c95eed26c8d721 [2,0,0,0,0,0|1,0,0]=3 2134 B8R0.6 CCCCNC(=O)CF ccc4967a8e0a27400c7d0139924f7409 [2,0,0,0,0,0|2,0,0]=4 2135 B8R0.6 CCCCNC(=O)CO a7ebdf854bf2900347fbb690e8e35978 [2,0,0,0,0,0|2,0,0]=4 2136 B8R0.6 CCCCNC(=O)CS c89622d02eae8eb9fb1a47fc8bb6fb10 [2,0,0,0,0,0|2,0,0]=4 2137 B8R0.6 CCCCOC(C)CC 7b743840237d8f1167e2a19145e2bb11 [2,0,0,0,0,0|1,0,1]=4 2138 B8R0.6 CCCCO[C@@H](C)CC 0568b6feb97809cefc1cbb08ceebedee [2,0,0,0,0,0|1,0,1]=4 2139 B8R0.6 CCCCO[C@H](C)CC 62d88e9696eb4ecbfe2b32e610c029fe [2,0,0,0,0,0|1,0,1]=4 2140 B8R0.6 CCCNCC(=O)CC 5f434fb49a11666bfc9ba500f0cbcfca [2,0,0,0,0,0|2,0,0]=4 2141 B8R0.6 CCCOCC(=O)CC 3f397a74b90866b03f1163a524097d68 [2,0,0,0,0,0|2,0,0]=4 2142 B8R0.7 C#CCOCCC(C)C d72bb51363c8e7ca5e67fd11d4f99fea [2,0,0,0,0,0|0,0,2]=4 2143 B8R0.7 C=C(C)CCOCCC 845281f0f16ba18f3aad20093af18d36 [2,0,0,0,0,0|0,0,2]=4 2144 B8R0.7 C=CCOCCC(C)C dc2b2939e1232ad92646d1a4f0a37a80 [2,0,0,0,0,0|0,0,2]=4 2145 B8R0.7 CC(C)CCNCCBr 63072d1bb0b37e13e4137a2658df5d3f [2,0,0,0,0,0|2,0,0]=4 2146 B8R0.7 CC(C)CCNCCF fa88e798a35cb724c574c6d9beb4e026 [2,0,0,0,0,0|2,0,0]=4 2147 B8R0.7 CC(C)CCNCCI 23da00c7d0e9607a32f436f0aa75fc42 [2,0,0,0,0,0|2,0,0]=4 2148 B8R0.7 CC(C)CCNCCO 8808dbc8c43d3215658a37aae8c42922 [2,0,0,0,0,0|2,0,0]=4 2149 B8R0.7 CC(C)CCNCCS f6fd9c0c9c1c8fd19eba108b534a9da0 [2,0,0,0,0,0|2,0,0]=4 2150 B8R0.7 CC(C)CCOCC#N b3cac106bbceade6f75af0b197358303 [2,0,0,0,0,0|1,0,1]=4 2151 B8R0.7 CC(C)CCOCC=O c3d2780edfa1fb6d6d194e7c0384e701 [2,0,0,0,0,0|1,0,1]=4 2152 B8R0.7 CC(C)CCOCCF 8c34c8e85518cf7592e3f685afefb143 [2,0,0,0,0,0|1,0,0]=3 2153 B8R0.7 CC(C)CCOCCS 32244445bbb2f48b4effe9772a2a7a0f [2,0,0,0,0,0|1,0,0]=3 2154 B8R0.7 CC(C)COCCCF 47b3e7003392b7e4d6af83ce49e8ae15 [2,0,0,0,0,0|1,0,1]=4 2155 B8R0.7 CC(C)COCCCS 4a6bc2e192e2a8c81d6a0173f59ed2af [2,0,0,0,0,0|1,0,1]=4 2156 B8R0.7 CC(C)OCOCCS 9144574496b338e238512c7a6f65237c [2,0,0,0,0,0|2,0,0]=4 2157 B8R0.7 CC/C=C/COC(C)C d67b04cdb3ee857cf285217420b83c9a [2,0,0,0,0,0|1,0,1]=4 2158 B8R0.7 CC/C=C\COC(C)C 1eaca156f92510db32152c3a8502c92d [2,0,0,0,0,0|1,0,1]=4 2159 B8R0.7 CCCCCNC(C)C fecd5fbc16956a143ac8609a2bd9e0c3 [2,0,0,0,0,0|1,0,1]=4 2160 B8R0.7 CCCCCOC(C)C d4e915467a92d9554e0d3ccd108d1b4d [2,0,0,0,0,0|1,0,1]=4 2161 B8R0.7 CCCCNCC(C)C 14e08612915cf77b2fa2c2f94f61132b [2,0,0,0,0,0|1,0,1]=4 2162 B8R0.7 CCCCOCC(C)C 68b7612d0f936ebbf9a831b7d6c778be [2,0,0,0,0,0|0,0,1]=3 2163 B8R0.7 CCCCOCC(C)F b61cc2ea745ef93460e21e251f057d4d [2,0,0,0,0,0|1,0,1]=4 2164 B8R0.7 CCCCOCC(C)S 0d43463b5fb693fda0dbccdcbbdd2ce0 [2,0,0,0,0,0|1,0,1]=4 2165 B8R0.7 CCCCOCN(C)C 3598f39145ccde2eee87aa91337fcbb4 [2,0,0,0,0,0|1,0,1]=4 2166 B8R0.7 CCCCOC[C@@H](C)F 395daf95e36b203ab6e7a7c03c8e4490 [2,0,0,0,0,0|1,0,1]=4 2167 B8R0.7 CCCCOC[C@H](C)F 26014bea3230facd252589a2fc4ef47c [2,0,0,0,0,0|1,0,1]=4 2168 B8R0.7 CCCNCCC(C)C 76a9f83b0ca62c4bc3c8277b05f628fa [2,0,0,0,0,0|1,0,0]=3 2169 B8R0.7 CCCNCCC(C)O ccdd4aef6b342b7b92e15346bf177ff3 [2,0,0,0,0,0|2,0,0]=4 2170 B8R0.7 CCCNCCN(C)C 1fd7d9835f7eceefef0e4025a05690fb [2,0,0,0,0,0|2,0,0]=4 2171 B8R0.7 CCCNCC[C@@H](C)O 96ed78371080616609e6a19f4bc6ef50 [2,0,0,0,0,0|2,0,0]=4 2172 B8R0.7 CCCNCC[C@H](C)O e223e4268330f6aea945d3b98613cfef [2,0,0,0,0,0|2,0,0]=4 2173 B8R0.7 CCCNCOC(C)C f9d15999e9514468c33a2297857aa4db [2,0,0,0,0,0|2,0,0]=4 2174 B8R0.7 CCCOCC=C(C)C b30e82a8d352d0695bc34774c65bba1f [2,0,0,0,0,0|0,0,2]=4 2175 B8R0.7 CCCOCCC(=O)C 8597bbc8bbaf08f1a613a7aab0165313 [2,0,0,0,0,0|1,0,1]=4 2176 B8R0.7 CCCOCCC(C)C 2eab4c15e86c20ee350695e4727673e2 [2,0,0,0,0,0|0,0,0]=2 2177 B8R0.7 CCCOCCC(F)F c238cb362dacb265d2fe0fdc1ac7cda2 [2,0,0,0,0,0|2,0,0]=4 2178 B8R0.7 CCCOCCN(C)C 79c8f5d530bd776f1befe5ca1224c45c [2,0,0,0,0,0|1,0,0]=3 2179 B8R0.7 CCCOCCS(=O)C 2c35684313aa0effe020f10a0837e485 [2,0,0,0,0,0|2,0,0]=4 2180 B8R0.7 CCCOCOC(C)C fd6891fd9649f5bf81816c72f5c16735 [2,0,0,0,0,0|1,0,0]=3 2181 B8R0.7 CCNCCCC(C)C 6e52cb7d352b50eb30e238c582f22475 [2,0,0,0,0,0|1,0,1]=4 2182 B8R0.7 CCOCCCC(C)C e68811d021b73c585b1339be7097acd9 [2,0,0,0,0,0|1,0,1]=4 2183 B8R0.7 CCOCOCC(C)C a62032555c2fcc8079d2a4ea098abbb2 [2,0,0,0,0,0|1,0,1]=4 2184 B8R0.7 CN(C)CCOCCF 777752e6a0beb4735bc253c792967a5a [2,0,0,0,0,0|2,0,0]=4 2185 B8R0.7 CN(C)CCOCCS 7dd441118b9732033165bff75cec585b [2,0,0,0,0,0|2,0,0]=4 2186 B8R0.7 COCCOCC(C)C d0e5035e5ad75d7667af2fe282c6f0ba [2,0,0,0,0,0|1,0,1]=4 2187 B8R0.7 COCNCCC(C)C d504197e2de2477c0ef95d33ccdc019c [2,0,0,0,0,0|2,0,0]=4 2188 B8R0.7 COCOCCC(C)C bcaaca22e174aa65ea31c88fa163f2b9 [2,0,0,0,0,0|1,0,0]=3 2189 B8R0.7 COCOCCN(C)C 8bd0804b3ca98a562e1fae9ec45423b6 [2,0,0,0,0,0|2,0,0]=4 2190 B8R0.7 COCOCOC(C)C 808acfcb204685ab9989b9ebb33f50d9 [2,0,0,0,0,0|2,0,0]=4 2191 B8R0.7 CSCCOCC(C)C 0d7a1f3f7a05c508cd670d9e86716796 [2,0,0,0,0,0|1,0,1]=4 2192 B8R0.7 CSCNCCC(C)C 1214140341214495e484e265d71b8d27 [2,0,0,0,0,0|2,0,0]=4 2193 B8R0.7 CSCOCCC(C)C de4759993ae77e6152e45a8e6c1a8f14 [2,0,0,0,0,0|1,0,0]=3 2194 B8R0.7 CSCOCCN(C)C 12c65a5bf6ef4fa41ce73a42c72404c0 [2,0,0,0,0,0|2,0,0]=4 2195 B8R0.28 CC(=O)CCOC(C)C aa63e522dd0ebf165c9748d141547c49 [2,0,0,0,0,0|2,0,0]=4 2196 B8R0.28 CC(=O)CNCC(C)C 58247fbcbea9991e7cd9ed1b77ee7a40 [2,0,0,0,0,0|2,0,0]=4 2197 B8R0.28 CC(=O)COCC(C)C 63d13f7ca3ddeaa73dc93b4258f7679e [2,0,0,0,0,0|2,0,0]=4 2198 B8R0.28 CC(=O)NCCC(C)C b73f1b13554baa3e34a3560715777fc7 [2,0,0,0,0,0|1,0,0]=3 2199 B8R0.28 CC(=O)NCCC(C)O 9f83d99fdee0bda30ff85f31b4ee4b24 [2,0,0,0,0,0|2,0,0]=4 2200 B8R0.28 CC(=O)NCCN(C)C 4d10f56d353a729da2aad8b96e7ef495 [2,0,0,0,0,0|2,0,0]=4 2201 B8R0.28 CC(=O)NCC[C@@H](C)O 40ba395f3243b6aab3575e45be2f2594 [2,0,0,0,0,0|2,0,0]=4 2202 B8R0.28 CC(=O)NCC[C@H](C)O ac547764dcce609b723a03cd4268cf9c [2,0,0,0,0,0|2,0,0]=4 2203 B8R0.28 CC(=O)NCOC(C)C 05afe8e43df805f9cf6a2136caacdf0b [2,0,0,0,0,0|2,0,0]=4 2204 B8R0.28 CC(=O)OCOC(C)C b15362469d0253806d0b351da68c3f40 [2,0,0,0,0,0|1,0,0]=3 2205 B8R0.28 CC(C)CCOC(C)C 7a47406221ef3ef784e2240c7ab399c4 [2,0,0,0,0,0|1,0,1]=4 2206 B8R0.4 CCC/C=C/COCC 194c2fe9a034aa9429bf8b431746f7e5 [2,0,0,0,0,0|2,0,0]=4 2207 B8R0.4 CCC/C=C\COCC 6a1508b69f1117002ddef7a5ce847c5e [2,0,0,0,0,0|2,0,0]=4 2208 B8R0.4 CCCCCNCCC e1899f21e9e3263889e806dca2898495 [2,0,0,0,0,0|2,0,0]=4 2209 B8R0.4 CCCCCOCCC c08adbc8512009f4d669d9cfc0c3fe67 [2,0,0,0,0,0|2,0,0]=4 2210 B8R0.4 CCCCNCCCC 83f5cde9216aaf13647a8beda79dab35 [2,0,0,0,0,0|1,0,1]=4 2211 B8R0.4 CCCCOCCCC a5b0ef99667fb81b30d5c592594cbe40 [2,0,0,0,0,0|0,0,1]=3 2212 B8R0.4 CCCCOCCCF 45b018660e48781496e6d186d7b4c5cd [2,0,0,0,0,0|1,0,1]=4 2213 B8R0.4 CCCCOCCCS 0d2d1055462c2504dc523af75dd3766f [2,0,0,0,0,0|1,0,1]=4 2214 B8R0.4 CCCCOCCOC 6735cacff3b7f7ef1ac59b3af2d64f94 [2,0,0,0,0,0|1,0,1]=4 2215 B8R0.4 CCCCOCCSC 7ffec2766bbf61d3fb8039a26d074049 [2,0,0,0,0,0|1,0,1]=4 2216 B8R0.4 CCCCOCOCC cfd273cfcd393094625c8ef6899069be [2,0,0,0,0,0|1,0,1]=4 2217 B8R0.1 CCCC(=O)NCCBr e3424ddfe0e4582b4445faadedeca9f3 [2,0,0,0,0,0|2,0,0]=4 2218 B8R0.1 CCCC(=O)NCCF abd86ad1a4854f306fa4ec91802cd24f [2,0,0,0,0,0|2,0,0]=4 2219 B8R0.1 CCCC(=O)NCCI effb943f4ec1dba1ee2232662d0cb367 [2,0,0,0,0,0|2,0,0]=4 2220 B8R0.1 CCCC(=O)NCCO d2bc78e5bd2f73aa8619f010857f1926 [2,0,0,0,0,0|2,0,0]=4 2221 B8R0.1 CCCC(=O)NCCS c2ef67720d0b2ef54134f82538ee13fd [2,0,0,0,0,0|2,0,0]=4 2222 B8R0.1 CCCC(=S)OCCF 4a3f66968fafe65a13eab591dccc8c9f [2,0,0,0,0,0|1,1,0]=4 2223 B8R0.1 CCCC(=S)OCCS 7161c28940ff0dc6e0b2d32d8bc2d5dc [2,0,0,0,0,0|1,1,0]=4 2224 B8R0.1 CCCC(=S)OCOC d7c66aa0be93e71a0e10702c93e66ce1 [2,0,0,0,0,0|1,1,0]=4 2225 B8R0.1 CCCC(=S)OCSC aaf32ff7376d2185d5b81bb017266ecd [2,0,0,0,0,0|1,1,0]=4 2226 B8R0.1 CCCCN(C)CCC 598958f1bf27154d8760346aca3fc1c7 [2,0,0,0,0,0|2,0,0]=4 2227 B8R0.1 CCCNC(=O)CCC 3a4ef615081398a2acfdf5d3349655c4 [2,0,0,0,0,0|1,0,0]=3 2228 B8R0.1 CCCNC(=O)CCF 80cac466548133e31f593852e3638107 [2,0,0,0,0,0|2,0,0]=4 2229 B8R0.1 CCCNC(=O)CCO 1e17d6cf040450a0042d7883a84b4d20 [2,0,0,0,0,0|2,0,0]=4 2230 B8R0.1 CCCNC(=O)CCS 5ca47d6ccf33cee73df146cfd5794783 [2,0,0,0,0,0|2,0,0]=4 2231 B8R0.1 CCCNC(=O)COC d992f0c3466a56e61d0974e6b6e8669f [2,0,0,0,0,0|2,0,0]=4 2232 B8R0.1 CCCNC(=O)CSC 6ae58cb75ea789964eebc3d4df556317 [2,0,0,0,0,0|2,0,0]=4 2233 B8R0.1 CCCOC(=S)CCC 553859e26557f67ca84075cb05814f3e [2,0,0,0,0,0|0,1,0]=3 2234 B8R0.1 CCCOC(C)CCC 5072af5c5b154601df0153ecc4f9a62c [2,0,0,0,0,0|1,0,1]=4 2235 B8R0.1 CCCO[C@@H](C)CCC 3768650ef68ec2d5f66e51478eb2c0cf [2,0,0,0,0,0|1,0,1]=4 2236 B8R0.1 CCCO[C@H](C)CCC d9937f3512bcf6b6a2b04993e218c5dc [2,0,0,0,0,0|1,0,1]=4 2237 B8R0.1 CCNC(=O)COCC c84e7c49da6c2baea65be933f5b80bea [2,0,0,0,0,0|2,0,0]=4 2238 B8R0.1 CCNCC(=O)NCC 85e3c6c463358c2ceb6c3f3c07ea189c [2,0,0,0,0,0|2,0,0]=4 2239 B8R0.1 CCNCC(=O)OCC 13e479e123264c7bc2cd9986b04b4c24 [2,0,0,0,0,0|2,0,0]=4 2240 B8R0.1 CCOCC(=O)OCC a71429e2784f27b770f80be9d4ceb826 [2,0,0,0,0,0|2,0,0]=4 2241 B10R0.44 CC(C)CC(C)NC(=O)CF e0a9c5f944186619fda26ef621230189 [1,1,0,0,0,0|2,0,0]=4 2242 B10R0.44 CC(C)CC(C)NC(=O)CO 6a4c9b6b8f9694ce7de6916611175497 [1,1,0,0,0,0|2,0,0]=4 2243 B10R0.44 CC(C)CC(C)NC(=O)CS bca62a93009b96587be256e1490ef8e9 [1,1,0,0,0,0|2,0,0]=4 2244 B10R0.44 CCC(=O)CN(C)CC(C)C 23bf11faa048642900c1e5cceb78d605 [1,1,0,0,0,0|2,0,0]=4 2245 B10R0.44 CCC(=O)NC(C)CC(C)C 981c9994770bc046df6d949337544832 [1,1,0,0,0,0|1,0,0]=3 2246 B10R0.44 CCC(=O)NC(C)CC(C)O e604e91cb39325433e808b0d38a7cc39 [1,1,0,0,0,0|2,0,0]=4 2247 B10R0.44 CCC(=O)NC(C)CN(C)C 82b979676aca904e3e2f67d84e54d311 [1,1,0,0,0,0|2,0,0]=4 2248 B10R0.44 CCC(=O)N[C@@H](C)CN(C)C a714506a6628dee877d724973fb28020 [1,1,0,0,0,0|2,0,0]=4 2249 B10R0.44 CCC(=O)N[C@H](C)CN(C)C f56bd7a929dfc347a0a5047290eea270 [1,1,0,0,0,0|2,0,0]=4 2250 B10R0.44 CCC(C)OC(C)CC(C)C a5d9d2c6694ddc34388e6e869c193d2a [1,1,0,0,0,0|1,0,1]=4 2251 B10R0.44 CCC(C)O[C@@H](C)CC(C)C 515474940e4cd46461f0020c3e60821d [1,1,0,0,0,0|1,0,1]=4 2252 B10R0.44 CCC(C)O[C@H](C)CC(C)C bd4d8df7836e1733ff00550273ec90b3 [1,1,0,0,0,0|1,0,1]=4 2253 B10R0.44 CC[C@@H](C)OC(C)CC(C)C 358b4d155694a5eace71f7f4d1f1d917 [1,1,0,0,0,0|1,0,1]=4 2254 B10R0.44 CC[C@H](C)OC(C)CC(C)C 6372fcad6829eea543058052195d7565 [1,1,0,0,0,0|1,0,1]=4 2255 B10R0.44 COC(=O)OC(C)OC(C)C 7a90efe6d6cb141ac0ce5fdb6afeb71d [1,1,0,0,0,0|2,0,0]=4 2256 B10R0.57 CC(C)CCN(C)C(=O)CF dab093a7f6e90f4802670e1e83b82eb6 [1,1,0,0,0,0|2,0,0]=4 2257 B10R0.57 CC(C)CCN(C)C(=O)CO 26700da76aaac5bb8e3e011e2e878537 [1,1,0,0,0,0|2,0,0]=4 2258 B10R0.57 CC(C)CCN(C)C(=O)CS 5c60c0ee01f7735706be5180191e7419 [1,1,0,0,0,0|2,0,0]=4 2259 B10R0.57 CCC(=O)C(=O)NCC(C)C 9895970f1d44a836a6fd9bd6b4fc6138 [1,1,0,0,0,0|2,0,0]=4 2260 B10R0.57 CCC(=O)C(C)NCC(C)C 52e9a5cd25d4a3cc517ef85c4c0cea83 [1,1,0,0,0,0|2,0,0]=4 2261 B10R0.57 CCC(=O)C(C)OCC(C)C 41fa6f77526b183dbad90b42573e0a48 [1,1,0,0,0,0|2,0,0]=4 2262 B10R0.57 CCC(=O)N(C)CCC(C)C f8f563bd907b4c8cafe9bbdd9632c2ce [1,1,0,0,0,0|1,0,0]=3 2263 B10R0.57 CCC(=O)N(C)CCC(C)O 9cf0223145bde241a863bbee7b729241 [1,1,0,0,0,0|2,0,0]=4 2264 B10R0.57 CCC(=O)N(C)CCN(C)C 706e577ed6343d76f5b343ca52c86767 [1,1,0,0,0,0|2,0,0]=4 2265 B10R0.59 C#CC(C)NCOC(=O)CC 140708938324ac8a59adc2a67bf27abf [1,1,0,0,0,0|1,0,1]=4 2266 B10R0.59 C#CC(C)OCOC(=O)CC 2e44d7702bee8da40b6991fc03f8f2d0 [1,1,0,0,0,0|1,0,1]=4 2267 B10R0.59 C#C[C@@H](C)NCOC(=O)CC 3a01c901ff9ab065f1c7b7cdcc965077 [1,1,0,0,0,0|1,0,1]=4 2268 B10R0.59 C#C[C@@H](C)OCOC(=O)CC edbf3df30442c9d7e4c5f2a5fcf2ebb2 [1,1,0,0,0,0|1,0,1]=4 2269 B10R0.59 C#C[C@H](C)NCOC(=O)CC aa8d678a00f64a965d76c949fc6c8e70 [1,1,0,0,0,0|1,0,1]=4 2270 B10R0.59 C#C[C@H](C)OCOC(=O)CC 93fa706c113714ce136a11bac50bf6ab [1,1,0,0,0,0|1,0,1]=4 2271 B10R0.59 C=CC(C)NCOC(=O)CC 35a59cac8d79ae09720d9f60bf223c82 [1,1,0,0,0,0|1,0,1]=4 2272 B10R0.59 C=CC(C)OCOC(=O)CC 25260b55405a366c62b9df94680cbd5f [1,1,0,0,0,0|1,0,1]=4 2273 B10R0.59 C=C[C@H](C)OCOC(=O)CC 5cca83ed5130fce097943547a2fac472 [1,1,0,0,0,0|1,0,1]=4 2274 B10R0.59 CC(CO)CCNC(=O)CF de42760192dec161d9611895cfcc2b58 [1,1,0,0,0,0|2,0,0]=4 2275 B10R0.59 CC(CO)CCNC(=O)CO 884ca61a806d132cee45f03eed0ed2a4 [1,1,0,0,0,0|2,0,0]=4 2276 B10R0.59 CC(CO)CCNC(=O)CS 45a65d8a033ec066e5fc8a067b6e0cf2 [1,1,0,0,0,0|2,0,0]=4 2277 B10R0.59 CCC(=O)CNCC(C)CC a4d13279e0ff8f2ad6ea0332dca71b40 [1,1,0,0,0,0|2,0,0]=4 2278 B10R0.59 CCC(=O)CNCC(C)CO ecab5367a4b37ed21019d2c39ad8c287 [1,1,0,0,0,0|2,0,0]=4 2279 B10R0.59 CCC(=O)CNC[C@@H](C)CC 27cc6ff71a950daa57e9e21f7de5ba24 [1,1,0,0,0,0|2,0,0]=4 2280 B10R0.59 CCC(=O)CNC[C@@H](C)OC a7ff6e6228226bdcd183618e14be1bcd [1,1,0,0,0,0|2,0,0]=4 2281 B10R0.59 CCC(=O)CNC[C@H](C)CO 5c07a3d40bf259c0045dae76e9515e72 [1,1,0,0,0,0|2,0,0]=4 2282 B10R0.59 CCC(=O)CNC[C@H](C)OC 98172d6c3eff0f40cd929ec8a83513c0 [1,1,0,0,0,0|2,0,0]=4 2283 B10R0.59 CCC(=O)COCC(C)CC ef081adfaad2df22509bac2c9a895b9b [1,1,0,0,0,0|2,0,0]=4 2284 B10R0.59 CCC(=O)COCC(C)OC 95fed1daab7a6348d0e62de09d731a0f [1,1,0,0,0,0|2,0,0]=4 2285 B10R0.59 CCC(=O)COC[C@@H](C)CC 02d0853befac175d877a6d9162c020f3 [1,1,0,0,0,0|2,0,0]=4 2286 B10R0.59 CCC(=O)COC[C@@H](C)OC 2e1fdf1e106859fa5348017f6bace68f [1,1,0,0,0,0|2,0,0]=4 2287 B10R0.59 CCC(=O)COC[C@H](C)CC 670d12323da84db322a4a145ae8e8782 [1,1,0,0,0,0|2,0,0]=4 2288 B10R0.59 CCC(=O)COC[C@H](C)OC 98a4fe1be2b0f9abeb092f04379f0063 [1,1,0,0,0,0|2,0,0]=4 2289 B10R0.59 CCC(=O)NCCC(C)CC 60245c66976cfd1af2877c21e474514e [1,1,0,0,0,0|1,0,0]=3 2290 B10R0.59 CCC(=O)NCCC(C)CO aa59a236d8a3d41e0c307cea7bd6d8f8 [1,1,0,0,0,0|1,0,0]=3 2291 B10R0.59 CCC(=O)NCCC(O)CO 3b5cfc37debe5597469ae583bd4c82a7 [1,1,0,0,0,0|2,0,0]=4 2292 B10R0.59 CCC(=O)NCC[C@@H](C)CO 902b54448893cc2442965673ff394eaf [1,1,0,0,0,0|1,0,0]=3 2293 B10R0.59 CCC(=O)OCNC(C)C#N 76992450de7f708d968e18b5d3d09fd7 [1,1,0,0,0,0|1,0,1]=4 2294 B10R0.59 CCC(=O)OCOC(C)C=O 7bbe2fb748ecb3e463973a465be7bc92 [1,1,0,0,0,0|1,0,1]=4 2295 B10R0.59 CCC(C)CCNC(=O)CF 47a9c9a1c3e1cf5bc44ffc3a7ae9fe12 [1,1,0,0,0,0|2,0,0]=4 2296 B10R0.59 CCC(C)CCNC(=O)CO f47b5736c2f294d7cff6e36ed78ca850 [1,1,0,0,0,0|2,0,0]=4 2297 B10R0.59 CCC(C)CCNC(=O)CS 7abecdbd4bba245c4a9ed68c22e0afed [1,1,0,0,0,0|2,0,0]=4 2298 B10R0.59 CCC(C)CCOC(C)CC d8b6ebca2ed4ad478ce0c3c8698c7359 [1,1,0,0,0,0|1,0,1]=4 2299 B10R0.59 CCC(C)CCO[C@@H](C)CC f1e2fae39af9a89f079de57f73fabfd4 [1,1,0,0,0,0|1,0,1]=4 2300 B10R0.59 CCC(C)CCO[C@H](C)CC 75abce699b887269d61c64bac720faa3 [1,1,0,0,0,0|1,0,1]=4 2301 B10R0.59 CCC(C)OCCC(C)OC 0083f7850f2aec41a46dd32ad7fcd3c8 [1,1,0,0,0,0|1,0,1]=4 2302 B10R0.59 CCC(C)OCC[C@@H](C)CC 7928d3aa18277f2f8463d0181942099e [1,1,0,0,0,0|1,0,1]=4 2303 B10R0.59 COC(=O)OCNC(C)CO 814a47e89d6c90cdb9b8b89fe3be9235 [1,1,0,0,0,0|2,0,0]=4 2304 B10R0.59 COC(=O)OCN[C@@H](C)CO 204d87002395dbbed476996fce2af7a5 [1,1,0,0,0,0|2,0,0]=4 2305 B10R0.59 COC(=O)OCN[C@H](C)CO 1317ca589cda13a7de1e8a699df34b23 [1,1,0,0,0,0|2,0,0]=4 2306 B10R0.59 C[C@@H](CO)CCNC(=O)CF 72921ef2267b69992e8b3d8f99455ac7 [1,1,0,0,0,0|2,0,0]=4 2307 B10R0.59 C[C@@H](CO)CCNC(=O)CO 56df1f7f630147f7a2fdcb2a81fdde81 [1,1,0,0,0,0|2,0,0]=4 2308 B10R0.59 C[C@@H](CO)CCNC(=O)CS 1dfef1ed215a8e42aa112492c98819d5 [1,1,0,0,0,0|2,0,0]=4 2309 B10R0.60 CC(C)(C)CCNC(=O)CF 240385c18ff541961676ff115205da5e [1,1,0,0,0,0|2,0,0]=4 2310 B10R0.60 CC(C)(C)CCNC(=O)CO d992cbd2da81cf75a7605bd8b2d4d0ce [1,1,0,0,0,0|2,0,0]=4 2311 B10R0.60 CC(C)(C)CCNC(=O)CS 0f3d3229a1c2c075e51fd83268ce2de4 [1,1,0,0,0,0|2,0,0]=4 2312 B10R0.60 CC(C)(F)CCNC(=O)CF 120871d6e37bcb22bad3f9174e5ebb28 [1,1,0,0,0,0|2,0,0]=4 2313 B10R0.60 CC(C)(F)CCNC(=O)CO 1f9e36f5b5a998b37e8575fd2c66075a [1,1,0,0,0,0|2,0,0]=4 2314 B10R0.60 CC(C)(F)CCNC(=O)CS 92954344267ddbff772be39c21c8c850 [1,1,0,0,0,0|2,0,0]=4 2315 B10R0.60 CC(C)(O)CCNC(=O)CF 3e433dca0472709d832794d5150abd2f [1,1,0,0,0,0|2,0,0]=4 2316 B10R0.60 CC(C)(O)CCNC(=O)CO dbc8037cd041bbb541820f5df73baad0 [1,1,0,0,0,0|2,0,0]=4 2317 B10R0.60 CC(C)(O)CCNC(=O)CS 93bed4f8b7fad36039f1c43c5c22efe7 [1,1,0,0,0,0|2,0,0]=4 2318 B10R0.60 CCC(=O)CNCC(C)(C)C 148b249f3ebdfe56e25781c60a0296fc [1,1,0,0,0,0|2,0,0]=4 2319 B10R0.60 CCC(=O)CNCC(C)(C)O 622b313c28b09c43af48df9d95a60474 [1,1,0,0,0,0|2,0,0]=4 2320 B10R0.60 CCC(=O)COCC(C)(C)Br 6bbf0ce3df86a91b4a2275f70a5f603e [1,1,0,0,0,0|2,0,0]=4 2321 B10R0.60 CCC(=O)COCC(C)(C)C ab60b874215af0cf0a2d1f1de20da2a7 [1,1,0,0,0,0|2,0,0]=4 2322 B10R0.60 CCC(=O)COCC(C)(C)F 83073f322bb5155677a1a2edec959e0c [1,1,0,0,0,0|2,0,0]=4 2323 B10R0.60 CCC(=O)COCC(C)(C)O 07dbd4a2ed583fb9c0b35c54f17cd0b6 [1,1,0,0,0,0|2,0,0]=4 2324 B10R0.60 CCC(=O)COCC(C)(C)S 41bc8b8b390f794651511f5a894053b8 [1,1,0,0,0,0|2,0,0]=4 2325 B10R0.60 CCC(=O)NCCC(C)(C)C e183f2ea80097472c9b4ef76269867d8 [1,1,0,0,0,0|1,0,0]=3 2326 B10R0.60 CCC(=O)NCCC(C)(C)F e6b03dad910f8f3c6ef274bf9f012732 [1,1,0,0,0,0|1,0,0]=3 2327 B10R0.60 CCC(=O)NCCC(C)(C)O da7ebb34fe7b8bd6c84a6d58aa9090a3 [1,1,0,0,0,0|1,0,0]=3 2328 B10R0.60 CCC(=O)OCNC(C)(C)C 9c1fd644280e9d6073b636e511cae93a [1,1,0,0,0,0|1,0,0]=3 2329 B10R0.60 CCC(C)OCCC(C)(C)C 5c3e426dc1de87297cc81184c9083d43 [1,1,0,0,0,0|1,0,1]=4 2330 B10R0.60 CCC(C)OCCC(C)(C)O bc8b25e8027d9db3304017ae6f51f3b1 [1,1,0,0,0,0|1,0,1]=4 2331 B10R0.60 CCC(C)OCCC(C)(C)S 9a3e019e41993c1d7f2881e676f0696a [1,1,0,0,0,0|1,0,1]=4 2332 B10R0.60 CC[C@@H](C)OCCC(C)(C)C 34850af55fe11d7358df2e72c6528f96 [1,1,0,0,0,0|1,0,1]=4 2333 B10R0.60 CC[C@@H](C)OCCC(C)(C)O 6ea1076fbf31ca5e539401683398327b [1,1,0,0,0,0|1,0,1]=4 2334 B10R0.60 CC[C@H](C)OCCC(C)(C)C 57c33e9ae3343d8f3dc76d03d3e96404 [1,1,0,0,0,0|1,0,1]=4 2335 B10R0.60 CC[C@H](C)OCCC(C)(C)O 3ce4933f6355ab6d37e2b9404cf9e999 [1,1,0,0,0,0|1,0,1]=4 2336 B10R0.60 COC(=O)OCNC(C)(C)C 87afa932d56899bbef74714412d341e3 [1,1,0,0,0,0|2,0,0]=4 2337 B10R0.77 C#CC(CC)OCCC(C)C 5c09eb24e4d75f7bc13f89c2c482beb7 [1,1,0,0,0,0|1,0,1]=4 2338 B10R0.77 C=CC(CC)OCCC(C)C 63eb1674f22a1b8179e75d63c97d26c2 [1,1,0,0,0,0|1,0,1]=4 2339 B10R0.77 CCC(C#N)OCCC(C)C 99e28e7c44ec246994ff2046b5b42917 [1,1,0,0,0,0|1,0,1]=4 2340 B10R0.77 CCC(C=O)NCCC(C)C c406ecabb95375a21bc5567cb81ed92e [1,1,0,0,0,0|1,0,1]=4 2341 B10R0.77 CCC(C=O)OCCC(C)C b63029965d90eb9396cd47f7aa21b5be [1,1,0,0,0,0|0,0,1]=3 2342 B10R0.77 CCC(C=O)OCCN(C)C 5f14bdf13dd8777d687708a7af4d2a17 [1,1,0,0,0,0|1,0,1]=4 2343 B10R0.77 CCC(CC)OCCC(C)C 790b79b1193f5e78f5e164b87bb82389 [1,1,0,0,0,0|1,0,1]=4 2344 B10R0.82 CC(C)C(O)CNC(=O)CF c796ae1bc2e5f7be75dd1239627ebb2b [1,1,0,0,0,0|2,0,0]=4 2345 B10R0.82 CC(C)C(O)CNC(=O)CO f9c18333ab571e29d42f7931d5ceb55b [1,1,0,0,0,0|2,0,0]=4 2346 B10R0.82 CC(C)C(O)CNC(=O)CS 809b47144db5dedb8a5cae133f0a2b51 [1,1,0,0,0,0|2,0,0]=4 2347 B10R0.82 CCC(=O)CNC(C)C(C)C 33c524664051fb64fd9634a5d94080b9 [1,1,0,0,0,0|2,0,0]=4 2348 B10R0.82 CCC(=O)CN[C@@H](C)C(C)C 65c0de7b99371b250a951106ca0855a0 [1,1,0,0,0,0|2,0,0]=4 2349 B10R0.82 CCC(=O)CN[C@H](C)C(C)C 322ff7221694dcd9401bffe0f57ac99d [1,1,0,0,0,0|2,0,0]=4 2350 B10R0.82 CCC(=O)COC(C)C(C)C e9648d7f60451313cc6d2ddf9242ac21 [1,1,0,0,0,0|2,0,0]=4 2351 B10R0.82 CCC(=O)CO[C@@H](C)C(C)C ddc19ca9576412df29b1037c8a0dbcf5 [1,1,0,0,0,0|2,0,0]=4 2352 B10R0.82 CCC(=O)CO[C@H](C)C(C)C f29de30800cb7104324d66be714d1997 [1,1,0,0,0,0|2,0,0]=4 2353 B10R0.82 CCC(=O)NCC(C)N(C)C 0a29ffeabfb4036a75b09d1467b50728 [1,1,0,0,0,0|2,0,0]=4 2354 B10R0.82 CCC(=O)NCC(O)C(C)C 7cc4388954b6f42d3ce0d5d7fbc76f1e [1,1,0,0,0,0|1,0,0]=3 2355 B10R0.82 CCC(=O)OCN(C)C(C)C 896777ad04ac4e97369dc19256142b85 [1,1,0,0,0,0|1,0,0]=3 2356 B10R0.82 CCC(C)OCC(C)C(C)C 61198a207a76dd095aa760dd47bb31d8 [1,1,0,0,0,0|1,0,1]=4 2357 B10R0.82 CC[C@@H](C)OCC(C)C(C)C 75593ad9554b48ef5ea29dca0a044800 [1,1,0,0,0,0|1,0,1]=4 2358 B10R0.82 CC[C@H](C)OCC(C)C(C)C 43c46163f48a348eae7f80ef016768bc [1,1,0,0,0,0|1,0,1]=4 2359 B10R0.98 C=C(C)C(=O)NCCC(C)C 07d424f2b54b5d35c35a2f43e16a4dab [1,1,0,0,0,0|1,0,1]=4 2360 B10R0.98 CC(=O)C(=O)NCCC(C)C f77bbc2097cd7f1c03c01e0d6b8bcca1 [1,1,0,0,0,0|1,0,1]=4 2361 B10R0.98 CC(C)CCNC(=O)C(C)F 8e7252e0a98226117aaa8628e637e6e5 [1,1,0,0,0,0|1,0,0]=3 2362 B10R0.98 CC(C)CCNC(=O)C(C)O 20e9b5628409a1a41cac44b802b408fc [1,1,0,0,0,0|1,0,0]=3 2363 B10R0.98 CC(C)CCNC(=O)C(C)S 75a70143a2a93aa941fa8a2b48dc9914 [1,1,0,0,0,0|1,0,0]=3 2364 B10R0.98 CC(C)CCNC(=O)C(F)F 3444348be3d6bf6ac55a654305b9fcbd [1,1,0,0,0,0|2,0,0]=4 2365 B10R0.98 CC(C)CCNC(=O)C(O)O b66027059068340cf0a6f2767c9a657f [1,1,0,0,0,0|2,0,0]=4 2366 B10R0.98 CC(C)CCNC(=O)[C@@H](C)F 677070b1bbc38ac10ee46283ca7d66fa [1,1,0,0,0,0|1,0,0]=3 2367 B10R0.98 CC(C)CCNC(=O)[C@@H](C)O d1bbf7430cef728ed7bb665e936cc864 [1,1,0,0,0,0|1,0,0]=3 2368 B10R0.98 CC(C)CCNC(=O)[C@H](C)F 4ca4a91287669ed00b2562c309520d8a [1,1,0,0,0,0|1,0,0]=3 2369 B10R0.98 CC(C)CCNC(=O)[C@H](C)O 8120aa20a408e8bf2461b14f83049660 [1,1,0,0,0,0|1,0,0]=3 2370 B10R0.98 CC(C)CCOC(C)C(C)C 81f1cc1ed2d0beffdea0159a24dde3d0 [1,1,0,0,0,0|1,0,1]=4 2371 B10R0.98 CC(C)CCOC(C)C(C)S 31c5ad3f1c8dfd3ac5b8d37ebf8faea2 [1,1,0,0,0,0|1,0,1]=4 2372 B10R0.98 CC(C)CCO[C@@H](C)C(C)C 8315b04d46cebb3de86666b2b470c24e [1,1,0,0,0,0|1,0,1]=4 2373 B10R0.98 CC(C)CCO[C@H](C)C(C)C c03b3abdce49feb36a49fdf3c294f351 [1,1,0,0,0,0|1,0,1]=4 2374 B10R0.98 CC(C)CNCC(=O)C(C)C d42f550439f5320f957e92de75a7e372 [1,1,0,0,0,0|2,0,0]=4 2375 B10R0.98 CC(C)COCC(=O)C(C)C 8ceb2e8abfac79e036f26591570b1161 [1,1,0,0,0,0|2,0,0]=4 2376 B10R0.98 CC(C)OCNC(=O)C(C)C 7b9a90c021d520ef0341947d8809def4 [1,1,0,0,0,0|2,0,0]=4 2377 B10R0.98 CC(C)OCOC(=O)C(C)C 5c26a4449032c81da55a0f8e0daa4e44 [1,1,0,0,0,0|1,0,0]=3 2378 B10R0.98 CC(F)C(=O)NCCN(C)C bdb93d42ffec4768f72d65324c1dc45e [1,1,0,0,0,0|2,0,0]=4 2379 B10R0.98 CC(F)C(=O)NCC[C@@H](C)O d233c5fcc953cf5b6e2b1707ae41df14 [1,1,0,0,0,0|2,0,0]=4 2380 B10R0.98 CC(F)C(=O)NCC[C@H](C)O ce4fe08a94aff25cb5f7542cc221edbe [1,1,0,0,0,0|2,0,0]=4 2381 B10R0.98 CC(O)C(=O)NCCN(C)C 807d47b3efb0f27378389e473737d9e3 [1,1,0,0,0,0|2,0,0]=4 2382 B10R0.98 CC(O)C(=O)NCC[C@@H](C)O 2c99eb8f4e3fde53b3cbc9a7d9fecf6a [1,1,0,0,0,0|2,0,0]=4 2383 B10R0.98 CC(O)C(=O)NCC[C@H](C)O 14f031bba5a802d6726b29bd988a4aeb [1,1,0,0,0,0|2,0,0]=4 2384 B10R0.98 CC(O)CCNC(=O)C(C)F a6d7713ba9e00f8f2a9156bc39aa3be9 [1,1,0,0,0,0|2,0,0]=4 2385 B10R0.98 CC(O)CCNC(=O)C(C)O 78c2223092372f9dc2bff9978cca9da1 [1,1,0,0,0,0|2,0,0]=4 2386 B10R0.98 CC(O)CCNC(=O)C(C)S 78cce57dd820d350aa22d9afe298b9f7 [1,1,0,0,0,0|2,0,0]=4 2387 B10R0.98 CC(O)CCNC(=O)[C@@H](C)F 10eff7a62a482c16794003d815d09737 [1,1,0,0,0,0|2,0,0]=4 2388 B10R0.98 CC(O)CCNC(=O)[C@@H](C)O 6c61dc2305ca04045d64583dc67f36d1 [1,1,0,0,0,0|2,0,0]=4 2389 B10R0.98 CC(O)CCNC(=O)[C@H](C)F 4d5a313cbe63621af3635b803abff047 [1,1,0,0,0,0|2,0,0]=4 2390 B10R0.98 CC(O)CCNC(=O)[C@H](C)O 502b39d8dd45a7b80aee5ec54c1e4f56 [1,1,0,0,0,0|2,0,0]=4 2391 B10R0.98 CC(S)C(=O)NCCN(C)C 520fe92bae157f21c69823ea63d19d30 [1,1,0,0,0,0|2,0,0]=4 2392 B10R0.98 CC(S)C(=O)NCC[C@@H](C)O 28b3d213d4ffc64e428122930c606b4c [1,1,0,0,0,0|2,0,0]=4 2393 B10R0.98 CC(S)C(=O)NCC[C@H](C)O 42162e4d8137fa1277b176b1bce32947 [1,1,0,0,0,0|2,0,0]=4 2394 B10R0.98 C[C@@H](F)C(=O)NCCN(C)C 0b37189bf2730f5656a4a615dc115967 [1,1,0,0,0,0|2,0,0]=4 2395 B10R0.98 C[C@@H](O)C(=O)NCCN(C)C 4be58d5816ed360514ffa00dcbdbacfb [1,1,0,0,0,0|2,0,0]=4 2396 B10R0.98 C[C@@H](O)CCNC(=O)[C@@H](C)F 3de464370a9374912dc286b99364489f [1,1,0,0,0,0|2,0,0]=4 2397 B10R0.98 C[C@@H](O)CCNC(=O)[C@@H](C)O 687ef948dcde2073173f38feb656bca7 [1,1,0,0,0,0|2,0,0]=4 2398 B10R0.98 C[C@H](F)C(=O)NCCN(C)C f598b068075a83889930e7bf923b50e0 [1,1,0,0,0,0|2,0,0]=4 2399 B10R0.98 C[C@H](F)C(=O)NCC[C@@H](C)O 03aa24dd114e3fd838fc7fc5875e0bd9 [1,1,0,0,0,0|2,0,0]=4 2400 B10R0.98 C[C@H](O)C(=O)NCCN(C)C 1a5bdd049a8c7f20f4547d983ab13c4e [1,1,0,0,0,0|2,0,0]=4 2401 B10R0.98 C[C@H](O)C(=O)NCC[C@@H](C)O 60d0556daab400755cf5ee8946aa8936 [1,1,0,0,0,0|2,0,0]=4 2402 B10R0.98 C[C@H](O)CCNC(=O)[C@@H](C)F 658ea87c1f9c1d90bf28f0ccbc386436 [1,1,0,0,0,0|2,0,0]=4 2403 B10R0.98 C[C@H](O)CCNC(=O)[C@@H](C)O 6b7aecdc79c47026341f64ec1d431758 [1,1,0,0,0,0|2,0,0]=4 2404 B10R0.98 C[C@H](O)CCNC(=O)[C@H](C)F 1b509c1504deaa1f173165cfe5803382 [1,1,0,0,0,0|2,0,0]=4 2405 B10R0.98 C[C@H](O)CCNC(=O)[C@H](C)O 2ee0d22413ae1b23d099a80a4113df43 [1,1,0,0,0,0|2,0,0]=4 2406 B10R0.4 C#CCCCOCCC(C)C aefe667ce42c99de439eab71b342cc80 [1,1,0,0,0,0|0,0,2]=4 2407 B10R0.4 C/C=C/CCOCCC(C)C f5640c034060398118a01975c91c6b90 [1,1,0,0,0,0|0,0,2]=4 2408 B10R0.4 C=CCCCOCCC(C)C 86a7b81a4bb433dba0fd6e6ea84ce28b [1,1,0,0,0,0|0,0,2]=4 2409 B10R0.4 CC#CCCOCCC(C)C 2b050c57d9a5f1529b4814741666d20e [1,1,0,0,0,0|0,0,2]=4 2410 B10R0.4 CC(C)CCCNCCCCl 6c2281a4c40a355cb49bba5d50acc455 [1,1,0,0,0,0|2,0,0]=4 2411 B10R0.4 CC(C)CCCNCCCF 19a9cfc5e38280a364d8c0e9e53a1423 [1,1,0,0,0,0|2,0,0]=4 2412 B10R0.4 CC(C)CCCNCCCO eeb0ca79d84d6625d506ca34a673132c [1,1,0,0,0,0|2,0,0]=4 2413 B10R0.4 CC(C)CCCNCCCS 96a91ec1f2d089739b4e3c91fc10871f [1,1,0,0,0,0|2,0,0]=4 2414 B10R0.4 CC(C)CCCOCCCF 32842131dd4e6bae299a603c9aafafad [1,1,0,0,0,0|1,0,1]=4 2415 B10R0.4 CC(C)CCCOCCCS 472aca12f415ca7a7f3024c60328c53c [1,1,0,0,0,0|1,0,1]=4 2416 B10R0.4 CC(C)CCNCCCCCl a0bfeb808c69c5fb233e14b27f25bd61 [1,1,0,0,0,0|1,0,1]=4 2417 B10R0.4 CC(C)CCNCCCCF 9f958522557d9264029fdac8096162f9 [1,1,0,0,0,0|1,0,1]=4 2418 B10R0.4 CC(C)CCNCCCCO 71fbd2989259325f3110820709fb8e95 [1,1,0,0,0,0|1,0,1]=4 2419 B10R0.4 CC(C)CCNCCCCS 88258554fcb471105958a571b73dd041 [1,1,0,0,0,0|1,0,1]=4 2420 B10R0.4 CC(C)CCOCCCC#N fffc7c35c2f0a5ca9bdbcb761640cdf0 [1,1,0,0,0,0|0,0,2]=4 2421 B10R0.4 CC(C)CCOCCCC=O 6a43417d5a08c6d5588e290a5c76bbb5 [1,1,0,0,0,0|0,0,2]=4 2422 B10R0.4 CC(C)CCOCCCCF 3de101a4d68eb0f151adfa8c068bf273 [1,1,0,0,0,0|0,0,1]=3 2423 B10R0.4 CC(C)CCOCCCCS 17e650b4a93e3864db53ab282168911c [1,1,0,0,0,0|0,0,1]=3 2424 B10R0.4 CC(C)NCCOCCCO c84cbda1b1fdf0d07a8a499e759513ef [1,1,0,0,0,0|1,0,1]=4 2425 B10R0.4 CC(C)OCCOCCCF bf069c35999420de6cda0a494b3662a8 [1,1,0,0,0,0|1,0,1]=4 2426 B10R0.4 CC(C)OCCOCCCS b87a0a413e370b11acd762987f144dfb [1,1,0,0,0,0|1,0,1]=4 2427 B10R0.4 CC(C)OCOCCCCF 9d2c07a4e5ac011b52b42851f8ce56c9 [1,1,0,0,0,0|1,0,1]=4 2428 B10R0.4 CC(C)OCOCCCCS c1b3d5327315e7202f2a3c922d0d85ff [1,1,0,0,0,0|1,0,1]=4 2429 B10R0.4 CC(C)SCCOCCCF 58b5d9cbe6eaa4a2bf2b867ae01cb980 [1,1,0,0,0,0|1,0,1]=4 2430 B10R0.4 CC(C)SCCOCCCS 3edda1271be7729484976ad837e01805 [1,1,0,0,0,0|1,0,1]=4 2431 B10R0.4 CC/C=C/CCOCC(C)C 8047ec6bd7bd5af11f15ce6bd8a489c7 [1,1,0,0,0,0|1,0,1]=4 2432 B10R0.4 CC/C=C/CNCCC(C)C a556bfef6249098061a61388b942e26e [1,1,0,0,0,0|1,0,1]=4 2433 B10R0.4 CC/C=C/COCCC(C)C 6e8cca9024de107188fad0f238a58932 [1,1,0,0,0,0|0,0,1]=3 2434 B10R0.4 CC/C=C/COCCN(C)C 07e47c2d57803e9074941a2350273672 [1,1,0,0,0,0|1,0,1]=4 2435 B10R0.4 CC/C=C/COCOC(C)C 133db1de707a62307b438fc108cb5faa [1,1,0,0,0,0|1,0,1]=4 2436 B10R0.4 CC/C=C\CCCOC(C)C 7ad55ae1fb9197cc03e27fe3c09bef79 [1,1,0,0,0,0|1,0,1]=4 2437 B10R0.4 CC/C=C\CCNCC(C)C ab5b5d109c7c4f76a8c5f42fd652b9ab [1,1,0,0,0,0|1,0,1]=4 2438 B10R0.4 CC/C=C\CCOCC(C)C 207b56b8a6b4b3af5e15c0f3cd7c326e [1,1,0,0,0,0|1,0,1]=4 2439 B10R0.4 CC/C=C\COCCC(C)C ebd84b9ce2c3d5a99a0edd16df9710a9 [1,1,0,0,0,0|0,0,1]=3 2440 B10R0.4 CC/C=C\COCCN(C)C 4d0a06a0bf54556de1b4cb5096f5f89c [1,1,0,0,0,0|1,0,1]=4 2441 B10R0.4 CC/C=C\COCOC(C)C 94fc88f14afab2397670fd8af9cc69e9 [1,1,0,0,0,0|1,0,1]=4 2442 B10R0.4 CCC#CCOCCC(C)C d68f65b983b96ddefe69d372ee6bec08 [1,1,0,0,0,0|0,0,2]=4 2443 B10R0.4 CCC/C=C/CNCC(C)C bf33c18b32fc4f099004cfa5dc97b5dc [1,1,0,0,0,0|1,0,0]=3 2444 B10R0.4 CCC/C=C/CNCC(C)O 88f4b9025d580f29c24456f15851a0eb [1,1,0,0,0,0|2,0,0]=4 2445 B10R0.4 CCC/C=C/CNC[C@@H](C)O 90fe731cc95a1bb87094f7ebc8d7568b [1,1,0,0,0,0|2,0,0]=4 2446 B10R0.4 CCC/C=C/CNC[C@H](C)O e0cd0f48aaec74442b1334061bd158b2 [1,1,0,0,0,0|2,0,0]=4 2447 B10R0.4 CCC/C=C/COCC(C)C 6aee71388aa393a00f90feabc9db34d1 [1,1,0,0,0,0|1,0,0]=3 2448 B10R0.4 CCC/C=C/COCC(C)F aa78cce1831b7a69d0dfafcfacf38862 [1,1,0,0,0,0|2,0,0]=4 2449 B10R0.4 CCC/C=C/COCC(C)S 58fe6b7b04b1178d6321b697f5da9208 [1,1,0,0,0,0|2,0,0]=4 2450 B10R0.4 CCC/C=C/COCN(C)C beac176581626bf71c17abff3f758f67 [1,1,0,0,0,0|2,0,0]=4 2451 B10R0.4 CCC/C=C/COC[C@@H](C)F 37fb6827cd1dd490e069c28b40ee7de3 [1,1,0,0,0,0|2,0,0]=4 2452 B10R0.4 CCC/C=C/COC[C@H](C)F ff53ba64e19414cdcf7bef969f6c1e96 [1,1,0,0,0,0|2,0,0]=4 2453 B10R0.4 CCC/C=C\CCOC(C)C 6439288e8c74ee1a7d86b821ddbd6d80 [1,1,0,0,0,0|1,0,0]=3 2454 B10R0.4 CCC/C=C\CNCC(C)C 26df2bb6b4cc9569a34d081650155c19 [1,1,0,0,0,0|1,0,0]=3 2455 B10R0.4 CCC/C=C\CNCC(C)O 96b16a03c90d480780a847b4ffde19d9 [1,1,0,0,0,0|2,0,0]=4 2456 B10R0.4 CCC/C=C\CNC[C@@H](C)O 375a19b3c5843ff281c17a4b98513e64 [1,1,0,0,0,0|2,0,0]=4 2457 B10R0.4 CCC/C=C\CNC[C@H](C)O 969752c5358585189315eeb63e6fb388 [1,1,0,0,0,0|2,0,0]=4 2458 B10R0.4 CCC/C=C\COCC(C)C 8260a1bdecaedee6a7bc007730d26119 [1,1,0,0,0,0|1,0,0]=3 2459 B10R0.4 CCC/C=C\COCC(C)F aa1d690e84801e639ab5ae28f6cb5391 [1,1,0,0,0,0|2,0,0]=4 2460 B10R0.4 CCC/C=C\COCC(C)S 3ffd71efe386dc2fb2d0ba39881da682 [1,1,0,0,0,0|2,0,0]=4 2461 B10R0.4 CCC/C=C\COCN(C)C fb16e67704ed9e1fcba51498944a5d14 [1,1,0,0,0,0|2,0,0]=4 2462 B10R0.4 CCC/C=C\COC[C@@H](C)F 3c47a45dbaed974ece92989d2cd02162 [1,1,0,0,0,0|2,0,0]=4 2463 B10R0.4 CCC/C=C\COC[C@H](C)F 8421d12e8670db35ffce37dd95322fc7 [1,1,0,0,0,0|2,0,0]=4 2464 B10R0.4 CCCC#CCCOC(C)C f040710aed37b00e038d16143a1c15ac [1,1,0,0,0,0|1,0,1]=4 2465 B10R0.4 CCCC#CCOCC(C)C de277ae756bc16695341f7b3ab780c44 [1,1,0,0,0,0|1,0,1]=4 2466 B10R0.4 CCCC/C=C/COC(C)C f133522b904defd9d4f7505691b5978c [1,1,0,0,0,0|2,0,0]=4 2467 B10R0.4 CCCC/C=C\COC(C)C aed812dc38c902937086817c82de2767 [1,1,0,0,0,0|2,0,0]=4 2468 B10R0.4 CCCCCCCNC(C)C 4c96ea7e499316e0ee9e00c46c63a3c1 [1,1,0,0,0,0|1,0,1]=4 2469 B10R0.4 CCCCCCCOC(C)C 27a0a967f36a71c677ab3969b10f24e8 [1,1,0,0,0,0|1,0,1]=4 2470 B10R0.4 CCCCCCNCC(C)C 1a2401845907eef233dd59227daa3a68 [1,1,0,0,0,0|1,0,1]=4 2471 B10R0.4 CCCCCCOCC(C)C b37c8621ec273a7e26019a803a340e20 [1,1,0,0,0,0|1,0,1]=4 2472 B10R0.4 CCCCCNCCC(C)C 2083eb70c05c1741486a9f522b36bddf [1,1,0,0,0,0|1,0,1]=4 2473 B10R0.4 CCCCCOCCC(C)C 1aa9f5e40c826e008fbbf8f79c7f1fea [1,1,0,0,0,0|0,0,1]=3 2474 B10R0.4 CCCCCOCCN(C)C 316463ff546cb9d7401f931a893e13eb [1,1,0,0,0,0|1,0,1]=4 2475 B10R0.4 CCCCCOCOC(C)C 1441e4efb031c4107c38c6573e1ecab4 [1,1,0,0,0,0|1,0,1]=4 2476 B10R0.4 CCCCNCCCC(C)C 1e31d9dbabf6be9187dab46866ffb34e [1,1,0,0,0,0|1,0,1]=4 2477 B10R0.4 CCCCNCCOC(C)C e7d670cad337283426b742bab6f47ebd [1,1,0,0,0,0|1,0,1]=4 2478 B10R0.4 CCCCNCCSC(C)C 07f15c97252f9d8b25969fa93a0d2199 [1,1,0,0,0,0|1,0,1]=4 2479 B10R0.4 CCCCOC/C=C/C(C)C b1f2e0e0dbab8fa754580343d5eea046 [1,1,0,0,0,0|0,0,2]=4 2480 B10R0.4 CCCCOCCC=C(C)C 12c3c1f2c9c2d69ab18de77f0a3087ea [1,1,0,0,0,0|0,0,2]=4 2481 B10R0.4 CCCCOCCCC(C)C eabf9177db773ec6de5ecc0edcb5d082 [1,1,0,0,0,0|0,0,1]=3 2482 B10R0.4 CCCCOCCCN(C)C 3d03ebce4d0f7c18096b62da2a143ba7 [1,1,0,0,0,0|1,0,1]=4 2483 B10R0.4 CCCCOCCNC(C)C d43b4651be436e7a18a143ea0db5475c [1,1,0,0,0,0|0,0,1]=3 2484 B10R0.4 CCCCOCCOC(C)C 86aa7c8545daae2de2013b50e7e899da [1,1,0,0,0,0|0,0,1]=3 2485 B10R0.4 CCCCOCCSC(C)C 86724aa57c48003152df231ad69710c4 [1,1,0,0,0,0|0,0,1]=3 2486 B10R0.4 CCCCOCNCC(C)C fbf0edd18161c9cbcdf7d0b248f3b74c [1,1,0,0,0,0|0,0,1]=3 2487 B10R0.4 CCCCOCNCC(C)O e801f8fbb8dbf94952cf78a13997aeca [1,1,0,0,0,0|1,0,1]=4 2488 B10R0.4 CCCCOCNC[C@@H](C)O 21eb3572cca9b48817c622887eeb3000 [1,1,0,0,0,0|1,0,1]=4 2489 B10R0.4 CCCCOCNC[C@H](C)O 06bdb6bf0acd2ace0c8a3b2a16d610e6 [1,1,0,0,0,0|1,0,1]=4 2490 B10R0.4 CCCCOCOCC(C)C f76cb4f3e2df2a6ccb3df0291b6aa825 [1,1,0,0,0,0|0,0,1]=3 2491 B10R0.4 CCCCOCOCC(C)F cd34d4b694e2051b6a8d4e0268bbc610 [1,1,0,0,0,0|1,0,1]=4 2492 B10R0.4 CCCCOCOCC(C)S f3aaffcd03310a3e20b7d2fe1264264b [1,1,0,0,0,0|1,0,1]=4 2493 B10R0.4 CCCCOCOC[C@@H](C)F ee6e73d719ed609d566c2bfe17d34d6e [1,1,0,0,0,0|1,0,1]=4 2494 B10R0.4 CCCCOCOC[C@H](C)F be928def4baac0f42dbb5257ad9f3746 [1,1,0,0,0,0|1,0,1]=4 2495 B10R0.4 CCCCSCCOC(C)C 2d09dea5ad4f2cd6b2de74e421c7a597 [1,1,0,0,0,0|0,1,1]=4 2496 B10R0.4 CCCNCCCCC(C)C f22e74f3c92982d86e30c1bb0f3509d3 [1,1,0,0,0,0|1,0,1]=4 2497 B10R0.4 CCCNCCCOC(C)C 4d860087ee5c767e715f628614b37300 [1,1,0,0,0,0|2,0,0]=4 2498 B10R0.4 CCCNCCCSC(C)C 3033d3fec1c71a1ec80a5bfa5c133572 [1,1,0,0,0,0|2,0,0]=4 2499 B10R0.4 CCCNCCOCC(C)C 938166f9aa8fdbc9fe303167e2e6357b [1,1,0,0,0,0|2,0,0]=4 2500 B10R0.4 CCCOCCCCC(C)C f86f1fee85db6c4439132050b4d45955 [1,1,0,0,0,0|1,0,1]=4 2501 B10R0.4 CCCOCCCNC(C)C 97e56004124f9f1be06a97e18672fb78 [1,1,0,0,0,0|2,0,0]=4 2502 B10R0.4 CCCOCCCOC(C)C 2860ba23bdd84f5d06b46ebf59935d79 [1,1,0,0,0,0|2,0,0]=4 2503 B10R0.4 CCCOCCCSC(C)C 45346ea51d981b2ef27e08d1180f96de [1,1,0,0,0,0|2,0,0]=4 2504 B10R0.4 CCCOCCNCC(C)C 5cd8f594d4236b2933fb695322356b2b [1,1,0,0,0,0|2,0,0]=4 2505 B10R0.4 CCCOCCOCC(C)C 67c7770602d90fbcb32b20089a953d09 [1,1,0,0,0,0|2,0,0]=4 2506 B10R0.4 CCCOCCSCC(C)C 6cc0266074462b6f0c3a9145b885dd2e [1,1,0,0,0,0|2,0,0]=4 2507 B10R0.4 CCCSCCOCC(C)C 9f141e56f84160364ae0d8e664cb2e31 [1,1,0,0,0,0|2,0,0]=4 2508 B10R0.4 CCNCCCCCC(C)C 44d0ce1c493c68ed6f77d5a4ff674f45 [1,1,0,0,0,0|1,0,1]=4 2509 B10R0.4 CCNCCOCCN(C)C 103261264562138c65b80841bae076c7 [1,1,0,0,0,0|1,0,1]=4 2510 B10R0.4 CCOCCCCCC(C)C 4039d0e82f922e3764f8c5fcab65c456 [1,1,0,0,0,0|1,0,1]=4 2511 B10R0.4 CCOCCNCCC(C)C 89a89ee936386f8d93b64a4e8411993c [1,1,0,0,0,0|1,0,1]=4 2512 B10R0.4 CCOCCOCCC(C)C 923678b55c863171c27f9a49a36aeadc [1,1,0,0,0,0|0,0,1]=3 2513 B10R0.4 CCOCCOCCN(C)C 06deef6a26b662668a28e6ec420ccba4 [1,1,0,0,0,0|1,0,1]=4 2514 B10R0.4 CCOCCOCOC(C)C 11a7bbdc8ffef5b18ba0b0ab8bb3a1c6 [1,1,0,0,0,0|1,0,1]=4 2515 B10R0.4 CCOCNCCCC(C)C 5e6ec9efde5f0f0855d1731dee5f52d6 [1,1,0,0,0,0|2,0,0]=4 2516 B10R0.4 CCOCOCCCC(C)C 1dba96d729202cea16ab703ee03cbd52 [1,1,0,0,0,0|1,0,1]=4 2517 B10R0.4 CCOCOCCOC(C)C f1a5c3155786594d5e7c6a922c77d0e0 [1,1,0,0,0,0|1,0,1]=4 2518 B10R0.4 CCOCOCCSC(C)C 70a53787da36b742447a1dedeba25913 [1,1,0,0,0,0|1,0,1]=4 2519 B10R0.4 CCSCCNCCC(C)C 699cf399b127d79c3e2fd6113aa6861f [1,1,0,0,0,0|1,0,1]=4 2520 B10R0.4 CCSCCOCCC(C)C 4a2dd077b692621b2f0216e08aa23d96 [1,1,0,0,0,0|0,0,1]=3 2521 B10R0.4 CCSCCOCCN(C)C 34eb8fe6d78647c6aa2c78ea65b858bd [1,1,0,0,0,0|1,0,1]=4 2522 B10R0.4 CCSCCOCOC(C)C 746caa3dfbee7e914e1ce77384218da2 [1,1,0,0,0,0|1,0,1]=4 2523 B10R0.4 CN(C)CCOCCCCF 8d99c08ec380da3edcec761765a7c232 [1,1,0,0,0,0|1,0,1]=4 2524 B10R0.4 CN(C)CCOCCCCS c16a630867332a19ff842cb62d9e22c3 [1,1,0,0,0,0|1,0,1]=4 2525 B10R0.4 COCCCNCCC(C)C d15c43a39d942fe7ac9ee01fb82391ee [1,1,0,0,0,0|1,0,1]=4 2526 B10R0.4 COCCCOCCC(C)C 865d0faf2dcbbda3993a35f9cc52a096 [1,1,0,0,0,0|0,0,1]=3 2527 B10R0.4 COCCCOCCN(C)C dbd096bbc0a25fb796044e307372e98c [1,1,0,0,0,0|1,0,1]=4 2528 B10R0.4 COCCCOCOC(C)C 2c6d6d8e4df1a50175134da672b80830 [1,1,0,0,0,0|1,0,1]=4 2529 B10R0.4 COCCNCCCC(C)C a15672a7f9379b0aab7bd577821aab21 [1,1,0,0,0,0|2,0,0]=4 2530 B10R0.4 COCCOCCCC(C)C 3e7429178e907c0608d22f5cf4f3163b [1,1,0,0,0,0|1,0,1]=4 2531 B10R0.4 COCCOCCNC(C)C a80ccc0c2de4cdee5f5a303302a4ebe7 [1,1,0,0,0,0|1,0,1]=4 2532 B10R0.4 COCCOCCOC(C)C 645e9cbf60978a0414a404a6436cc881 [1,1,0,0,0,0|1,0,1]=4 2533 B10R0.4 COCCOCCSC(C)C fbcc93945234c1c430d1d7f67c5b6eee [1,1,0,0,0,0|1,0,1]=4 2534 B10R0.4 COCCOCNCC(C)C 620f802e1e065fd65719d4abc6f24f80 [1,1,0,0,0,0|1,0,1]=4 2535 B10R0.4 COCCOCOCC(C)C 6e4085dc9bfd3676d18aaae4c0edc22c [1,1,0,0,0,0|1,0,1]=4 2536 B10R0.4 CSCCCNCCC(C)C 9d006537826218f9107780847678384c [1,1,0,0,0,0|1,0,1]=4 2537 B10R0.4 CSCCCOCCC(C)C 0d917d595e4921f5004e30ae85d48259 [1,1,0,0,0,0|0,0,1]=3 2538 B10R0.4 CSCCCOCCN(C)C 49858f3f57a520a7feabb3f49aca922e [1,1,0,0,0,0|1,0,1]=4 2539 B10R0.4 CSCCCOCOC(C)C b1d03280c70f0ccd9541fa86397ed9f4 [1,1,0,0,0,0|1,0,1]=4 2540 B10R0.4 CSCCNCCCC(C)C f5f68349658f6cd20aed92671b18014a [1,1,0,0,0,0|2,0,0]=4 2541 B10R0.4 CSCCOCCCC(C)C ae475609096bb18c03f0ff4e290fb9d9 [1,1,0,0,0,0|1,0,1]=4 2542 B10R0.4 CSCCOCCOC(C)C 1f23ac81aabf955e4ea761e2fcacae50 [1,1,0,0,0,0|1,0,1]=4 2543 B10R0.4 CSCCOCCSC(C)C 26e1a82c2dea5fd8a04943f623421520 [1,1,0,0,0,0|1,0,1]=4 2544 B10R0.6 CC(C)CC(C)OCCCF 38d5b9816c70d5d38c554f304a9fb2d1 [1,1,0,0,0,0|1,0,1]=4 2545 B10R0.6 CC(C)CC(C)OCCCS 2603219bc9e6742b0148d8aafe4cb67f [1,1,0,0,0,0|1,0,1]=4 2546 B10R0.6 CC(C)C[C@@H](C)OCCCF 6f6cb4bb6a1ebe24bb43d8ce90c24d2b [1,1,0,0,0,0|1,0,1]=4 2547 B10R0.6 CC(C)C[C@@H](C)OCCCS 00a432ac45f32891c29b58ac7ade0418 [1,1,0,0,0,0|1,0,1]=4 2548 B10R0.6 CC(C)C[C@H](C)OCCCF f9d42601cc3dbb01a487175e0e7d164f [1,1,0,0,0,0|1,0,1]=4 2549 B10R0.6 CC(C)C[C@H](C)OCCCS f44d21f2ef7b39778ba5876b88ad52ed [1,1,0,0,0,0|1,0,1]=4 2550 B10R0.6 CCCCNC(C)CC(C)C 81b2606fa5d420f2301ad6206a2c46c0 [1,1,0,0,0,0|1,0,1]=4 2551 B10R0.6 CCCCOC(C)CC(C)C 30222795e797652dedd77f4f8402fee4 [1,1,0,0,0,0|0,0,1]=3 2552 B10R0.6 CCCCOC(C)CN(C)C 077c1dd4d3862b643ac0f448ba7b4a18 [1,1,0,0,0,0|1,0,1]=4 2553 B10R0.6 CCCCO[C@@H](C)CC(C)C 9768e37772e493f567b9d9b4dbee377e [1,1,0,0,0,0|0,0,1]=3 2554 B10R0.6 CCCCO[C@@H](C)CN(C)C 15b6d7dde57143097bca3677a20a89c1 [1,1,0,0,0,0|1,0,1]=4 2555 B10R0.6 CCCCO[C@H](C)CC(C)C 486d5c04f57633f6e44ee063c791613e [1,1,0,0,0,0|0,0,1]=3 2556 B10R0.6 CCCCO[C@H](C)CN(C)C b12e5963110fb07b999c7eed8128bbe8 [1,1,0,0,0,0|1,0,1]=4 2557 B10R0.6 CCCNCC(O)CC(C)C d45de2986327e204ca9ff02ab6f21b81 [1,1,0,0,0,0|2,0,0]=4 2558 B10R0.6 CCCOCC(C)CC(C)C abd01a0866ae86eccde4c7f8d63e5359 [1,1,0,0,0,0|2,0,0]=4 2559 B10R0.6 COCCOC(C)CC(C)C 5abcb46169c4e72a87b1fc63b4ec6331 [1,1,0,0,0,0|1,0,1]=4 2560 B10R0.6 COCCO[C@@H](C)CC(C)C 51217cc793445de69eadb66d64927797 [1,1,0,0,0,0|1,0,1]=4 2561 B10R0.6 COCCO[C@H](C)CC(C)C 3d0865a4feb1ba34ffe80859feef6d6a [1,1,0,0,0,0|1,0,1]=4 2562 B10R0.6 CSCCOC(C)CC(C)C 60a0a8220e585c2de6a2c0ad1fc9526c [1,1,0,0,0,0|1,0,1]=4 2563 B10R0.6 CSCCO[C@@H](C)CC(C)C 6e92ba6e0a52adb19b0c77674b0437cb [1,1,0,0,0,0|1,0,1]=4 2564 B10R0.6 CSCCO[C@H](C)CC(C)C 553e0695de65d879e85e8a2227570d68 [1,1,0,0,0,0|1,0,1]=4 2565 B10R0.22 CC(C)(C)CCOCCCF 9c1b4495f10fd2a173a6aa32a9fd4248 [1,1,0,0,0,0|1,0,1]=4 2566 B10R0.22 CC(C)(C)CCOCCCS 4762df2704efd9f79ff8fda30bf3c819 [1,1,0,0,0,0|1,0,1]=4 2567 B10R0.22 CC(C)(O)CCOCCCF bdc92ac349daab88e0eae57da80313f4 [1,1,0,0,0,0|1,0,1]=4 2568 B10R0.22 CC(C)(O)CCOCCCS f51ca7c74fe2564434a913bb9fb51e36 [1,1,0,0,0,0|1,0,1]=4 2569 B10R0.22 CC(C)(S)CCOCCCF 166e182aea997cd3bc29d73a3b932842 [1,1,0,0,0,0|1,0,1]=4 2570 B10R0.22 CC(C)(S)CCOCCCS cbd2b87fb8b5e11a91eb2a8ae8658b25 [1,1,0,0,0,0|1,0,1]=4 2571 B10R0.22 CCC/C=C/CNC(C)(C)C be897d7c22e0c24c09db7660cbb1f5ce [1,1,0,0,0,0|2,0,0]=4 2572 B10R0.22 CCC/C=C\CNC(C)(C)C 9fc88647c7ca4b3cb56e11e52e0b53f3 [1,1,0,0,0,0|2,0,0]=4 2573 B10R0.22 CCCCNCCC(C)(C)C f5657a45c84dd293ca7722b29d511ae4 [1,1,0,0,0,0|1,0,1]=4 2574 B10R0.22 CCCCNCCC(C)(C)F 4ea39a5a824213826f0e4f8298be5c57 [1,1,0,0,0,0|1,0,1]=4 2575 B10R0.22 CCCCNCCC(C)(C)O f6662fa2ef50877aaf425a71e1319028 [1,1,0,0,0,0|1,0,1]=4 2576 B10R0.22 CCCCOCCC(C)(C)C dd5b8363feaac6db8ea8ec7b0c29e30e [1,1,0,0,0,0|0,0,1]=3 2577 B10R0.22 CCCCOCCC(C)(C)O 8a996f4b5951e279667e40071f0a4e68 [1,1,0,0,0,0|0,0,1]=3 2578 B10R0.22 CCCCOCCC(C)(C)S 922e9624566731302169baa198c25737 [1,1,0,0,0,0|0,0,1]=3 2579 B10R0.22 CCCCOCCC(C)(F)F 6117e9c8188947cbdfb75b526bbaf6c7 [1,1,0,0,0,0|1,0,1]=4 2580 B10R0.22 CCCCOCNC(C)(C)C 6f29f37d400868e5b147d2f3dc8b6899 [1,1,0,0,0,0|1,0,1]=4 2581 B10R0.22 CCCNCCCC(C)(C)C 4cf302384e37b61e8f50b1b52cfc796e [1,1,0,0,0,0|2,0,0]=4 2582 B10R0.22 CCCNCCCC(C)(C)O 61651489957c568eec9c91fe7dc9a238 [1,1,0,0,0,0|2,0,0]=4 2583 B10R0.22 CCCOCCCC(C)(C)C 4279be04a786d8947bbd9b33620101f5 [1,1,0,0,0,0|2,0,0]=4 2584 B10R0.22 CCCOCCCC(C)(C)O 2b98d0ef5702340b2a272ca19269d4f3 [1,1,0,0,0,0|2,0,0]=4 2585 B10R0.22 CCOCOCCC(C)(C)C 4a8a253297a7d2186084c9ad7dd88ac7 [1,1,0,0,0,0|1,0,1]=4 2586 B10R0.22 CCOCOCCC(C)(C)S c671b77d443b9e593dd5f7b8b2df709b [1,1,0,0,0,0|1,0,1]=4 2587 B10R0.22 COCCOCCC(C)(C)C 10b69f7bfab0321179a1b46f51e89174 [1,1,0,0,0,0|1,0,1]=4 2588 B10R0.22 COCCOCCC(C)(C)O aefc2c1e046433d7afd1ab5a22ec6b1e [1,1,0,0,0,0|1,0,1]=4 2589 B10R0.22 COCCOCCC(C)(C)S 088dc806ccbf42f2fd5fbe5473cf3396 [1,1,0,0,0,0|1,0,1]=4 2590 B10R0.22 CSCCOCCC(C)(C)C 566927d0748334362ed36761bae20144 [1,1,0,0,0,0|1,0,1]=4 2591 B10R0.22 CSCCOCCC(C)(C)O 6c1325de41902002c9772f8720768a6a [1,1,0,0,0,0|1,0,1]=4 2592 B10R0.22 CSCCOCCC(C)(C)S 42e95ccd561d21abbe67c5e4b07f7a59 [1,1,0,0,0,0|1,0,1]=4 2593 B10R0.55 C=C(CC)COCCC(C)C e3a31c8babc951c6945b047afd37ed9c [1,1,0,0,0,0|0,0,2]=4 2594 B10R0.55 CC(C)CCOCC(Br)CBr 1f9cf5513bccde1ac9d4236674e3c893 [1,1,0,0,0,0|1,0,1]=4 2595 B10R0.55 CC(C)CCOCC(Cl)CCl fee648f2132dd46512d5816f432901f5 [1,1,0,0,0,0|1,0,1]=4 2596 B10R0.55 CC(C)CCOCC(O)CO 1de19c6d1788ed85651df72ab7d6eb69 [1,1,0,0,0,0|1,0,1]=4 2597 B10R0.55 CC(C)CCOCC(S)CS afe8724e8ce51e17baaf8b1b3c670e2d [1,1,0,0,0,0|1,0,1]=4 2598 B10R0.55 CC(C)CCOC[C@@H](O)CO c516db4bacccc470ca7c1b054525892d [1,1,0,0,0,0|1,0,1]=4 2599 B10R0.55 CC(C)CCOC[C@H](O)CO 14bc024f237346e58296178ed3309438 [1,1,0,0,0,0|1,0,1]=4 2600 B10R0.55 CCC(=O)COCCC(C)C ee914b8910e29157266bcbd585498678 [1,1,0,0,0,0|0,0,2]=4 2601 B10R0.55 CCC(C)CNCCC(C)C 0d46681e2922236f2be35fece2b71e0b [1,1,0,0,0,0|1,0,1]=4 2602 B10R0.55 CCC(C)COCCC(C)C f93c336fc42dcbccca06d4ea0c33aabe [1,1,0,0,0,0|0,0,1]=3 2603 B10R0.55 CCC(C)COCCN(C)C de3a61e04b42e9260c21b621c7fc525b [1,1,0,0,0,0|1,0,1]=4 2604 B10R0.55 CCC(C)COCOC(C)C 05bfba2bba00e909b97bc4a1b41d5a76 [1,1,0,0,0,0|1,0,1]=4 2605 B10R0.55 CCC(C)NCCCC(C)C 0518b6f26bc64b6aca23a949730e4aa2 [1,1,0,0,0,0|2,0,0]=4 2606 B10R0.55 CCC(C)OCCCC(C)C 7292591b3a33d8ddb2501130515f0a24 [1,1,0,0,0,0|2,0,0]=4 2607 B10R0.55 CCC(O)CNCCC(C)C 55cbe45ac061a1408c59bdedd5d75026 [1,1,0,0,0,0|1,0,1]=4 2608 B10R0.55 CC[C@@H](C)CNCCC(C)C d7cf28abf29432202cb5729b579d7f57 [1,1,0,0,0,0|1,0,1]=4 2609 B10R0.55 CC[C@@H](C)COCCC(C)C 7460131b7ac491206dab1411f3ea9f47 [1,1,0,0,0,0|0,0,1]=3 2610 B10R0.55 CC[C@@H](C)COCCN(C)C be2df5c7a04e042e25c6e2f778eacce9 [1,1,0,0,0,0|1,0,1]=4 2611 B10R0.55 CC[C@@H](C)COCOC(C)C 1a17eaba18c2c7284ebc2e153801c324 [1,1,0,0,0,0|1,0,1]=4 2612 B10R0.55 CC[C@@H](C)NCCCC(C)C 3659e0f9b31ca568d8065959d744541d [1,1,0,0,0,0|2,0,0]=4 2613 B10R0.55 CC[C@@H](C)OCCCC(C)C 681b2627835725bc1ffe460c69ea17eb [1,1,0,0,0,0|2,0,0]=4 2614 B10R0.55 CC[C@@H](O)CNCCC(C)C 9be6544c9506232c560a1c3a7f00334b [1,1,0,0,0,0|1,0,1]=4 2615 B10R0.55 CC[C@H](C)CNCCC(C)C 187d202989a1f084ae1e789ecaf470da [1,1,0,0,0,0|1,0,1]=4 2616 B10R0.55 CC[C@H](C)COCCC(C)C f1b85a23c95d042e5b2f00a83c21bb2e [1,1,0,0,0,0|0,0,1]=3 2617 B10R0.55 CC[C@H](C)COCCN(C)C 4c7b74f4491ea8b291b3649d34b54adb [1,1,0,0,0,0|1,0,1]=4 2618 B10R0.55 CC[C@H](C)COCOC(C)C ed8a292e1fd3da6f014b319013f7dbd2 [1,1,0,0,0,0|1,0,1]=4 2619 B10R0.55 CC[C@H](C)NCCCC(C)C 277eca69bdc5777afcf3a389c13b6b9c [1,1,0,0,0,0|2,0,0]=4 2620 B10R0.55 CC[C@H](C)OCCCC(C)C f178e2b0f68146cb8a49bb25f8cda50f [1,1,0,0,0,0|2,0,0]=4 2621 B10R0.55 COC(C)COCCC(C)C e3253b191ae3880800eb38059adfffe4 [1,1,0,0,0,0|1,0,1]=4 2622 B10R0.55 CO[C@@H](C)COCCC(C)C 9c0fbadc4f385f1bc74084d3ac7c7693 [1,1,0,0,0,0|1,0,1]=4 2623 B10R0.55 CO[C@H](C)COCCC(C)C de5faa1b77960d563536b38112ddc709 [1,1,0,0,0,0|1,0,1]=4 2624 B10R0.74 CCC(C)CCOCCCF 088b5e09865e143620390774633098b7 [1,1,0,0,0,0|1,0,1]=4 2625 B10R0.74 CCC(C)CCOCCCS c9d94861156b939110ea5fc9d36aecf2 [1,1,0,0,0,0|1,0,1]=4 2626 B10R0.74 CCC(C)CCOCCOC 8d7bae248d09a56ebc54466239cee237 [1,1,0,0,0,0|1,0,1]=4 2627 B10R0.74 CCC(C)CCOCCSC b64c3063c6c6eb45bc2fba1d8ff3787c [1,1,0,0,0,0|1,0,1]=4 2628 B10R0.74 CCC/C=C/CNC(C)CC 4e48ba9c0fd98caefbe85435fa5b1a78 [1,1,0,0,0,0|2,0,0]=4 2629 B10R0.74 CCC/C=C/CNC(C)CO 786d962881a88caefef6e91f90143a84 [1,1,0,0,0,0|2,0,0]=4 2630 B10R0.74 CCC/C=C/CN[C@@H](C)CC b7605e996cb0e45ab279f62487cb2b40 [1,1,0,0,0,0|2,0,0]=4 2631 B10R0.74 CCC/C=C/CN[C@@H](C)CO 7800d39c8b09f22c2beedf5ba2c9269b [1,1,0,0,0,0|2,0,0]=4 2632 B10R0.74 CCC/C=C/CN[C@H](C)CC dd95691b136f2707f8767c08a69f2a66 [1,1,0,0,0,0|2,0,0]=4 2633 B10R0.74 CCC/C=C/CN[C@H](C)CO da54bc68de5d4c7cfa9ae6413cfe6b83 [1,1,0,0,0,0|2,0,0]=4 2634 B10R0.74 CCC/C=C/COC(C)CC 9d98da554dcc872c553125211755c2f1 [1,1,0,0,0,0|2,0,0]=4 2635 B10R0.74 CCC/C=C/COC(C)CF bffb5c56486c0dd823547940b57562bb [1,1,0,0,0,0|2,0,0]=4 2636 B10R0.74 CCC/C=C/COC(C)CS bf0814900ab622978fc3ab799726161c [1,1,0,0,0,0|2,0,0]=4 2637 B10R0.74 CCC/C=C/CO[C@@H](C)CC a336b5e3decea76f5731829ecb170ae9 [1,1,0,0,0,0|2,0,0]=4 2638 B10R0.74 CCC/C=C/CO[C@H](C)CC aeb209c4e3a2af254650316b293cd84f [1,1,0,0,0,0|2,0,0]=4 2639 B10R0.74 CCC/C=C/CO[C@H](C)CS 2e57bad1e5cfb70889667fec274fddc7 [1,1,0,0,0,0|2,0,0]=4 2640 B10R0.74 CCC/C=C\CNC(C)CC 93778ee7585781e977d18115d2d5927a [1,1,0,0,0,0|2,0,0]=4 2641 B10R0.74 CCC/C=C\CNC(C)CO c8103e183d41bbcfd802c20623c8d5f1 [1,1,0,0,0,0|2,0,0]=4 2642 B10R0.74 CCC/C=C\CN[C@@H](C)CC b3e7fcd5abd5ab3c2e18e130810a40c3 [1,1,0,0,0,0|2,0,0]=4 2643 B10R0.74 CCC/C=C\CN[C@@H](C)CO 1eaefd1f2139dd190642c364a75fb876 [1,1,0,0,0,0|2,0,0]=4 2644 B10R0.74 CCC/C=C\CN[C@H](C)CC 2bc95e0a31d669a6c49f2c90c0267941 [1,1,0,0,0,0|2,0,0]=4 2645 B10R0.74 CCC/C=C\CN[C@H](C)CO c135d6168a6b5e846e7aa60dab09a779 [1,1,0,0,0,0|2,0,0]=4 2646 B10R0.74 CCC/C=C\COC(C)CC a26ef22927ba4d735254ddc319a96279 [1,1,0,0,0,0|2,0,0]=4 2647 B10R0.74 CCC/C=C\COC(C)CF e04a1dea1b62b2182810444bfacd3532 [1,1,0,0,0,0|2,0,0]=4 2648 B10R0.74 CCC/C=C\COC(C)CS 6db62838ec9f281878c75b63f08f21e2 [1,1,0,0,0,0|2,0,0]=4 2649 B10R0.74 CCC/C=C\CO[C@@H](C)CC 4c4ab28a89b9b3d70d6378bd67ee91bc [1,1,0,0,0,0|2,0,0]=4 2650 B10R0.74 CCC/C=C\CO[C@H](C)CC 52fe4cd33011e343d8fae8f0ccfc7dac [1,1,0,0,0,0|2,0,0]=4 2651 B10R0.74 CCC/C=C\CO[C@H](C)CS f2086fddcaf8c078462f94b6b3b2ae3a [1,1,0,0,0,0|2,0,0]=4 2652 B10R0.74 CCCCNCCC(C)CC 1e9bc7ea0a0af354300a85f57c2aaa99 [1,1,0,0,0,0|1,0,1]=4 2653 B10R0.74 CCCCNCCC(C)CO b4c09f84716ff041596d971974cd520f [1,1,0,0,0,0|1,0,1]=4 2654 B10R0.74 CCCCNCC[C@@H](C)CO 79c77af43a32e53f0b9406150011cecb [1,1,0,0,0,0|1,0,1]=4 2655 B10R0.74 CCCCOCCC(C)CC f254ee673c9931edff6d585f5329842f [1,1,0,0,0,0|0,0,1]=3 2656 B10R0.74 CCCCOCCC(C)OC c8652128de7645f740690c6ee96dd945 [1,1,0,0,0,0|0,0,1]=3 2657 B10R0.74 CCCCOCCC(S)CC bc2f3b2f58c19e9a9629224575cf313f [1,1,0,0,0,0|1,0,1]=4 2658 B10R0.74 CCCCOCCN(C)CC 33cc8b6700841eb82fab445c5dbbc64d [1,1,0,0,0,0|1,0,1]=4 2659 B10R0.74 CCCCOCC[C@@H](C)CC 993c3afca03cb97ff2687a4bdbe6e055 [1,1,0,0,0,0|0,0,1]=3 2660 B10R0.74 CCCCOCNC(C)CC 4fe9d60f8c260b4fe9a74e716daf1c8e [1,1,0,0,0,0|1,0,1]=4 2661 B10R0.74 CCCCOCNC(C)CO 76aa6fb25da70ad41f89e1ad0d3d7cd1 [1,1,0,0,0,0|1,0,1]=4 2662 B10R0.74 CCCCOCN[C@@H](C)CC 4b2c024e16df14de4a5afafb50cc30b0 [1,1,0,0,0,0|1,0,1]=4 2663 B10R0.74 CCCCOCN[C@@H](C)CO 0d3371170619167d8c6805f434bd4215 [1,1,0,0,0,0|1,0,1]=4 2664 B10R0.74 CCCCOCN[C@H](C)CC a46028efe411312aa4bf0a52de5acbfc [1,1,0,0,0,0|1,0,1]=4 2665 B10R0.74 CCCCOCN[C@H](C)CO eb68e03805c719e5901577b96a1e26db [1,1,0,0,0,0|1,0,1]=4 2666 B10R0.74 CCCCOCOC(C)CC b1b4b0a9028982023e445a30acf0111b [1,1,0,0,0,0|1,0,1]=4 2667 B10R0.74 CCCCOCOC(C)CF 04860ec1dc1c18bafa835a2001327317 [1,1,0,0,0,0|1,0,1]=4 2668 B10R0.74 CCCCOCO[C@@H](C)CC cb49f022c3ab9d1366df5238e6c3b898 [1,1,0,0,0,0|1,0,1]=4 2669 B10R0.74 CCCCOCO[C@H](C)CC de52d6cb33e0e7e7e6b0bc636cc3594c [1,1,0,0,0,0|1,0,1]=4 2670 B10R0.74 CCCNCCCC(C)CO 67fe566447d872b897b076ee88527f4f [1,1,0,0,0,0|2,0,0]=4 2671 B10R0.74 CCCOCCCC(C)CC 830720c7a42a213e98aa1689bfd341de [1,1,0,0,0,0|2,0,0]=4 2672 B10R0.74 CCCOCCC[C@@H](C)CC 6a40126846604dd5c0859f3f0606466c [1,1,0,0,0,0|2,0,0]=4 2673 B10R0.74 CCOCOCCC(C)CC ac3cd7b41d826a0b62bdf9ae8e99918d [1,1,0,0,0,0|1,0,1]=4 2674 B10R0.74 CCOCOCCC(C)OC c3784aaccca525fb91616616852dfe83 [1,1,0,0,0,0|1,0,1]=4 2675 B10R0.74 CCOCOCC[C@@H](C)CC c661efaf1bc7a58e0e8f6471aa7fc67e [1,1,0,0,0,0|1,0,1]=4 2676 B10R0.74 CC[C@H](C)CCOCCCF 099e12d26b1e665d7b0efe6dbdc60589 [1,1,0,0,0,0|1,0,1]=4 2677 B10R0.74 CC[C@H](C)CCOCCCS 990329958d5601b9fcd5212f75727e50 [1,1,0,0,0,0|1,0,1]=4 2678 B10R0.74 CC[C@H](C)CCOCCOC 1186266719a819af26c27812701041b7 [1,1,0,0,0,0|1,0,1]=4 2679 B10R0.74 CC[C@H](C)CCOCCSC e46d67288b01436612559991cec7882a [1,1,0,0,0,0|1,0,1]=4 2680 B10R0.74 COC(C)CCOCCCF 32c986a01f36b1ecf020159aa0e45f3a [1,1,0,0,0,0|1,0,1]=4 2681 B10R0.74 COC(C)CCOCCCS 57dee0c214971c8009d3cb687417f043 [1,1,0,0,0,0|1,0,1]=4 2682 B10R0.74 COC(C)CCOCCSC aff0fccec208610cf63129394e417be3 [1,1,0,0,0,0|1,0,1]=4 2683 B10R0.74 COCCOCCC(C)OC 2dba2fb6bfe0674b6a142a716b2e4c09 [1,1,0,0,0,0|1,0,1]=4 2684 B10R0.75 CC(C)C(C)COCCCF cf13e16bceb289abf8fff06d03e69c59 [1,1,0,0,0,0|1,0,1]=4 2685 B10R0.75 CC(C)C(C)COCCCS 420de6211d13a182b72d28255c6ca933 [1,1,0,0,0,0|1,0,1]=4 2686 B10R0.75 CCC/C=C/CN(C)C(C)C 6fd19cbfc63658441cec2ecc9453eae4 [1,1,0,0,0,0|2,0,0]=4 2687 B10R0.75 CCC/C=C\CN(C)C(C)C 515b3f2b675ab7e26ae3b6ee55e7a128 [1,1,0,0,0,0|2,0,0]=4 2688 B10R0.75 CCCCNCC(C)C(C)C e07c4132057b1dc4fccb2c76b9ef9cc0 [1,1,0,0,0,0|1,0,1]=4 2689 B10R0.75 CCCCNCC(O)C(C)C 2d692f157f7ed15045b29d6c1f98b249 [1,1,0,0,0,0|1,0,1]=4 2690 B10R0.75 CCCCOCC(=O)C(C)C e9ef953a4e368fd4c3e6fe8af934ea0e [1,1,0,0,0,0|0,0,2]=4 2691 B10R0.75 CCCCOCC(C)C(C)C 0e4fab34eaadbc1d8f659bd8f38fa288 [1,1,0,0,0,0|0,0,1]=3 2692 B10R0.75 CCCCOCC(C)N(C)C a7a3d978d2e9f09a5069434b5cc740cb [1,1,0,0,0,0|1,0,1]=4 2693 B10R0.75 CCCCOCN(C)C(C)C ad20d76523c1ccf3edea02493c9290eb [1,1,0,0,0,0|1,0,1]=4 2694 B10R0.75 CCCCOC[C@@H](C)N(C)C 0ea01c9f271ff74c420f3909c7a11bfc [1,1,0,0,0,0|1,0,1]=4 2695 B10R0.75 CCCCOC[C@H](C)N(C)C 993f2f22a5b655b596a803a1707ed752 [1,1,0,0,0,0|1,0,1]=4 2696 B10R0.75 CCCOCCC(C)C(C)C a3688e04830714b7ec5ac5404f21f381 [1,1,0,0,0,0|2,0,0]=4 2697 B10R0.75 CCOCOCC(C)C(C)C c031e72256334da598797323cdeef9e4 [1,1,0,0,0,0|1,0,1]=4 2698 B10R0.75 COCCOCC(C)C(C)C a3c1fc451f2727a8c77ec0a8f465a5f6 [1,1,0,0,0,0|1,0,1]=4 2699 B10R0.75 CSCCOCC(C)C(C)C a6fd6afd915694b47e1fbe20143b4d27 [1,1,0,0,0,0|1,0,1]=4 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8f33aee3e85a2ae399b081964a97dbe1 [1,1,0,0,0,0|2,0,0]=4 2712 B10R0.97 CC(C)CCCOCC(C)S 19fa299321ddeeb727853112e4a109f6 [1,1,0,0,0,0|2,0,0]=4 2713 B10R0.97 CC(C)CCCOC[C@@H](C)F 7607806ad9df7b3f2bc8cfbb0cf285b7 [1,1,0,0,0,0|2,0,0]=4 2714 B10R0.97 CC(C)CCCOC[C@H](C)F 7715b39d53df0096a52d9f0595191ef9 [1,1,0,0,0,0|2,0,0]=4 2715 B10R0.97 CC(C)CCNCCC(C)C a05ec9aabaa41c9b701694321bf78d9e [1,1,0,0,0,0|1,0,1]=4 2716 B10R0.97 CC(C)CCNCCC(C)O 34fcec0ca110cc0e84744342fd4628b3 [1,1,0,0,0,0|1,0,1]=4 2717 B10R0.97 CC(C)CCNCC[C@@H](C)O b602b9ffb5960c19b4e3f32687c1c8ff [1,1,0,0,0,0|1,0,1]=4 2718 B10R0.97 CC(C)CCNCC[C@H](C)O ccfe2f8c8facf2433ba466b9ecd28169 [1,1,0,0,0,0|1,0,1]=4 2719 B10R0.97 CC(C)CCOCCC(C)C 6f4531b0906febc001dd614203b46ef2 [1,1,0,0,0,0|0,0,1]=3 2720 B10R0.97 CC(C)CCOCCC(F)F 65f6cdcffa9a5b83a97984a63efcb3e3 [1,1,0,0,0,0|1,0,1]=4 2721 B10R0.97 CC(C)CCOCCN(C)C 71977f4b25be90f879066e46c3ce8795 [1,1,0,0,0,0|1,0,1]=4 2722 B10R0.97 CC(C)CCOCCS(=O)C 131b27d446716b2e45b9860b1de4db16 [1,1,0,0,0,0|1,0,1]=4 2723 B10R0.97 CC(C)CCOCOC(C)C d9d3bfcb1aa116649d9e48d3fe938744 [1,1,0,0,0,0|1,0,1]=4 2724 B10R0.1 C#CCCCNC(=O)CCC 1e5aba94a15dbf62ea93232b53804dde [1,1,0,0,0,0|1,0,1]=4 2725 B10R0.1 C#CCCCOC(=S)CCC 62e3bb31049efd0c4ab70b827b2bca95 [1,1,0,0,0,0|0,1,1]=4 2726 B10R0.1 C#CCCOCC(=O)CCC 4b16cb2cf69aa46b6e6a8c9c82f2cec9 [1,1,0,0,0,0|0,0,2]=4 2727 B10R0.1 C#CCNCOC(=O)CCC 768f435dfe684476f2a37237f832b685 [1,1,0,0,0,0|0,0,2]=4 2728 B10R0.1 C#CCOCOC(=O)CCC ae38276a30cb67c85368440db9572933 [1,1,0,0,0,0|0,0,2]=4 2729 B10R0.1 C/C=C/COCC(=O)CCC e705dd41e10e42b7866df48e1ca92157 [1,1,0,0,0,0|0,0,2]=4 2730 B10R0.1 C/C=C\COCC(=O)CCC 8bf6bfccd0bb73cc8d5f50cefcee622b [1,1,0,0,0,0|0,0,2]=4 2731 B10R0.1 C=CCCCNC(=O)CCC 36add1eb0b637534ddbc7b909527399d [1,1,0,0,0,0|1,0,1]=4 2732 B10R0.1 C=CCCCOC(=S)CCC 4cb56d9bc436f4caf74e6534297d8c48 [1,1,0,0,0,0|0,1,1]=4 2733 B10R0.1 C=CCCOCC(=O)CCC 5fa19dac02f4734efaaffc6177d1b445 [1,1,0,0,0,0|0,0,2]=4 2734 B10R0.1 CC#CCOCC(=O)CCC b631437fcbe06f5bf58285241b38365a [1,1,0,0,0,0|0,0,2]=4 2735 B10R0.1 CC/C=C/COC(=S)CCC 70ec4c0977dbca2d1155ab6d62691382 [1,1,0,0,0,0|0,1,1]=4 2736 B10R0.1 CC=CCOCC(=O)CCC 8f6ba979a3d95982df241a72b750c80a [1,1,0,0,0,0|0,0,2]=4 2737 B10R0.1 CCC#CCOC(=S)CCC 883ac2a6298a5dc1c13d73f99a78d7fd [1,1,0,0,0,0|0,1,1]=4 2738 B10R0.1 CCCC(=O)CNCCCCl c0f1363d0e8689562363b48372f1c1fb [1,1,0,0,0,0|2,0,0]=4 2739 B10R0.1 CCCC(=O)CNCCCO af23909a43cb4df58e0bd24d961ffff2 [1,1,0,0,0,0|2,0,0]=4 2740 B10R0.1 CCCC(=O)CNCCOC 317e67aceabfbe7a232fb2e03d7a50fc [1,1,0,0,0,0|2,0,0]=4 2741 B10R0.1 CCCC(=O)CNCCSC 3695c07515b783531beb51fbbf72d8bd [1,1,0,0,0,0|2,0,0]=4 2742 B10R0.1 CCCC(=O)COCCC#N de2911d958dfedb1968ade1bc892e1fd [1,1,0,0,0,0|1,0,1]=4 2743 B10R0.1 CCCC(=O)COCCC=O a3f44f7038af8e0629e44e7280315658 [1,1,0,0,0,0|1,0,1]=4 2744 B10R0.1 CCCC(=O)COCCCF 62bf1ed7b351b58b6ed0990794725915 [1,1,0,0,0,0|1,0,0]=3 2745 B10R0.1 CCCC(=O)COCCCS 019fcf2db5438ee1091d1c151725150a [1,1,0,0,0,0|1,0,0]=3 2746 B10R0.1 CCCC(=O)COCCOC a601e67880a5e9a5fc70d75a9a8aab5b [1,1,0,0,0,0|1,0,0]=3 2747 B10R0.1 CCCC(=O)COCCSC bb4a6374ae7cadeee3ba62422eca67c7 [1,1,0,0,0,0|1,0,0]=3 2748 B10R0.1 CCCC(=O)NCCCC#N cf2eb2b08ac770f0ecc60b81767531c8 [1,1,0,0,0,0|1,0,1]=4 2749 B10R0.1 CCCC(=O)NCCCCCl f671a3330fe2c47b146f725c22547753 [1,1,0,0,0,0|1,0,0]=3 2750 B10R0.1 CCCC(=O)NCCCCO 5dcc5934786fd672ded2e88e6ca59c07 [1,1,0,0,0,0|1,0,0]=3 2751 B10R0.1 CCCC(=O)NCCCCS 4ffd987e848f5ce52a73d93f5062b35c [1,1,0,0,0,0|1,0,0]=3 2752 B10R0.1 CCCC(=O)NCCCOC 7712654c76c69518ffc7db7f1c70c47f [1,1,0,0,0,0|1,0,0]=3 2753 B10R0.1 CCCC(=O)NCCCSC 0162770f8d54f07949cd04a73d25d9ee [1,1,0,0,0,0|1,0,0]=3 2754 B10R0.1 CCCC(=O)NCCOCC 79d9b92616c769d2cdcd747927c60328 [1,1,0,0,0,0|1,0,0]=3 2755 B10R0.1 CCCC(=O)NCCSCC 80b0e19972a11cccc458980ea52b2299 [1,1,0,0,0,0|1,0,0]=3 2756 B10R0.1 CCCC(=O)OCCOCC 9a285a2c378d3b3e5e911c97d35a22b7 [1,1,0,0,0,0|0,0,0]=2 2757 B10R0.1 CCCC(=O)OCCOCF 3c9e2aeba7aac381e328973102e6b518 [1,1,0,0,0,0|1,0,0]=3 2758 B10R0.1 CCCC(=O)OCNCC#N 403277cd78e7c9274bc2205f54a88502 [1,1,0,0,0,0|1,0,1]=4 2759 B10R0.1 CCCC(=O)OCNCCBr 30734e62ea61515bfcd7b9963185a180 [1,1,0,0,0,0|1,0,0]=3 2760 B10R0.1 CCCC(=O)OCNCCF 9461371387da09d32e1a124fabb3128d [1,1,0,0,0,0|1,0,0]=3 2761 B10R0.1 CCCC(=O)OCNCCI 10e5dfc9291f4d6a52bef8bfbd46ea72 [1,1,0,0,0,0|1,0,0]=3 2762 B10R0.1 CCCC(=O)OCNCCO a51bae12876ca95add56b81db6ac58f9 [1,1,0,0,0,0|1,0,0]=3 2763 B10R0.1 CCCC(=O)OCNCCS e8f339d65a1c2e70198227e13ce11765 [1,1,0,0,0,0|1,0,0]=3 2764 B10R0.1 CCCC(=O)OCOCC#N f6372911fc334e1716c8009b8034525e [1,1,0,0,0,0|1,0,1]=4 2765 B10R0.1 CCCC(=O)OCOCCS fc6fc7ed68bb3d8ebc4097c031c4d7b2 [1,1,0,0,0,0|1,0,0]=3 2766 B10R0.1 CCCC(=O)OCOCOC fbb7c8e9294a5d705a5a9e62492b2491 [1,1,0,0,0,0|1,0,0]=3 2767 B10R0.1 CCCC(=S)OCCCC#N 3471077d86ee02e1005cb85701460e64 [1,1,0,0,0,0|0,1,1]=4 2768 B10R0.1 CCCC(=S)OCCCC=O ee7e8872e425d6f5224cb761edeae8a2 [1,1,0,0,0,0|0,1,1]=4 2769 B10R0.1 CCCC(=S)OCCCCF a87f2db53eb48cbc176427ca92313c59 [1,1,0,0,0,0|0,1,0]=3 2770 B10R0.1 CCCC(=S)OCCCOC 0f4db520c0f579ec24c237eea823c892 [1,1,0,0,0,0|0,1,0]=3 2771 B10R0.1 CCCC(=S)OCCCSC 12882614c3d678eebfd0f7f1164a7738 [1,1,0,0,0,0|0,1,0]=3 2772 B10R0.1 CCCC(=S)OCCOCC a1bd1ecdf3a74bbe1c29303e11aeb9ee [1,1,0,0,0,0|0,1,0]=3 2773 B10R0.1 CCCC(=S)OCCSCC 57566a2b28663af6eed39d2cf1b8b53f [1,1,0,0,0,0|0,1,0]=3 2774 B10R0.1 CCCC(C)OCCCCF 13ba8b7531bcfc70a81d1accbd4c7f44 [1,1,0,0,0,0|1,0,1]=4 2775 B10R0.1 CCCC(C)OCCCCS d72c779ebf544bb433c5b952cfb1f0a0 [1,1,0,0,0,0|1,0,1]=4 2776 B10R0.1 CCCC(C)OCCCOC 27dd498ad340f5477304caf042496cdc [1,1,0,0,0,0|1,0,1]=4 2777 B10R0.1 CCCC(C)OCCCSC af2a37f320e9cb1def2a06f1bd8da43b [1,1,0,0,0,0|1,0,1]=4 2778 B10R0.1 CCCC(C)OCCOCC f74f7fa41a2da07c6ada5e572fcee475 [1,1,0,0,0,0|1,0,1]=4 2779 B10R0.1 CCCC(C)OCCSCC 369979e35e101e7801c5f92538b1f3a1 [1,1,0,0,0,0|1,0,1]=4 2780 B10R0.1 CCCCCNC(=O)CCC cd3617b761f054cae655d3c214537a01 [1,1,0,0,0,0|1,0,0]=3 2781 B10R0.1 CCCCCNC(=O)CCF 8f55dcb051c9e4fa4d8e7353d886739d [1,1,0,0,0,0|2,0,0]=4 2782 B10R0.1 CCCCCNC(=O)CCO e4a8972fa724b6f0f9b4d6b3c835d2fb [1,1,0,0,0,0|2,0,0]=4 2783 B10R0.1 CCCCCNC(=O)CCS 3733c740ac8be76287971250e938eadf [1,1,0,0,0,0|2,0,0]=4 2784 B10R0.1 CCCCCNC(=O)COC 3c827a5b8568a226ab9d7a96910886e4 [1,1,0,0,0,0|2,0,0]=4 2785 B10R0.1 CCCCCNC(=O)CSC a633d95815fa33f04c44be165a312304 [1,1,0,0,0,0|2,0,0]=4 2786 B10R0.1 CCCCCOC(=S)CCC e70fcd071a998201c96ff7af83897208 [1,1,0,0,0,0|0,1,0]=3 2787 B10R0.1 CCCCCOC(C)CCC 95598e4482fa2acf5532e4fa9a6ad6e3 [1,1,0,0,0,0|1,0,1]=4 2788 B10R0.1 CCCCCO[C@@H](C)CCC d796f1fbb42029d496f1afefad90a0c9 [1,1,0,0,0,0|1,0,1]=4 2789 B10R0.1 CCCCCO[C@H](C)CCC 8ec1919c97beba8a5a1b87817d43e6ed [1,1,0,0,0,0|1,0,1]=4 2790 B10R0.1 CCCCNCC(=O)CCC 453fddd4efd403580a47150fb6a1b943 [1,1,0,0,0,0|1,0,0]=3 2791 B10R0.1 CCCCNCC(=O)COC c8c6b69bbcb048c0297d4859878c7a37 [1,1,0,0,0,0|2,0,0]=4 2792 B10R0.1 CCCCNCC(=O)NCC a218683c63b1bb6bc4fada805a19d3fa [1,1,0,0,0,0|2,0,0]=4 2793 B10R0.1 CCCCNCC(=O)OCC b97c56bc755b41308bd27845c7930d51 [1,1,0,0,0,0|2,0,0]=4 2794 B10R0.1 CCCCOCC(=O)CCC 3c18382cf685be3b48662cc000c9f11f [1,1,0,0,0,0|0,0,0]=2 2795 B10R0.1 CCCCOCC(=O)COC 5492555264028ec97fd6f9a9065a58cf [1,1,0,0,0,0|1,0,0]=3 2796 B10R0.1 CCCCOCC(=O)NCC 1a816a8692edc4d39f6404d2712f2a39 [1,1,0,0,0,0|1,0,0]=3 2797 B10R0.1 CCCCOCC(=O)OCC b9d8b0969b606fca5e0d886f04b1b9a2 [1,1,0,0,0,0|1,0,0]=3 2798 B10R0.1 CCCCOCC(C)CCC 2a98bf460dddd7a4e9e45b8087a55eec [1,1,0,0,0,0|1,0,1]=4 2799 B10R0.1 CCCCOCN(C)CCC 7f0f02d15a6378bca5e117d267dfb251 [1,1,0,0,0,0|2,0,0]=4 2800 B10R0.1 CCCNCCC(=O)NCC fed5cf7995e8bcb3cb088a7324683334 [1,1,0,0,0,0|2,0,0]=4 2801 B10R0.1 CCCNCCC(=O)OCC a5eca5b369834181d5c681e73bc5df58 [1,1,0,0,0,0|2,0,0]=4 2802 B10R0.1 CCCNCOC(=O)CCC 38cbf3506e155a3e433f65aa13f4e89b [1,1,0,0,0,0|0,0,0]=2 2803 B10R0.1 CCCNCOC(=O)OCC dd5fb1e82de8f1385da13ffd886652b3 [1,1,0,0,0,0|1,0,0]=3 2804 B10R0.1 CCCNCOC(=O)SCC afe6d13e5e63696216df6a5e42e8e018 [1,1,0,0,0,0|1,0,0]=3 2805 B10R0.1 CCCOCCC(=O)NCC 716a0638bd662663b8cdb9317f882e86 [1,1,0,0,0,0|2,0,0]=4 2806 B10R0.1 CCCOCCC(=O)OCC 7807b520106a1db433af53f99cc9cebe [1,1,0,0,0,0|2,0,0]=4 2807 B10R0.1 CCCOCOC(=O)CCC ae34f309fddde79fb1b78768c738001e [1,1,0,0,0,0|0,0,0]=2 2808 B10R0.1 CCCOCOC(=O)OCC 00ffc636bc87edde518c508ef349454a [1,1,0,0,0,0|1,0,0]=3 2809 B10R0.1 CCCOCOC(=O)SCC db970673b3d242e11b09ecfcd7404053 [1,1,0,0,0,0|1,0,0]=3 2810 B10R0.1 CCC[C@@H](C)OCCCCF c7f4a0dfd0d9a93120bf3e300079a2ed [1,1,0,0,0,0|1,0,1]=4 2811 B10R0.1 CCC[C@@H](C)OCCCOC 1c887a342a2e7b5a90c1aa2e3c97c3da [1,1,0,0,0,0|1,0,1]=4 2812 B10R0.1 CCC[C@@H](C)OCCCSC c3b0da73eeed24f460ad43097e8014cb [1,1,0,0,0,0|1,0,1]=4 2813 B10R0.1 CCC[C@@H](C)OCCOCC 3a42c254752838b833672be593233f0d [1,1,0,0,0,0|1,0,1]=4 2814 B10R0.1 CCC[C@@H](C)OCCSCC 45039a4155790bf73751859d1594005d [1,1,0,0,0,0|1,0,1]=4 2815 B10R0.1 CCC[C@H](C)OCCCCF 1185d84c08384ef6e0aa4e601e46a47f [1,1,0,0,0,0|1,0,1]=4 2816 B10R0.1 CCC[C@H](C)OCCCOC e2e708b7d4bdaf5c1cb04b6f79671d82 [1,1,0,0,0,0|1,0,1]=4 2817 B10R0.1 CCC[C@H](C)OCCCSC 692958a2d3e2afd3539d323d4ad69d08 [1,1,0,0,0,0|1,0,1]=4 2818 B10R0.1 CCC[C@H](C)OCCOCC b689ae6df6247584becb7b7915f481aa [1,1,0,0,0,0|1,0,1]=4 2819 B10R0.1 CCC[C@H](C)OCCSCC 3b192f827edc34a5309e84248c0416dd [1,1,0,0,0,0|1,0,1]=4 2820 B10R0.1 CCNC(=O)COCCCF 6879e55a53a664dbfdf20f5ed4986686 [1,1,0,0,0,0|2,0,0]=4 2821 B10R0.1 CCNC(=O)COCCCS 09f971483aba30f1c8cfc0f9bb6ee313 [1,1,0,0,0,0|2,0,0]=4 2822 B10R0.1 CCNC(=O)COCCOC 126af58aa417d53e2decba7593c648a0 [1,1,0,0,0,0|2,0,0]=4 2823 B10R0.1 CCNC(=O)COCCSC deaff2a084443a15847ffbe142fafa63 [1,1,0,0,0,0|2,0,0]=4 2824 B10R0.1 CCNC(=O)COCOCC 10ced6eb548f01ba9d4a8f1cb1adaad1 [1,1,0,0,0,0|2,0,0]=4 2825 B10R0.1 CCNCCCC(=O)OCC ec7ea6af2e873221783738c3262f1017 [1,1,0,0,0,0|2,0,0]=4 2826 B10R0.1 CCOC(=O)COCCCF 9db06f731f4e085bb967620bc40e73c5 [1,1,0,0,0,0|2,0,0]=4 2827 B10R0.1 CCOC(=O)COCCCS 910154b5a69cb476fce331dfd79628e5 [1,1,0,0,0,0|2,0,0]=4 2828 B10R0.1 CCOC(=O)COCCOC 8d9669626e8f41a69132fe558212487f [1,1,0,0,0,0|2,0,0]=4 2829 B10R0.1 CCOC(=O)COCCSC 68d82d823b73c14bf81455b24058a7e8 [1,1,0,0,0,0|2,0,0]=4 2830 B10R0.1 CCOC(=O)OCNCCBr a61ffdc0f93223afd6057dc21cb45d66 [1,1,0,0,0,0|2,0,0]=4 2831 B10R0.1 CCOC(=O)OCNCCF 2c7106c293115ac97d34a3ad49a8a2f3 [1,1,0,0,0,0|2,0,0]=4 2832 B10R0.1 CCOC(=O)OCNCCI 5c08bb8871acb4665eefbedb8465a7af [1,1,0,0,0,0|2,0,0]=4 2833 B10R0.1 CCOC(=O)OCNCCO 41ff48df0b0b1bb9ae91f5c7f14f3eb2 [1,1,0,0,0,0|2,0,0]=4 2834 B10R0.1 CCOC(=O)OCNCCS 4284da6d1820be51ec95046775df3a83 [1,1,0,0,0,0|2,0,0]=4 2835 B10R0.1 CCOC(=O)OCOCCS 837640ad7e95b1ea09b0e9bd60b58cce [1,1,0,0,0,0|2,0,0]=4 2836 B10R0.1 CCOC(=O)OCOCOC 980e31dc6b923991b3b50a858a6c660c [1,1,0,0,0,0|2,0,0]=4 2837 B10R0.1 CCOCCCC(=O)OCC 065e688430f5956cbb53aefa5e1e9a90 [1,1,0,0,0,0|2,0,0]=4 2838 B10R0.1 CCOCCNC(=O)CCF 30ff3d1e0d42d88b890503467a1d0faf [1,1,0,0,0,0|2,0,0]=4 2839 B10R0.1 CCOCCNC(=O)CCO 07fe0269889c2bb3a011a39b226f32c2 [1,1,0,0,0,0|2,0,0]=4 2840 B10R0.1 CCOCCNC(=O)CCS ba9fc205a8abbd5100b90e72fc8022c0 [1,1,0,0,0,0|2,0,0]=4 2841 B10R0.1 CCOCCNC(=O)COC 78fcea0c24a356c716c115100dc7a09f [1,1,0,0,0,0|2,0,0]=4 2842 B10R0.1 CCOCCNC(=O)CSC cc96c76b4bd9e83a7fed71cad246cb3d [1,1,0,0,0,0|2,0,0]=4 2843 B10R0.1 CCOCOCC(=O)OCC 91dce8a6e34fa8cace96e79585b8811b [1,1,0,0,0,0|2,0,0]=4 2844 B10R0.1 CCSC(=O)OCNCCBr fcebbedb499ca6205ca1f02ac2f5223f [1,1,0,0,0,0|2,0,0]=4 2845 B10R0.1 CCSC(=O)OCNCCF 33176aeba2024fdd93467bc5d62bb817 [1,1,0,0,0,0|2,0,0]=4 2846 B10R0.1 CCSC(=O)OCNCCI cd5d5e832e44331dc5e99c1366a30d76 [1,1,0,0,0,0|2,0,0]=4 2847 B10R0.1 CCSC(=O)OCNCCO 241eaf7f0b2ae6b814f815132322c120 [1,1,0,0,0,0|2,0,0]=4 2848 B10R0.1 CCSC(=O)OCNCCS bda1e510740cd7c2a86ec829f4ac28ed [1,1,0,0,0,0|2,0,0]=4 2849 B10R0.1 CCSC(=O)OCOCCF 150adb32985dd649f09deb9e85b0af26 [1,1,0,0,0,0|2,0,0]=4 2850 B10R0.1 CCSC(=O)OCOCCS 462e726a31afc3478b6b9f6a57df71b3 [1,1,0,0,0,0|2,0,0]=4 2851 B10R0.1 CCSC(=O)OCOCOC 63f95407bcabe56a574337df5d18bb8e [1,1,0,0,0,0|2,0,0]=4 2852 B10R0.1 CCSCCNC(=O)CCF 546f28f99d32729a57edd07a91f6d52b [1,1,0,0,0,0|2,0,0]=4 2853 B10R0.1 CCSCCNC(=O)CCO cdd7f8211b4e390617f39925d56f3718 [1,1,0,0,0,0|2,0,0]=4 2854 B10R0.1 CCSCCNC(=O)CCS 7c9b93abf3ea2c2a2c588739c4cb7bac [1,1,0,0,0,0|2,0,0]=4 2855 B10R0.1 CCSCCNC(=O)COC a19b0a93f49032c26f16e852a9c205d9 [1,1,0,0,0,0|2,0,0]=4 2856 B10R0.1 CCSCCNC(=O)CSC b409c0a5f6b4d3adf33fab235d1c16f6 [1,1,0,0,0,0|2,0,0]=4 2857 B10R0.1 COCC(=O)COCCCF 1efac76f6d965af83427c8cd3db40039 [1,1,0,0,0,0|2,0,0]=4 2858 B10R0.1 COCC(=O)COCCSC c326bd99d2ec3dca71ebad02c9717b24 [1,1,0,0,0,0|2,0,0]=4 2859 B10R0.1 COCC(=O)NCCCCCl bf98da29268c6c731a21be48ca575909 [1,1,0,0,0,0|2,0,0]=4 2860 B10R0.1 COCC(=O)NCCCCO 9788392c77d4b9388dfcec5602286f1d [1,1,0,0,0,0|2,0,0]=4 2861 B10R0.1 COCC(=O)NCCCCS 575c3c3b4fc3fe0df2c117d292232b27 [1,1,0,0,0,0|2,0,0]=4 2862 B10R0.1 COCC(=O)NCCCSC 484918eb6915e305a98942cd577ff66d [1,1,0,0,0,0|2,0,0]=4 2863 B10R0.1 COCCCNC(=O)CCF 07ad89282b12d855b19aea54b65f7037 [1,1,0,0,0,0|2,0,0]=4 2864 B10R0.1 COCCCNC(=O)CCO 82a3671f6ca25e1924fb0d12d2c00443 [1,1,0,0,0,0|2,0,0]=4 2865 B10R0.1 COCCCNC(=O)CCS eb8f8b417a7b6ca67973a0cb951e1903 [1,1,0,0,0,0|2,0,0]=4 2866 B10R0.1 COCCCNC(=O)COC a95f3d1c56fc9699b3e78feef59d36ec [1,1,0,0,0,0|2,0,0]=4 2867 B10R0.1 COCCCNC(=O)CSC c5cb8f5af4ec02bc1896a3f0c0a40533 [1,1,0,0,0,0|2,0,0]=4 2868 B10R0.1 COCCOCC(=O)COC 8482545c4e53647501dc212160973072 [1,1,0,0,0,0|2,0,0]=4 2869 B10R0.1 CSCC(=O)NCCCCCl d28cebc86c70f68b723b95fa8a51740d [1,1,0,0,0,0|2,0,0]=4 2870 B10R0.1 CSCC(=O)NCCCCO b5716720caa9ef6737a301802ba2bb6d [1,1,0,0,0,0|2,0,0]=4 2871 B10R0.1 CSCC(=O)NCCCCS 0946012f9eefb75ee640ee74283678f3 [1,1,0,0,0,0|2,0,0]=4 2872 B10R0.1 CSCCCNC(=O)CCF 836c8274edab8263bfb65d176ae9a745 [1,1,0,0,0,0|2,0,0]=4 2873 B10R0.1 CSCCCNC(=O)CCO b1a9b2a734ea204292bf17a713e67108 [1,1,0,0,0,0|2,0,0]=4 2874 B10R0.1 CSCCCNC(=O)CCS ec915c99e64127ae48269170511ca292 [1,1,0,0,0,0|2,0,0]=4 2875 B10R0.1 CSCCCNC(=O)CSC df4e66fa8a1d90beb12e79e61332cd13 [1,1,0,0,0,0|2,0,0]=4 2876 B10R0.1 O=C(CCF)NCCCCCl da4326635e79533dd9f88241957bd62b [1,1,0,0,0,0|2,0,0]=4 2877 B10R0.1 O=C(CCF)NCCCCO 7ca3d07f8aa6c3791730aa748f304038 [1,1,0,0,0,0|2,0,0]=4 2878 B10R0.1 O=C(CCF)NCCCCS dc9c03eef229da864a0075977eb454f4 [1,1,0,0,0,0|2,0,0]=4 2879 B10R0.1 O=C(CCO)NCCCCCl feeb571388f6c0dca819e020bdd3b7aa [1,1,0,0,0,0|2,0,0]=4 2880 B10R0.1 O=C(CCO)NCCCCO eb8190f503184dce54f6503361fba3c2 [1,1,0,0,0,0|2,0,0]=4 2881 B10R0.1 O=C(CCO)NCCCCS fcdf16f99c7b22054491ea7f6b6ffbaa [1,1,0,0,0,0|2,0,0]=4 2882 B10R0.1 O=C(CCS)NCCCCCl 7848a4967d9fe44f8a74667860e19313 [1,1,0,0,0,0|2,0,0]=4 2883 B10R0.1 O=C(CCS)NCCCCO b8d3238d1c88465a91908b8a194ebaf3 [1,1,0,0,0,0|2,0,0]=4 2884 B10R0.1 O=C(CCS)NCCCCS 52d8805717368edb54f0ed297ea0dde5 [1,1,0,0,0,0|2,0,0]=4 2885 B10R0.2 CCCC(=O)CN(C)CCC ed9faa47710b4c8cbd4da864234d5bf1 [1,1,0,0,0,0|2,0,0]=4 2886 B10R0.2 CCCC(=O)NC(C)CCC 56490631c48f2aca072c23f49ee9d058 [1,1,0,0,0,0|1,0,0]=3 2887 B10R0.2 CCCC(=O)NC(C)CCO 5919b60c107cc1ebaf9d386a0f33a7c3 [1,1,0,0,0,0|2,0,0]=4 2888 B10R0.2 CCCC(=O)NC(C)COC 03f2d6c28fcaf9c50b1441eb116940a4 [1,1,0,0,0,0|2,0,0]=4 2889 B10R0.2 CCCC(=O)N[C@@H](C)CCC 8e5c769688371942cde58e588e37dc9d [1,1,0,0,0,0|1,0,0]=3 2890 B10R0.2 CCCC(=O)N[C@@H](C)CCO 932b928501cefed5a897b0c541a84c74 [1,1,0,0,0,0|2,0,0]=4 2891 B10R0.2 CCCC(=O)N[C@@H](C)COC 32d1fede2fae362d50263839bfd066c4 [1,1,0,0,0,0|2,0,0]=4 2892 B10R0.2 CCCC(=O)N[C@H](C)CCO 194b81205d9e7b862e31fe13833f72fe [1,1,0,0,0,0|2,0,0]=4 2893 B10R0.2 CCCC(=O)N[C@H](C)COC 33c5d1f5df178ec4598f4c705fc15027 [1,1,0,0,0,0|2,0,0]=4 2894 B10R0.2 CCCC(=S)OC(C)CCC a1e27c222b99617f74081c2514499359 [1,1,0,0,0,0|0,1,0]=3 2895 B10R0.2 CCCC(=S)OC(C)COC 7774b4f3565fd7de1ff4d02d9b145efe [1,1,0,0,0,0|1,1,0]=4 2896 B10R0.2 CCCC(C)NC(=O)CCF c75651a0446867fa721b8be04398f841 [1,1,0,0,0,0|2,0,0]=4 2897 B10R0.2 CCCC(C)NC(=O)CCO a6465449ef301530ae7d40e780707a33 [1,1,0,0,0,0|2,0,0]=4 2898 B10R0.2 CCCC(C)NC(=O)CCS 37888992e4b4c91d972f05d2146acb68 [1,1,0,0,0,0|2,0,0]=4 2899 B10R0.2 CCCC(C)NC(=O)COC 80d5b2db690d4b3a34721723600b0eae [1,1,0,0,0,0|2,0,0]=4 2900 B10R0.2 CCCC(C)NC(=O)CSC 60a0dde5f0fb97ce04784b7dd4042df4 [1,1,0,0,0,0|2,0,0]=4 2901 B10R0.2 CCCC(C)OC(C)CCC e6ec8d46eb9bf5911ec844cefe4f2f0f [1,1,0,0,0,0|1,0,1]=4 2902 B10R0.2 CCCC(C)O[C@@H](C)CCC e5a8750ed6143b0892f00961458f282a [1,1,0,0,0,0|1,0,1]=4 2903 B10R0.2 CCCC(C)O[C@H](C)CCC 110c475fa89ee054a610c24ae05e9130 [1,1,0,0,0,0|1,0,1]=4 2904 B10R0.2 CCC[C@H](C)NC(=O)CCF e475e4a781571e55175c590b3ea9f9cd [1,1,0,0,0,0|2,0,0]=4 2905 B10R0.2 CCC[C@H](C)NC(=O)CCO 2fe417e155c60a2b404a8aadb741f290 [1,1,0,0,0,0|2,0,0]=4 2906 B10R0.2 CCC[C@H](C)NC(=O)CCS d03b67e7e4e3e5fedfdca048be8e7b00 [1,1,0,0,0,0|2,0,0]=4 2907 B10R0.2 CCC[C@H](C)NC(=O)COC 98cc4d38fdc7658d5f12c1a8f33cae62 [1,1,0,0,0,0|2,0,0]=4 2908 B10R0.2 CCC[C@H](C)NC(=O)CSC a10a8f758c4607dca24c6c6481884f31 [1,1,0,0,0,0|2,0,0]=4 2909 B10R0.19 CCCC(=O)N(C)CCCO aa526b2cb34561ea37f14fc606f15b54 [1,1,0,0,0,0|2,0,0]=4 2910 B10R0.19 CCCC(=O)N(C)CCOC 5fee7231bfc5953066c981c54b1ddc91 [1,1,0,0,0,0|2,0,0]=4 2911 B10R0.19 CCCC(=O)N(C)CCSC 61727274333cc9fb15271abbb1d84beb [1,1,0,0,0,0|2,0,0]=4 2912 B10R0.19 CCCCN(C)C(=O)CCC 2b7b784470b8b7ff831c528c223e6a34 [1,1,0,0,0,0|1,0,0]=3 2913 B10R0.19 CCCCN(C)C(=O)CCF 391e477ab1fb6a69251f8957ca28e495 [1,1,0,0,0,0|2,0,0]=4 2914 B10R0.19 CCCCN(C)C(=O)CCO 38d92cdad79d05905c316479ef7e8763 [1,1,0,0,0,0|2,0,0]=4 2915 B10R0.19 CCCCN(C)C(=O)CCS afb13be8e05a3692f482a3be73f1fe23 [1,1,0,0,0,0|2,0,0]=4 2916 B10R0.19 CCCCN(C)C(=O)COC 2577def73493edeac0c4ed538d627414 [1,1,0,0,0,0|2,0,0]=4 2917 B10R0.19 CCCCN(C)C(=O)CSC 68573d7f429ecb339090cdbe2bbbc786 [1,1,0,0,0,0|2,0,0]=4 2918 B10R0.19 CCCNC(=O)C(=O)CCC 5f1ca2ad77e4e87193cbe96fbe565f08 [1,1,0,0,0,0|2,0,0]=4 2919 B10R0.24 C#CC(CCC)OCCCC 23500774d38d364371d1497dd663b850 [1,1,0,0,0,0|1,0,1]=4 2920 B10R0.24 C=CC(CCC)OCCCC 69ea78e3fe0936af58dac88120ef5c7b [1,1,0,0,0,0|1,0,1]=4 2921 B10R0.24 CCCCCN(C=O)CCC 8646abf1faa254eafc312659290c903a [1,1,0,0,0,0|2,0,0]=4 2922 B10R0.24 CCCCOC(C#N)CCC db11ccbb3b62ec8b5907f34008a10bc2 [1,1,0,0,0,0|1,0,1]=4 2923 B10R0.24 CCCCOC(CC)CCC 5a3345c3fdcca9a094cc115eabb5cbe3 [1,1,0,0,0,0|1,0,1]=4 2924 B10R0.24 CCCCO[C@H](CC)CCC a393df8aa8abbe82bcb4c3927372605f [1,1,0,0,0,0|1,0,1]=4 2925 B10R0.83 C=C(CC)C(=O)NCCCC 9ecf90067c139255ad96e608ea3e7b91 [1,1,0,0,0,0|1,0,1]=4 2926 B10R0.83 CCC(O)C(=O)NCCCCl 9ce76e2e16255cf45719b1b759f04822 [1,1,0,0,0,0|2,0,0]=4 2927 B10R0.83 CCC(O)C(=O)NCCCO 2406374cdf2c85dcb9e6f87639fd940b [1,1,0,0,0,0|2,0,0]=4 2928 B10R0.83 CCC(O)C(=O)NCCOC 76bd8e622cea127c938fdfa28035f1cc [1,1,0,0,0,0|2,0,0]=4 2929 B10R0.83 CCC(O)C(=O)NCCSC 0688f327066619e2c7e150d42feb589c [1,1,0,0,0,0|2,0,0]=4 2930 B10R0.83 CCCCCC(=O)N(C)CC 5faccaab2625fd396450487f4aa68930 [1,1,0,0,0,0|2,0,0]=4 2931 B10R0.83 CCCCNC(=O)C(=O)CC f70364b47518d044d4168c14edef081c [1,1,0,0,0,0|1,0,1]=4 2932 B10R0.83 CCCCNC(=O)C(C)OC b55068bf7a4db16e7cedc99e858c4871 [1,1,0,0,0,0|2,0,0]=4 2933 B10R0.83 CCCCNC(=O)C(C)SC 70fdddc2c637497f84b3a6ab01d732d6 [1,1,0,0,0,0|2,0,0]=4 2934 B10R0.83 CCCCNC(=O)C(O)CC 0bb7cae020f8d9a6f1ab0021bf8a298d [1,1,0,0,0,0|1,0,0]=3 2935 B10R0.83 CCCCNC(=O)C(O)CO d98d9133743f731cf08495d863edb929 [1,1,0,0,0,0|2,0,0]=4 2936 B10R0.83 CCCCNC(=O)N(C)CC 281153b38e5b0720f98fb991dbfaf202 [1,1,0,0,0,0|2,0,0]=4 2937 B10R0.83 CCCCNC(=O)[C@@H](C)OC e789ae086f9ed633afca669e35f42777 [1,1,0,0,0,0|2,0,0]=4 2938 B10R0.83 CCCCNC(=O)[C@@H](O)CC ce320a80fc74e2960ab5c1b56d0c1177 [1,1,0,0,0,0|1,0,0]=3 2939 B10R0.83 CCCCNC(=O)[C@@H](O)CO 8320f21a23ab3c4834e9f96d8866433e [1,1,0,0,0,0|2,0,0]=4 2940 B10R0.83 CCCCNC(=O)[C@@H](S)CC 86e97a222f204fadccdea11157c8e72f [1,1,0,0,0,0|1,0,0]=3 2941 B10R0.83 CCCCNC(=O)[C@H](C)OC ac821403e6615ab5c9463a45ef84f512 [1,1,0,0,0,0|2,0,0]=4 2942 B10R0.83 CCCCNC(=O)[C@H](O)CC ccbdd8cd94855236f2a70575c312a593 [1,1,0,0,0,0|1,0,0]=3 2943 B10R0.83 CCCCNC(=O)[C@H](O)CF 2c27eb611eb186e3e9278ea9236ea1e0 [1,1,0,0,0,0|2,0,0]=4 2944 B10R0.83 CCCCOC(C)C(C)CC 052825037807bf416b1248eb7bd312bd [1,1,0,0,0,0|1,0,1]=4 2945 B10R0.83 CCCNCC(=O)C(C)CC 421f60228013d880568584f5c10554a9 [1,1,0,0,0,0|2,0,0]=4 2946 B10R0.83 CCCOCC(=O)C(C)CC be769a4148e4c3e25a48685acf6e03de [1,1,0,0,0,0|2,0,0]=4 2947 B10R0.83 CC[C@@H](O)C(=O)NCCCCl 1782330c8fc34e5e44373a9ccaeab0a2 [1,1,0,0,0,0|2,0,0]=4 2948 B10R0.83 CC[C@@H](O)C(=O)NCCCO ac6d552f2281f6fb11c74acdef51635d [1,1,0,0,0,0|2,0,0]=4 2949 B10R0.83 CC[C@@H](O)C(=O)NCCOC b923ff692a7553fe2bf7f5b93eae0dbf [1,1,0,0,0,0|2,0,0]=4 2950 B10R0.83 CC[C@@H](O)C(=O)NCCSC 0d5a3b831bd7ab7706b9d337df6267cd [1,1,0,0,0,0|2,0,0]=4 2951 B10R0.83 CC[C@H](O)C(=O)NCCCCl b61a2770e12c607a7c4c13079fe0da29 [1,1,0,0,0,0|2,0,0]=4 2952 B10R0.83 CC[C@H](O)C(=O)NCCCO 07e1ec970f418d460b98f9ea6d72bd3d [1,1,0,0,0,0|2,0,0]=4 2953 B10R0.83 CC[C@H](O)C(=O)NCCOC 12508f6e5ce78129e40dd490fd606d8b [1,1,0,0,0,0|2,0,0]=4 2954 B10R0.83 CC[C@H](O)C(=O)NCCSC 97369a1526f485b8e388718769cc5b54 [1,1,0,0,0,0|2,0,0]=4 2955 B10R0.83 CC[C@H](S)C(=O)NCCCCl 7a3054e875c4c61801bec677db59c13b [1,1,0,0,0,0|2,0,0]=4 2956 B10R0.83 CC[C@H](S)C(=O)NCCCO 306b56de5184e53997df2309b774e8e5 [1,1,0,0,0,0|2,0,0]=4 2957 B10R0.83 CC[C@H](S)C(=O)NCCOC df2bb1c0694eb9dfa23f664b32ee4b1d [1,1,0,0,0,0|2,0,0]=4 2958 B10R0.83 CC[C@H](S)C(=O)NCCSC 5ef56f1262bff7cdb07bd76d7eb1d7ec [1,1,0,0,0,0|2,0,0]=4 2959 B10R0.91 C#CCCC(=O)NCCCC 5fe7a91e626a115b7fd20a7f46a80c67 [1,1,0,0,0,0|1,0,1]=4 2960 B10R0.91 C/C=C/CC(=O)NCCCC 36087e9f780b7b5769d5a09c52717782 [1,1,0,0,0,0|1,0,1]=4 2961 B10R0.91 C=CCCC(=O)NCCCC c179eac9e1b3e18e9a6dfaa5dad688c2 [1,1,0,0,0,0|1,0,1]=4 2962 B10R0.91 CC#CCC(=O)NCCCC 820fba93e19e4e4d93f26dd4d797f9b5 [1,1,0,0,0,0|1,0,1]=4 2963 B10R0.91 CC/C=C/C(=O)NCCCC c9d7698c45e961917c65b16fe10c228c [1,1,0,0,0,0|1,0,1]=4 2964 B10R0.91 CC/C=C\C(=O)NCCCC e763bdcbf0afee106f8b1aa0242ce88a [1,1,0,0,0,0|1,0,1]=4 2965 B10R0.91 CCC#CC(=O)NCCCC eb0d5ef3057613a48ba20ba5c7d222fb [1,1,0,0,0,0|1,0,1]=4 2966 B10R0.91 CCC/C=C/C(=O)NCCC d392f1b784a241f143e2ff6e6c67f397 [1,1,0,0,0,0|1,0,1]=4 2967 B10R0.91 CCC=CC(=O)NCCCC 7db747ae7974c9974839229645987c28 [1,1,0,0,0,0|1,0,1]=4 2968 B10R0.91 CCCC#CC(=O)NCCC bd0faf45af765227fba34862d826c3f5 [1,1,0,0,0,0|1,0,1]=4 2969 B10R0.91 CCCC=CC(=O)NCCC 7f0c42e078f87c7991322000d746efa0 [1,1,0,0,0,0|1,0,1]=4 2970 B10R0.91 CCCCC(=O)NCCCCl 33a4b5638fdb717aefdcf6539c550173 [1,1,0,0,0,0|2,0,0]=4 2971 B10R0.91 CCCCC(=O)NCCCO a506e03803236b22b3ae12611eccbe7c [1,1,0,0,0,0|2,0,0]=4 2972 B10R0.91 CCCCC(=O)NCCOC 5ea5ee64f6f2aa6ec9332a0ab051832d [1,1,0,0,0,0|2,0,0]=4 2973 B10R0.91 CCCCC(=O)NCCSC 8fb8629ea12736b986b6b7c52fdb4519 [1,1,0,0,0,0|2,0,0]=4 2974 B10R0.91 CCCCCC(=O)NCCBr fec600b048b9d57116c2b5748a328020 [1,1,0,0,0,0|2,0,0]=4 2975 B10R0.91 CCCCCC(=O)NCCC 476273c2f4455ec9a0886335ed7ef341 [1,1,0,0,0,0|1,0,0]=3 2976 B10R0.91 CCCCCC(=O)NCCF 37faddc206bd3b00f66a7e3bde923aa9 [1,1,0,0,0,0|2,0,0]=4 2977 B10R0.91 CCCCCC(=O)NCCI 369522553d6e91903d542a4f6550697a [1,1,0,0,0,0|2,0,0]=4 2978 B10R0.91 CCCCCC(=O)NCCO 92903432fe4eb247c90d29401a47cf8c [1,1,0,0,0,0|2,0,0]=4 2979 B10R0.91 CCCCCC(=O)NCCS 4780dcd137d64b0482a6c8e0700623f7 [1,1,0,0,0,0|2,0,0]=4 2980 B10R0.91 CCCCNC(=O)CCC#N 93c8bdd209851ca74100c559d61cba00 [1,1,0,0,0,0|1,0,1]=4 2981 B10R0.91 CCCCNC(=O)CCC=O 16ee83c32f77bd6cec353975767c82cb [1,1,0,0,0,0|1,0,1]=4 2982 B10R0.91 CCCCNC(=O)CCCC 5b6c1a774ebc9cf6b3cca95003cc944e [1,1,0,0,0,0|1,0,0]=3 2983 B10R0.91 CCCCNC(=O)CCCF 2018023c6b79f86bf88e0ae98d70f56e [1,1,0,0,0,0|1,0,0]=3 2984 B10R0.91 CCCCNC(=O)CCCS 1acf0f095503723b4d5b3e9341583954 [1,1,0,0,0,0|1,0,0]=3 2985 B10R0.91 CCCCNC(=O)CCOC 6f0c7655b0241fead5cc4be83519576f [1,1,0,0,0,0|1,0,0]=3 2986 B10R0.91 CCCCNC(=O)CCSC 6faaa951076ffc1f5066685857593ae9 [1,1,0,0,0,0|1,0,0]=3 2987 B10R0.91 CCCCNC(=O)CNCC c8a7f81d189a0f129789cdd44548f084 [1,1,0,0,0,0|1,0,0]=3 2988 B10R0.91 CCCCNC(=O)CNCF db89eb86f902596dde56fd91da4f9feb [1,1,0,0,0,0|2,0,0]=4 2989 B10R0.91 CCCCNC(=O)CNCO 4a393d383ee0c344b4ad1ec1b76c773b [1,1,0,0,0,0|2,0,0]=4 2990 B10R0.91 CCCCNC(=O)COCC cfe07acc4d092a3a207ae22828e3982e [1,1,0,0,0,0|1,0,0]=3 2991 B10R0.91 CCCCNC(=O)CSCC 833d758cb45613aad283ee5c135a2097 [1,1,0,0,0,0|1,0,0]=3 2992 B10R0.91 CCCCNC(=O)CSSC f360af222a3dccfabe61f8306373bde8 [1,1,0,0,0,0|2,0,0]=4 2993 B10R0.91 CCCCNC(=O)NCCC 3b1fa47b4b47d4900a6dc31a059123bf [1,1,0,0,0,0|1,0,0]=3 2994 B10R0.91 CCCCNC(=O)NCCF a47ebad6a4344a8cd6d64af41a55ef59 [1,1,0,0,0,0|2,0,0]=4 2995 B10R0.91 CCCCNC(=O)NCCN e4608c7e9103e64951b3b3e91bede52b [1,1,0,0,0,0|2,0,0]=4 2996 B10R0.91 CCCCNC(=O)NCCO 5ce976866a1b734a0c37601e6cd8a545 [1,1,0,0,0,0|2,0,0]=4 2997 B10R0.91 CCCCNC(=O)NCCS 811b9b16ef161d504f08855ff40cdae4 [1,1,0,0,0,0|2,0,0]=4 2998 B10R0.91 CCCCNC(=S)NCCC 2d59550982b008190310ae7fe640daa6 [1,1,0,0,0,0|1,1,0]=4 2999 B10R0.91 CCCCOC(=O)CNC#N 3f5aebe0994aba595c40caa3af8ca29b [1,1,0,0,0,0|1,0,1]=4 3000 B10R0.91 CCCCOC(=O)COCC d484bc8a8e1cb9f1bc7a12a52a402449 [1,1,0,0,0,0|0,0,0]=2 3001 B10R0.91 CCCCOC(=O)COCF 977c18c762e99407307de342070f2942 [1,1,0,0,0,0|1,0,0]=3 3002 B10R0.91 CCCCOC(C)CCCC 7752635d00cac0640dd2ec5dbf9e52a3 [1,1,0,0,0,0|1,0,1]=4 3003 B10R0.91 CCCCOC(C)CCOC ab13b185c3300f9772932662841bc2bf [1,1,0,0,0,0|1,0,1]=4 3004 B10R0.91 CCCCOC(C)CCSC 06224d71643498deb86013866ccd3170 [1,1,0,0,0,0|1,0,1]=4 3005 B10R0.91 CCCCOC(C)COCC af6114043e10ad13d96eda72b033e314 [1,1,0,0,0,0|1,0,1]=4 3006 B10R0.91 CCCCO[C@@H](C)CCCC c6c923102de856d0f10b7d64a1c257c9 [1,1,0,0,0,0|1,0,1]=4 3007 B10R0.91 CCCCO[C@H](C)CCCC 281397569e3850d5ee5ca2dbdbe8e8e7 [1,1,0,0,0,0|1,0,1]=4 3008 B10R0.91 CCCNC(=O)CCCCF 52b734d8c4d54e3a8a30180636c55039 [1,1,0,0,0,0|2,0,0]=4 3009 B10R0.91 CCCNC(=O)CCCCO 8579912c0ebfc7cd5885587b4db2a847 [1,1,0,0,0,0|2,0,0]=4 3010 B10R0.91 CCCNC(=O)CCCCS 835528c0eae9e13b3d035166dc558ccf [1,1,0,0,0,0|2,0,0]=4 3011 B10R0.91 CCCNC(=O)CCCOC a5e2d1ac29c442ac5d22076049e634e1 [1,1,0,0,0,0|2,0,0]=4 3012 B10R0.91 CCCNC(=O)CCCSC aa203c0b5604f7443b39ec139b1594a1 [1,1,0,0,0,0|2,0,0]=4 3013 B10R0.91 CCCNC(=O)CCOCC 346f5ddb484887d61ec41ac0a6570f48 [1,1,0,0,0,0|2,0,0]=4 3014 B10R0.91 CCCNC(=O)CCSCC 6fe01c91f2feda5344fc25c7a6443960 [1,1,0,0,0,0|2,0,0]=4 3015 B10R0.91 CCCNC(=O)COCCC 5ab770845b9dc23dab9a6ba7b394ac07 [1,1,0,0,0,0|2,0,0]=4 3016 B10R0.91 CCCNC(=O)CSCCC c50ee73842a3ee50027f989f32b96f00 [1,1,0,0,0,0|2,0,0]=4 3017 B10R0.91 CCCNC(=O)NCCCN 0bf407d5632b4101f8cf633915f4e96d [1,1,0,0,0,0|2,0,0]=4 3018 B10R0.91 CCCNC(=O)NCCCO 63a6a2a86470ccd63a7e40c0827e9a44 [1,1,0,0,0,0|2,0,0]=4 3019 B10R0.91 CCCNC(=O)NCCOC c16b91ad1ebe777bb6a620f9870cf478 [1,1,0,0,0,0|2,0,0]=4 3020 B10R0.91 CCCNC(=O)NCCSC 049f212894e8dccddc3ee91084c21bf8 [1,1,0,0,0,0|2,0,0]=4 3021 B10R0.91 CCCNCC(=O)CCSC e99b18891702742d95fcbf5b0385ae01 [1,1,0,0,0,0|2,0,0]=4 3022 B10R0.91 CCCNCC(=O)NCCC 78f724898d671a946b9a4cbff0b855a1 [1,1,0,0,0,0|2,0,0]=4 3023 B10R0.91 CCCNCC(=O)OCCC 9e84091f29a5e60de22e3fa48f4a379f [1,1,0,0,0,0|2,0,0]=4 3024 B10R0.91 CCCOC(=O)CCOCC eb2288e0eb1e17d54ff3e8eb454761b3 [1,1,0,0,0,0|2,0,0]=4 3025 B10R0.91 CCCOCC(=O)CCSC 804bf7535409b65ab8bc61b4a21bc9b3 [1,1,0,0,0,0|2,0,0]=4 3026 B10R0.91 CCCOCC(=O)OCCC fd9823e87b4eb570e52bf2a10033572b [1,1,0,0,0,0|2,0,0]=4 3027 B10R0.91 CCOCC(=O)NCCCCl 1c5fe844ec1f78a372588a0dd9ba19e2 [1,1,0,0,0,0|2,0,0]=4 3028 B10R0.91 CCOCC(=O)NCCCO 73ecebf06bfaf05fcf351a839b737112 [1,1,0,0,0,0|2,0,0]=4 3029 B10R0.91 CCOCC(=O)NCCOC 6a17a354ed9d99dcdb3aee364e835bce [1,1,0,0,0,0|2,0,0]=4 3030 B10R0.91 CCOCC(=O)NCCSC 69b0e7bd02a25fede9c9260a702a20b4 [1,1,0,0,0,0|2,0,0]=4 3031 B10R0.91 CCSCC(=O)NCCCCl 16619a0caa424666c6a59d8f3ab7a63a [1,1,0,0,0,0|2,0,0]=4 3032 B10R0.91 CCSCC(=O)NCCCO 17a32710ac22e4a99af6a47df5d1b9d2 [1,1,0,0,0,0|2,0,0]=4 3033 B10R0.91 CCSCC(=O)NCCOC 39ec8b303fe26850fbaaa3dbc59d7c39 [1,1,0,0,0,0|2,0,0]=4 3034 B10R0.91 CCSCC(=O)NCCSC bda454679b331580e1a1c31d63580097 [1,1,0,0,0,0|2,0,0]=4 3035 B10R0.91 COCCC(=O)NCCCCl 4cfc99097fc092f2d3271625aa77c24c [1,1,0,0,0,0|2,0,0]=4 3036 B10R0.91 COCCC(=O)NCCCO 60610cf07fc72f4151953b16ec38236a [1,1,0,0,0,0|2,0,0]=4 3037 B10R0.91 COCCC(=O)NCCSC c1e50ed9f2fce5df6afae47fcc81580f [1,1,0,0,0,0|2,0,0]=4 3038 B10R0.91 COCCNC(=O)CCCF bb675c74f1478f8cc484cd546eb95196 [1,1,0,0,0,0|2,0,0]=4 3039 B10R0.91 COCCNC(=O)CCCS 1bc83e37b979e45d1459dfaccae155a3 [1,1,0,0,0,0|2,0,0]=4 3040 B10R0.91 COCCNC(=O)CCOC 49628ed3613ea8f314910694a3e08343 [1,1,0,0,0,0|2,0,0]=4 3041 B10R0.91 COCCNC(=O)CCSC d79753d91e2bd15e05ce9e83e2d1fe01 [1,1,0,0,0,0|2,0,0]=4 3042 B10R0.91 CSCCC(=O)NCCCCl 24c9dcf0018a36e9a6aa8e98018a7181 [1,1,0,0,0,0|2,0,0]=4 3043 B10R0.91 CSCCC(=O)NCCCO c311576971c5628c54601762b2c2ff76 [1,1,0,0,0,0|2,0,0]=4 3044 B10R0.91 CSCCNC(=O)CCCF bc6e3b87addd1d5ae083441932958941 [1,1,0,0,0,0|2,0,0]=4 3045 B10R0.91 CSCCNC(=O)CCCS ab3470d66a5f0a54e6803ed4542a106f [1,1,0,0,0,0|2,0,0]=4 3046 B10R0.91 CSCCNC(=O)CCSC 4d9fd7d13b8966be8fbf009ce35931e0 [1,1,0,0,0,0|2,0,0]=4 3047 B10R0.91 O=C(CCCF)NCCCCl 2aa5c38e88c915e3b0f70c9a9fb205e3 [1,1,0,0,0,0|2,0,0]=4 3048 B10R0.91 O=C(CCCF)NCCCO 53b45cc0798c01ecdd0a631d3019c370 [1,1,0,0,0,0|2,0,0]=4 3049 B10R0.91 O=C(CCCS)NCCCCl e08b728979d13cb529e767a0ec246a93 [1,1,0,0,0,0|2,0,0]=4 3050 B10R0.91 O=C(CCCS)NCCCO 09206a1384d82aefe8cc7f5957fb30d6 [1,1,0,0,0,0|2,0,0]=4 3051 B10R0.108 C=C(CC)COC(=S)CCC bf55b49fe60fc523463d8bd9840fab01 [1,1,0,0,0,0|0,1,1]=4 3052 B10R0.108 CCC(C)CNC(=O)CCF 90b38ea11e2854365f1896ee9544b73d [1,1,0,0,0,0|2,0,0]=4 3053 B10R0.108 CCC(C)CNC(=O)CCO 5f206f039df278a75b56b0edae95b828 [1,1,0,0,0,0|2,0,0]=4 3054 B10R0.108 CCC(C)CNC(=O)CCS de5977d5673b4c0680bdffdb9b8ab0a7 [1,1,0,0,0,0|2,0,0]=4 3055 B10R0.108 CCC(C)CNC(=O)COC 78e2c0ce9040fe760a4cd8f80bf92bee [1,1,0,0,0,0|2,0,0]=4 3056 B10R0.108 CCC(C)CNC(=O)CSC 0d636f102a10f14e93ff6aff78c1a81a [1,1,0,0,0,0|2,0,0]=4 3057 B10R0.108 CCC(O)CNC(=O)CCF 3866eb9117ae829aeda688427bd4a86c [1,1,0,0,0,0|2,0,0]=4 3058 B10R0.108 CCC(O)CNC(=O)CCO bde11ebc6991f24eaea387ae244053c1 [1,1,0,0,0,0|2,0,0]=4 3059 B10R0.108 CCC(O)CNC(=O)CCS 4c6f2a1cde2251899f8ff0130fb68fb3 [1,1,0,0,0,0|2,0,0]=4 3060 B10R0.108 CCC(O)CNC(=O)COC 38158b49d948454e666fc21da10af1ab [1,1,0,0,0,0|2,0,0]=4 3061 B10R0.108 CCC(O)CNC(=O)CSC d1ea3886a493afdb60d22c58d9d5466e [1,1,0,0,0,0|2,0,0]=4 3062 B10R0.108 CCCC(=O)CNC(C)CC a628358924cf0b79502e0c17fcc59c4d [1,1,0,0,0,0|2,0,0]=4 3063 B10R0.108 CCCC(=O)CN[C@@H](C)CC e2297104809933b73fd319df0c337fbc [1,1,0,0,0,0|2,0,0]=4 3064 B10R0.108 CCCC(=O)CN[C@H](C)CC c3c6970e7c9f8cda9a95ac382a74d40d [1,1,0,0,0,0|2,0,0]=4 3065 B10R0.108 CCCC(=O)COC(C)CC 1256581baab2cd6985d50630ae332d34 [1,1,0,0,0,0|2,0,0]=4 3066 B10R0.108 CCCC(=O)CO[C@@H](C)CC d5dc5c90cafeede78ef651f2739a6258 [1,1,0,0,0,0|2,0,0]=4 3067 B10R0.108 CCCC(=O)CO[C@H](C)CC 1bd012501e9168658d73d06f9bb542ff [1,1,0,0,0,0|2,0,0]=4 3068 B10R0.108 CCCC(=O)NCC(Br)CBr eadbb2e43f5ff4980ce187bf00337279 [1,1,0,0,0,0|2,0,0]=4 3069 B10R0.108 CCCC(=O)NCC(C)CC 11a7d7b226318edbbf3f3676dccd97fc [1,1,0,0,0,0|1,0,0]=3 3070 B10R0.108 CCCC(=O)NCC(C)CO b78a36e813fb23c724929b442391aec1 [1,1,0,0,0,0|2,0,0]=4 3071 B10R0.108 CCCC(=O)NCC(F)CO e82acb7919e86cb5e0430b08f0a89d08 [1,1,0,0,0,0|2,0,0]=4 3072 B10R0.108 CCCC(=O)NCC(O)CC e1547e4df4f917bb79a24b5c3077c899 [1,1,0,0,0,0|1,0,0]=3 3073 B10R0.108 CCCC(=O)NCC(O)CO 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01afb188b1f393a85fea7cdbdfc7bfd7 [1,1,0,0,0,0|0,1,1]=4 3085 B10R0.108 CCCC(=S)OCC(C)CC e16cb751e3d09d9ad5b0df3db569de2c [1,1,0,0,0,0|0,1,0]=3 3086 B10R0.108 CCCC(=S)OCC(C)OC 6ba014b10c29da1d7d503d5654250e7d [1,1,0,0,0,0|1,1,0]=4 3087 B10R0.108 CCCC(=S)OCC(O)CO 186815b68a0f877af9b3f122e60bdaeb [1,1,0,0,0,0|1,1,0]=4 3088 B10R0.108 CCCC(=S)OC[C@@H](C)CC 19d37b226cb00bbdb75e432dcb10b8d2 [1,1,0,0,0,0|0,1,0]=3 3089 B10R0.108 CCCC(=S)OC[C@@H](C)OC 3dd6a3a6272ad2c48b9ca15a066415ec [1,1,0,0,0,0|1,1,0]=4 3090 B10R0.108 CCCC(=S)OC[C@@H](O)CO ef83682773bde37361c2868b04abc773 [1,1,0,0,0,0|1,1,0]=4 3091 B10R0.108 CCCC(=S)OC[C@H](C)CC 44ca62e53a524d9067426b0ec06152ea [1,1,0,0,0,0|0,1,0]=3 3092 B10R0.108 CCCC(=S)OC[C@H](C)OC 64650b05baac2a1fa06923187e68315f [1,1,0,0,0,0|1,1,0]=4 3093 B10R0.108 CCCC(=S)OC[C@H](O)CO 9119789ac71cabd965f6cf8e6c8cd017 [1,1,0,0,0,0|1,1,0]=4 3094 B10R0.108 CCCC(C)OCC(C)CC e5093c89c1432d4a9155e79086c96b90 [1,1,0,0,0,0|1,0,1]=4 3095 B10R0.108 CCCC(C)OC[C@@H](C)CC 980c0b26db6bf70f2741ca1d3a165335 [1,1,0,0,0,0|1,0,1]=4 3096 B10R0.108 CCCC(C)OC[C@H](C)CC 4e28d4c4d380c41714d33e0ac3b70f94 [1,1,0,0,0,0|1,0,1]=4 3097 B10R0.108 CCC[C@@H](C)OCC(C)CC 3ee25dc6150f736c1e3e271643b5c87e [1,1,0,0,0,0|1,0,1]=4 3098 B10R0.108 CCC[C@@H](C)OC[C@@H](C)CC fdcb8b65860830c130b999bcb0d32d2f [1,1,0,0,0,0|1,0,1]=4 3099 B10R0.108 CCC[C@@H](C)OC[C@H](C)CC 2fffe216c57a18bcda16467753d64f9f [1,1,0,0,0,0|1,0,1]=4 3100 B10R0.108 CCC[C@H](C)OCC(C)CC 23eaaebe326cebeada9fc66cd7cb418a [1,1,0,0,0,0|1,0,1]=4 3101 B10R0.108 CCC[C@H](C)OC[C@@H](C)CC 9dc4471d597bb6f320fb2a0034e1c7be [1,1,0,0,0,0|1,0,1]=4 3102 B10R0.108 CCC[C@H](C)OC[C@H](C)CC 25aa255ed1fc427039484b8fb2d2e833 [1,1,0,0,0,0|1,0,1]=4 3103 B10R0.108 CCOC(=O)OCN(C)CC e5cf37d77f8b082fb54d39684c51e485 [1,1,0,0,0,0|2,0,0]=4 3104 B10R0.108 CCSC(=O)OCN(C)CC 9fc08970d76a5d0ea0ab5995d324103b [1,1,0,0,0,0|2,0,0]=4 3105 B10R0.108 CC[C@@H](O)CNC(=O)CCF aaa219a27914bf1d172c54faa3b1e32c [1,1,0,0,0,0|2,0,0]=4 3106 B10R0.108 CC[C@@H](O)CNC(=O)CCO 2e59938b3b6729fe54a07275f5b02997 [1,1,0,0,0,0|2,0,0]=4 3107 B10R0.108 CC[C@@H](O)CNC(=O)CCS 0c3f2f0e6882f8a32156060583b021ff [1,1,0,0,0,0|2,0,0]=4 3108 B10R0.108 CC[C@@H](O)CNC(=O)COC 465ca9adc182a4642396e91f1e782fe8 [1,1,0,0,0,0|2,0,0]=4 3109 B10R0.108 CC[C@@H](O)CNC(=O)CSC 6bdab830640b58d515dc82df2ee50bc1 [1,1,0,0,0,0|2,0,0]=4 3110 B10R0.108 CC[C@H](C)CNC(=O)CCF 1dcb43a6ca27cb1bc9584064523665da [1,1,0,0,0,0|2,0,0]=4 3111 B10R0.108 CC[C@H](C)CNC(=O)CCO f198519df6a38780e5fb42bdf436c71b [1,1,0,0,0,0|2,0,0]=4 3112 B10R0.108 CC[C@H](C)CNC(=O)CCS 810c3a432f8028f2ac0f341ac42d13ea [1,1,0,0,0,0|2,0,0]=4 3113 B10R0.108 CC[C@H](C)CNC(=O)COC 3c99596929b796c1d0fa161c28f4680c [1,1,0,0,0,0|2,0,0]=4 3114 B10R0.108 CC[C@H](C)CNC(=O)CSC 95051d8afb14b977f4244a15a44b6fe0 [1,1,0,0,0,0|2,0,0]=4 3115 B10R0.26 CC(C)C(C)NC(=O)CCF 1679ee833bdf60969aba13b116945252 [0,1,0,0,1,0|2,0,0]=4 3116 B10R0.26 CC(C)C(C)NC(=O)CCO bea2303469e361fb0597e3e0fb4df3e4 [0,1,0,0,1,0|2,0,0]=4 3117 B10R0.26 CC(C)C(C)NC(=O)CCS eff3ca14365e350083d936fac19aa38c [0,1,0,0,1,0|2,0,0]=4 3118 B10R0.26 CC(C)[C@@H](C)NC(=O)CCF 6ab56b1d34b8889bef3a8f8ca8748184 [0,1,0,0,1,0|2,0,0]=4 3119 B10R0.26 CC(C)[C@@H](C)NC(=O)CCO 307394837af0c5d7007ffbba0a2bad62 [0,1,0,0,1,0|2,0,0]=4 3120 B10R0.26 CC(C)[C@@H](C)NC(=O)CCS 237e6a95f9942e37956c5661bfd03772 [0,1,0,0,1,0|2,0,0]=4 3121 B10R0.26 CC(C)[C@H](C)NC(=O)CCF 148719b19d53f26a0ffa6ab1284c194d [0,1,0,0,1,0|2,0,0]=4 3122 B10R0.26 CC(C)[C@H](C)NC(=O)CCO ee00daa5e7e018fb46f49ce63dbfc623 [0,1,0,0,1,0|2,0,0]=4 3123 B10R0.26 CC(C)[C@H](C)NC(=O)CCS 8ee7026667e6c7c1ace6939db8693ec3 [0,1,0,0,1,0|2,0,0]=4 3124 B10R0.26 CCCC(=O)NC(C)C(C)C 5c30641d2fec6b0f47fbf69a6d47e002 [0,1,0,0,1,0|1,0,0]=3 3125 B10R0.26 CCCC(=O)NC(C)C(C)O c42260828cdcf6c64712d6624bcc2315 [0,1,0,0,1,0|2,0,0]=4 3126 B10R0.26 CCCC(=O)N[C@@H](C)C(C)C 9724b0952fc2adfae196293bfad5d499 [0,1,0,0,1,0|1,0,0]=3 3127 B10R0.26 CCCC(=O)N[C@H](C)C(C)C 2825c3ab7c026cd16abaa07e8ff95041 [0,1,0,0,1,0|1,0,0]=3 3128 B10R0.26 CCCC(=S)OC(C)C(C)C 235e7fba72c04fdf8eb08843c0804933 [0,1,0,0,1,0|0,1,0]=3 3129 B10R0.26 CCCC(C)OC(C)C(C)C 58af9ab4c91a9acf807377b7c8dcbd01 [0,1,0,0,1,0|1,0,1]=4 3130 B10R0.26 CCCC(C)O[C@@H](C)C(C)C 7bd6b95124d258013524b240e5db5345 [0,1,0,0,1,0|1,0,1]=4 3131 B10R0.26 CCCC(C)O[C@H](C)C(C)C d0f4c07eb021ae2f6b560c0fb26e4549 [0,1,0,0,1,0|1,0,1]=4 3132 B10R0.26 CCCN(C)CC(C)C(C)C 91cb10a7b1d22c3a9040c5f527ede074 [0,1,0,0,1,0|2,0,0]=4 3133 B10R0.26 CCC[C@@H](C)OC(C)C(C)C 430a5b0069980c0a0d9d268590d8e30f [0,1,0,0,1,0|1,0,1]=4 3134 B10R0.26 CCC[C@H](C)OC(C)C(C)C 63521bf5934a2180b9fcabffcb4ffd0c [0,1,0,0,1,0|1,0,1]=4 3135 B10R0.26 CCNC(=O)CN(C)C(C)C 75b501cca7fb39d9a671bc3af1f160da [0,1,0,0,1,0|2,0,0]=4 3136 B10R0.26 CCOC(=O)CN(C)C(C)C 0abab4be4b5955817bdfb630b11d840d [0,1,0,0,1,0|2,0,0]=4 3137 B10R0.26 COCC(=O)NC(C)C(C)C ce9bcae839ba589366a2a547eb0d026a [0,1,0,0,1,0|2,0,0]=4 3138 B10R0.26 COCC(=O)N[C@@H](C)C(C)C 906c284e210edd0977a02e57f455f3b1 [0,1,0,0,1,0|2,0,0]=4 3139 B10R0.26 COCC(=O)N[C@H](C)C(C)C efe806988beeba7049c267ff9efed0eb [0,1,0,0,1,0|2,0,0]=4 3140 B10R0.26 CSCC(=O)NC(C)C(C)C 7b90385a6e1b974fbc25a03e4c908453 [0,1,0,0,1,0|2,0,0]=4 3141 B10R0.26 CSCC(=O)N[C@@H](C)C(C)C d0ce4735605f571583068f7998a4c12d [0,1,0,0,1,0|2,0,0]=4 3142 B10R0.26 CSCC(=O)N[C@H](C)C(C)C 63b21774ac967eabdbdf3cfa144fd137 [0,1,0,0,1,0|2,0,0]=4 3143 B10R0.27 C#CC(CCC)OCC(C)C b0f3a4096d9a9510e383387c30977d13 [0,1,0,0,1,0|1,0,1]=4 3144 B10R0.27 C=CC(CCC)OCC(C)C 8e06337121743af7c7f57b72fb7b7073 [0,1,0,0,1,0|1,0,1]=4 3145 B10R0.27 CCCC(C#N)OCC(C)C dfe92fe1c9c3797dc8614c1bf47bf93c [0,1,0,0,1,0|1,0,1]=4 3146 B10R0.27 CCCC(CC)OCC(C)C 4bfc2771f8984c92e43cb341a142ffd4 [0,1,0,0,1,0|1,0,1]=4 3147 B10R0.27 CCCN(C=O)CCN(C)C 56165996e67039c21df29a57a4dca808 [0,1,0,0,1,0|2,0,0]=4 3148 B10R0.27 CCCN(CC)CCC(C)C 66d6a63681f2ee00e899d0b208cece44 [0,1,0,0,1,0|2,0,0]=4 3149 B10R0.27 CCC[C@@H](CC)OCC(C)C 790644aa61d9a5d25cbfcc155ca98d55 [0,1,0,0,1,0|1,0,1]=4 3150 B10R0.32 CC(C)CN(C)C(=O)CCF 601b9ab409dbcc31f477bff72b007a26 [0,1,0,0,1,0|2,0,0]=4 3151 B10R0.32 CC(C)CN(C)C(=O)CCO 580af2f180129aa7cb7a8a1ac97582d2 [0,1,0,0,1,0|2,0,0]=4 3152 B10R0.32 CC(C)CN(C)C(=O)CCS 5c94d226469839b37509871e91b6d7a1 [0,1,0,0,1,0|2,0,0]=4 3153 B10R0.32 CCCC(=O)N(C)CC(C)C 7fc1fe91423f4dfb538afc9f42079eef [0,1,0,0,1,0|1,0,0]=3 3154 B10R0.32 CCCC(=O)N(C)CC(C)O 08dcb14694e01049dc74b747a0f30268 [0,1,0,0,1,0|2,0,0]=4 3155 B10R0.32 CCCC(=O)N(C)C[C@H](C)O 2c5cd2f52221591131e2a52c392d55c2 [0,1,0,0,1,0|2,0,0]=4 3156 B10R0.32 CCCN(C)C(C)CC(C)C 7ef4ca28dff42caaa404369d42bc75c3 [0,1,0,0,1,0|2,0,0]=4 3157 B10R0.32 CCNC(=O)C(C)OC(C)C c7ec661729c6eeb392378e15bd89f55d [0,1,0,0,1,0|2,0,0]=4 3158 B10R0.32 CCNC(=O)[C@H](C)NC(C)C b687fbffc2fa33f09a3f0e3a892a3102 [0,1,0,0,1,0|2,0,0]=4 3159 B10R0.32 CCOC(=O)C(C)OC(C)C 40b9466bd1395e3a3d555e7c598a298b [0,1,0,0,1,0|2,0,0]=4 3160 B10R0.32 CCOC(=O)C(F)OC(C)C da583e971ab09e67feb094fb81b2c550 [0,1,0,0,1,0|2,0,0]=4 3161 B10R0.32 CCOC(=O)[C@@H](C)NC(C)C 58fe057280cb20ab629d59f8e607cb2f [0,1,0,0,1,0|2,0,0]=4 3162 B10R0.32 CCOC(=O)[C@@H](C)OC(C)C f58756954883304cfc6dc6e3abcb8407 [0,1,0,0,1,0|2,0,0]=4 3163 B10R0.32 CCOC(=O)[C@H](C)OC(C)C 210f545df21ce04515d9e8777b0da8a8 [0,1,0,0,1,0|2,0,0]=4 3164 B10R0.32 COCC(=O)N(C)CC(C)C 3b4d9e19c1aef88dd6934e2d6654c2a3 [0,1,0,0,1,0|2,0,0]=4 3165 B10R0.32 CSCC(=O)N(C)CC(C)C 054149d7b754f98572e511c7e44de60d [0,1,0,0,1,0|2,0,0]=4 3166 B10R0.96 C=C(C)CC(=O)NCC(C)C 97b041bfbe8ddb250c62d8ac2466b591 [0,1,0,0,1,0|1,0,1]=4 3167 B10R0.96 CC(=O)CC(=O)NCC(C)C 9f6311eeb9a2f874856805de0f6523c8 [0,1,0,0,1,0|1,0,1]=4 3168 B10R0.96 CC(C)CC(=O)COC(C)C 38236af479c7375789667325a90d4c6b [0,1,0,0,1,0|1,0,0]=3 3169 B10R0.96 CC(C)CC(=O)NCC(C)O 12f34b4a0e208c989365fd3dc211b457 [0,1,0,0,1,0|2,0,0]=4 3170 B10R0.96 CC(C)CC(=O)NC[C@@H](C)O 18349716c40e08c644cd05a52083ae17 [0,1,0,0,1,0|2,0,0]=4 3171 B10R0.96 CC(C)CC(=O)NC[C@H](C)O 93d163a074517735963bd037427cfb8e [0,1,0,0,1,0|2,0,0]=4 3172 B10R0.96 CC(C)CCN(C)CC(C)C a6fd8e499c2dd8ac9b8f0080df078f7b [0,1,0,0,1,0|2,0,0]=4 3173 B10R0.96 CC(C)CCN(C)CC(C)O 839a92cb7f2eb1197ee283d59219a7c5 [0,1,0,0,1,0|2,0,0]=4 3174 B10R0.96 CC(C)CCN(C)C[C@@H](C)O 9bcda3064d77e6270e102c86a5be3623 [0,1,0,0,1,0|2,0,0]=4 3175 B10R0.96 CC(C)CCN(C)C[C@H](C)O cf366ba5a388366cd24266a446d559fd [0,1,0,0,1,0|2,0,0]=4 3176 B10R0.96 CC(C)CNC(=O)CC(C)C baf3d6e02e7c9d5a42aaf06a477418e9 [0,1,0,0,1,0|1,0,0]=3 3177 B10R0.96 CC(C)CNC(=O)CC(C)O 2e05e51011957e318f7b50aac8f2aea3 [0,1,0,0,1,0|1,0,0]=3 3178 B10R0.96 CC(C)CNC(=O)CC(F)F d30fa4fa79d720d6dbbab10345145745 [0,1,0,0,1,0|2,0,0]=4 3179 B10R0.96 CC(C)CNC(=O)CN(C)C 8f9e7d999aa876473f4e60c4003af149 [0,1,0,0,1,0|2,0,0]=4 3180 B10R0.96 CC(C)CNC(=O)C[C@@H](C)O d7a72ecc74cbc46104bd299749ab240d [0,1,0,0,1,0|1,0,0]=3 3181 B10R0.96 CC(C)CNC(=O)C[C@H](C)O 03c2de2370737457922f23a5ab1fbd26 [0,1,0,0,1,0|1,0,0]=3 3182 B10R0.96 CC(C)COC(C)CC(C)C f7fe9d39d625349db21e5877f2ec55a2 [0,1,0,0,1,0|1,0,1]=4 3183 B10R0.96 CC(C)CO[C@@H](C)CC(C)C 2fc40254192750a6d61c18053d7eb708 [0,1,0,0,1,0|1,0,1]=4 3184 B10R0.96 CC(C)CO[C@H](C)CC(C)C db487d8db44a723e66990232dcc95c91 [0,1,0,0,1,0|1,0,1]=4 3185 B10R0.96 CC(C)NC(=O)COC(C)C 1d59c8e18d946ef30977d114276acda7 [0,1,0,0,1,0|2,0,0]=4 3186 B10R0.96 CC(C)NCC(=O)NC(C)C 1d8e583bf131415b96d474a9f4c54a0c [0,1,0,0,1,0|2,0,0]=4 3187 B10R0.96 CC(C)OCC(=O)OC(C)C 3f63f30258beb9fb3f3e706ad686c470 [0,1,0,0,1,0|2,0,0]=4 3188 B10R0.96 CC(O)CC(=O)NC[C@@H](C)O 42f31eccf86ba0e3153be90f33c1f97e [0,1,0,0,1,0|2,0,0]=4 3189 B10R0.96 CC(O)CC(=O)NC[C@H](C)O dac369dfc67f44af4b4da6a330ae8e13 [0,1,0,0,1,0|2,0,0]=4 3190 B10R0.96 CC(O)CNC(=O)CC(C)O 36cd7a2b1072e4204164a2ad31b7998e [0,1,0,0,1,0|2,0,0]=4 3191 B10R0.96 CC(O)CNC(=O)C[C@@H](C)O 10f966c3165fd3dd71ab808ce24857b9 [0,1,0,0,1,0|2,0,0]=4 3192 B10R0.96 CC(O)CNC(=O)C[C@H](C)O 692ef6faa1105dfafa615b248e6edd0d [0,1,0,0,1,0|2,0,0]=4 3193 B10R0.96 C[C@@H](O)CNC(=O)C[C@@H](C)O 049c38911741020f9a40b5affbd32f8e [0,1,0,0,1,0|2,0,0]=4 3194 B10R0.96 C[C@H](O)CC(=O)NC[C@@H](C)O 929e8c02a0ddb953803ef7aee434d97b [0,1,0,0,1,0|2,0,0]=4 3195 B10R0.96 C[C@H](O)CNC(=O)C[C@@H](C)O 1782ed0e34e99832e2034b8a7f65c191 [0,1,0,0,1,0|2,0,0]=4 3196 B10R0.96 C[C@H](O)CNC(=O)C[C@H](C)O fd69888406213570f2653d87dc4916ed [0,1,0,0,1,0|2,0,0]=4 3197 B10R0.109 CC(C)(C)CNC(=O)CCF e6167dd53eee34cb9616dbb99468827b [0,1,0,0,1,0|2,0,0]=4 3198 B10R0.109 CC(C)(C)CNC(=O)CCO 7ee8dce3f6b1f7aa8d287420091642a9 [0,1,0,0,1,0|2,0,0]=4 3199 B10R0.109 CC(C)(C)CNC(=O)CCS aa3c7799a1d2aa74a4506621dbb59ace [0,1,0,0,1,0|2,0,0]=4 3200 B10R0.109 CC(C)(O)CNC(=O)CCF 6606329a4cb3a580ecb893386d09ed3f [0,1,0,0,1,0|2,0,0]=4 3201 B10R0.109 CC(C)(O)CNC(=O)CCO cdef1b9b83ab8e03fcaedd06975ad7fd [0,1,0,0,1,0|2,0,0]=4 3202 B10R0.109 CC(C)(O)CNC(=O)CCS 92feef3b28beafe31c8ee63b469bf367 [0,1,0,0,1,0|2,0,0]=4 3203 B10R0.109 CCCC(=O)CNC(C)(C)C 619b814cdd0399dc91268c5fa7d1fe62 [0,1,0,0,1,0|1,0,0]=3 3204 B10R0.109 CCCC(=O)NCC(C)(C)C 6bdb59a085c0b7dddc17efb19d5abcb5 [0,1,0,0,1,0|1,0,0]=3 3205 B10R0.109 CCCC(=O)NCC(C)(C)O 49e784242a045ea565698a849d0a388c [0,1,0,0,1,0|1,0,0]=3 3206 B10R0.109 CCCC(=O)NCC(C)(F)F 2dcfb0654f885dd52929f33b650022fb [0,1,0,0,1,0|2,0,0]=4 3207 B10R0.109 CCCC(=S)OCC(C)(C)C dd579ecdbf0625a6c0c09151023b24e1 [0,1,0,0,1,0|0,1,0]=3 3208 B10R0.109 CCCC(=S)OCC(C)(C)F fd63e236373e00b2c36139f67d5be866 [0,1,0,0,1,0|0,1,0]=3 3209 B10R0.109 CCCC(=S)OCC(C)(C)O 1249c99c738621001c618161dbb86f31 [0,1,0,0,1,0|0,1,0]=3 3210 B10R0.109 CCCC(=S)OCC(C)(F)F b04ad6aa4c750ce9ce68e3dda5c8751c [0,1,0,0,1,0|1,1,0]=4 3211 B10R0.109 CCCC(C)OCC(C)(C)Br d29160461c3dd24427f4f7e6686cedae [0,1,0,0,1,0|1,0,1]=4 3212 B10R0.109 CCCC(C)OCC(C)(C)C c53fba7ccb51a59be2ae52a613556ac7 [0,1,0,0,1,0|1,0,1]=4 3213 B10R0.109 CCCC(C)OCC(C)(C)F a14e8596f0dfc032d8df80a37275f7e2 [0,1,0,0,1,0|1,0,1]=4 3214 B10R0.109 CCCC(C)OCC(C)(C)O 011241aed2f11c4fc6d76794cd2e4e7b [0,1,0,0,1,0|1,0,1]=4 3215 B10R0.109 CCCC(C)OCC(C)(C)S bc91517378e00add7c9538190ab870be [0,1,0,0,1,0|1,0,1]=4 3216 B10R0.109 CCCN(C)CCC(C)(C)C 0278615517aa9255bf8041f1a5c7d6f3 [0,1,0,0,1,0|2,0,0]=4 3217 B10R0.109 CCCN(C)CCC(C)(C)O d9c49cc6a9b7e8e776bba76b256d4931 [0,1,0,0,1,0|2,0,0]=4 3218 B10R0.109 CCC[C@@H](C)OCC(C)(C)C f8e967aacc5b1847d795eabc6c44f7ea [0,1,0,0,1,0|1,0,1]=4 3219 B10R0.109 CCC[C@@H](C)OCC(C)(C)F a105746a59f47e1be788ab884cd0c29b [0,1,0,0,1,0|1,0,1]=4 3220 B10R0.109 CCC[C@@H](C)OCC(C)(C)O 1269b514678b8ae34725db9ad872148b [0,1,0,0,1,0|1,0,1]=4 3221 B10R0.109 CCC[C@H](C)OCC(C)(C)C 4850c07f0d4b81ce17f82b42d31e6050 [0,1,0,0,1,0|1,0,1]=4 3222 B10R0.109 CCC[C@H](C)OCC(C)(C)F e9993c5897e615977680b5f2650a6854 [0,1,0,0,1,0|1,0,1]=4 3223 B10R0.109 CCC[C@H](C)OCC(C)(C)O 0359b35339de4550174ecd659c59cad0 [0,1,0,0,1,0|1,0,1]=4 3224 B10R0.109 CCNC(=O)CNC(C)(C)C 60c1b2791a4535c6d64854517c210b4e [0,1,0,0,1,0|2,0,0]=4 3225 B10R0.109 CCOC(=O)CNC(C)(C)C 6f62d8404b51fbaf0519a18c84ae52f2 [0,1,0,0,1,0|2,0,0]=4 3226 B10R0.109 COCC(=O)CNC(C)(C)C c3d7281b6a04301e962479f47cfaf377 [0,1,0,0,1,0|2,0,0]=4 3227 B10R0.109 COCC(=O)NCC(C)(C)C 61b3ab40db557ec6e10839bc9c1a1f5d [0,1,0,0,1,0|2,0,0]=4 3228 B10R0.109 COCC(=O)NCC(C)(C)O 5a60d325a30bb6a93cfc7b88d42e4db5 [0,1,0,0,1,0|2,0,0]=4 3229 B10R0.109 CSCC(=O)NCC(C)(C)C c13dfb296239b669a82a219f201fbeae [0,1,0,0,1,0|2,0,0]=4 3230 B10R0.109 CSCC(=O)NCC(C)(C)O 4505258d89102a99af0c31e2b94d31e9 [0,1,0,0,1,0|2,0,0]=4 3231 B12R0.54 C=C(CCC)C(=O)NCCC(C)C 802d3ad2a6d5a944a22f414f9c7fbf8d [0,1,0,0,0,1|2,0,0]=4 3232 B12R0.54 C=C(CNCC(C)C)C(=O)OCC c08dad919ece587d173226973f564c70 [0,1,0,0,0,1|2,0,0]=4 3233 B12R0.54 C=C(COCC(C)C)C(=O)OCC 77ed3448361594ea37472cbf42870fe3 [0,1,0,0,0,1|2,0,0]=4 3234 B12R0.54 CC(C)OCCN(C)C(=O)CCF bbc19bc8b026f49e1328b4657fd23c09 [0,1,0,0,0,1|2,0,0]=4 3235 B12R0.54 CC(C)OCCN(C)C(=O)CCO 2dff103d05244f4672226d7becc3fc7d [0,1,0,0,0,1|2,0,0]=4 3236 B12R0.54 CC(C)OCCN(C)C(=O)CCS cf3581ef19dc3f7b802ce55482dfa644 [0,1,0,0,0,1|2,0,0]=4 3237 B12R0.54 CCCC(=O)C(=O)NCCC(C)C 80c117f31127e42888087206a3f6ae55 [0,1,0,0,0,1|1,0,0]=3 3238 B12R0.54 CCCC(=O)C(=O)NCCC(C)O 322acc277823e80a025934f322d5a776 [0,1,0,0,0,1|2,0,0]=4 3239 B12R0.54 CCCC(=O)C(=O)NCCN(C)C 2cbe2c7821f509b06ee99a9a4d7f26fb [0,1,0,0,0,1|2,0,0]=4 3240 B12R0.54 CCCC(=O)C(=O)NCC[C@@H](C)O 59793354d079ffec2c6c471c19d46857 [0,1,0,0,0,1|2,0,0]=4 3241 B12R0.54 CCCC(=O)C(=O)NCC[C@H](C)O bbef738340f5e10d3ade96583fef06a3 [0,1,0,0,0,1|2,0,0]=4 3242 B12R0.54 CCCC(=O)N(C)CCCN(C)C f15e3615b672f1609eb01434f3b4ee16 [0,1,0,0,0,1|2,0,0]=4 3243 B12R0.54 CCCC(=O)N(C)CCOC(C)C 75ad5931a8f27bd2a77a249273c3b7d9 [0,1,0,0,0,1|1,0,0]=3 3244 B12R0.54 CCNC(=O)C(=O)NCCC(C)C 04e28b58acba69e362d7014a41076f8b [0,1,0,0,0,1|2,0,0]=4 3245 B12R0.54 CCNC(=O)C(C)NCCC(C)C 8d2899fac1eceedde41df0f4f5f4808f [0,1,0,0,0,1|2,0,0]=4 3246 B12R0.54 CCNC(=O)C(C)OCCC(C)C 235d596abbcba51290665ef4de997f01 [0,1,0,0,0,1|1,0,0]=3 3247 B12R0.54 CCNC(=O)C(C)OCCN(C)C b9dc29684f8dba27c9134dce36700dd4 [0,1,0,0,0,1|2,0,0]=4 3248 B12R0.54 CCNC(=O)[C@H](C)NCCC(C)C 9f457c1cdbc5c09866bf223adfb09aed [0,1,0,0,0,1|2,0,0]=4 3249 B12R0.54 CCOC(=O)C(=O)NCCC(C)C 534a19ed113a12416e767f48bbb64102 [0,1,0,0,0,1|2,0,0]=4 3250 B12R0.54 CCOC(=O)C(C)CNCC(C)C 717e2d1df069029a1bad9c0d1d82753c [0,1,0,0,0,1|2,0,0]=4 3251 B12R0.54 CCOC(=O)C(C)COCC(C)C 81598a18699ecd45b9881a6995ba49d6 [0,1,0,0,0,1|2,0,0]=4 3252 B12R0.54 CCOC(=O)C(C)NCCC(C)C 99b4e50529a922f65270b7413dd3df2f [0,1,0,0,0,1|2,0,0]=4 3253 B12R0.54 CCOC(=O)C(C)OCCC(C)C 6989ad0a9f2f1b9cc4e0532c2aade4d0 [0,1,0,0,0,1|1,0,0]=3 3254 B12R0.54 CCOC(=O)C(C)OCCN(C)C 7f381ce913cb7565212648d1da17ddd2 [0,1,0,0,0,1|2,0,0]=4 3255 B12R0.54 CCOC(=O)C(C)OCOC(C)C e1edf2e34fc08b7fa16665735895a661 [0,1,0,0,0,1|2,0,0]=4 3256 B12R0.54 CCOC(=O)C(F)NCCC(C)C 5f23c91023301bee372e7a64af4341e5 [0,1,0,0,0,1|2,0,0]=4 3257 B12R0.54 CCOC(=O)C(F)OCCC(C)C beb3d60a5394d63272c69c782f9dfb86 [0,1,0,0,0,1|1,0,0]=3 3258 B12R0.54 CCOC(=O)C(F)OCCN(C)C c25075c06db49bf4888ec0ea7b3eebfc [0,1,0,0,0,1|2,0,0]=4 3259 B12R0.54 CCOC(=O)C(O)CNCC(C)C 3468480155825cef3cd2ba96f7de1177 [0,1,0,0,0,1|2,0,0]=4 3260 B12R0.54 CCOC(=O)[C@@H](C)NCCC(C)C 44134956c484b1f7c1db7ef5171562d1 [0,1,0,0,0,1|2,0,0]=4 3261 B12R0.54 CCOC(=O)[C@@H](C)OCCC(C)C 83a9a9b8b2d21a9014162ed7d0417f97 [0,1,0,0,0,1|1,0,0]=3 3262 B12R0.54 CCOC(=O)[C@@H](C)OCCN(C)C c806259bf554c176af38785f4da61486 [0,1,0,0,0,1|2,0,0]=4 3263 B12R0.54 CCOC(=O)[C@@H](C)OCOC(C)C 0162496bf451c44e054f79425227014a [0,1,0,0,0,1|2,0,0]=4 3264 B12R0.54 CCOC(=O)[C@H](C)NCCC(C)C 9cdcb25a379ba05c8b8ff12df069e0e3 [0,1,0,0,0,1|2,0,0]=4 3265 B12R0.54 CCOC(=O)[C@H](C)OCCC(C)C 27a79240f17c33a7d6f717b72d779ca3 [0,1,0,0,0,1|1,0,0]=3 3266 B12R0.54 CCOC(=O)[C@H](C)OCCN(C)C 0b07aa277202b84f1d61fb305c1cdf1b [0,1,0,0,0,1|2,0,0]=4 3267 B12R0.54 CCOC(=O)[C@H](C)OCOC(C)C 9ecfabf31a0fd21029b49ae4e86d8bf3 [0,1,0,0,0,1|2,0,0]=4 3268 B12R0.54 COCC(=O)N(C)CCOC(C)C 98e2a3c236fcc8b872f5bb6218431967 [0,1,0,0,0,1|2,0,0]=4 3269 B12R0.54 CSCC(=O)N(C)CCOC(C)C 0f740db62c956209e8d2d390b3fd089d [0,1,0,0,0,1|2,0,0]=4 3270 B12R0.72 CC(C)(C)CCCNC(=O)CCF e9d4750133ee36c9bc8ca945bed0de72 [0,1,0,0,0,1|2,0,0]=4 3271 B12R0.72 CC(C)(C)CCCNC(=O)CCO ffbb2c67e92a51c71218d877b69eccfd [0,1,0,0,0,1|2,0,0]=4 3272 B12R0.72 CC(C)(C)CCCNC(=O)CCS fe1c7dbb0258e0ac109a5ea8234ae2d5 [0,1,0,0,0,1|2,0,0]=4 3273 B12R0.72 CC(C)(C)OCCNC(=O)CCF 0f011db7a8ed03a6baf1edafb5f6bf19 [0,1,0,0,0,1|2,0,0]=4 3274 B12R0.72 CC(C)(C)OCCNC(=O)CCO 721850b09144f6605130fcd1204f3fad [0,1,0,0,0,1|2,0,0]=4 3275 B12R0.72 CC(C)(C)OCCNC(=O)CCS 6e8756b641e63ad97cf9785bd85ea063 [0,1,0,0,0,1|2,0,0]=4 3276 B12R0.72 CC(C)(C)SCCNC(=O)CCF 21a489b856fde2f5191c08855cabb985 [0,1,0,0,0,1|2,0,0]=4 3277 B12R0.72 CC(C)(C)SCCNC(=O)CCO 256260ad5be1dc613d08544e548ea945 [0,1,0,0,0,1|2,0,0]=4 3278 B12R0.72 CC(C)(C)SCCNC(=O)CCS f7268f2006c7db21dd64fe7aae64dd31 [0,1,0,0,0,1|2,0,0]=4 3279 B12R0.72 CC(C)(O)CCCNC(=O)CCF fd600fae38c21bc90ea1566782dd18d6 [0,1,0,0,0,1|2,0,0]=4 3280 B12R0.72 CC(C)(O)CCCNC(=O)CCO e39cce245eb42c3b27df3693b0c38022 [0,1,0,0,0,1|2,0,0]=4 3281 B12R0.72 CC(C)(O)CCCNC(=O)CCS bf7cc11d1feb247314e16699a0829f9d [0,1,0,0,0,1|2,0,0]=4 3282 B12R0.72 CCCC(=O)CNCCC(C)(C)C 6e49dce4b4120b04bc874744dbda8001 [0,1,0,0,0,1|1,0,0]=3 3283 B12R0.72 CCCC(=O)CNCCC(C)(C)F f0724971095ed0e6ae86eb77223606d2 [0,1,0,0,0,1|1,0,0]=3 3284 B12R0.72 CCCC(=O)CNCCC(C)(C)O 518816e6bb13b8a91898d06182d3e717 [0,1,0,0,0,1|1,0,0]=3 3285 B12R0.72 CCCC(=O)COCCC(C)(C)C 7bcafe54e04e7d6da17d1cfb57b85361 [0,1,0,0,0,1|0,0,0]=2 3286 B12R0.72 CCCC(=O)COCCC(C)(C)S c8d0ec0778f711f6f8dbe5d20cc38d85 [0,1,0,0,0,1|0,0,0]=2 3287 B12R0.72 CCCC(=O)COCCC(C)(F)F 2a8b94cb200eb9301b4d02f0fefdcdde [0,1,0,0,0,1|1,0,0]=3 3288 B12R0.72 CCCC(=O)COCCC(F)(F)F dc17fa78e095c7b0a0dad2ba2557fd26 [0,1,0,0,0,1|2,0,0]=4 3289 B12R0.72 CCCC(=O)COCCS(=N)(=O)C 2721132a171b23dba999b3376053e3c8 [0,1,0,0,0,1|2,0,0]=4 3290 B12R0.72 CCCC(=O)COCCS(=O)(=O)C ec696172538a947ef60a753fd881ab1f [0,1,0,0,0,1|2,0,0]=4 3291 B12R0.72 CCCC(=O)NCC#CC(C)(C)C 37f56109663d7f61ee51b320d01ffc47 [0,1,0,0,0,1|1,0,1]=4 3292 B12R0.72 CCCC(=O)NCCCC(C)(C)C 56b24197ef9b1faa1b574ef8416a9287 [0,1,0,0,0,1|1,0,0]=3 3293 B12R0.72 CCCC(=O)NCCCC(C)(C)O 333acbffe143156fd9fe509d7213535d [0,1,0,0,0,1|1,0,0]=3 3294 B12R0.72 CCCC(=O)NCCOC(C)(C)C 8fbd9f93a6ceed6bc62bb818e76f4ba5 [0,1,0,0,0,1|1,0,0]=3 3295 B12R0.72 CCCC(=O)NCCSC(C)(C)C 6f11abdb61b8f272bb384f394065295d [0,1,0,0,0,1|1,0,0]=3 3296 B12R0.72 CCCC(=O)OCNCC(C)(C)C 1bd91fd90cb10eff76b0051003f9b40e [0,1,0,0,0,1|0,0,0]=2 3297 B12R0.72 CCCC(=O)OCNCC(C)(C)O d42dc0dad2b7c2555de55bb58d24805e [0,1,0,0,0,1|0,0,0]=2 3298 B12R0.72 CCCC(=O)OCOCC(C)(C)Br 4628c8649c6dea4e22b20c9af959280f [0,1,0,0,0,1|0,0,0]=2 3299 B12R0.72 CCCC(=O)OCOCC(C)(C)C 0a04090c46f5637550ffa0e877525784 [0,1,0,0,0,1|0,0,0]=2 3300 B12R0.72 CCCC(=O)OCOCC(C)(C)S e844084d71c96f0ac723fd171e666a78 [0,1,0,0,0,1|0,0,0]=2 3301 B12R0.72 CCCC(=O)OCOCC(F)(F)Br 91cbeef2d281f9e167697348217633c5 [0,1,0,0,0,1|2,0,0]=4 3302 B12R0.72 CCCC(=S)OCC#CC(C)(C)C f2d5fc2958fc8050d88e23a9656d6c46 [0,1,0,0,0,1|0,1,1]=4 3303 B12R0.72 CCCC(=S)OCCCC(C)(C)O 01361770761edace9aa7fad01aee9ba9 [0,1,0,0,0,1|0,1,0]=3 3304 B12R0.72 CCCC(=S)OCCCC(C)(F)F b7cbef6122f0628222cf84906f677d5f [0,1,0,0,0,1|1,1,0]=4 3305 B12R0.72 CCCC(=S)OCCOC(C)(C)C 28e689bb8ad1411b385f5a825015beff [0,1,0,0,0,1|0,1,0]=3 3306 B12R0.72 CCCC(=S)OCCSC(C)(C)C 45f1d959e97cea2815a8297acfb40e34 [0,1,0,0,0,1|0,1,0]=3 3307 B12R0.72 CCCC(C)COCCC(C)(C)C bbe5ea576c0e2ec347421dbdda5662c9 [0,1,0,0,0,1|1,0,1]=4 3308 B12R0.72 CCCC(C)COCCC(C)(C)O 6b96b0602d202f24720469a996e5d36d [0,1,0,0,0,1|1,0,1]=4 3309 B12R0.72 CCCC(C)COCCC(C)(C)S a9c98d9a5261b705075820cd567588b3 [0,1,0,0,0,1|1,0,1]=4 3310 B12R0.72 CCCC(C)OCCCC(C)(C)C 40f767be22fbb561744e7cb6397f6bbe [0,1,0,0,0,1|1,0,1]=4 3311 B12R0.72 CCCC(C)OCCCC(C)(C)O eb2d231ee06273860f24c96ddf2973d7 [0,1,0,0,0,1|1,0,1]=4 3312 B12R0.72 CCCC(C)OCCOC(C)(C)C a0d95a94bd348a96ebc4688c2d876797 [0,1,0,0,0,1|1,0,1]=4 3313 B12R0.72 CCCC(C)OCCSC(C)(C)C e0dd16131a9e988ce53bb059ec96d7e5 [0,1,0,0,0,1|1,0,1]=4 3314 B12R0.72 CCC[C@@H](C)OCCCC(C)(C)O b45da7ae9b988aefa88b26e31a4aaafb [0,1,0,0,0,1|1,0,1]=4 3315 B12R0.72 CCC[C@@H](C)OCCOC(C)(C)C 9a8d0875da6918aa82e161c13c83c489 [0,1,0,0,0,1|1,0,1]=4 3316 B12R0.72 CCC[C@@H](C)OCCSC(C)(C)C cd6a22d044b14c4c023c7b79c241d4bc [0,1,0,0,0,1|1,0,1]=4 3317 B12R0.72 CCC[C@H](C)OCCCC(C)(C)O f0b630a9b39be12540340c77daec2aac [0,1,0,0,0,1|1,0,1]=4 3318 B12R0.72 CCC[C@H](C)OCCOC(C)(C)C 6f79406ad399c1e42da08a0ad5d36ad4 [0,1,0,0,0,1|1,0,1]=4 3319 B12R0.72 CCC[C@H](C)OCCSC(C)(C)C d7006f6da2c81771387b90013c8e0095 [0,1,0,0,0,1|1,0,1]=4 3320 B12R0.72 CCNC(=O)CCNCC(C)(C)C 2f1ea00e32458807016b66820cbd792a [0,1,0,0,0,1|2,0,0]=4 3321 B12R0.72 CCNC(=O)CCNCC(C)(C)O 37d62f2268bd720e6e57b4670cd8bf0a [0,1,0,0,0,1|2,0,0]=4 3322 B12R0.72 CCNC(=O)CCOCC(C)(C)Br 99b936cf4f2c08eec679846003e6c9c6 [0,1,0,0,0,1|2,0,0]=4 3323 B12R0.72 CCNC(=O)CCOCC(C)(C)C 47fd4fc10cf6cb7b5ca2d34621a96665 [0,1,0,0,0,1|2,0,0]=4 3324 B12R0.72 CCNC(=O)CCOCC(C)(C)F 26fffe4bbfc94a2111c403e0692428d2 [0,1,0,0,0,1|2,0,0]=4 3325 B12R0.72 CCNC(=O)CCOCC(C)(C)S 3882c24897ce39c0f87fa4beb3081d74 [0,1,0,0,0,1|2,0,0]=4 3326 B12R0.72 CCNC(=O)CNCCC(C)(C)C cdf36fca3d51ac78752e982bb753d0d3 [0,1,0,0,0,1|2,0,0]=4 3327 B12R0.72 CCNC(=O)CNCCC(C)(C)F bfa5847b5e8859f061d988f66eb6f300 [0,1,0,0,0,1|2,0,0]=4 3328 B12R0.72 CCNC(=O)CNCCC(C)(C)O 7de0c57d7dd73aa79f1ba249b49dbd3c [0,1,0,0,0,1|2,0,0]=4 3329 B12R0.72 CCNC(=O)COCCC(C)(C)C 2576cd0f9ff777a2e515260e64bf6dec [0,1,0,0,0,1|1,0,0]=3 3330 B12R0.72 CCNC(=O)COCCC(C)(C)O 8f83f3a61b55c939e22a92ef55599de3 [0,1,0,0,0,1|1,0,0]=3 3331 B12R0.72 CCNC(=O)COCCC(C)(C)S 490a393b3588a14214b140c454ed0f13 [0,1,0,0,0,1|1,0,0]=3 3332 B12R0.72 CCNC(=O)COCCC(C)(F)F 76cf2af0a61b0501645571485d80619a [0,1,0,0,0,1|2,0,0]=4 3333 B12R0.72 CCOC(=O)CCCNC(C)(C)C 939aa70adee835cdc228f6533ddb991d [0,1,0,0,0,1|2,0,0]=4 3334 B12R0.72 CCOC(=O)CCNCC(C)(C)C 3478136c25d96fcec1b0cf4f8f3b7ae2 [0,1,0,0,0,1|2,0,0]=4 3335 B12R0.72 CCOC(=O)CCNCC(C)(C)F 8825c6a602a78cfd6fdc69e71a41a9de [0,1,0,0,0,1|2,0,0]=4 3336 B12R0.72 CCOC(=O)CCNCC(C)(C)O e8abd9b0e18df872eb4032155c4574ce [0,1,0,0,0,1|2,0,0]=4 3337 B12R0.72 CCOC(=O)CCOCC(C)(C)Br 70745110ecb79f8936d7815a43a7fecf [0,1,0,0,0,1|2,0,0]=4 3338 B12R0.72 CCOC(=O)CCOCC(C)(C)C fab030b17c6c730a63c071a0c3a34fa2 [0,1,0,0,0,1|2,0,0]=4 3339 B12R0.72 CCOC(=O)CCOCC(C)(C)F 5745028d4a47c3ab709373049f84835b [0,1,0,0,0,1|2,0,0]=4 3340 B12R0.72 CCOC(=O)CCOCC(C)(C)O bf1910fa051d572dde9d4921162ded44 [0,1,0,0,0,1|2,0,0]=4 3341 B12R0.72 CCOC(=O)CCOCC(C)(C)S 1c0f9b73e05f87d18840a72e3cf3d471 [0,1,0,0,0,1|2,0,0]=4 3342 B12R0.72 CCOC(=O)CNCCC(C)(C)C 37e03ac7acbc641e21da3f63a2b7e9e1 [0,1,0,0,0,1|2,0,0]=4 3343 B12R0.72 CCOC(=O)CNCCC(C)(C)F 0fd1dfd303141ed402d0b7fa89870201 [0,1,0,0,0,1|2,0,0]=4 3344 B12R0.72 CCOC(=O)CNCCC(C)(C)O 882af745373ddffbe51400b4e258485a [0,1,0,0,0,1|2,0,0]=4 3345 B12R0.72 CCOC(=O)COCCC(C)(C)C 6e68e64359a4fd0ccd17042baea02f65 [0,1,0,0,0,1|1,0,0]=3 3346 B12R0.72 CCOC(=O)COCCC(C)(C)O 4743cf59ac38d23803eb9f582bfa641c [0,1,0,0,0,1|1,0,0]=3 3347 B12R0.72 CCOC(=O)COCCC(C)(C)S df055f531789c85b3a8b24b734d6896b [0,1,0,0,0,1|1,0,0]=3 3348 B12R0.72 CCOC(=O)COCCC(C)(F)F cb904ea0b73fea3d14f040fd515973f0 [0,1,0,0,0,1|2,0,0]=4 3349 B12R0.72 CCOC(=O)OCNCC(C)(C)C 89c204084f5bcf5f8b500532480345be [0,1,0,0,0,1|1,0,0]=3 3350 B12R0.72 CCOC(=O)OCNCC(C)(C)O 9d2b6dd972ad2e0daf265473137f7410 [0,1,0,0,0,1|1,0,0]=3 3351 B12R0.72 CCOC(=O)OCOCC(C)(C)Br 3700201e67b8ea1286cc4749c6e05d95 [0,1,0,0,0,1|1,0,0]=3 3352 B12R0.72 CCOC(=O)OCOCC(C)(C)C f3162a88e0f115a64ab9e91a4cf9f273 [0,1,0,0,0,1|1,0,0]=3 3353 B12R0.72 CCOC(=O)OCOCC(C)(C)F 71f1220d73f8bf522790e976bad42cb3 [0,1,0,0,0,1|1,0,0]=3 3354 B12R0.72 CCOC(=O)OCOCC(C)(C)S 27ae208a9d1ecf93ec7bb250058f9d28 [0,1,0,0,0,1|1,0,0]=3 3355 B12R0.72 CCSC(=O)OCNCC(C)(C)C ef5090143a9f483d9381513b6b849e0a [0,1,0,0,0,1|1,0,0]=3 3356 B12R0.72 CCSC(=O)OCNCC(C)(C)O 295a1e0babca2bd1585c66a7ca7e325a [0,1,0,0,0,1|1,0,0]=3 3357 B12R0.72 CCSC(=O)OCNCC(C)(F)F b6ea0a39098cca854f098604e999ebf2 [0,1,0,0,0,1|2,0,0]=4 3358 B12R0.72 CCSC(=O)OCOCC(C)(C)Br d843687d7f24981300c57f00d74f9acc [0,1,0,0,0,1|1,0,0]=3 3359 B12R0.72 CCSC(=O)OCOCC(C)(C)C ccc4c8a279a30a0ee87561c3452d3b24 [0,1,0,0,0,1|1,0,0]=3 3360 B12R0.72 CCSC(=O)OCOCC(C)(C)F 7b8ae0b21fbb499afd3a2711a500328a [0,1,0,0,0,1|1,0,0]=3 3361 B12R0.72 CCSC(=O)OCOCC(C)(C)S 2214472df0c9827327eb6ed444684681 [0,1,0,0,0,1|1,0,0]=3 3362 B12R0.72 COCC(=O)CNCCC(C)(C)C be389a7121233147f6e120619eddd85e [0,1,0,0,0,1|2,0,0]=4 3363 B12R0.72 COCC(=O)CNCCC(C)(C)F 7e2226e25f09869954e8b2d3c240d136 [0,1,0,0,0,1|2,0,0]=4 3364 B12R0.72 COCC(=O)CNCCC(C)(C)O aaf39a11b6e4364ec6d0e8b533f3f893 [0,1,0,0,0,1|2,0,0]=4 3365 B12R0.72 COCC(=O)COCCC(C)(C)C 9151ccaaec70841f6b0ef0cf09a3cb7d [0,1,0,0,0,1|1,0,0]=3 3366 B12R0.72 COCC(=O)COCCC(C)(C)S d6f96c7a36daa3aa52decf617f6adc00 [0,1,0,0,0,1|1,0,0]=3 3367 B12R0.72 COCC(=O)NCCCC(C)(C)C 9c0600c8e976f944dee8d37aa312f8eb [0,1,0,0,0,1|2,0,0]=4 3368 B12R0.72 COCC(=O)NCCCC(C)(C)O 98a8fc2c72447f4fbbe1efdfa89f55e2 [0,1,0,0,0,1|2,0,0]=4 3369 B12R0.72 COCC(=O)NCCOC(C)(C)C 82d4faf10038ec6f7ef105ea0500b892 [0,1,0,0,0,1|2,0,0]=4 3370 B12R0.72 COCC(=O)NCCSC(C)(C)C a6b2ca74bbf6446a8a9df9cb6fe6cfbe [0,1,0,0,0,1|2,0,0]=4 3371 B12R0.72 CSCC(=O)NCCCC(C)(C)C 8516c92330f3a927fa1f079146bda5d6 [0,1,0,0,0,1|2,0,0]=4 3372 B12R0.72 CSCC(=O)NCCCC(C)(C)O 1d08603b5248aecf8f56eefc5440ad03 [0,1,0,0,0,1|2,0,0]=4 3373 B12R0.72 CSCC(=O)NCCOC(C)(C)C d05c2c49bc9cad577952890fc17cf033 [0,1,0,0,0,1|2,0,0]=4 3374 B12R0.72 CSCC(=O)NCCSC(C)(C)C 4a2e58eeeaafcaada0365820bd0b13a3 [0,1,0,0,0,1|2,0,0]=4 3375 B12R0.86 C=C(C)CCOCC(=O)C(C)CC 2475e3e23ceb55b6ca17e6d4bcf035ee [0,1,0,0,0,1|0,0,2]=4 3376 B12R0.86 C=C(CC)C(=O)NCCCC(C)C f2387eebfce9dc50ffe8e9ca5e444bf2 [0,1,0,0,0,1|1,0,1]=4 3377 B12R0.86 C=C(CC)C(=O)NCCOC(C)C fafa21c57b75c270b9fb71a806c3ef8f [0,1,0,0,0,1|1,0,1]=4 3378 B12R0.86 CC(C)CCCNC(=O)C(O)CO 85fa3e9ff69ccc8fc205c0026bff3672 [0,1,0,0,0,1|2,0,0]=4 3379 B12R0.86 CC(C)CCCNC(=O)[C@@H](O)CO 61c0844692bac3d7e39c6dbe6e1005f0 [0,1,0,0,0,1|2,0,0]=4 3380 B12R0.86 CC(C)CCCNC(=O)[C@H](O)CF 06e32f9967443a403f0f3e0986a2fed1 [0,1,0,0,0,1|2,0,0]=4 3381 B12R0.86 CC(C)OCCNC(=O)C(O)CO ca3663a2f5f4c9dd7416725d8a0efb17 [0,1,0,0,0,1|2,0,0]=4 3382 B12R0.86 CC(C)OCCNC(=O)[C@@H](O)CO 2ee2480e07d26edef4a6cfb048aca936 [0,1,0,0,0,1|2,0,0]=4 3383 B12R0.86 CC(C)OCCNC(=O)[C@H](O)CF 2d65360db1644e7ee601fe75b5cb3663 [0,1,0,0,0,1|2,0,0]=4 3384 B12R0.86 CCC(=O)C(=O)NCCCC(C)C 1b6b8e0166d1efe315fc7d55faad3649 [0,1,0,0,0,1|1,0,1]=4 3385 B12R0.86 CCC(=O)C(=O)NCCOC(C)C e01319cde4af8677b92750ca8d1993e1 [0,1,0,0,0,1|1,0,1]=4 3386 B12R0.86 CCC(C)C(=O)CNCCC(C)C 78237bf015db47136fab8cc45753d2c2 [0,1,0,0,0,1|1,0,0]=3 3387 B12R0.86 CCC(C)C(=O)CNCCC(C)O 3c9431fe5ace956d836b989a9d407a22 [0,1,0,0,0,1|2,0,0]=4 3388 B12R0.86 CCC(C)C(=O)CNCCN(C)C d5a3d190ca78266408292e84fec990ab [0,1,0,0,0,1|2,0,0]=4 3389 B12R0.86 CCC(C)C(=O)CNCC[C@@H](C)O faf454a3b4fdfa3e796c1825f75a429e [0,1,0,0,0,1|2,0,0]=4 3390 B12R0.86 CCC(C)C(=O)CNCC[C@H](C)O 284ca295c1c9b94df5bf28e725e55b79 [0,1,0,0,0,1|2,0,0]=4 3391 B12R0.86 CCC(C)C(=O)COCC=C(C)C d4fdbb7da2b33ead71a35a5adb1a41af [0,1,0,0,0,1|0,0,2]=4 3392 B12R0.86 CCC(C)C(=O)COCCC(=O)C ed8d8fe532292ccaacaeb7ce0b25fd8d [0,1,0,0,0,1|1,0,1]=4 3393 B12R0.86 CCC(C)C(=O)COCCC(C)C b5ee9505a5ee36cfde60ffe433ae76b6 [0,1,0,0,0,1|0,0,0]=2 3394 B12R0.86 CCC(C)C(=O)COCCC(F)F 3130bec722d2204a8adf6a0e80326cb9 [0,1,0,0,0,1|2,0,0]=4 3395 B12R0.86 CCC(C)C(=O)COCCN(C)C b9c9834ce995f25558a72843aef7c3bc [0,1,0,0,0,1|1,0,0]=3 3396 B12R0.86 CCC(C)C(=O)COCCS(=O)C 3198c734018083d794eb1a2571d4a8ec [0,1,0,0,0,1|2,0,0]=4 3397 B12R0.86 CCC(C)C(C)OCCCC(C)C a2463d57311614267dc32edce0b8e4d4 [0,1,0,0,0,1|1,0,1]=4 3398 B12R0.86 CCC(C)C(C)OCCOC(C)C 1488df5a8e50bb5d42e5ae6dcfd39316 [0,1,0,0,0,1|1,0,1]=4 3399 B12R0.86 CCC(C)C(C)OCCSC(C)C c1dc76ccb724eb866f7d2535fddfc8dc [0,1,0,0,0,1|1,0,1]=4 3400 B12R0.86 CCC(O)C(=O)NCCCC(C)C a81eb22130c4bff949cb7e1c5bbe372d [0,1,0,0,0,1|1,0,0]=3 3401 B12R0.86 CCC(O)C(=O)NCCCN(C)C 72fef3b111bef658ed1a8ff830e406c7 [0,1,0,0,0,1|2,0,0]=4 3402 B12R0.86 CCC(O)C(=O)NCCOC(C)C 2e740ec42b7408a43c32b9de1ee5e682 [0,1,0,0,0,1|1,0,0]=3 3403 B12R0.86 CCC(S)C(C)COCCC(C)C ab76158df1149e7fabc50886226c1cba [0,1,0,0,0,1|1,0,1]=4 3404 B12R0.86 CCN(C)C(=O)CCCCC(C)C 939bdefc8ae6318f842507d7304ab221 [0,1,0,0,0,1|2,0,0]=4 3405 B12R0.86 CCN(C)C(=O)CCCSC(C)C 15e9d60e77d5d4d40994fac4fdfe7029 [0,1,0,0,0,1|2,0,0]=4 3406 B12R0.86 CCN(C)C(=O)CNCCC(C)C 4da403b81e1356deffccc2c0b9fafb5b [0,1,0,0,0,1|2,0,0]=4 3407 B12R0.86 CCN(C)C(=O)COCCC(C)C b93166ad95304ad4f0d3f16c145ea213 [0,1,0,0,0,1|1,0,0]=3 3408 B12R0.86 CCN(C)C(=O)COCCN(C)C 390aeafce0d6050bc2da20716f56560b [0,1,0,0,0,1|2,0,0]=4 3409 B12R0.86 CCN(C)C(=O)NCCCC(C)C 1dad33f49f01c3e8125b596060ec79ca [0,1,0,0,0,1|2,0,0]=4 3410 B12R0.86 CCN(C)C(=O)NCCOC(C)C d0ce433006b6042db95463b60f1f4e90 [0,1,0,0,0,1|2,0,0]=4 3411 B12R0.86 CC[C@@H](O)C(=O)NCCCC(C)C 4d8b2675d05553e9aa191ffa5ce56160 [0,1,0,0,0,1|1,0,0]=3 3412 B12R0.86 CC[C@@H](O)C(=O)NCCCN(C)C c84a89b54cb40b616217f8622e7b7788 [0,1,0,0,0,1|2,0,0]=4 3413 B12R0.86 CC[C@@H](O)C(=O)NCCOC(C)C e8f25a89bb5015d4b9c28237c333f7f4 [0,1,0,0,0,1|1,0,0]=3 3414 B12R0.86 CC[C@H](O)C(=O)NCCCC(C)C 4d1d091a7e81a3c13988b9ad318db410 [0,1,0,0,0,1|1,0,0]=3 3415 B12R0.86 CC[C@H](O)C(=O)NCCCN(C)C 9e307a79791db16328e2a98cfc0666b5 [0,1,0,0,0,1|2,0,0]=4 3416 B12R0.86 CC[C@H](O)C(=O)NCCOC(C)C 3fb0335476a4c64cbfca7354742a38e7 [0,1,0,0,0,1|1,0,0]=3 3417 B12R0.86 CC[C@H](S)C(=O)NCCCC(C)C 7253153cfce1a188df64e2ce86e41c6c [0,1,0,0,0,1|1,0,0]=3 3418 B12R0.86 CC[C@H](S)C(=O)NCCCN(C)C b527deaf5112ba89c32df2250cb8700d [0,1,0,0,0,1|2,0,0]=4 3419 B12R0.86 CC[C@H](S)C(=O)NCCOC(C)C 4291e9b8dd548ebeed987e714f61694b [0,1,0,0,0,1|1,0,0]=3 3420 B12R0.86 COC(=O)C(=O)COCCC(C)C f950a9537da0fd6bde5681e602f9b43f [0,1,0,0,0,1|1,0,1]=4 3421 B12R0.86 COC(C)C(=O)NCCCC(C)C ca3cf46f2da024bae55ef3b5d0aa13c4 [0,1,0,0,0,1|2,0,0]=4 3422 B12R0.86 COC(C)C(=O)NCCOC(C)C b676e423c812a49f0ec7311eba498147 [0,1,0,0,0,1|2,0,0]=4 3423 B12R0.86 CO[C@@H](C)C(=O)NCCCC(C)C 5611ab04f8ae8fd7bfa0743398d9c0d1 [0,1,0,0,0,1|2,0,0]=4 3424 B12R0.86 CO[C@@H](C)C(=O)NCCOC(C)C 7cfaf37114bdc4a5c740b753a0b746cf [0,1,0,0,0,1|2,0,0]=4 3425 B12R0.86 CO[C@H](C)C(=O)NCCCC(C)C b263b52dcbb1f15e5f708dc9821fcf0e [0,1,0,0,0,1|2,0,0]=4 3426 B12R0.86 CO[C@H](C)C(=O)NCCOC(C)C 687e23592f2cd3c633dc894741854558 [0,1,0,0,0,1|2,0,0]=4 3427 B12R0.86 CSC(C)C(=O)NCCCC(C)C 561536787bf9b63ead6add5e247f8971 [0,1,0,0,0,1|2,0,0]=4 3428 B12R0.86 CSC(C)C(=O)NCCOC(C)C efff131341c93224e83e1b8656adde67 [0,1,0,0,0,1|2,0,0]=4 3429 B12R0.95 C#CCCC(=O)CCOCC(C)C 86f1adbc3f81172141580eb5254adcc3 [0,1,0,0,0,1|1,0,1]=4 3430 B12R0.95 C#CCCC(=O)NCCCC(C)C a54390a3afb106dd81c63d3269bdbb30 [0,1,0,0,0,1|1,0,1]=4 3431 B12R0.95 C#CCCC(=O)NCCNC(C)C 1f4d10dad6d270b251ee3cec34220b32 [0,1,0,0,0,1|1,0,1]=4 3432 B12R0.95 C#CCCC(=O)NCCOC(C)C 818b12ad6c5709c513e0af7c35cf9334 [0,1,0,0,0,1|1,0,1]=4 3433 B12R0.95 C#CCNC(=O)COCCC(C)C 59bc8eb6d0cb4be29abcd74764893228 [0,1,0,0,0,1|0,0,2]=4 3434 B12R0.95 C/C=C/CC(=O)NCCCC(C)C 432695d4528b415d8fab52d720c7325a [0,1,0,0,0,1|1,0,1]=4 3435 B12R0.95 C/C=C/CC(=O)NCCOC(C)C 2b4d907c328a4f05b24965652d89d6fa [0,1,0,0,0,1|1,0,1]=4 3436 B12R0.95 C=C(C)CCOCC(=O)CCSC 6ef8bb17ed5590da5dfac575229930b3 [0,1,0,0,0,1|0,0,2]=4 3437 B12R0.95 C=C(C)CCOCC(=O)NCCC 2f09c7e6523a3a7b27cb4f03f17376b3 [0,1,0,0,0,1|0,0,2]=4 3438 B12R0.95 C=C(C)CCOCC(=O)OCCC 59c343094d45b09ebb54d18a52d6660c [0,1,0,0,0,1|0,0,2]=4 3439 B12R0.95 C=C(C)CNCOC(=O)CCCC 415cda3b3e26c7cc69b781ce5d4507c5 [0,1,0,0,0,1|0,0,2]=4 3440 B12R0.95 C=C(C)CNCOC(=O)OCCC 921a4a660c5c7dce5e9fe052be480cd8 [0,1,0,0,0,1|0,0,2]=4 3441 B12R0.95 C=C(C)COCOC(=O)CCCC fb1a9bf240c0417ca05159952c7bdae9 [0,1,0,0,0,1|0,0,2]=4 3442 B12R0.95 C=C(C)COCOC(=O)OCCC f5f7d23f64d3572328ba0fcb045a706a [0,1,0,0,0,1|0,0,2]=4 3443 B12R0.95 C=C(COCCC(C)C)OCOC 067701fabdd5ae6cef1f60514024d4ca [0,1,0,0,0,1|2,0,0]=4 3444 B12R0.95 C=CCCC(=O)NCCCC(C)C 689b81b32b8f7d420ec3402d0dca2b62 [0,1,0,0,0,1|1,0,1]=4 3445 B12R0.95 C=CCCC(=O)NCCOC(C)C 1e1b29076a2fb0fcb3d237db69301914 [0,1,0,0,0,1|1,0,1]=4 3446 B12R0.95 C=CCNC(=O)COCCC(C)C a90af195a1a35c570a33e622f40de396 [0,1,0,0,0,1|0,0,2]=4 3447 B12R0.95 C=CCOC(=O)COCCC(C)C d278eb063cf5ce356e96158c5b35b27f [0,1,0,0,0,1|0,0,2]=4 3448 B12R0.95 CC#CCC(=O)NCCCC(C)C 5e149aab48b098fbd889fa60ae0e141a [0,1,0,0,0,1|1,0,1]=4 3449 B12R0.95 CC#CCC(=O)NCCOC(C)C 6e68259fa43d67648e802aa19e2b4def [0,1,0,0,0,1|1,0,1]=4 3450 B12R0.95 CC(C)CCCCC(=O)NCCBr f8bf5c4aee30e18c138849a9589130ad [0,1,0,0,0,1|2,0,0]=4 3451 B12R0.95 CC(C)CCCCC(=O)NCCF cbf249a019f3ddd6cdcf4dfb91b8da64 [0,1,0,0,0,1|2,0,0]=4 3452 B12R0.95 CC(C)CCCCC(=O)NCCI f05299986aa6cdf24bda00b2655c1c52 [0,1,0,0,0,1|2,0,0]=4 3453 B12R0.95 CC(C)CCCCC(=O)NCCO 9a5c8e6c15524d7fb8fe5c88b77eb99e [0,1,0,0,0,1|2,0,0]=4 3454 B12R0.95 CC(C)CCCCC(=O)NCCS 32a75eb9b58b17b0ed886e34a88807e5 [0,1,0,0,0,1|2,0,0]=4 3455 B12R0.95 CC(C)CCCNC(=O)CCC#N eef7566b87e59413f03b73eb2ff9c4fa [0,1,0,0,0,1|1,0,1]=4 3456 B12R0.95 CC(C)CCCNC(=O)CCC=O 701cafe88ed505879e33b436909ef129 [0,1,0,0,0,1|1,0,1]=4 3457 B12R0.95 CC(C)CCCNC(=O)CCCF b1cc9b254e3f963b95e8a832d6cf1b7c [0,1,0,0,0,1|1,0,0]=3 3458 B12R0.95 CC(C)CCCNC(=O)CCCS f6da542094d1e1704ea418dccf825300 [0,1,0,0,0,1|1,0,0]=3 3459 B12R0.95 CC(C)CCCNC(=O)NCCF 827158e51c8db7ddcf73e112b36c24d5 [0,1,0,0,0,1|2,0,0]=4 3460 B12R0.95 CC(C)CCCNC(=O)NCCN 8bde9a8ed2044939c532a98ac5718fad [0,1,0,0,0,1|2,0,0]=4 3461 B12R0.95 CC(C)CCCNC(=O)NCCO 2c5c203a1bff98ad3d13063ae2021149 [0,1,0,0,0,1|2,0,0]=4 3462 B12R0.95 CC(C)CCCNC(=O)NCCS e0329481866afea0142ce88fd980861d [0,1,0,0,0,1|2,0,0]=4 3463 B12R0.95 CC(C)CCNCC(=O)NCCO 671bcbac067d72945a997f4ea6d6c30e [0,1,0,0,0,1|2,0,0]=4 3464 B12R0.95 CC(C)CCOCC(=O)NCC#N c000371f9a8e84052927e1492e1b6085 [0,1,0,0,0,1|1,0,1]=4 3465 B12R0.95 CC(C)OCCNC(=O)CCC#N 3b7f8bd1e5b84fbc33723fe06be746f3 [0,1,0,0,0,1|1,0,1]=4 3466 B12R0.95 CC(C)OCCNC(=O)CCC=O a9a4bc2bc9ef21594bbba25353bed669 [0,1,0,0,0,1|1,0,1]=4 3467 B12R0.95 CC(C)OCCNC(=O)CCCF c8df9ca8eb27ad6f3b1006501a299376 [0,1,0,0,0,1|1,0,0]=3 3468 B12R0.95 CC(C)OCCNC(=O)CCCS 645e49c12a1c76c4977771f736ba9c59 [0,1,0,0,0,1|1,0,0]=3 3469 B12R0.95 CC(C)OCCNC(=O)NCCF e6bcadcae3aec4cd8cdd1e577eada892 [0,1,0,0,0,1|2,0,0]=4 3470 B12R0.95 CC(C)OCCNC(=O)NCCN fd625444ed56111cf3cbf29ed52fe286 [0,1,0,0,0,1|2,0,0]=4 3471 B12R0.95 CC(C)OCCNC(=O)NCCO f316c8a9d1fb8f964a2dce4518fa57b0 [0,1,0,0,0,1|2,0,0]=4 3472 B12R0.95 CC(C)OCCNC(=O)NCCS 63a738f6e9fc6a190548689dcb598867 [0,1,0,0,0,1|2,0,0]=4 3473 B12R0.95 CC(C)SCCCC(=O)NCCBr 1645f9f1e1531f58f1849dee6831c91e [0,1,0,0,0,1|2,0,0]=4 3474 B12R0.95 CC(C)SCCCC(=O)NCCF 945df5eefcaa04a585f14719c301cdaf [0,1,0,0,0,1|2,0,0]=4 3475 B12R0.95 CC(C)SCCCC(=O)NCCI 4aa0f61a739c2f31f200e57c83f4364d [0,1,0,0,0,1|2,0,0]=4 3476 B12R0.95 CC(C)SCCCC(=O)NCCO 9c7666d87b20557dfbe792ebb2fd3a34 [0,1,0,0,0,1|2,0,0]=4 3477 B12R0.95 CC(C)SCCCC(=O)NCCS 9853a589454c799b9ce9be0bc190990e [0,1,0,0,0,1|2,0,0]=4 3478 B12R0.95 CC/C=C/C(=O)NCCCC(C)C 3ebe3c580f0665574c2dd500d3cb2bfa [0,1,0,0,0,1|1,0,1]=4 3479 B12R0.95 CC/C=C/C(=O)NCCOC(C)C ca9a5fdfd38c9e92787320d1d4486e24 [0,1,0,0,0,1|1,0,1]=4 3480 B12R0.95 CC/C=C\C(=O)NCCCC(C)C 8f91eb5b5c26d03d9c94b91d7b1ae27f [0,1,0,0,0,1|1,0,1]=4 3481 B12R0.95 CC/C=C\C(=O)NCCOC(C)C ed2235ffc574bbb89e70bdf744a10cdd [0,1,0,0,0,1|1,0,1]=4 3482 B12R0.95 CCC#CC(=O)NCCCC(C)C 04e030695e2ce6d0350e8b1bddea49b9 [0,1,0,0,0,1|1,0,1]=4 3483 B12R0.95 CCC#CC(=O)NCCOC(C)C 4b4d7b2ba9e6cb285c0b749d7647f829 [0,1,0,0,0,1|1,0,1]=4 3484 B12R0.95 CCC=CC(=O)NCCCC(C)C 8005c5a41188fb3f84b12403b1093cf0 [0,1,0,0,0,1|1,0,1]=4 3485 B12R0.95 CCC=CC(=O)NCCOC(C)C 513e3176121352acc29cc1db01f10ec8 [0,1,0,0,0,1|1,0,1]=4 3486 B12R0.95 CCCCC(=O)NCCCC(C)C 4cfbd8cd4787b68f67725c2f6395b859 [0,1,0,0,0,1|1,0,0]=3 3487 B12R0.95 CCCCC(=O)NCCCN(C)C c9aac6fc3f3134bdb9f9101491a3ee41 [0,1,0,0,0,1|2,0,0]=4 3488 B12R0.95 CCCCC(=O)NCCOC(C)C 6fdc7d7ca2aabe1a6cdd81d4c3e9f3e6 [0,1,0,0,0,1|1,0,0]=3 3489 B12R0.95 CCCCC(=O)OCNCC(=O)C cac5cc43bee8bcbb528738f26d00aba6 [0,1,0,0,0,1|1,0,1]=4 3490 B12R0.95 CCCCC(=O)OCNCC(C)C 398b5c2dd73854504a11d47800dfa85c [0,1,0,0,0,1|0,0,0]=2 3491 B12R0.95 CCCCC(=O)OCNCC(C)O 44153623ecf39cc3939ac933198b5245 [0,1,0,0,0,1|1,0,0]=3 3492 B12R0.95 CCCCC(=O)OCNCC(F)F 5f3a7eb8967735c6cb883f3c0c962364 [0,1,0,0,0,1|2,0,0]=4 3493 B12R0.95 CCCCC(=O)OCNC[C@@H](C)O 154d85b5e31ba6f85d6cd62d8271e631 [0,1,0,0,0,1|1,0,0]=3 3494 B12R0.95 CCCCC(=O)OCNC[C@H](C)O e3492d206ed25d7c1e0ea2b05bf1e2bd [0,1,0,0,0,1|1,0,0]=3 3495 B12R0.95 CCCCC(=O)OCOCC(=O)C b946cb4e564cb1d85364c86401444267 [0,1,0,0,0,1|1,0,1]=4 3496 B12R0.95 CCCCC(=O)OCOCC(C)C d415ef9bdea7f5aca14fd71c6f1d7e8e [0,1,0,0,0,1|0,0,0]=2 3497 B12R0.95 CCCCC(=O)OCOCC(C)F 40d933d076752a93a273432d476a671f [0,1,0,0,0,1|1,0,0]=3 3498 B12R0.95 CCCCC(=O)OCOCC(C)S cc9e25e72674342f1ff946950434f5e5 [0,1,0,0,0,1|1,0,0]=3 3499 B12R0.95 CCCCC(=O)OCOCC(F)F e75e93ff07ace0a3f2dd0fc1340a538f [0,1,0,0,0,1|2,0,0]=4 3500 B12R0.95 CCCCC(=O)OCOC[C@@H](C)F a391fe0f327a4a5711323c423e71c560 [0,1,0,0,0,1|1,0,0]=3 3501 B12R0.95 CCCCC(=O)OCOC[C@H](C)F da7ea854b57a8ef4e443cccb85659192 [0,1,0,0,0,1|1,0,0]=3 3502 B12R0.95 CCCCC(C)COCCC(C)C 33b9afb2e96b175222239ab0d09e270c [0,1,0,0,0,1|1,0,1]=4 3503 B12R0.95 CCCCC(C)OCCCC(C)C 6eb82a262fc3c9f93db19d4d8511d1fb [0,1,0,0,0,1|1,0,1]=4 3504 B12R0.95 CCCCC(C)OCCOC(C)C cf4d510e580a8e97983d508e6485764d [0,1,0,0,0,1|1,0,1]=4 3505 B12R0.95 CCCCC(C)OCCSC(C)C 5c15b9c4feecda03ba35b33f4b54d80a [0,1,0,0,0,1|1,0,1]=4 3506 B12R0.95 CCCC[C@@H](C)OCCCC(C)C 19fb73957c0527d6e0e0c50e5ddba220 [0,1,0,0,0,1|1,0,1]=4 3507 B12R0.95 CCCC[C@@H](C)OCCOC(C)C a75b41437129e959684839493b07aac7 [0,1,0,0,0,1|1,0,1]=4 3508 B12R0.95 CCCC[C@@H](C)OCCSC(C)C 82b270864c2a16880a983f31ff0f3cd6 [0,1,0,0,0,1|1,0,1]=4 3509 B12R0.95 CCCC[C@H](C)OCCCC(C)C 8ca55e3b1a997d66401f601e823ac590 [0,1,0,0,0,1|1,0,1]=4 3510 B12R0.95 CCCC[C@H](C)OCCOC(C)C 1013a6830e0ce4f6310b65651de7595e [0,1,0,0,0,1|1,0,1]=4 3511 B12R0.95 CCCC[C@H](C)OCCSC(C)C e772289ad3fd81c90d7f1ba579959697 [0,1,0,0,0,1|1,0,1]=4 3512 B12R0.95 CCCNC(=O)CCCCC(C)C df71677e2f93f09f4955ba2e6046b4ae [0,1,0,0,0,1|1,0,0]=3 3513 B12R0.95 CCCNC(=O)CCCCN(C)C 48164338f3f788a9e9adefe4f0b203ff [0,1,0,0,0,1|2,0,0]=4 3514 B12R0.95 CCCNC(=O)CCCOC(C)C 6619ef7fa7ad414c01db075aa0bcbeae [0,1,0,0,0,1|1,0,0]=3 3515 B12R0.95 CCCNC(=O)CCCSC(C)C 33f210d0bf587bc303a0e7e3713bd406 [0,1,0,0,0,1|1,0,0]=3 3516 B12R0.95 CCCNC(=O)CNCCC(C)C bcc3a0e80af9747011f089d13b7b27f1 [0,1,0,0,0,1|1,0,0]=3 3517 B12R0.95 CCCNC(=O)CNCCC(C)O 7b52e17ee86d5a2c7b090ba4c1b70491 [0,1,0,0,0,1|2,0,0]=4 3518 B12R0.95 CCCNC(=O)CNCCN(C)C e7d39c86e0eb4fd3526b73feb7ea03f9 [0,1,0,0,0,1|2,0,0]=4 3519 B12R0.95 CCCNC(=O)CNCC[C@@H](C)O 6b1c7f1e8c60a4e619e4fea5e48331ae [0,1,0,0,0,1|2,0,0]=4 3520 B12R0.95 CCCNC(=O)CNCC[C@H](C)O 3f22f1a13aa7a440aef7f4569b2e26c0 [0,1,0,0,0,1|2,0,0]=4 3521 B12R0.95 CCCNC(=O)CNCOC(C)C 1b1c03a4734b5bbfd5408d1d08fea89e [0,1,0,0,0,1|2,0,0]=4 3522 B12R0.95 CCCNC(=O)COCC=C(C)C 3a9ef20acd1e43dc7463d21c049df29a [0,1,0,0,0,1|0,0,2]=4 3523 B12R0.95 CCCNC(=O)COCCC(=O)C 8538033b52b5093377175cea82bdc107 [0,1,0,0,0,1|1,0,1]=4 3524 B12R0.95 CCCNC(=O)COCCC(C)C 0106111ffd98343174db62b7bd4737c2 [0,1,0,0,0,1|0,0,0]=2 3525 B12R0.95 CCCNC(=O)COCCC(F)F 10156559986cc90db9c70171834d8545 [0,1,0,0,0,1|2,0,0]=4 3526 B12R0.95 CCCNC(=O)COCCN(C)C 15d6564f6909715b3ab0a77416ed9f89 [0,1,0,0,0,1|1,0,0]=3 3527 B12R0.95 CCCNC(=O)COCCS(=O)C 49483ba41d1153b37ee9512d4697380d [0,1,0,0,0,1|2,0,0]=4 3528 B12R0.95 CCCNC(=O)NCCCC(C)C 5ff58622df6f6304e760f5ebf6f1c6e7 [0,1,0,0,0,1|1,0,0]=3 3529 B12R0.95 CCCNC(=O)NCCCN(C)C ad782b311d2c09eb0cdd8ca62ce15b52 [0,1,0,0,0,1|2,0,0]=4 3530 B12R0.95 CCCNC(=O)NCCOC(C)C 44ee4d686aba83ef294389f4fc8b329d [0,1,0,0,0,1|1,0,0]=3 3531 B12R0.95 CCCNC(=S)NCCCC(C)C 1d5e85810e10e7acdd60107309599612 [0,1,0,0,0,1|1,1,0]=4 3532 B12R0.95 CCCNC(=S)NCCOC(C)C 397905e65fd9ec1753e78fceecc58b82 [0,1,0,0,0,1|1,1,0]=4 3533 B12R0.95 CCCOC(=O)CCOCC(C)C 325bd84036096b35d689a2aeacebb45a [0,1,0,0,0,1|1,0,0]=3 3534 B12R0.95 CCCOC(=O)CCOCN(C)C 0a88160f536451c8b08421f070889911 [0,1,0,0,0,1|2,0,0]=4 3535 B12R0.95 CCCOC(=O)CNCCC(C)C 74b2549c7197ab3eb9a019d32e1efe79 [0,1,0,0,0,1|1,0,0]=3 3536 B12R0.95 CCCOC(=O)CNCCC(C)O c366f7c3e376a8b7e4758f4cbb892ff7 [0,1,0,0,0,1|2,0,0]=4 3537 B12R0.95 CCCOC(=O)CNCCN(C)C a83934c95731ca7decb307a25d2b2a59 [0,1,0,0,0,1|2,0,0]=4 3538 B12R0.95 CCCOC(=O)CNCC[C@@H](C)O a9bcf3a7044bef31157516e087e5742d [0,1,0,0,0,1|2,0,0]=4 3539 B12R0.95 CCCOC(=O)CNCC[C@H](C)O 720e7d2cac2a4b47d1e391b4ee911556 [0,1,0,0,0,1|2,0,0]=4 3540 B12R0.95 CCCOC(=O)COCC=C(C)C 0c33a2730062a58554b755f472f890d6 [0,1,0,0,0,1|0,0,2]=4 3541 B12R0.95 CCCOC(=O)COCCC(=O)C 3ca13b555a6844ed813e1ef5a70d276b [0,1,0,0,0,1|1,0,1]=4 3542 B12R0.95 CCCOC(=O)COCCC(C)C 704338dc796d61c02b256ccaf9246466 [0,1,0,0,0,1|0,0,0]=2 3543 B12R0.95 CCCOC(=O)COCCC(F)F 709461c71c00f035611dc9a7d2098e0f [0,1,0,0,0,1|2,0,0]=4 3544 B12R0.95 CCCOC(=O)COCCN(C)C 95b629ab65be3b41c33265423e7c7868 [0,1,0,0,0,1|1,0,0]=3 3545 B12R0.95 CCCOC(=O)COCCS(=O)C 7e7270fd6ba33e668f65cfb68aa3ab89 [0,1,0,0,0,1|2,0,0]=4 3546 B12R0.95 CCCOC(=O)OCNCC(=O)C 5f7f5e4112b9ec96621d303097daf913 [0,1,0,0,0,1|1,0,1]=4 3547 B12R0.95 CCCOC(=O)OCNCC(C)C 8d599ea8b6caaf060699dcf00967f7a2 [0,1,0,0,0,1|0,0,0]=2 3548 B12R0.95 CCCOC(=O)OCNCC(C)O e4bc2fc2ac6b2503af04e76bfafac06e [0,1,0,0,0,1|1,0,0]=3 3549 B12R0.95 CCCOC(=O)OCNCC(F)F 4c81803f650d6fdb8a617b6ffb404967 [0,1,0,0,0,1|2,0,0]=4 3550 B12R0.95 CCCOC(=O)OCNC[C@@H](C)O 90b5184da8659c866ac6c109eec45287 [0,1,0,0,0,1|1,0,0]=3 3551 B12R0.95 CCCOC(=O)OCNC[C@H](C)O 37966f1752165176ba6af5cbea0ef508 [0,1,0,0,0,1|1,0,0]=3 3552 B12R0.95 CCCOC(=O)OCOCC(=O)C 870b62ee833da611d1cf12ab4d6112a9 [0,1,0,0,0,1|1,0,1]=4 3553 B12R0.95 CCCOC(=O)OCOCC(C)C 58f5c456bfe26d581a8fcd3b6568ec0c [0,1,0,0,0,1|0,0,0]=2 3554 B12R0.95 CCCOC(=O)OCOCC(C)F f5da25d3dd07a459db094fef5b336307 [0,1,0,0,0,1|1,0,0]=3 3555 B12R0.95 CCCOC(=O)OCOCC(C)S be45b1edc190f03b77fff069ccd6cd3a [0,1,0,0,0,1|1,0,0]=3 3556 B12R0.95 CCCOC(=O)OCOCC(F)F f075d23f305f7ab8102759c3be16edda [0,1,0,0,0,1|2,0,0]=4 3557 B12R0.95 CCCOC(=O)OCOC[C@@H](C)F 6f8ef3305bd8903aba91036b57d220b0 [0,1,0,0,0,1|1,0,0]=3 3558 B12R0.95 CCCOC(=O)OCOC[C@H](C)F 57df96ac24d4f8bd9147a6c22f3c8334 [0,1,0,0,0,1|1,0,0]=3 3559 B12R0.95 CCOCC(=O)NCCCC(C)C 328089ac347b1bd5125ac943dccc78a3 [0,1,0,0,0,1|1,0,0]=3 3560 B12R0.95 CCOCC(=O)NCCCN(C)C ea14ff27c262bb99f7235730e267d55a [0,1,0,0,0,1|2,0,0]=4 3561 B12R0.95 CCOCC(=O)NCCOC(C)C 789da822b68dd064ba6b55276660bcee [0,1,0,0,0,1|1,0,0]=3 3562 B12R0.95 CCOCC(C)COCCC(C)C b9f8c08d1a40dcc79884580f7c7b732f [0,1,0,0,0,1|1,0,1]=4 3563 B12R0.95 CCOCC(C)OCCCC(C)C 425f8f5eb9159a7af129b3ff253aa33d [0,1,0,0,0,1|1,0,1]=4 3564 B12R0.95 CCOCC(C)OCCOC(C)C 92c182ae4ccc878d63cd67f152850eaa [0,1,0,0,0,1|1,0,1]=4 3565 B12R0.95 CCOCC(C)OCCSC(C)C 3049a79687b3896565133d174bc2f5b2 [0,1,0,0,0,1|1,0,1]=4 3566 B12R0.95 CCSCC(=O)NCCCC(C)C 8997e9db122ddb08389490255ae88ac2 [0,1,0,0,0,1|1,0,0]=3 3567 B12R0.95 CCSCC(=O)NCCCN(C)C 94c714084a53d8b9276a36a77de4a9c3 [0,1,0,0,0,1|2,0,0]=4 3568 B12R0.95 CCSCC(=O)NCCOC(C)C c06d355e6e451c9108068b8d98fa07d8 [0,1,0,0,0,1|1,0,0]=3 3569 B12R0.95 CN(C)CCCNC(=O)CCCF f5b0e033a80014c1233a4c11cbfacb34 [0,1,0,0,0,1|2,0,0]=4 3570 B12R0.95 CN(C)CCCNC(=O)CCCS 5b25a7a6946c248750fffcb2e21cbfdb [0,1,0,0,0,1|2,0,0]=4 3571 B12R0.95 COCCC(=O)NCCCC(C)C 44c3bb2306e35aae764faa470f8d793e [0,1,0,0,0,1|1,0,0]=3 3572 B12R0.95 COCCC(=O)NCCCN(C)C 62270e0d495f3b691076bff91e7c2bfd [0,1,0,0,0,1|2,0,0]=4 3573 B12R0.95 COCCC(=O)NCCOC(C)C 39395696b1ed9462064480b5559da363 [0,1,0,0,0,1|1,0,0]=3 3574 B12R0.95 COCCC(C)OCCCC(C)C 0520e9be3c1f3ebc5126e872453d63ab [0,1,0,0,0,1|1,0,1]=4 3575 B12R0.95 COCCC(C)OCCOC(C)C 217a4e77fb0fdc4ebf6d0dfbcc2deca5 [0,1,0,0,0,1|1,0,1]=4 3576 B12R0.95 COCCC(C)OCCSC(C)C 51f3f1f3d595305e39b17b5d437fc05c [0,1,0,0,0,1|1,0,1]=4 3577 B12R0.95 CSCCC(=O)CNCCC(C)C 33b7e66c24185d101d2d4384ec8aab3e [0,1,0,0,0,1|1,0,0]=3 3578 B12R0.95 CSCCC(=O)CNCCC(C)O d724ab708646770f61c82f1808fff2c7 [0,1,0,0,0,1|2,0,0]=4 3579 B12R0.95 CSCCC(=O)CNCCN(C)C d3de0d5acd801985d047226f1c2c7b6b [0,1,0,0,0,1|2,0,0]=4 3580 B12R0.95 CSCCC(=O)CNCC[C@@H](C)O 534ba15a1ac9507ae5c81ac270c767ca [0,1,0,0,0,1|2,0,0]=4 3581 B12R0.95 CSCCC(=O)CNCC[C@H](C)O 92750f6f24508a0b910919aa15228561 [0,1,0,0,0,1|2,0,0]=4 3582 B12R0.95 CSCCC(=O)COCC=C(C)C b5071252e587003c3fde3a8d97877349 [0,1,0,0,0,1|0,0,2]=4 3583 B12R0.95 CSCCC(=O)COCCC(=O)C 84bc33191267529c3c7a852e4782ada2 [0,1,0,0,0,1|1,0,1]=4 3584 B12R0.95 CSCCC(=O)COCCC(C)C dc1b1a3c2c3e37b0f082196ae87fd8ea [0,1,0,0,0,1|0,0,0]=2 3585 B12R0.95 CSCCC(=O)COCCC(F)F 0b1325c4ef648b56aa0264744fd1896c [0,1,0,0,0,1|2,0,0]=4 3586 B12R0.95 CSCCC(=O)COCCN(C)C bae042acf3e3645f57221bc35868cf70 [0,1,0,0,0,1|1,0,0]=3 3587 B12R0.95 CSCCC(=O)COCCS(=O)C f4a52fac7b831544ca992e722d863635 [0,1,0,0,0,1|2,0,0]=4 3588 B12R0.95 CSCCC(=O)NCCCC(C)C fe065b4e3051b1be70442927276cd6e9 [0,1,0,0,0,1|1,0,0]=3 3589 B12R0.95 CSCCC(=O)NCCCN(C)C 03c95eac0cd9af5046b9fe1d7d536374 [0,1,0,0,0,1|2,0,0]=4 3590 B12R0.95 CSCCC(=O)NCCOC(C)C 3137f3210891a4e7e49d602c3b921e73 [0,1,0,0,0,1|1,0,0]=3 3591 B12R0.95 CSCCC(C)OCCCC(C)C 7e55d32832fd215d3847550c131aad87 [0,1,0,0,0,1|1,0,1]=4 3592 B12R0.95 CSCCC(C)OCCOC(C)C 480cf3b351eae0972fdf91880a674b3c [0,1,0,0,0,1|1,0,1]=4 3593 B12R0.95 CSCCC(C)OCCSC(C)C d1aaefe2bcc421620bf061da6ef385af [0,1,0,0,0,1|1,0,1]=4 3594 B12R0.95 CSSCC(=O)NCCCC(C)C ce2c206ac8cf425c1a39f2a66faa5149 [0,1,0,0,0,1|2,0,0]=4 3595 B12R0.95 CSSCC(=O)NCCOC(C)C 3bab9b2dd82476794fc5a35822f64b85 [0,1,0,0,0,1|2,0,0]=4 3596 B12R0.224 C#CC(CCC)OCCCC(C)C 09b571b7118a40ff9d65dc180e734528 [0,1,0,0,0,1|1,0,1]=4 3597 B12R0.224 C#CC(CCC)OCCOC(C)C bd54eb0a3b7a6d4d93a92da76ac6bb3a [0,1,0,0,0,1|1,0,1]=4 3598 B12R0.224 C#CC(CCC)OCCSC(C)C 2e4f11edd1a48bf0a1df348ee0057b26 [0,1,0,0,0,1|1,0,1]=4 3599 B12R0.224 C=CC(CCC)OCCCC(C)C da648f9a19301d7a357e018a6e8a76da [0,1,0,0,0,1|1,0,1]=4 3600 B12R0.224 C=CC(CCC)OCCOC(C)C d0d8aaebf50132aa571e1f6a28171af8 [0,1,0,0,0,1|1,0,1]=4 3601 B12R0.224 C=CC(CCC)OCCSC(C)C 0a1bb53bd19d50e89ed39be2896148a7 [0,1,0,0,0,1|1,0,1]=4 3602 B12R0.224 CCCC(C#N)OCCCC(C)C 4934cf9e3f6b3bbb380b0f984df8decd [0,1,0,0,0,1|1,0,1]=4 3603 B12R0.224 CCCC(C#N)OCCOC(C)C 042f063f4e74ee43c78aeb5f33e6852f [0,1,0,0,0,1|1,0,1]=4 3604 B12R0.224 CCCC(C#N)OCCSC(C)C 620e22562fbffae185c63aafac21f1fe [0,1,0,0,0,1|1,0,1]=4 3605 B12R0.224 CCCC(CC)COCCC(C)C 4a1c32bdd2aa93f17cdfcaba8fbefcdc [0,1,0,0,0,1|1,0,1]=4 3606 B12R0.224 CCCC(CC)OCCCC(C)C 0f6b72460dbd7af276527a9fece8e093 [0,1,0,0,0,1|1,0,1]=4 3607 B12R0.224 CCCC(CC)OCCOC(C)C 8c55885790ba7499d2feaea4a5b42045 [0,1,0,0,0,1|1,0,1]=4 3608 B12R0.224 CCCC(CC)OCCSC(C)C c15a55e051d58bc865bd35edcb7a12e1 [0,1,0,0,0,1|1,0,1]=4 3609 B12R0.224 CCC[C@@H](CC)OCCCC(C)C 220b29316d00a6b550d0395d8e7229bc [0,1,0,0,0,1|1,0,1]=4 3610 B12R0.224 CCC[C@@H](CC)OCCOC(C)C 0ce40eefe4294bc44209878b1981fa2a [0,1,0,0,0,1|1,0,1]=4 3611 B12R0.224 CCC[C@@H](CC)OCCSC(C)C 82abd76446836aafc5334d41c1e1d4e8 [0,1,0,0,0,1|1,0,1]=4 3612 B12R0.270 C=C(C)CC(=O)NCCCC(C)C 5bb2c2c9c3d79f3638b87a08834d1e7f [0,1,0,0,0,1|1,0,1]=4 3613 B12R0.270 C=C(C)CC(=O)NCCOC(C)C 4fff3527f10f0b4c0ff9bcb72ba4cfdd [0,1,0,0,0,1|1,0,1]=4 3614 B12R0.270 C=C(C)CCOCC(=O)CC(C)C daf091eadf837ee6e22a6a363d3b1170 [0,1,0,0,0,1|0,0,2]=4 3615 B12R0.270 C=C(C)CNCOC(=O)CC(C)C 02c219db0087387f16a3e6fc464a8602 [0,1,0,0,0,1|0,0,2]=4 3616 B12R0.270 C=C(C)COCOC(=O)CC(C)C e1de043d76a8f0634da00c2d19be192e [0,1,0,0,0,1|0,0,2]=4 3617 B12R0.270 CC(=CCOCC(=O)CC(C)C)C eb7dfe8e284a227e5fe16e173f93b766 [0,1,0,0,0,1|0,0,2]=4 3618 B12R0.270 CC(=O)CC(=O)NCCCC(C)C b9cbe255f4dceddd12afdbac4c06ac27 [0,1,0,0,0,1|1,0,1]=4 3619 B12R0.270 CC(=O)CC(=O)NCCOC(C)C 900c6fc8d4a8195b88ceadb5385bb237 [0,1,0,0,0,1|1,0,1]=4 3620 B12R0.270 CC(=O)CC(=O)OCCOC(C)C 28cef2fa4da7e5b75b42f4586fba26ea [0,1,0,0,0,1|0,0,1]=3 3621 B12R0.270 CC(=O)CCOCC(=O)CC(C)C 38b6e49a26998901f858cb064839dc28 [0,1,0,0,0,1|1,0,1]=4 3622 B12R0.270 CC(=O)CNCOC(=O)CC(C)C 71e7337eb5113ef5b64692a6c7491d04 [0,1,0,0,0,1|1,0,1]=4 3623 B12R0.270 CC(=O)COCOC(=O)CC(C)C 9c61ad0cd29dac3e07b25bf6e959d3cb [0,1,0,0,0,1|1,0,1]=4 3624 B12R0.270 CC(=O)NC(=O)COCCC(C)C 23394e307abcaa3eaa10987adad23561 [0,1,0,0,0,1|1,0,1]=4 3625 B12R0.270 CC(C)CC(=O)CNCCC(C)O d2681ed8a94899d760e2cb3211ac86a1 [0,1,0,0,0,1|2,0,0]=4 3626 B12R0.270 CC(C)CC(=O)CNCCN(C)C 03e0adfcf0f3d8ec4eed4bfe732e7acf [0,1,0,0,0,1|2,0,0]=4 3627 B12R0.270 CC(C)CC(=O)CNCC[C@@H](C)O f3fa98487d805d32d8a1de0ff286d543 [0,1,0,0,0,1|2,0,0]=4 3628 B12R0.270 CC(C)CC(=O)CNCC[C@H](C)O bac88df339d631873124d3f1738a3f67 [0,1,0,0,0,1|2,0,0]=4 3629 B12R0.270 CC(C)CC(=O)COCCC(F)F 2640a037b38b8fe39dbfd7e1b88a5ede [0,1,0,0,0,1|2,0,0]=4 3630 B12R0.270 CC(C)CC(=O)COCCN(C)C 7c2e0e60e249eefee0ee37ecae100fe7 [0,1,0,0,0,1|1,0,0]=3 3631 B12R0.270 CC(C)CC(=O)COCCS(=O)C 934b232f8ea6fefe40c9922fea17815d [0,1,0,0,0,1|2,0,0]=4 3632 B12R0.270 CC(C)CC(=O)NCCCN(C)C 7b6e7c46f64b4e6fd5d701dae9797bc1 [0,1,0,0,0,1|2,0,0]=4 3633 B12R0.270 CC(C)CC(=O)NCCOC(C)C 9a348a871b31339293ffe5c904aaaf91 [0,1,0,0,0,1|1,0,0]=3 3634 B12R0.270 CC(C)CC(=O)OCNCC(C)O 087caa8f1c2f2f6786abf7a7ceb7b617 [0,1,0,0,0,1|1,0,0]=3 3635 B12R0.270 CC(C)CC(=O)OCNCC(F)F 6af9c833026f3926ebdcef9e94bc5ad1 [0,1,0,0,0,1|2,0,0]=4 3636 B12R0.270 CC(C)CC(=O)OCNC[C@@H](C)O dec26399e6117ffaad21d34bc0f27e2f [0,1,0,0,0,1|1,0,0]=3 3637 B12R0.270 CC(C)CC(=O)OCNC[C@H](C)O 2892bac6ebb542d706061eccf888854d [0,1,0,0,0,1|1,0,0]=3 3638 B12R0.270 CC(C)CC(=O)OCOCC(C)F d7a52a3374f5b7a97cb68832d19c9558 [0,1,0,0,0,1|1,0,0]=3 3639 B12R0.270 CC(C)CC(=O)OCOCC(C)S 7ae48406ec16eaaf9b1c2c089b548e60 [0,1,0,0,0,1|1,0,0]=3 3640 B12R0.270 CC(C)CC(=O)OCOCC(F)F 88004384243b53034510491b235e21d6 [0,1,0,0,0,1|2,0,0]=4 3641 B12R0.270 CC(C)CC(=O)OCOC[C@@H](C)F ab0b96bb84ea8cb01a59c180c940f4ce [0,1,0,0,0,1|1,0,0]=3 3642 B12R0.270 CC(C)CC(=O)OCOC[C@H](C)F 7da7296b5682b1741e42e8e128b823c7 [0,1,0,0,0,1|1,0,0]=3 3643 B12R0.270 CC(C)CC(C)OCCOC(C)C 5a944e0fbcbdc905d379261573eee4db [0,1,0,0,0,1|1,0,1]=4 3644 B12R0.270 CC(C)CC(C)OCCSC(C)C 6131a74e32e26332fe3911730cbfbab7 [0,1,0,0,0,1|1,0,1]=4 3645 B12R0.270 CC(C)CCCNC(=O)CC(C)C 28eb7d5c4538aa4eb50323efa79a117d [0,1,0,0,0,1|1,0,0]=3 3646 B12R0.270 CC(C)CCCNC(=O)CC(C)O 0e071abecc9d0467aee65cff4abbdac6 [0,1,0,0,0,1|1,0,0]=3 3647 B12R0.270 CC(C)CCCNC(=O)CC(F)F 29c395478b578bdf1e0502f2219addd4 [0,1,0,0,0,1|2,0,0]=4 3648 B12R0.270 CC(C)CCCNC(=O)CN(C)C 27106268b99a47397fd30b0efa1da760 [0,1,0,0,0,1|2,0,0]=4 3649 B12R0.270 CC(C)CCCNC(=O)C[C@@H](C)O eac2d08329c78040839815a44e402b54 [0,1,0,0,0,1|1,0,0]=3 3650 B12R0.270 CC(C)CCCNC(=O)C[C@H](C)O 1b5c7e9dc4000b2b5f11dda012b373f3 [0,1,0,0,0,1|1,0,0]=3 3651 B12R0.270 CC(C)CCCOC(C)CC(C)C bc342ef50e956a28f0225237bb26e444 [0,1,0,0,0,1|1,0,1]=4 3652 B12R0.270 CC(C)CCCO[C@@H](C)CC(C)C ff5d02e349401cd2ab60f65ce09249a4 [0,1,0,0,0,1|1,0,1]=4 3653 B12R0.270 CC(C)CCCO[C@H](C)CC(C)C b07f8f00f3e9edcd5af6b4ff48a628ca [0,1,0,0,0,1|1,0,1]=4 3654 B12R0.270 CC(C)CCNCC(=O)CC(C)C 0e34a56949b1f5efc34b35bb5a26ddc7 [0,1,0,0,0,1|1,0,0]=3 3655 B12R0.270 CC(C)CCNCC(=O)NC(C)C dfbc974cc40e39ecc0444103c780bab8 [0,1,0,0,0,1|2,0,0]=4 3656 B12R0.270 CC(C)CCNCC(=O)OC(C)C abb68ef9796940ffd6fb50e0a695bc50 [0,1,0,0,0,1|2,0,0]=4 3657 B12R0.270 CC(C)CCOCC(=O)CC(=O)O ea42350d6f7aa6152049707f77385c1d [0,1,0,0,0,1|1,0,1]=4 3658 B12R0.270 CC(C)CCOCC(=O)CC(C)C 4056709ae3a53bc85e55e5ca4177a708 [0,1,0,0,0,1|0,0,0]=2 3659 B12R0.270 CC(C)CCOCC(=O)NC(C)C 5424f07e7bd64358e7cb183344d518d4 [0,1,0,0,0,1|1,0,0]=3 3660 B12R0.270 CC(C)CCOCC(=O)OC(C)C 1c2c5355a3737d231ec92a2e5bc73995 [0,1,0,0,0,1|1,0,0]=3 3661 B12R0.270 CC(C)CCOCC(C)CC(C)C 15c914e85a24b605e6165a5361b1677e [0,1,0,0,0,1|1,0,1]=4 3662 B12R0.270 CC(C)CNCCC(=O)NC(C)C 926dddc8a0531ba07bb33656473dcee1 [0,1,0,0,0,1|2,0,0]=4 3663 B12R0.270 CC(C)CNCCC(=O)OC(C)C 37d3bdd87d67af98d199465b21ff31ff [0,1,0,0,0,1|2,0,0]=4 3664 B12R0.270 CC(C)CNCOC(=O)CC(C)C 114f8cf4a8cf2c8f478bae99b7007a36 [0,1,0,0,0,1|0,0,0]=2 3665 B12R0.270 CC(C)CNCOC(=O)OC(C)C dda6302a16865b05edb5520ff29792e5 [0,1,0,0,0,1|1,0,0]=3 3666 B12R0.270 CC(C)COCCC(=O)NC(C)C b1a2b768bf7e4402e9f3ce59fcaa2b97 [0,1,0,0,0,1|2,0,0]=4 3667 B12R0.270 CC(C)COCCC(=O)OC(C)C 0074fd93c1c4106061be56d559a1f708 [0,1,0,0,0,1|2,0,0]=4 3668 B12R0.270 CC(C)COCOC(=O)CC(C)C a3e9d5344c75e3148e8a911cd2a05328 [0,1,0,0,0,1|0,0,0]=2 3669 B12R0.270 CC(C)COCOC(=O)OC(C)C aaa1ceae84023b6dafd292ebc80134f1 [0,1,0,0,0,1|1,0,0]=3 3670 B12R0.270 CC(C)C[C@@H](C)OCCOC(C)C 6aa288ab99a9f06afd1c19ecbd09fd9a [0,1,0,0,0,1|1,0,1]=4 3671 B12R0.270 CC(C)C[C@@H](C)OCCSC(C)C 748c834b09c6d18807f0af77b22544bc [0,1,0,0,0,1|1,0,1]=4 3672 B12R0.270 CC(C)C[C@H](C)OCCOC(C)C b9f19318892dc6ff633d0298bec30b33 [0,1,0,0,0,1|1,0,1]=4 3673 B12R0.270 CC(C)C[C@H](C)OCCSC(C)C 156b6130b7fff05cd8cef4ba5882c67d [0,1,0,0,0,1|1,0,1]=4 3674 B12R0.270 CC(C)NC(=O)COCCN(C)C e81d4c61f13390498438204cb5ca138c [0,1,0,0,0,1|2,0,0]=4 3675 B12R0.270 CC(C)NC(=O)COCOC(C)C baf8285a2f4e0611041cb43989ea7df6 [0,1,0,0,0,1|2,0,0]=4 3676 B12R0.270 CC(C)NCCNC(=O)NC(C)C 35604050844036ded6193fc2f5c47401 [0,1,0,0,0,1|2,0,0]=4 3677 B12R0.270 CC(C)OC(=O)COCCN(C)C 4ebbd85bc1bf5c2d6d7a2be35cebd047 [0,1,0,0,0,1|2,0,0]=4 3678 B12R0.270 CC(C)OC(=O)OCNC[C@@H](C)O 746b50c1de59e8f9f76f604a7d73fe27 [0,1,0,0,0,1|2,0,0]=4 3679 B12R0.270 CC(C)OC(=O)OCNC[C@H](C)O 0dbd6331a870de6cd1e2382516cbac55 [0,1,0,0,0,1|2,0,0]=4 3680 B12R0.270 CC(C)OC(=O)OCOC[C@@H](C)F 71fc9d8fc321a9895155fe0d8559028d [0,1,0,0,0,1|2,0,0]=4 3681 B12R0.270 CC(C)OC(=O)OCOC[C@H](C)F 859a3a8d29f3c3e257fcff44af8bbeba [0,1,0,0,0,1|2,0,0]=4 3682 B12R0.270 CC(C)OCCNC(=O)CC(F)F 39a9564bac0d6c6045d810c97d4621d7 [0,1,0,0,0,1|2,0,0]=4 3683 B12R0.270 CC(C)OCCNC(=O)CN(C)C d5a62e86cb5e443d6f839bda3a6979d2 [0,1,0,0,0,1|2,0,0]=4 3684 B12R0.270 CC(C)OCCNC(=O)C[C@@H](C)O 3c3acc1f2d533cdfea5b2209a7145756 [0,1,0,0,0,1|1,0,0]=3 3685 B12R0.270 CC(C)OCCNC(=O)C[C@H](C)O 41043de8b6f65b5051535cd4419eca4d [0,1,0,0,0,1|1,0,0]=3 3686 B12R0.270 CC(C)OCOCC(=O)OC(C)C fb8dad64040aff23670cffb4b76761d1 [0,1,0,0,0,1|2,0,0]=4 3687 B12R0.270 CC(F)COCOC(=O)OC(C)C a90dba7d333256f7eea5e67c70401863 [0,1,0,0,0,1|2,0,0]=4 3688 B12R0.270 CC(O)CC(=O)NCCCN(C)C 4435def4bed83859043e8e4756dcc105 [0,1,0,0,0,1|2,0,0]=4 3689 B12R0.270 CC(O)CC(=O)NCCOC(C)C 3925ba532c24033420c1d629d755857d [0,1,0,0,0,1|1,0,0]=3 3690 B12R0.270 CC(O)CNCOC(=O)OC(C)C 63c5163d05c05fe1bf4d72cac5a922c7 [0,1,0,0,0,1|2,0,0]=4 3691 B12R0.270 CC(S)COCOC(=O)OC(C)C e3ae5419c89c025187ba4c5ee3974216 [0,1,0,0,0,1|2,0,0]=4 3692 B12R0.270 C[C@@H](O)CC(=O)NCCCN(C)C 1bc89048fc6008a2c4e9bd5132f75bfa [0,1,0,0,0,1|2,0,0]=4 3693 B12R0.270 C[C@H](O)CC(=O)NCCCN(C)C ad819e09727fdd2748b1eb8cdc9b9b99 [0,1,0,0,0,1|2,0,0]=4 3694 B12R0.272 CC(C)CC(O)CNC(=O)CCF 5e353e4852e1aefdea16a50a71e130a0 [0,1,0,0,0,1|2,0,0]=4 3695 B12R0.272 CC(C)CC(O)CNC(=O)CCO eb35a80288cb98d2143375191a187cbe [0,1,0,0,0,1|2,0,0]=4 3696 B12R0.272 CC(C)CC(O)CNC(=O)CCS 5443ba2063f3dd3e3e4313bc4c758d73 [0,1,0,0,0,1|2,0,0]=4 3697 B12R0.272 CCCC(=O)CNC(C)CC(C)C 2c18da683b8e8c49f4c23f8e399a1c67 [0,1,0,0,0,1|1,0,0]=3 3698 B12R0.272 CCCC(=O)CNC(C)CC(C)O d8f000e2e674c2b674b682b688b7ae0b [0,1,0,0,0,1|2,0,0]=4 3699 B12R0.272 CCCC(=O)CNC(C)CN(C)C be3e859f64151bb69b3979c9b5a5ca3a [0,1,0,0,0,1|2,0,0]=4 3700 B12R0.272 CCCC(=O)CN[C@@H](C)CN(C)C 7078d3f82a39777d586d6e64ccc4b11b [0,1,0,0,0,1|2,0,0]=4 3701 B12R0.272 CCCC(=O)CN[C@H](C)CN(C)C c705031969667ba654475cbcde7ed3a2 [0,1,0,0,0,1|2,0,0]=4 3702 B12R0.272 CCCC(=O)COC(C)CC(C)C 9259f26ae85884306aff92439843ede8 [0,1,0,0,0,1|0,0,0]=2 3703 B12R0.272 CCCC(=O)COC(C)CN(C)C 025bb995d68705c9decc249725f9b8cc [0,1,0,0,0,1|1,0,0]=3 3704 B12R0.272 CCCC(=O)CO[C@@H](C)CC(C)C acb63438dd687a9fec05824d306bcaa9 [0,1,0,0,0,1|0,0,0]=2 3705 B12R0.272 CCCC(=O)CO[C@@H](C)CN(C)C 3fe0f0a402520ed3f72562a1199e8e74 [0,1,0,0,0,1|1,0,0]=3 3706 B12R0.272 CCCC(=O)CO[C@H](C)CC(C)C 0722174853ec844516044a5f2f6031d0 [0,1,0,0,0,1|0,0,0]=2 3707 B12R0.272 CCCC(=O)CO[C@H](C)CN(C)C d31deacf0618ce2d87e38ba1fb23ba0d [0,1,0,0,0,1|1,0,0]=3 3708 B12R0.272 CCCC(=O)NCC(=O)NC(C)C 00c1fcb4b5bd7e50471cd3eac772ce1a [0,1,0,0,0,1|1,0,1]=4 3709 B12R0.272 CCCC(=O)NCC(C)CN(C)C 2d4051cf5b95edc8774945e6d8c3013f [0,1,0,0,0,1|2,0,0]=4 3710 B12R0.272 CCCC(=O)NCC(O)CC(C)C 2dc1f2b5eb7798a9f7bc8c2b341931fc [0,1,0,0,0,1|1,0,0]=3 3711 B12R0.272 CCCC(=O)NCC(O)CN(C)C 9250e2288aa423d6e8185a6450846393 [0,1,0,0,0,1|2,0,0]=4 3712 B12R0.272 CCCC(=O)OCN(C)CC(C)C d2027a97a3a228fd97fcfa26ba22e0ad [0,1,0,0,0,1|0,0,0]=2 3713 B12R0.272 CCCC(=O)OCN(C)CC(C)O 1f4e7d6932f4cfc5af7c22283f4256a7 [0,1,0,0,0,1|1,0,0]=3 3714 B12R0.272 CCCC(=O)OCN(C)CC(F)F f199138a7cb36bea49efb8d336f07116 [0,1,0,0,0,1|2,0,0]=4 3715 B12R0.272 CCCC(=O)OCN(C)C[C@H](C)O 570a7452a4fc6ff9e61a95dae6444ab2 [0,1,0,0,0,1|1,0,0]=3 3716 B12R0.272 CCCC(=S)OCC(=O)CC(C)C b89fa21c4ee33deb5024d92bd0b584a7 [0,1,0,0,0,1|0,1,0]=3 3717 B12R0.272 CCCC(=S)OCC(=O)NC(C)C ffaedbf4812f39d4a2c96d43f5ec1f6c [0,1,0,0,0,1|0,1,1]=4 3718 B12R0.272 CCCC(=S)OCC(=O)OC(C)C b2ab04ffa9551a459241b71c8d0aec6a [0,1,0,0,0,1|0,1,1]=4 3719 B12R0.272 CCCC(=S)OCC(C)CN(C)C e19cbbd1299d9eccef1809a669fdc5b0 [0,1,0,0,0,1|1,1,0]=4 3720 B12R0.272 CCCC(C)COC(C)CC(C)C b60c7b80115f92c9f58aec4f91c9c72f [0,1,0,0,0,1|1,0,1]=4 3721 B12R0.272 CCCC(C)CO[C@@H](C)CC(C)C bface1ea40ffc464035837b65281c83c [0,1,0,0,0,1|1,0,1]=4 3722 B12R0.272 CCCC(C)CO[C@H](C)CC(C)C ee9b46a335305ba23fb003f026cb56f9 [0,1,0,0,0,1|1,0,1]=4 3723 B12R0.272 CCCC(C)OCC(=O)CC(C)C bb8b97107986540f1b895feace0f03b5 [0,1,0,0,0,1|1,0,1]=4 3724 B12R0.272 CCCC(C)OCC(C)CC(C)C 7581f3b696d62131f6e2f6dd3f5e06cc [0,1,0,0,0,1|1,0,1]=4 3725 B12R0.272 CCC[C@@H](C)OCC(=O)CC(C)C b95b4a3b7688f5f57fb1a1e9654c9f3d [0,1,0,0,0,1|1,0,1]=4 3726 B12R0.272 CCC[C@H](C)OCC(=O)CC(C)C aa53c1b1f285092dc2287d7597c0455a [0,1,0,0,0,1|1,0,1]=4 3727 B12R0.272 CCNC(=O)CCN(C)CC(C)C b1a852cacf76a578566c1124ebf30df8 [0,1,0,0,0,1|2,0,0]=4 3728 B12R0.272 CCNC(=O)CNC(C)CC(C)C 7659c5ad3d948d2968c8abfcb90bf670 [0,1,0,0,0,1|2,0,0]=4 3729 B12R0.272 CCNC(=O)COC(C)CC(C)C a2eae5cf222b5c418ba6d1cbb2f99be1 [0,1,0,0,0,1|1,0,0]=3 3730 B12R0.272 CCNC(=O)COC(C)CN(C)C f75cae6b24f0f93912be6327632606a5 [0,1,0,0,0,1|2,0,0]=4 3731 B12R0.272 CCNC(=O)CO[C@@H](C)CC(C)C 1135188c963b3d81bb012f85b55783ee [0,1,0,0,0,1|1,0,0]=3 3732 B12R0.272 CCNC(=O)CO[C@@H](C)CN(C)C b4cc10630e24a52ac0f68a3b15054b17 [0,1,0,0,0,1|2,0,0]=4 3733 B12R0.272 CCNC(=O)CO[C@H](C)CC(C)C bf2c5d4e05f4f1fb9735ff41a9c27cea [0,1,0,0,0,1|1,0,0]=3 3734 B12R0.272 CCNC(=O)CO[C@H](C)CN(C)C 1c9d907d7a012e51d34383d7088752f8 [0,1,0,0,0,1|2,0,0]=4 3735 B12R0.272 CCOC(=O)CCC(C)OC(C)C fe510f99b8e9ebd8380d070783dca9a0 [0,1,0,0,0,1|2,0,0]=4 3736 B12R0.272 CCOC(=O)CCN(C)CC(C)C adae75235a190f6490f196066bcd8d5b [0,1,0,0,0,1|2,0,0]=4 3737 B12R0.272 CCOC(=O)CNC(C)CC(C)C fa8bfadb20ca1e94f19bce3247413d4f [0,1,0,0,0,1|2,0,0]=4 3738 B12R0.272 CCOC(=O)COC(C)CC(C)C 47ad9dfba8395c396f05c2bdfadd1e37 [0,1,0,0,0,1|1,0,0]=3 3739 B12R0.272 CCOC(=O)COC(C)CN(C)C db725faec6a937da86f00234c870d226 [0,1,0,0,0,1|2,0,0]=4 3740 B12R0.272 CCOC(=O)CO[C@@H](C)CC(C)C fa11b95502e92f613ff180a8f576c671 [0,1,0,0,0,1|1,0,0]=3 3741 B12R0.272 CCOC(=O)CO[C@@H](C)CN(C)C bd88148ddb37289b9b0db4e5cee0b804 [0,1,0,0,0,1|2,0,0]=4 3742 B12R0.272 CCOC(=O)CO[C@H](C)CC(C)C ead76602780b8413a733c6a13b092a18 [0,1,0,0,0,1|1,0,0]=3 3743 B12R0.272 CCOC(=O)CO[C@H](C)CN(C)C b8af961f21d582cba0b959e9e788e16c [0,1,0,0,0,1|2,0,0]=4 3744 B12R0.272 CCOC(=O)OCN(C)CC(C)C 15741e48f982344182880a274a97c1de [0,1,0,0,0,1|1,0,0]=3 3745 B12R0.272 CCOC(=O)OCN(C)CC(C)O 70d43ff91f06df327ec67421e665b8f2 [0,1,0,0,0,1|2,0,0]=4 3746 B12R0.272 CCOC(=O)OCN(C)C[C@H](C)O 686cebfdfcf7026e31a1ffa8057c1f33 [0,1,0,0,0,1|2,0,0]=4 3747 B12R0.272 CCSC(=O)OCN(C)CC(C)C 03683596b2ac459b6283333bea1ba6a7 [0,1,0,0,0,1|1,0,0]=3 3748 B12R0.272 CCSC(=O)OCN(C)CC(C)O 16e19d4202f0af6156b73b21cc01bdc2 [0,1,0,0,0,1|2,0,0]=4 3749 B12R0.272 CCSC(=O)OCN(C)C[C@H](C)O 22033a80d1f3ee3afab492df18983455 [0,1,0,0,0,1|2,0,0]=4 3750 B12R0.272 COCC(=O)CNC(C)CC(C)C abe119c6c3821928f4d6c53a03fc8b14 [0,1,0,0,0,1|2,0,0]=4 3751 B12R0.272 COCC(=O)COC(C)CC(C)C 1c1de63ba9588f3923050308cd3a2777 [0,1,0,0,0,1|1,0,0]=3 3752 B12R0.272 COCC(=O)COC(C)CN(C)C 20d90e9bc4956ae75a5aeaf48ce65f1d [0,1,0,0,0,1|2,0,0]=4 3753 B12R0.272 COCC(=O)CO[C@@H](C)CC(C)C c57ec9ac119e1274600d35da7735d031 [0,1,0,0,0,1|1,0,0]=3 3754 B12R0.272 COCC(=O)CO[C@@H](C)CN(C)C cbd63340712f02dff9600ed0ee33b9dd [0,1,0,0,0,1|2,0,0]=4 3755 B12R0.272 COCC(=O)CO[C@H](C)CC(C)C 14128b1250e94e9471bdbfaddf0c3df9 [0,1,0,0,0,1|1,0,0]=3 3756 B12R0.272 COCC(=O)CO[C@H](C)CN(C)C 312560facec7980a14fd0fb5cb426c2b [0,1,0,0,0,1|2,0,0]=4 3757 B12R0.272 COCC(=O)NCC(O)CC(C)C 5f1bd08506dcce7d102f48a3d7f5312e [0,1,0,0,0,1|2,0,0]=4 3758 B12R0.272 CSCC(=O)NCC(O)CC(C)C 7a3e8d795916f6f17627e8382b9eb98e [0,1,0,0,0,1|2,0,0]=4 3759 B12R0.276 C=CC(C)COCOC(=O)CCC aefd15a7561f402471a86550201fdc1e [0,1,0,0,0,1|0,0,1]=3 3760 B12R0.276 C=CC(C)COCOC(=O)OCC 964c674d20b42104ec723676adfcbcff [0,1,0,0,0,1|1,0,1]=4 3761 B12R0.276 C=CC(C)COCOC(=O)SCC 5a820e1cf8f4a10ba1622dd475a9f6d0 [0,1,0,0,0,1|1,0,1]=4 3762 B12R0.276 C=CC(C)OCCOC(=O)CCC d79d3fd725fdc66dad0e5004ffea96fd [0,1,0,0,0,1|0,0,1]=3 3763 B12R0.276 C=CC(O)CNCOC(=O)CCC c3c590b57cbf76be2362e2a6451cad29 [0,1,0,0,0,1|1,0,1]=4 3764 B12R0.276 CC(CO)CCCNC(=O)CCF d3c088d81f133442a69cae7a0918432c [0,1,0,0,0,1|2,0,0]=4 3765 B12R0.276 CC(CO)CCCNC(=O)CCO 9e526af8735e6f5912d029af25e2e0df [0,1,0,0,0,1|2,0,0]=4 3766 B12R0.276 CC(CO)CCCNC(=O)CCS 7962b8c1741b017eb585f9b25743b97a [0,1,0,0,0,1|2,0,0]=4 3767 B12R0.276 CCC(C)CCNCC(=O)COC 9bc6c96b5d87008fba522aaae05950a5 [0,1,0,0,0,1|2,0,0]=4 3768 B12R0.276 CCC(C)CCOCC(=O)COC d47a45f3fb83b603efe5e5eea107ddbf [0,1,0,0,0,1|1,0,0]=3 3769 B12R0.276 CCC(S)CCOCC(=O)COC fec57679ee1f0e155db9938b339d44c9 [0,1,0,0,0,1|2,0,0]=4 3770 B12R0.276 CCCC(=O)CNCCC(C)CC 7addffaddc3f54d44ecc8e40d4abba07 [0,1,0,0,0,1|1,0,0]=3 3771 B12R0.276 CCCC(=O)CNCCC(C)CO 5aae0a4b9d2795659040bde0d82892bb [0,1,0,0,0,1|1,0,0]=3 3772 B12R0.276 CCCC(=O)CNCCC(O)CO c72b5ba6fe9946502962ae7613548898 [0,1,0,0,0,1|2,0,0]=4 3773 B12R0.276 CCCC(=O)CNCC[C@@H](C)CO b1c1414adbf69521b3950cdae649abc7 [0,1,0,0,0,1|1,0,0]=3 3774 B12R0.276 CCCC(=O)COCCC(=O)NC 1c7a5e7e2348763c348d8187567e95ea [0,1,0,0,0,1|1,0,1]=4 3775 B12R0.276 CCCC(=O)COCCC(=O)OC e4767c4a9de8a2e6600a4d60f87a6e6c [0,1,0,0,0,1|1,0,1]=4 3776 B12R0.276 CCCC(=O)COCCC(C)CC c7f459959a4b2fe0ac3657eddf397440 [0,1,0,0,0,1|0,0,0]=2 3777 B12R0.276 CCCC(=O)COCCC(C)OC 2912188d150e016287e770c7d5f965b9 [0,1,0,0,0,1|0,0,0]=2 3778 B12R0.276 CCCC(=O)COCCC(S)CC f4e36e7f12be4aa62a14a2df627fe5f0 [0,1,0,0,0,1|1,0,0]=3 3779 B12R0.276 CCCC(=O)COCCN(C)C#N 812ac256f03e19163d1dc06fc3d74ef1 [0,1,0,0,0,1|1,0,1]=4 3780 B12R0.276 CCCC(=O)COCCN(C)C=O 7923890df369458dccf5ee718dc6a654 [0,1,0,0,0,1|1,0,1]=4 3781 B12R0.276 CCCC(=O)COCC[C@@H](C)CC a56882399cd5b386d520ee473b017a1b [0,1,0,0,0,1|0,0,0]=2 3782 B12R0.276 CCCC(=O)NCCCC(C)CO b600fdc6d95aeb9b7e936d7c088ccd4e [0,1,0,0,0,1|1,0,0]=3 3783 B12R0.276 CCCC(=O)NCCCN(C)CC 1fa3bb713caffb490857dea70d222b0d [0,1,0,0,0,1|2,0,0]=4 3784 B12R0.276 CCCC(=O)OCCOC(C)C=O faa55f0ac8b4b4d2e06f0e427ca0d559 [0,1,0,0,0,1|0,0,1]=3 3785 B12R0.276 CCCC(=O)OCCOC(C)CC a4a6a2589daf29b089c1916679f2ee47 [0,1,0,0,0,1|0,0,0]=2 3786 B12R0.276 CCCC(=O)OCCO[C@H](C)C=O 56e7f3214d8e6bc3b37cb8c8941b11cf [0,1,0,0,0,1|0,0,1]=3 3787 B12R0.276 CCCC(=O)OCNCC(=O)NC 481054dbe1a6186629c8da61cb1f5cbc [0,1,0,0,0,1|1,0,1]=4 3788 B12R0.276 CCCC(=O)OCNCC(=O)OC 42fc508b3f6855685d2f11bc5b7cf3d2 [0,1,0,0,0,1|1,0,1]=4 3789 B12R0.276 CCCC(=O)OCNCC(Br)CBr 448f4d1124d009ceeb57c006d49bf138 [0,1,0,0,0,1|1,0,0]=3 3790 B12R0.276 CCCC(=O)OCNCC(C)C#N 913e6d0038d42878a829fe2be1819b0f [0,1,0,0,0,1|0,0,1]=3 3791 B12R0.276 CCCC(=O)OCNCC(C)CC e131bf4ecd9f14af8743b770d3a33652 [0,1,0,0,0,1|0,0,0]=2 3792 B12R0.276 CCCC(=O)OCNCC(C)CO 09d7ebd0c3c1fd992192bbbc9d35da1d [0,1,0,0,0,1|0,0,0]=2 3793 B12R0.276 CCCC(=O)OCNCC(F)CO 7d9ca3d8c1d73e9ba011a4ad2d38a16f [0,1,0,0,0,1|1,0,0]=3 3794 B12R0.276 CCCC(=O)OCNCC(O)CC c75b80727e50c6fd43c640c7d3a47288 [0,1,0,0,0,1|1,0,0]=3 3795 B12R0.276 CCCC(=O)OCNCC(O)CO 71884209985bb886eea5d819b34a9195 [0,1,0,0,0,1|1,0,0]=3 3796 B12R0.276 CCCC(=O)OCNC[C@@H](C)CC 32e4757c004e17d1a4c06a6ca7ba9e37 [0,1,0,0,0,1|0,0,0]=2 3797 B12R0.276 CCCC(=O)OCNC[C@@H](F)CO 5a415b825819bf365fcc8ca837be4715 [0,1,0,0,0,1|1,0,0]=3 3798 B12R0.276 CCCC(=O)OCNC[C@@H](O)CO ef05bcb1d5d33a4ad68dea66af85d958 [0,1,0,0,0,1|1,0,0]=3 3799 B12R0.276 CCCC(=O)OCNC[C@H](C)CO 60347cb82e85cda9a87d1b0bdadb98a4 [0,1,0,0,0,1|0,0,0]=2 3800 B12R0.276 CCCC(=O)OCNC[C@H](F)CO 22c3381d99fbf8d4d234dbedbdc4dc86 [0,1,0,0,0,1|1,0,0]=3 3801 B12R0.276 CCCC(=O)OCNC[C@H](O)CC 1ec0baa2338bbf9bb8cd2784e2a15135 [0,1,0,0,0,1|1,0,0]=3 3802 B12R0.276 CCCC(=O)OCNC[C@H](O)CO b67a8e5374b347510b74d5f452370b77 [0,1,0,0,0,1|1,0,0]=3 3803 B12R0.276 CCCC(=O)OCOC/C(=C/I)/C ce03ff234ef9bb0fde892876a38c54f2 [0,1,0,0,0,1|0,0,2]=4 3804 B12R0.276 CCCC(=O)OCOCC(=CI)C 27fd14db72a47cc1784b635c6ff72f0d [0,1,0,0,0,1|0,0,2]=4 3805 B12R0.276 CCCC(=O)OCOCC(=O)CC 1cc4b38efa7c501f34136db55a54cb2f [0,1,0,0,0,1|1,0,1]=4 3806 B12R0.276 CCCC(=O)OCOCC(=O)NC 1e956095281dddd267e59a5175faab35 [0,1,0,0,0,1|1,0,1]=4 3807 B12R0.276 CCCC(=O)OCOCC(=O)OC c5ad0689f3f17cb4ece56825443040d7 [0,1,0,0,0,1|1,0,1]=4 3808 B12R0.276 CCCC(=O)OCOCC(Br)CBr 2e9ab23ca6a96580eadb73cffc706419 [0,1,0,0,0,1|1,0,0]=3 3809 B12R0.276 CCCC(=O)OCOCC(C)C#N d64afe3a7d220de9018a929ea56a0a8c [0,1,0,0,0,1|0,0,1]=3 3810 B12R0.276 CCCC(=O)OCOCC(C)CC 258f6f6dc38197d29685f235e6f4317e [0,1,0,0,0,1|0,0,0]=2 3811 B12R0.276 CCCC(=O)OCOCC(C)OC abb326fae7812ce691471197aba691b4 [0,1,0,0,0,1|0,0,0]=2 3812 B12R0.276 CCCC(=O)OCOCC(Cl)CCl e217f1b1b462eb18e98b4e6d73275aa2 [0,1,0,0,0,1|1,0,0]=3 3813 B12R0.276 CCCC(=O)OCOCC(S)CS 917324717a3ce9f288689d389dc81dcf [0,1,0,0,0,1|1,0,0]=3 3814 B12R0.276 CCCC(=O)OCOC[C@@H](C)CC 251e3f0d67663a862b5bfbc94c847e1e [0,1,0,0,0,1|0,0,0]=2 3815 B12R0.276 CCCC(=O)OCOC[C@@H](C)OC c9982c8169d33534bc352b1045019388 [0,1,0,0,0,1|0,0,0]=2 3816 B12R0.276 CCCC(=O)OCOC[C@H](C)CC 02c7c60e9861764e38c0bd96fa99d3b1 [0,1,0,0,0,1|0,0,0]=2 3817 B12R0.276 CCCC(=O)OCOC[C@H](C)OC 4d700542e33caf8294569daad8c4ed1e [0,1,0,0,0,1|0,0,0]=2 3818 B12R0.276 CCCC(=S)OCCOC(C)C#N fd2b4dca3db8d58c9fada3d0b955f73f [0,1,0,0,0,1|0,1,1]=4 3819 B12R0.276 CCCC(C)COCCC(C)CC c57fd5b7b9cab09533115f0f42102c9f [0,1,0,0,0,1|1,0,1]=4 3820 B12R0.276 CCCC(C)COCCC(C)OC f00bb29faa60862db03b602b02b3961c [0,1,0,0,0,1|1,0,1]=4 3821 B12R0.276 CCCC(C)COCC[C@@H](C)CC 2b007eb7caeae5fd1c33612a863449eb [0,1,0,0,0,1|1,0,1]=4 3822 B12R0.276 CCCC(C)OCCCC(C)CC 066d6e284a4157007d9f519bd7df8f6c [0,1,0,0,0,1|1,0,1]=4 3823 B12R0.276 CCCC(C)OCCC[C@@H](C)CC 171e035e7e70b79797e5f4f97b2e6d92 [0,1,0,0,0,1|1,0,1]=4 3824 B12R0.276 CCNC(=O)CCNCC(C)CC b3c10ae7c9159b42c4092845b03de511 [0,1,0,0,0,1|2,0,0]=4 3825 B12R0.276 CCNC(=O)CCNCC(C)CO 30a586679029f71bf90492194c229c2f [0,1,0,0,0,1|2,0,0]=4 3826 B12R0.276 CCNC(=O)CCNC[C@@H](C)CC 0dcb4e7f55d50d2ae288f4c3c756c4c3 [0,1,0,0,0,1|2,0,0]=4 3827 B12R0.276 CCNC(=O)CCNC[C@@H](C)OC fa647ae39479e2732badcead95efef11 [0,1,0,0,0,1|2,0,0]=4 3828 B12R0.276 CCNC(=O)CCNC[C@H](C)CO 8aef7842aeff7c5b21aa62e47b498fe7 [0,1,0,0,0,1|2,0,0]=4 3829 B12R0.276 CCNC(=O)CCNC[C@H](C)OC 36f0187877f2b5d12f46b468c7c6a82d [0,1,0,0,0,1|2,0,0]=4 3830 B12R0.276 CCNC(=O)CCOCC(C)CC ba199194ab8a8adfb793561c972e3872 [0,1,0,0,0,1|2,0,0]=4 3831 B12R0.276 CCNC(=O)CCOCC(C)OC cd04b3f51d8f458ccbc08ca3dd223859 [0,1,0,0,0,1|2,0,0]=4 3832 B12R0.276 CCNC(=O)CCOC[C@@H](C)CC 7de9f41a2f8568af910011644a62fa54 [0,1,0,0,0,1|2,0,0]=4 3833 B12R0.276 CCNC(=O)CCOC[C@@H](C)OC 0ad78999c15bec6387593cab7acc7b39 [0,1,0,0,0,1|2,0,0]=4 3834 B12R0.276 CCNC(=O)CCOC[C@H](C)CC 4360ee4ad8f504a29d5f5cb41546e7d6 [0,1,0,0,0,1|2,0,0]=4 3835 B12R0.276 CCNC(=O)CCOC[C@H](C)OC 7ccf0983c33a117a077a56abbb9d7f34 [0,1,0,0,0,1|2,0,0]=4 3836 B12R0.276 CCNC(=O)CNCCC(C)CC 88576509745e460f777260663369d93d [0,1,0,0,0,1|2,0,0]=4 3837 B12R0.276 CCNC(=O)CNCCC(C)CO 7131c904fce51e43a7336dd958a6e0f4 [0,1,0,0,0,1|2,0,0]=4 3838 B12R0.276 CCNC(=O)CNCC[C@@H](C)CO 867909a08e05e0e8a002aab2faf874a0 [0,1,0,0,0,1|2,0,0]=4 3839 B12R0.276 CCNC(=O)COCCC(C)CC 5910c5d57e87e53c20428bf29b1acdf3 [0,1,0,0,0,1|1,0,0]=3 3840 B12R0.276 CCNC(=O)COCCC(C)OC d89ecf08745d3d24ad28d56dc6aec01a [0,1,0,0,0,1|1,0,0]=3 3841 B12R0.276 CCNC(=O)COCCC(S)CC cede9677b050f3280794f0a349fd254f [0,1,0,0,0,1|2,0,0]=4 3842 B12R0.276 CCNC(=O)COCC[C@@H](C)CC f7da9b5193a6369da0b6b4813712cdfa [0,1,0,0,0,1|1,0,0]=3 3843 B12R0.276 CCOC(=O)CCCNC(C)CC beb95b7ecc1f2cd05f6df378e369bad3 [0,1,0,0,0,1|2,0,0]=4 3844 B12R0.276 CCOC(=O)CCCNC(C)CO 3ede27bdff6861f9a01d15b62e74eb09 [0,1,0,0,0,1|2,0,0]=4 3845 B12R0.276 CCOC(=O)CCCN[C@@H](C)CC c08178b231a4920784961cd36d92dba8 [0,1,0,0,0,1|2,0,0]=4 3846 B12R0.276 CCOC(=O)CCCN[C@@H](C)CO 1d220465b2b02e12e065242674e27956 [0,1,0,0,0,1|2,0,0]=4 3847 B12R0.276 CCOC(=O)CCCN[C@H](C)CC 1c5836220dc57dd0c7a5a6784b114dfc [0,1,0,0,0,1|2,0,0]=4 3848 B12R0.276 CCOC(=O)CCCN[C@H](C)CO 0270a3c9429ee0ce53e8ee7228812416 [0,1,0,0,0,1|2,0,0]=4 3849 B12R0.276 CCOC(=O)CCCOC(C)CC 75fc84fbbc1258a79d9f956ae6e1ad71 [0,1,0,0,0,1|2,0,0]=4 3850 B12R0.276 CCOC(=O)CCCOC(C)CF 8a59c805beb0df0f453bbe1a00a2e50a [0,1,0,0,0,1|2,0,0]=4 3851 B12R0.276 CCOC(=O)CCCOC(C)CS cf72f444286b38b544fe019ac7f55dec [0,1,0,0,0,1|2,0,0]=4 3852 B12R0.276 CCOC(=O)CCCO[C@@H](C)CC 9bb24c6b0eabe1dcd3df53886938874e [0,1,0,0,0,1|2,0,0]=4 3853 B12R0.276 CCOC(=O)CCCO[C@H](C)CC 1434fb0b55fe92d808b5c6f71b926bb6 [0,1,0,0,0,1|2,0,0]=4 3854 B12R0.276 CCOC(=O)CCCO[C@H](C)CS d4fb0ad758fad3d8f6c5bbab55eeb95f [0,1,0,0,0,1|2,0,0]=4 3855 B12R0.276 CCOC(=O)CCNCC(C)CC a9834b8974ea52160da23299eafcfe55 [0,1,0,0,0,1|2,0,0]=4 3856 B12R0.276 CCOC(=O)CCNCC(C)CO ce925d23c3173b5f19b09e7ffac0eda9 [0,1,0,0,0,1|2,0,0]=4 3857 B12R0.276 CCOC(=O)CCNCC(C)OC f8133cd96e4a930eb006f7804f202cf1 [0,1,0,0,0,1|2,0,0]=4 3858 B12R0.276 CCOC(=O)CCNC[C@@H](C)CC 6e42212600b9c2d83d9aa71b8ec529ac [0,1,0,0,0,1|2,0,0]=4 3859 B12R0.276 CCOC(=O)CCNC[C@@H](C)CO c38ac4d25e473dcb131cf7dc764a5d1c [0,1,0,0,0,1|2,0,0]=4 3860 B12R0.276 CCOC(=O)CCNC[C@@H](C)OC 8cba93312ba5fb53b746dd05c3cc4e6f [0,1,0,0,0,1|2,0,0]=4 3861 B12R0.276 CCOC(=O)CCNC[C@H](C)CC b2b631177af9af0e145eeb9c6f369235 [0,1,0,0,0,1|2,0,0]=4 3862 B12R0.276 CCOC(=O)CCNC[C@H](C)CO 263dbd7d17d3ddf1b12ec249dad7f669 [0,1,0,0,0,1|2,0,0]=4 3863 B12R0.276 CCOC(=O)CCNC[C@H](C)OC b19fa00e9fcc2f3c6fcfd20196cf9899 [0,1,0,0,0,1|2,0,0]=4 3864 B12R0.276 CCOC(=O)CCOCC(C)CC f50c84868ccba9a95882f742193ea6b5 [0,1,0,0,0,1|2,0,0]=4 3865 B12R0.276 CCOC(=O)CCOCC(C)OC 84dd96881dac69bc82a56f5200204886 [0,1,0,0,0,1|2,0,0]=4 3866 B12R0.276 CCOC(=O)CCOC[C@@H](C)CC 0cc6f2becb8f8bc487193870755fc87a [0,1,0,0,0,1|2,0,0]=4 3867 B12R0.276 CCOC(=O)CCOC[C@@H](C)OC 65cae3bc763fbdaf4cc443eba6faf582 [0,1,0,0,0,1|2,0,0]=4 3868 B12R0.276 CCOC(=O)CCOC[C@H](C)CC 8e91b4481829b59b006fe3f233ef7338 [0,1,0,0,0,1|2,0,0]=4 3869 B12R0.276 CCOC(=O)CCOC[C@H](C)OC eccfbf779d9b2979fe528f8029e0ddbe [0,1,0,0,0,1|2,0,0]=4 3870 B12R0.276 CCOC(=O)CNCCC(C)CC ea6f45ef3596a93906ed058be6dcab49 [0,1,0,0,0,1|2,0,0]=4 3871 B12R0.276 CCOC(=O)CNCCC(C)CO 2e85516cc7c2442382a4c4eb13b7fbc3 [0,1,0,0,0,1|2,0,0]=4 3872 B12R0.276 CCOC(=O)CNCC[C@@H](C)CO 9b5191530ed32ca5fdcc42878b33f11f [0,1,0,0,0,1|2,0,0]=4 3873 B12R0.276 CCOC(=O)COCCC(C)CC 39cfa337f35e6c5cc1f9ac82d18e2a51 [0,1,0,0,0,1|1,0,0]=3 3874 B12R0.276 CCOC(=O)COCCC(C)OC 81f3bb0a51bae645d40422a9b1844e2b [0,1,0,0,0,1|1,0,0]=3 3875 B12R0.276 CCOC(=O)COCCC(S)CC e9f6fd893f9e46af7bb6010d6bf37b2d [0,1,0,0,0,1|2,0,0]=4 3876 B12R0.276 CCOC(=O)COCC[C@@H](C)CC 6c0a0bcb0a35dcc87ead0eb527257d6c [0,1,0,0,0,1|1,0,0]=3 3877 B12R0.276 CCOC(=O)OCNCC(Br)CBr 3940e26d8469243a1985fd2470f4d3e0 [0,1,0,0,0,1|2,0,0]=4 3878 B12R0.276 CCOC(=O)OCNCC(C)C#N edd38ea17cfabed80e6bd93b55cd8790 [0,1,0,0,0,1|1,0,1]=4 3879 B12R0.276 CCOC(=O)OCNCC(C)CC ce67f7c2fac1bac695caead08dfa240f [0,1,0,0,0,1|1,0,0]=3 3880 B12R0.276 CCOC(=O)OCNCC(C)CO 1cdd3694df55895e4ba3e7974d3615e9 [0,1,0,0,0,1|1,0,0]=3 3881 B12R0.276 CCOC(=O)OCNCC(F)CO d5cb434c92f8333acd78fb55eb2f1758 [0,1,0,0,0,1|2,0,0]=4 3882 B12R0.276 CCOC(=O)OCNCC(O)CC bc950e362832326310658a338130b5c2 [0,1,0,0,0,1|2,0,0]=4 3883 B12R0.276 CCOC(=O)OCNCC(O)CO 06c183a07f216fcfd4036802a095218d [0,1,0,0,0,1|2,0,0]=4 3884 B12R0.276 CCOC(=O)OCNC[C@@H](C)CC f3e2c694011e5c311893aded95f34254 [0,1,0,0,0,1|1,0,0]=3 3885 B12R0.276 CCOC(=O)OCNC[C@@H](C)OC 4da82d031fb03e804bf65e77283f6bdf [0,1,0,0,0,1|1,0,0]=3 3886 B12R0.276 CCOC(=O)OCNC[C@@H](F)CO 4047172b1f86f839672312afcdb98f9f [0,1,0,0,0,1|2,0,0]=4 3887 B12R0.276 CCOC(=O)OCNC[C@@H](O)CO d2db3f4ca65d4912dcc02e86aa2816a8 [0,1,0,0,0,1|2,0,0]=4 3888 B12R0.276 CCOC(=O)OCNC[C@H](C)CO e5ebc01309cc31029dfe95322a6a3097 [0,1,0,0,0,1|1,0,0]=3 3889 B12R0.276 CCOC(=O)OCNC[C@H](C)OC 5e42f50a86f72f5898d4664188e1e3d2 [0,1,0,0,0,1|1,0,0]=3 3890 B12R0.276 CCOC(=O)OCNC[C@H](F)CO 590fc8395fb54c0fc5cf901a83a3bee8 [0,1,0,0,0,1|2,0,0]=4 3891 B12R0.276 CCOC(=O)OCNC[C@H](O)CC 85cf6757e734334cc9c349467a8c3c0a [0,1,0,0,0,1|2,0,0]=4 3892 B12R0.276 CCOC(=O)OCNC[C@H](O)CO 5d3a3a281d8a2bd42ae2be9a1c7c77bb [0,1,0,0,0,1|2,0,0]=4 3893 B12R0.276 CCOC(=O)OCOCC(Br)CBr b0f602ad41d3f5a50787a265c1b49fb7 [0,1,0,0,0,1|2,0,0]=4 3894 B12R0.276 CCOC(=O)OCOCC(C)C#N 39869ecd8da6e84f9ceef134f4fee9bd [0,1,0,0,0,1|1,0,1]=4 3895 B12R0.276 CCOC(=O)OCOCC(C)CC 5dd1fe02f2ca83f0ce9ec7cec01bdc76 [0,1,0,0,0,1|1,0,0]=3 3896 B12R0.276 CCOC(=O)OCOCC(C)OC 01b2f7c3a3951c1893d08e35aba23fe5 [0,1,0,0,0,1|1,0,0]=3 3897 B12R0.276 CCOC(=O)OCOCC(Cl)CCl 493adf9c428cd588d732d6202fa8ad5a [0,1,0,0,0,1|2,0,0]=4 3898 B12R0.276 CCOC(=O)OCOCC(S)CS a69fec4f54a5db4b86a73e593adbca87 [0,1,0,0,0,1|2,0,0]=4 3899 B12R0.276 CCOC(=O)OCOC[C@@H](C)CC 860b4a368a419e432f30fc043ecb7f3a [0,1,0,0,0,1|1,0,0]=3 3900 B12R0.276 CCOC(=O)OCOC[C@@H](C)OC f587479b3c728efc807bd7cdb3d74953 [0,1,0,0,0,1|1,0,0]=3 3901 B12R0.276 CCOC(=O)OCOC[C@H](C)CC b8efb951c46cdcdf97c7330081b9cf2c [0,1,0,0,0,1|1,0,0]=3 3902 B12R0.276 CCOC(=O)OCOC[C@H](C)OC eec1b824d02aad6aed97c9ff1692509f [0,1,0,0,0,1|1,0,0]=3 3903 B12R0.276 CCSC(=O)OCNCC(Br)CBr 50ce54dfd1213472b5da033f8fd5a257 [0,1,0,0,0,1|2,0,0]=4 3904 B12R0.276 CCSC(=O)OCNCC(C)C#N a062a4911060fdd8bb7033a0fbf663f0 [0,1,0,0,0,1|1,0,1]=4 3905 B12R0.276 CCSC(=O)OCNCC(C)CC 0771ae3aff54e91198ca3e0f435b1480 [0,1,0,0,0,1|1,0,0]=3 3906 B12R0.276 CCSC(=O)OCNCC(C)CO bff0322b8291e9999c2e209322d92013 [0,1,0,0,0,1|1,0,0]=3 3907 B12R0.276 CCSC(=O)OCNCC(F)CO a375576fe76e92340b46f8a339945e5c [0,1,0,0,0,1|2,0,0]=4 3908 B12R0.276 CCSC(=O)OCNCC(O)CC c650d228591b82be9bc7d0afac5fa5df [0,1,0,0,0,1|2,0,0]=4 3909 B12R0.276 CCSC(=O)OCNCC(O)CO c04f534f9ecde14b88d77a76aacffb3a [0,1,0,0,0,1|2,0,0]=4 3910 B12R0.276 CCSC(=O)OCNC[C@@H](C)CC 640d4863cd97e1d261d65d3dd3cd2fc9 [0,1,0,0,0,1|1,0,0]=3 3911 B12R0.276 CCSC(=O)OCNC[C@@H](C)OC 090b1fe800742ddf3a358a1b47ef2470 [0,1,0,0,0,1|1,0,0]=3 3912 B12R0.276 CCSC(=O)OCNC[C@@H](F)CO 2b67d2034272735d0fc248e4de8ac489 [0,1,0,0,0,1|2,0,0]=4 3913 B12R0.276 CCSC(=O)OCNC[C@@H](O)CO 0bb1de1240bf763d4fa6b3b5da02d2da [0,1,0,0,0,1|2,0,0]=4 3914 B12R0.276 CCSC(=O)OCNC[C@H](C)CO 8eb22d31269bf65a435d2d54af6ce611 [0,1,0,0,0,1|1,0,0]=3 3915 B12R0.276 CCSC(=O)OCNC[C@H](C)OC bfed6f5695ff7ecca49f2033f1580daa [0,1,0,0,0,1|1,0,0]=3 3916 B12R0.276 CCSC(=O)OCNC[C@H](F)CO 8028e6464a4fa62b04648de6b9621587 [0,1,0,0,0,1|2,0,0]=4 3917 B12R0.276 CCSC(=O)OCNC[C@H](O)CC 6774e03ea076ee210f5af50c3ebd831d [0,1,0,0,0,1|2,0,0]=4 3918 B12R0.276 CCSC(=O)OCNC[C@H](O)CO 9d5ea77a1aaa59fd564adb1b60055057 [0,1,0,0,0,1|2,0,0]=4 3919 B12R0.276 CCSC(=O)OCOCC(Br)CBr 20ebef347def0d42c3399a6c66839745 [0,1,0,0,0,1|2,0,0]=4 3920 B12R0.276 CCSC(=O)OCOCC(C)C#N 5ff964100bfd3afe3e7b00e07bf6a577 [0,1,0,0,0,1|1,0,1]=4 3921 B12R0.276 CCSC(=O)OCOCC(C)CC 737e8d608f70319ee9c954f1048fc9f6 [0,1,0,0,0,1|1,0,0]=3 3922 B12R0.276 CCSC(=O)OCOCC(C)OC df1e54543fdf0ccc72ac5a26e32b97a8 [0,1,0,0,0,1|1,0,0]=3 3923 B12R0.276 CCSC(=O)OCOCC(Cl)CCl 40dfd7f2fb4e5f8887de98a57148e7fb [0,1,0,0,0,1|2,0,0]=4 3924 B12R0.276 CCSC(=O)OCOCC(S)CS bb5a7790fa9094a0903effbef05cb3aa [0,1,0,0,0,1|2,0,0]=4 3925 B12R0.276 CCSC(=O)OCOC[C@@H](C)CC 8a401127dd577af72ae336bc849b2aca [0,1,0,0,0,1|1,0,0]=3 3926 B12R0.276 CCSC(=O)OCOC[C@@H](C)OC 10bf4f3e778dccbbeae6a2e2a096dba2 [0,1,0,0,0,1|1,0,0]=3 3927 B12R0.276 CCSC(=O)OCOC[C@H](C)CC 087943ef20d3aa760d8dbc436337ca8e [0,1,0,0,0,1|1,0,0]=3 3928 B12R0.276 CCSC(=O)OCOC[C@H](C)OC a870cf66788f84c7e17a223cf15926ca [0,1,0,0,0,1|1,0,0]=3 3929 B12R0.276 CC[C@H](C)CCOCC(=O)COC b0edb295c3119f3756a3b88562b66801 [0,1,0,0,0,1|1,0,0]=3 3930 B12R0.276 COCC(=O)CNCCC(C)CO b01e5b52c6ff5e6b7f659dab0afe73f8 [0,1,0,0,0,1|2,0,0]=4 3931 B12R0.276 COCC(=O)CNCC[C@@H](C)CO b78c478bde8393cb87b7d3845242bcee [0,1,0,0,0,1|2,0,0]=4 3932 B12R0.276 COCC(=O)COCCC(C)OC c9fe9acc2a7a2e776f3ff04b2f72fed2 [0,1,0,0,0,1|1,0,0]=3 3933 B12R0.276 COCC(=O)NCCCC(C)CO 1296c0f4ce7d415377a0ae8d20c856a9 [0,1,0,0,0,1|2,0,0]=4 3934 B12R0.276 CSCC(=O)NCCCC(C)CO c9deda695b4db51554ebd709e90bf852 [0,1,0,0,0,1|2,0,0]=4 3935 B12R0.279 CC(C)N(C)CCNC(=O)CCF b15167cd9a0c1d64629cddf7fad2d317 [0,1,0,0,0,1|2,0,0]=4 3936 B12R0.279 CC(C)N(C)CCNC(=O)CCO 6a5031d87c8f4f2491d54ec7ccdee5dd [0,1,0,0,0,1|2,0,0]=4 3937 B12R0.279 CC(C)N(C)CCNC(=O)CCS dfe9fa01316a9b4f81d05bda78387566 [0,1,0,0,0,1|2,0,0]=4 3938 B12R0.279 CCCC(=O)CNCC(C)N(C)C 42df9fcc514c66ba7e372425730289a5 [0,1,0,0,0,1|2,0,0]=4 3939 B12R0.279 CCCC(=O)CNCC(O)C(C)C 4a056e89ca8fa2e1cf671128a602050d [0,1,0,0,0,1|1,0,0]=3 3940 B12R0.279 CCCC(=O)COCC(=O)N(C)C 8c9dc47e50dbb60aa6a40885342cfaba [0,1,0,0,0,1|1,0,1]=4 3941 B12R0.279 CCCC(=O)COCC(C)C(=O)C b418bcc4e974a1bc7cba95e7800556b1 [0,1,0,0,0,1|1,0,1]=4 3942 B12R0.279 CCCC(=O)COCC(C)C(C)C d92b4ebcd4d7458fddd49f0b703b9fb0 [0,1,0,0,0,1|0,0,0]=2 3943 B12R0.279 CCCC(=O)COCC(C)N(C)C 59b67611b1715d95b1d45f0ecc26d150 [0,1,0,0,0,1|1,0,0]=3 3944 B12R0.279 CCCC(=O)COC[C@@H](C)N(C)C 977634c1c65b619c84719452f80d6ad8 [0,1,0,0,0,1|1,0,0]=3 3945 B12R0.279 CCCC(=O)COC[C@H](C)N(C)C 51f047c670757c804c94b6160bc8ed15 [0,1,0,0,0,1|1,0,0]=3 3946 B12R0.279 CCCC(=O)NCCC(=O)N(C)C f3ff1adad51db3689179b32f2a2b0515 [0,1,0,0,0,1|2,0,0]=4 3947 B12R0.279 CCCC(=O)NCCC(C)N(C)C 4792dd40911d9b8b5e9041b387aa1b0a [0,1,0,0,0,1|2,0,0]=4 3948 B12R0.279 CCCC(=O)NCCN(C)C(C)C bbfeb14ec214cd8d415bb75c43dd3bf7 [0,1,0,0,0,1|1,0,0]=3 3949 B12R0.279 CCCC(=O)NCC[C@@H](C)N(C)C a1f062e01def449c3dda27737083c31e [0,1,0,0,0,1|2,0,0]=4 3950 B12R0.279 CCCC(=O)NCC[C@H](C)N(C)C c8fb89d2707d874342d4059c431d130c [0,1,0,0,0,1|2,0,0]=4 3951 B12R0.279 CCCC(=O)OCNC(C)C(C)C 3b061970ce6afc68a2d56aa0abec8972 [0,1,0,0,0,1|0,0,0]=2 3952 B12R0.279 CCCC(=O)OCNC(C)C(C)O 9aabb4760393d20536f507652f5da1ee [0,1,0,0,0,1|1,0,0]=3 3953 B12R0.279 CCCC(=O)OCN[C@@H](C)C(C)C dbcebf2f7382e7fc8a70dc4a679643d9 [0,1,0,0,0,1|0,0,0]=2 3954 B12R0.279 CCCC(=O)OCN[C@@H](C)C(F)F 31964957fa83e86bb6772f7937067518 [0,1,0,0,0,1|2,0,0]=4 3955 B12R0.279 CCCC(=O)OCN[C@H](C)C(C)C 90f5d846dd8d302b7ecfe8497f4aeb2a [0,1,0,0,0,1|0,0,0]=2 3956 B12R0.279 CCCC(=O)OCN[C@H](C)C(F)F e39e06fed154f129e7bcd85c32a25708 [0,1,0,0,0,1|2,0,0]=4 3957 B12R0.279 CCCC(=O)OCOC(C)C(=O)C bf3db0eae2a2cb21c886c9d9bd743000 [0,1,0,0,0,1|1,0,1]=4 3958 B12R0.279 CCCC(=O)OCOC(C)C(C)C c2accffffba48812b19653797f4a8f98 [0,1,0,0,0,1|0,0,0]=2 3959 B12R0.279 CCCC(=O)OCOC(C)C(C)S 59996a49529b8571cbe982419462711b [0,1,0,0,0,1|1,0,0]=3 3960 B12R0.279 CCCC(=O)OCOC(C)C(F)F d528ff80bba628e3f6c00b5a1bff126c [0,1,0,0,0,1|2,0,0]=4 3961 B12R0.279 CCCC(=O)OCO[C@@H](C)C(C)C ff38d091e47a2f2852806d39870bb615 [0,1,0,0,0,1|0,0,0]=2 3962 B12R0.279 CCCC(=O)OCO[C@H](C)C(C)C a870b6cad8f81008965a685726ca8911 [0,1,0,0,0,1|0,0,0]=2 3963 B12R0.279 CCCC(=S)OCCC(=O)N(C)C 4ce4f21a52f9925074e158ad2fff3b7a [0,1,0,0,0,1|1,1,0]=4 3964 B12R0.279 CCCC(=S)OCOC(=O)C(C)C 4a156a66ca62814f2828e852b3b9007b [0,1,0,0,0,1|0,1,1]=4 3965 B12R0.279 CCCC(C)COCC(C)C(C)C 61d57c187ec9447bac001e1493abf052 [0,1,0,0,0,1|1,0,1]=4 3966 B12R0.279 CCCC(C)OCCC(C)C(C)C 9cf709aeb1c15462901cfff3e2bfea71 [0,1,0,0,0,1|1,0,1]=4 3967 B12R0.279 CCNC(=O)CCNC(C)C(C)C f58f06bffa1ee58af7538398efb08b84 [0,1,0,0,0,1|2,0,0]=4 3968 B12R0.279 CCNC(=O)CCN[C@@H](C)C(C)C 3ac99d2a33d2dc348bea0ce537d32455 [0,1,0,0,0,1|2,0,0]=4 3969 B12R0.279 CCNC(=O)CCN[C@H](C)C(C)C 4513f84aa3d2725edef54cb3b8d9185f [0,1,0,0,0,1|2,0,0]=4 3970 B12R0.279 CCNC(=O)CCOC(C)C(C)C 8084e4c3197ab1fdede7ddba6bde0440 [0,1,0,0,0,1|2,0,0]=4 3971 B12R0.279 CCNC(=O)CCO[C@@H](C)C(C)C 93262c39b1fc96ec2d9074058f1d9544 [0,1,0,0,0,1|2,0,0]=4 3972 B12R0.279 CCNC(=O)CCO[C@H](C)C(C)C 0896a8662839d54991d06b57a1a29b18 [0,1,0,0,0,1|2,0,0]=4 3973 B12R0.279 CCNC(=O)CNCC(C)C(C)C 7534fa7f47a648e79fc9ce428fb3b790 [0,1,0,0,0,1|2,0,0]=4 3974 B12R0.279 CCNC(=O)CNCC(O)C(C)C e73198b046f5f92804f5f383ffd32e7e [0,1,0,0,0,1|2,0,0]=4 3975 B12R0.279 CCNC(=O)COCC(=O)C(C)C f0322c28f6cb2b40103c5c63f0e871dc [0,1,0,0,0,1|1,0,1]=4 3976 B12R0.279 CCNC(=O)COCC(C)C(C)C 0b71f3f5cd2bc8186685ebbf80eb5bd4 [0,1,0,0,0,1|1,0,0]=3 3977 B12R0.279 CCNC(=O)COCC(C)N(C)C 153beb79a88a593f32f7c4972bd0381e [0,1,0,0,0,1|2,0,0]=4 3978 B12R0.279 CCNC(=O)COC[C@@H](C)N(C)C 23be35b7835680665f8a3688bf1188ea [0,1,0,0,0,1|2,0,0]=4 3979 B12R0.279 CCNC(=O)COC[C@H](C)N(C)C 25230d1a0e9bb25d3c1d7f8f724ad39b [0,1,0,0,0,1|2,0,0]=4 3980 B12R0.279 CCOC(=O)CCNC(C)C(C)C 5d4173fc65814894c7c0c44b549eeda2 [0,1,0,0,0,1|2,0,0]=4 3981 B12R0.279 CCOC(=O)CCN[C@@H](C)C(C)C 7c975044a436ac42f44b8bf873c3b76a [0,1,0,0,0,1|2,0,0]=4 3982 B12R0.279 CCOC(=O)CCN[C@H](C)C(C)C a37913c39c7f50abfd3079e0ac13207b [0,1,0,0,0,1|2,0,0]=4 3983 B12R0.279 CCOC(=O)CCOC(C)C(C)C 88c72a0ff94bee8e5ee31c454680ad76 [0,1,0,0,0,1|2,0,0]=4 3984 B12R0.279 CCOC(=O)CCO[C@@H](C)C(C)C 3fde3040cb2691c5f1a260dc3d72b4d2 [0,1,0,0,0,1|2,0,0]=4 3985 B12R0.279 CCOC(=O)CCO[C@H](C)C(C)C 54a58c015a5cbaa87fcc0de481e03dbb [0,1,0,0,0,1|2,0,0]=4 3986 B12R0.279 CCOC(=O)CNCC(C)C(C)C 3373c652bf6482ce7b18469b9f2c725d [0,1,0,0,0,1|2,0,0]=4 3987 B12R0.279 CCOC(=O)CNCC(O)C(C)C 64c5871886c67875c33de269fd5a3232 [0,1,0,0,0,1|2,0,0]=4 3988 B12R0.279 CCOC(=O)COCC(=O)C(C)C 2e43743a047b55df6d55a9a247e82dba [0,1,0,0,0,1|1,0,1]=4 3989 B12R0.279 CCOC(=O)COCC(C)C(C)C 38294057d970da43b7f4d3c0c20ce8cd [0,1,0,0,0,1|1,0,0]=3 3990 B12R0.279 CCOC(=O)COCC(C)N(C)C d2f3210a7a23cfe70fe87ee3ed49ab91 [0,1,0,0,0,1|2,0,0]=4 3991 B12R0.279 CCOC(=O)COC[C@@H](C)N(C)C ee5a9922083bd1c299c27b25256e7561 [0,1,0,0,0,1|2,0,0]=4 3992 B12R0.279 CCOC(=O)COC[C@H](C)N(C)C 8c8be22fc3394fafd911f047cc7b80c0 [0,1,0,0,0,1|2,0,0]=4 3993 B12R0.279 CCOC(=O)OCNC(C)C(C)C 2a9887d255acf7621ef91505f3ce8378 [0,1,0,0,0,1|1,0,0]=3 3994 B12R0.279 CCOC(=O)OCNC(C)C(C)O 58c2210ff1bc2aee8aeeeb63de96dbf1 [0,1,0,0,0,1|2,0,0]=4 3995 B12R0.279 CCOC(=O)OCN[C@@H](C)C(C)C 27368b86a82510ed2d4f4a7ef819ee61 [0,1,0,0,0,1|1,0,0]=3 3996 B12R0.279 CCOC(=O)OCN[C@H](C)C(C)C 33ff1105ea20fb69bd3790642dee330f [0,1,0,0,0,1|1,0,0]=3 3997 B12R0.279 CCOC(=O)OCOC(C)C(C)C e003ce610ca423f70a6467a9a7c9a4e0 [0,1,0,0,0,1|1,0,0]=3 3998 B12R0.279 CCOC(=O)OCOC(C)C(C)S 08cd656907890a33421b4db7db1e1966 [0,1,0,0,0,1|2,0,0]=4 3999 B12R0.279 CCOC(=O)OCO[C@@H](C)C(C)C 5994cb46e993d19c4da8b5c4aa625342 [0,1,0,0,0,1|1,0,0]=3 4000 B12R0.279 CCOC(=O)OCO[C@H](C)C(C)C 95dd2590d72ad6a4a4f013589930ad43 [0,1,0,0,0,1|1,0,0]=3 4001 B12R0.279 CCSC(=O)OCNC(C)C(C)C ead5513332f2266c6a4934f122e2ee8b [0,1,0,0,0,1|1,0,0]=3 4002 B12R0.279 CCSC(=O)OCNC(C)C(C)O 0b63c1c2a384662d5ceaeafb8ad3a2cb [0,1,0,0,0,1|2,0,0]=4 4003 B12R0.279 CCSC(=O)OCN[C@@H](C)C(C)C 5dd92203432976c105ccaf4663d33fba [0,1,0,0,0,1|1,0,0]=3 4004 B12R0.279 CCSC(=O)OCN[C@H](C)C(C)C a34c20c026109b1faad81f3683676d53 [0,1,0,0,0,1|1,0,0]=3 4005 B12R0.279 CCSC(=O)OCOC(C)C(C)C b6a25bbafc22a27b9f88e1febd2fc979 [0,1,0,0,0,1|1,0,0]=3 4006 B12R0.279 CCSC(=O)OCOC(C)C(C)S 461f12b8eb6f803358fd35493153afcf [0,1,0,0,0,1|2,0,0]=4 4007 B12R0.279 CCSC(=O)OCO[C@@H](C)C(C)C 8430c9212b89ff039804d863ce59fa2e [0,1,0,0,0,1|1,0,0]=3 4008 B12R0.279 CCSC(=O)OCO[C@H](C)C(C)C 518a3b848159c73b04c6b0307c3aeedb [0,1,0,0,0,1|1,0,0]=3 4009 B12R0.279 COCC(=O)CNCC(O)C(C)C 22df071231a3e0b33235dbe13f55e73b [0,1,0,0,0,1|2,0,0]=4 4010 B12R0.279 COCC(=O)COCC(C)C(C)C dd58d25ae61a7f3e5f8b3371be23a369 [0,1,0,0,0,1|1,0,0]=3 4011 B12R0.279 COCC(=O)COCC(C)N(C)C 80d29dfc8d5cf54d427e11de6535f970 [0,1,0,0,0,1|2,0,0]=4 4012 B12R0.279 COCC(=O)COC[C@@H](C)N(C)C c6b9cd5f9ad052b17488ec19e948b0fa [0,1,0,0,0,1|2,0,0]=4 4013 B12R0.279 COCC(=O)COC[C@H](C)N(C)C 84a0bd78b2229ea506f97b4c42addf89 [0,1,0,0,0,1|2,0,0]=4 4014 B12R0.279 COCC(=O)NCCN(C)C(C)C 3e41556ecc98fdbcdaac75e442de4536 [0,1,0,0,0,1|2,0,0]=4 4015 B12R0.279 CSCC(=O)NCCN(C)C(C)C 37eeb23b1975f66d15631cb48e04a6b4 [0,1,0,0,0,1|2,0,0]=4 4016 B12R0.283 CC(C)CCC(C)NC(=O)CCF 8059d89493cc1a4751429c05339a84eb [0,1,0,0,0,1|2,0,0]=4 4017 B12R0.283 CC(C)CCC(C)NC(=O)CCO e22ccc14667cc9bbe0a2b996ff0fd75a [0,1,0,0,0,1|2,0,0]=4 4018 B12R0.283 CC(C)CCC(C)NC(=O)CCS 7ac6b5ee13168afa47b9a988314202f4 [0,1,0,0,0,1|2,0,0]=4 4019 B12R0.283 CCCC(=O)CC(=O)NCC(C)C 6da34ce0249229a18801b7e16108c807 [0,1,0,0,0,1|1,0,1]=4 4020 B12R0.283 CCCC(=O)CN(C)CCC(C)C 240119eb287f8a50a572acfcd6d89eb1 [0,1,0,0,0,1|1,0,0]=3 4021 B12R0.283 CCCC(=O)CN(C)CCC(C)O 3c9850533d248e52cbba3c2b92fe3333 [0,1,0,0,0,1|2,0,0]=4 4022 B12R0.283 CCCC(=O)CN(C)CCN(C)C 53d9c4a01ce7e65efd419d1ff26e2d0a [0,1,0,0,0,1|2,0,0]=4 4023 B12R0.283 CCCC(=O)NC(C)CCC(C)C c4787f98fb703edfe798b311201a5efa [0,1,0,0,0,1|1,0,0]=3 4024 B12R0.283 CCCC(=O)NC(C)CCN(C)C e83fbfdfb9cebb3889d2220bbb363c19 [0,1,0,0,0,1|2,0,0]=4 4025 B12R0.283 CCCC(=O)N[C@@H](C)CCN(C)C c72cdff309901933ffd6d1b909f92dd8 [0,1,0,0,0,1|2,0,0]=4 4026 B12R0.283 CCCC(=O)N[C@H](C)CCN(C)C c55c33213bd52d5645d7b7fdd99a2dc1 [0,1,0,0,0,1|2,0,0]=4 4027 B12R0.283 CCCC(=S)OC(C)CCC(C)C ee3691871b962623d0b183dc740d32a1 [0,1,0,0,0,1|0,1,0]=3 4028 B12R0.283 CCCC(C)OC(C)CCC(C)C 67aed6449a66109f932d230db5da03dd [0,1,0,0,0,1|1,0,1]=4 4029 B12R0.283 CCCC(C)OC(C)COC(C)C a914eae545f44451d17d655e37fc0c63 [0,1,0,0,0,1|1,0,1]=4 4030 B12R0.283 CCCC(C)O[C@@H](C)COC(C)C 64bd02b9ef603bd88713d4dde794c330 [0,1,0,0,0,1|1,0,1]=4 4031 B12R0.283 CCC[C@@H](C)OC(C)CCC(C)C 4493d29e72caf7df896125b08b0011c7 [0,1,0,0,0,1|1,0,1]=4 4032 B12R0.283 CCC[C@H](C)OC(C)CCC(C)C b2fb4a984683d600581787412c203b10 [0,1,0,0,0,1|1,0,1]=4 4033 B12R0.283 CCNC(=O)CN(C)CCC(C)C 7cc32b419d8554184371535b3fa5482f [0,1,0,0,0,1|2,0,0]=4 4034 B12R0.283 CCOC(=O)CC(C)NCC(C)C 014f214a3546077694989b79103b4c9d [0,1,0,0,0,1|2,0,0]=4 4035 B12R0.283 CCOC(=O)CC(C)OCC(C)C 2d53705e46b8ad5eeff0ad6454b6b91c [0,1,0,0,0,1|2,0,0]=4 4036 B12R0.283 CCOC(=O)CC(F)COC(C)C c3db4c6b69410e55bd673c3c297a8461 [0,1,0,0,0,1|2,0,0]=4 4037 B12R0.283 CCOC(=O)CN(C)CCC(C)C e8456eb921f1b1c0a561271159173e2c [0,1,0,0,0,1|2,0,0]=4 4038 B12R0.283 CCOC(=O)C[C@@H](C)OCC(C)C ef82c51ccdeacc71118858a05269d5ae [0,1,0,0,0,1|2,0,0]=4 4039 B12R0.283 CCOC(=O)C[C@H](C)OCC(C)C 22d2008b6de686ac7c19cb308fb0be42 [0,1,0,0,0,1|2,0,0]=4 4040 B12R0.283 CCOC(=O)OC(C)NCC(C)C 6241bd1bdd603cacb1d0c9b32b4bae7a [0,1,0,0,0,1|1,0,0]=3 4041 B12R0.283 CCOC(=O)OC(C)NCC(C)O ad88d09e730efdc0fa873ff0213c0e13 [0,1,0,0,0,1|2,0,0]=4 4042 B12R0.283 CCOC(=O)OC(C)NC[C@@H](C)O 55a7db3ca03753083b987fa597ce6f14 [0,1,0,0,0,1|2,0,0]=4 4043 B12R0.283 CCOC(=O)OC(C)NC[C@H](C)O f4db08e9bcad02dab52e6f2a477ecbf7 [0,1,0,0,0,1|2,0,0]=4 4044 B12R0.283 CCOC(=O)OC(C)OCC(C)C e57d6da70a03464a872db2156ddafbd7 [0,1,0,0,0,1|1,0,0]=3 4045 B12R0.283 CCOC(=O)OC(C)OCC(C)F 63092f4b63cedcf146ae4c60d068635b [0,1,0,0,0,1|2,0,0]=4 4046 B12R0.283 CCOC(=O)OC(C)OCC(C)S fc7adf71a1f0764f2b573cea17c47afc [0,1,0,0,0,1|2,0,0]=4 4047 B12R0.283 CCOC(=O)OC(C)OC[C@@H](C)F cbd4eb1530cb16d098ad068037264f02 [0,1,0,0,0,1|2,0,0]=4 4048 B12R0.283 CCOC(=O)OC(C)OC[C@H](C)F 80ce6cbb426df8f04638c932d383def2 [0,1,0,0,0,1|2,0,0]=4 4049 B12R0.283 COCC(=O)CN(C)CCC(C)C b98513f241ccd181bcc64b8ffa9df0d4 [0,1,0,0,0,1|2,0,0]=4 4050 B12R0.283 COCC(=O)NC(C)CCC(C)C 773fac0d111deb87d3ead007f7dbf069 [0,1,0,0,0,1|2,0,0]=4 4051 B12R0.283 CSCC(=O)NC(C)CCC(C)C 49f9f56e9bb0d3e06a81a1d4f1459bdf [0,1,0,0,0,1|2,0,0]=4 4052 B12R0.2 C#CCCC(=O)NC(C)CC(C)C a3f3973a3aa92e0e01f978640f8f3264 [0,2,0,0,0,0|1,0,1]=4 4053 B12R0.2 C/C=C/CC(=O)NC(C)CC(C)C d87b1aa8484d6627e14da23960f3803b [0,2,0,0,0,0|1,0,1]=4 4054 B12R0.2 C=CCCC(=O)NC(C)CC(C)C 360c78ba54c0826bf498c1e4c86911a7 [0,2,0,0,0,0|1,0,1]=4 4055 B12R0.2 CC#CCC(=O)NC(C)CC(C)C 3775482b675a8fdad15d4ff371f6408a [0,2,0,0,0,0|1,0,1]=4 4056 B12R0.2 CC(C)CC(C)CC(=O)NCCBr aff333fe11f7f8e158cee1d765002869 [0,2,0,0,0,0|2,0,0]=4 4057 B12R0.2 CC(C)CC(C)CC(=O)NCCF 79a911c1cf252de73bf9082cde4423fa [0,2,0,0,0,0|2,0,0]=4 4058 B12R0.2 CC(C)CC(C)CC(=O)NCCI 0428143e2649828cf24fbbc5a0e444c4 [0,2,0,0,0,0|2,0,0]=4 4059 B12R0.2 CC(C)CC(C)CC(=O)NCCO f900cb1d4d64674f781cf7396309a564 [0,2,0,0,0,0|2,0,0]=4 4060 B12R0.2 CC(C)CC(C)CC(=O)NCCS 65ba2d795c71d9cafacdfe20957db2ff [0,2,0,0,0,0|2,0,0]=4 4061 B12R0.2 CC(C)CC(C)NC(=O)CCC#N 76641ed0bc7051faf091fd4bd717c8ed [0,2,0,0,0,0|1,0,1]=4 4062 B12R0.2 CC(C)CC(C)NC(=O)CCC=O e39749ef57483a3b249708078d384af1 [0,2,0,0,0,0|1,0,1]=4 4063 B12R0.2 CC(C)CC(C)NC(=O)CCCF 73206a75bccedf52a6aa789055c5e75a [0,2,0,0,0,0|1,0,0]=3 4064 B12R0.2 CC(C)CC(C)NC(=O)CCCS 15f98e86d96e8d75a8f3c4fc71c41d3d [0,2,0,0,0,0|1,0,0]=3 4065 B12R0.2 CC(C)CC(C)NC(=O)NCCF 2b1c6c7369b1202c693f8345b4bf3ea9 [0,2,0,0,0,0|2,0,0]=4 4066 B12R0.2 CC(C)CC(C)NC(=O)NCCN 8d9b54a596d2f6c35c594c9de682323a [0,2,0,0,0,0|2,0,0]=4 4067 B12R0.2 CC(C)CC(C)NC(=O)NCCO 01b943222e5360f879d3fe429573897d [0,2,0,0,0,0|2,0,0]=4 4068 B12R0.2 CC(C)CC(C)NC(=O)NCCS 0bf025bcc21fecbbd1aad0843a93906e [0,2,0,0,0,0|2,0,0]=4 4069 B12R0.2 CC(C)CC(O)CC(=O)NCCBr 57b05a05d0d58e8a2cc6c08e1cd0ce72 [0,2,0,0,0,0|2,0,0]=4 4070 B12R0.2 CC(C)CC(O)CC(=O)NCCF 12e4b465a8e3bda091deee88938d4cc2 [0,2,0,0,0,0|2,0,0]=4 4071 B12R0.2 CC(C)CC(O)CC(=O)NCCI 86f5f371fbcada59094261780a1ae4e5 [0,2,0,0,0,0|2,0,0]=4 4072 B12R0.2 CC(C)CC(O)CC(=O)NCCO 4d539d92b5c2b02477752cca2716f22f [0,2,0,0,0,0|2,0,0]=4 4073 B12R0.2 CC(C)CC(O)CC(=O)NCCS a7bf450eb6380283653860f9c5c8b4b5 [0,2,0,0,0,0|2,0,0]=4 4074 B12R0.2 CC(CN(C)C)NC(=O)CCCF 34a118e5e48f0400a70897b124009950 [0,2,0,0,0,0|2,0,0]=4 4075 B12R0.2 CC(CN(C)C)NC(=O)CCCS f41b1061b014cae3cee2abf2a8260250 [0,2,0,0,0,0|2,0,0]=4 4076 B12R0.2 CC(O)CC(C)NC(=O)CCCF d7f57a5d681f8861d0d06f2af23e43c9 [0,2,0,0,0,0|2,0,0]=4 4077 B12R0.2 CC(O)CC(C)NC(=O)CCCS 09be70f704b263518c512b3bd1afa279 [0,2,0,0,0,0|2,0,0]=4 4078 B12R0.2 CC/C=C/C(=O)NC(C)CC(C)C 4279aa3b1d31caeb27666535e444ea2b [0,2,0,0,0,0|1,0,1]=4 4079 B12R0.2 CC/C=C\C(=O)NC(C)CC(C)C edacae0f73827e3d22337c1b6a0fe368 [0,2,0,0,0,0|1,0,1]=4 4080 B12R0.2 CCC#CC(=O)NC(C)CC(C)C ae8899b41879be73aeb9b8b9bac89aa0 [0,2,0,0,0,0|1,0,1]=4 4081 B12R0.2 CCC=CC(=O)NC(C)CC(C)C e11c7170b85887e0ccefb10edcbe9c8d [0,2,0,0,0,0|1,0,1]=4 4082 B12R0.2 CCCCC(=O)NC(C)CC(C)C 8741167164621bc1af071dca0f6daea7 [0,2,0,0,0,0|1,0,0]=3 4083 B12R0.2 CCCCC(=O)NC(C)CC(C)O 290cea5e4941770b3e3feed5cedccd0f [0,2,0,0,0,0|2,0,0]=4 4084 B12R0.2 CCCCC(=O)NC(C)CN(C)C c760f34fad55a28ddff03c8c07af4018 [0,2,0,0,0,0|2,0,0]=4 4085 B12R0.2 CCCCC(=O)N[C@@H](C)CN(C)C 73379fdb654113ba1f03162395bda177 [0,2,0,0,0,0|2,0,0]=4 4086 B12R0.2 CCCCC(=O)N[C@H](C)CN(C)C 615d246c85d4326fc47b50b2c7994f9f [0,2,0,0,0,0|2,0,0]=4 4087 B12R0.2 CCCCC(C)OC(C)CC(C)C 0a4432f48169e5c2e08a8687b666469f [0,2,0,0,0,0|1,0,1]=4 4088 B12R0.2 CCCCC(C)O[C@@H](C)CC(C)C 7d3da19f938792a7547b3769b4d86eb2 [0,2,0,0,0,0|1,0,1]=4 4089 B12R0.2 CCCCC(C)O[C@H](C)CC(C)C 342ad2b9482bca9bd8e2b894940c1f2b [0,2,0,0,0,0|1,0,1]=4 4090 B12R0.2 CCCC[C@@H](C)OC(C)CC(C)C ec1e5df070c9fc492a805dc057f5045b [0,2,0,0,0,0|1,0,1]=4 4091 B12R0.2 CCCC[C@H](C)OC(C)CC(C)C e84b92aac9e7668635aa77690007c059 [0,2,0,0,0,0|1,0,1]=4 4092 B12R0.2 CCCNC(=O)CC(C)CC(C)C 727306cbee96c714a7e597aade6ceb25 [0,2,0,0,0,0|1,0,0]=3 4093 B12R0.2 CCCNC(=O)CC(O)CC(C)C 1b53352b0866b04d82ad6268659878a6 [0,2,0,0,0,0|1,0,0]=3 4094 B12R0.2 CCCNC(=O)CN(C)CC(C)C 7b4f6a0869c7d59a55978a155d4ac372 [0,2,0,0,0,0|2,0,0]=4 4095 B12R0.2 CCCNC(=O)NC(C)CC(C)C 7b8e27d87479d419d07a1309979a407d [0,2,0,0,0,0|1,0,0]=3 4096 B12R0.2 CCCNC(=O)NC(C)CC(C)O b361f6ce2c4c0708a74911a3d972c5aa [0,2,0,0,0,0|2,0,0]=4 4097 B12R0.2 CCCNC(=O)NC(C)CN(C)C 86da3a3fedfb15db7e321cd753b10c7b [0,2,0,0,0,0|2,0,0]=4 4098 B12R0.2 CCCNC(=O)N[C@@H](C)CN(C)C a8763d5fd1a5aaea9b2fb6f32b619f6e [0,2,0,0,0,0|2,0,0]=4 4099 B12R0.2 CCCNC(=O)N[C@H](C)CN(C)C 6696058b13d80cd7eebcaa06986e3f88 [0,2,0,0,0,0|2,0,0]=4 4100 B12R0.2 CCCNC(=S)NC(C)CC(C)C 4ed2ff1516b72e166dc1b313cf8bed84 [0,2,0,0,0,0|1,1,0]=4 4101 B12R0.2 CCCOC(=O)CN(C)CC(C)C 4bf3e6fa6f7b4541616d348dc2fa119a [0,2,0,0,0,0|2,0,0]=4 4102 B12R0.2 CCOCC(=O)NC(C)CC(C)C 3618293d10efbec0a84ee8585dcd7369 [0,2,0,0,0,0|1,0,0]=3 4103 B12R0.2 CCOCC(=O)NC(C)CC(C)O 94fbbdabf8a9e44d2ea2d2af42cabfb0 [0,2,0,0,0,0|2,0,0]=4 4104 B12R0.2 CCOCC(=O)NC(C)CN(C)C 4741e671221c02a947381bba045a5a0d [0,2,0,0,0,0|2,0,0]=4 4105 B12R0.2 CCOCC(=O)N[C@@H](C)CN(C)C 8d313f1d2038aa93446517c4c6a0dcc9 [0,2,0,0,0,0|2,0,0]=4 4106 B12R0.2 CCOCC(=O)N[C@H](C)CN(C)C 1ae62525173f1e9be05d39f85e1ddd2e [0,2,0,0,0,0|2,0,0]=4 4107 B12R0.2 CCOCC(C)OC(C)CC(C)C ddd0657da295a95c082c61fda58e92f7 [0,2,0,0,0,0|1,0,1]=4 4108 B12R0.2 CCSCC(=O)NC(C)CC(C)C 9dd5c23b801e5968bb97d64c15e0b816 [0,2,0,0,0,0|1,0,0]=3 4109 B12R0.2 CCSCC(=O)NC(C)CC(C)O af1219980cd2586427ae65a356e28992 [0,2,0,0,0,0|2,0,0]=4 4110 B12R0.2 CCSCC(=O)NC(C)CN(C)C 1356dd96e68cdbe60d70440cd61334e9 [0,2,0,0,0,0|2,0,0]=4 4111 B12R0.2 CCSCC(=O)N[C@@H](C)CN(C)C c8bbb8996aab5a7426097a2a5f6ebb56 [0,2,0,0,0,0|2,0,0]=4 4112 B12R0.2 CCSCC(=O)N[C@H](C)CN(C)C 8d32e2bdc342b9433b9822a870d4a514 [0,2,0,0,0,0|2,0,0]=4 4113 B12R0.2 COCCC(=O)NC(C)CC(C)C 5c3a438134d1c7b3c156e0e5773ed8af [0,2,0,0,0,0|1,0,0]=3 4114 B12R0.2 COCCC(=O)NC(C)CC(C)O 37b3a009ad6736eab11db057fd0260f6 [0,2,0,0,0,0|2,0,0]=4 4115 B12R0.2 COCCC(=O)NC(C)CN(C)C 839a176e9afce09dc9cf660a0f89f771 [0,2,0,0,0,0|2,0,0]=4 4116 B12R0.2 COCCC(=O)N[C@@H](C)CN(C)C 568e38906e5761a2edaaf46ea904a6bc [0,2,0,0,0,0|2,0,0]=4 4117 B12R0.2 COCCC(=O)N[C@H](C)CN(C)C a55483c6f3026ad66d664c504f24c45a [0,2,0,0,0,0|2,0,0]=4 4118 B12R0.2 COCCC(C)OC(C)CC(C)C 3414187a9b49e3e42499e046e7d34221 [0,2,0,0,0,0|1,0,1]=4 4119 B12R0.2 CSCCC(=O)CN(C)CC(C)C 396bdaf9fa364ec20117a38702814c26 [0,2,0,0,0,0|2,0,0]=4 4120 B12R0.2 CSCCC(=O)NC(C)CC(C)C 05d076bc30f98a198c634b0dd8fcffc7 [0,2,0,0,0,0|1,0,0]=3 4121 B12R0.2 CSCCC(=O)NC(C)CC(C)O aebf14336f4a1cb55840858be4072c7c [0,2,0,0,0,0|2,0,0]=4 4122 B12R0.2 CSCCC(=O)NC(C)CN(C)C b0c3e2a5cc789b401583e06d61cb508f [0,2,0,0,0,0|2,0,0]=4 4123 B12R0.2 CSCCC(=O)N[C@@H](C)CN(C)C 422c9cfb372aab680d4bfa84f995e223 [0,2,0,0,0,0|2,0,0]=4 4124 B12R0.2 CSCCC(=O)N[C@H](C)CN(C)C 225aff9be769b7fdff9daab3e1bf891e [0,2,0,0,0,0|2,0,0]=4 4125 B12R0.2 CSCCC(C)OC(C)CC(C)C 8a0b0c7e1bd1f1d79c1848a8ce8c2b8c [0,2,0,0,0,0|1,0,1]=4 4126 B12R0.2 CSSCC(=O)NC(C)CC(C)C c54f518c70754eae0ded2cc3d3ccde5e [0,2,0,0,0,0|2,0,0]=4 4127 B12R0.2 C[C@@H](CN(C)C)NC(=O)CCCF 8ea321a2a9889320f9449bbad8e042b2 [0,2,0,0,0,0|2,0,0]=4 4128 B12R0.2 C[C@@H](CN(C)C)NC(=O)CCCS 6380bc549303cefd8e29cb7c4908b528 [0,2,0,0,0,0|2,0,0]=4 4129 B12R0.2 C[C@H](CN(C)C)NC(=O)CCCF b6c43b7e6bd3ad52d4cb5a42c2e7b243 [0,2,0,0,0,0|2,0,0]=4 4130 B12R0.2 C[C@H](CN(C)C)NC(=O)CCCS 7455bae99b9e234850a5bb3cdef6d9d0 [0,2,0,0,0,0|2,0,0]=4 4131 B12R0.3 C=C(C)CC(=O)NC(C)CC(C)C cbdbb8a15d085c59ef52414ac1b06b77 [0,2,0,0,0,0|1,0,1]=4 4132 B12R0.3 CC(=O)CC(=O)NC(C)CC(C)C f884c8d526e8cd1a18ec9f313a50f236 [0,2,0,0,0,0|1,0,1]=4 4133 B12R0.3 CC(C)CC(=O)CN(C)CC(C)C 7474142563a75ed25b4407560660afdf [0,2,0,0,0,0|2,0,0]=4 4134 B12R0.3 CC(C)CC(=O)NC(C)CC(C)C 7e94e19592265b56eaba19eb9f72c041 [0,2,0,0,0,0|1,0,0]=3 4135 B12R0.3 CC(C)CC(=O)NC(C)CC(C)O f71158ce1b2032bc121459e0018b15c2 [0,2,0,0,0,0|2,0,0]=4 4136 B12R0.3 CC(C)CC(=O)NC(C)CN(C)C 8e55e632446896ae95e8a08379c40677 [0,2,0,0,0,0|2,0,0]=4 4137 B12R0.3 CC(C)CC(=O)N[C@@H](C)CN(C)C 883ab483027c2db38c7e570c8fd870f0 [0,2,0,0,0,0|2,0,0]=4 4138 B12R0.3 CC(C)CC(=O)N[C@H](C)CN(C)C 456d1a4e2a6c96d279424b6dde551c2b [0,2,0,0,0,0|2,0,0]=4 4139 B12R0.3 CC(C)CC(C)NC(=O)CC(C)O 55c07fc5089ac5725f737d45e7a4ed5d [0,2,0,0,0,0|1,0,0]=3 4140 B12R0.3 CC(C)CC(C)NC(=O)CC(F)F 91991b410d89575469b67c4bec1e98bf [0,2,0,0,0,0|2,0,0]=4 4141 B12R0.3 CC(C)CC(C)NC(=O)CN(C)C afae3da8e434b5a71ca9e0cf2eae0a87 [0,2,0,0,0,0|2,0,0]=4 4142 B12R0.3 CC(C)CC(C)NC(=O)C[C@@H](C)O 4f000a0cd307f55c9945ace3c14ca3c0 [0,2,0,0,0,0|1,0,0]=3 4143 B12R0.3 CC(C)CC(C)NC(=O)C[C@H](C)O 83a0ef08466e66ffd7e0ac21cf1b5941 [0,2,0,0,0,0|1,0,0]=3 4144 B12R0.3 CC(C)CC(C)OC(C)CC(C)C 8f82a52720e76e125fe4b10b0a916266 [0,2,0,0,0,0|1,0,1]=4 4145 B12R0.3 CC(C)CC(C)O[C@@H](C)CC(C)C c079744c6a624391b91d8c58f7e290d8 [0,2,0,0,0,0|1,0,1]=4 4146 B12R0.3 CC(C)CC(C)O[C@H](C)CC(C)C b37234eb476458334ac19d4458ed1d9e [0,2,0,0,0,0|1,0,1]=4 4147 B12R0.3 CC(C)OC(=O)OC(C)OC(C)C 59477f16e2b8b551254508ad0d15d38e [0,2,0,0,0,0|2,0,0]=4 4148 B12R0.3 CC(CN(C)C)NC(=O)C[C@@H](C)O ea72f98f009fbe5705f60db9bfef406d [0,2,0,0,0,0|2,0,0]=4 4149 B12R0.3 CC(CN(C)C)NC(=O)C[C@H](C)O 94c94c9f00220172ef4c1bb4cdebe812 [0,2,0,0,0,0|2,0,0]=4 4150 B12R0.3 CC(O)CC(=O)NC(C)CC(C)O 80f10968a80fd79a0fee948948893b4b [0,2,0,0,0,0|2,0,0]=4 4151 B12R0.3 CC(O)CC(=O)NC(C)CN(C)C cde5ea13a87bde2360f8bad6306b1445 [0,2,0,0,0,0|2,0,0]=4 4152 B12R0.3 CC(O)CC(=O)N[C@@H](C)CN(C)C e383781c095c4cea78a0bcda64c73644 [0,2,0,0,0,0|2,0,0]=4 4153 B12R0.3 CC(O)CC(=O)N[C@H](C)CN(C)C 5345f1db584ed02801c47d39ee87cb91 [0,2,0,0,0,0|2,0,0]=4 4154 B12R0.3 CC(O)CC(C)NC(=O)C[C@@H](C)O 93de532df981122944f3a31adc1f66dc [0,2,0,0,0,0|2,0,0]=4 4155 B12R0.3 CC(O)CC(C)NC(=O)C[C@H](C)O 02cd30c8920703e3505abb2be5fa8562 [0,2,0,0,0,0|2,0,0]=4 4156 B12R0.3 C[C@@H](O)CC(=O)N[C@@H](C)CN(C)C a4bd246d1e40d1fac8ab6001d17536ea [0,2,0,0,0,0|2,0,0]=4 4157 B12R0.3 C[C@H](CN(C)C)NC(=O)C[C@@H](C)O fccbe96fbd20fc0f365d39354e900f9e [0,2,0,0,0,0|2,0,0]=4 4158 B12R0.3 C[C@H](O)CC(=O)N[C@@H](C)CN(C)C c46d5a0e453b3dafc1dbb8cc1a7f7123 [0,2,0,0,0,0|2,0,0]=4 4159 B12R0.3 C[C@H](O)CC(=O)N[C@H](C)CN(C)C ce722e9014bd7d393086ca38641735f6 [0,2,0,0,0,0|2,0,0]=4 4160 B12R0.18 C#CC(CC(C)C)OC(C)CCC 90a81c6fca7a7d28fbfe8fa194105faa [0,2,0,0,0,0|1,0,1]=4 4161 B12R0.18 C=CC(CC(C)C)OC(C)CCC 274cf9eed92e42886ef81f26d515734f [0,2,0,0,0,0|1,0,1]=4 4162 B12R0.18 CC(C)CC(C#N)NC(=O)CCF eed4a7d397ede57aa5d3e6ab4d2fa6e0 [0,2,0,0,0,0|2,0,0]=4 4163 B12R0.18 CC(C)CC(C#N)NC(=O)CCO b4f02453a0d1d99ffdecfa73986d1802 [0,2,0,0,0,0|2,0,0]=4 4164 B12R0.18 CC(C)CC(C#N)NC(=O)CCS 7a25f0fc457903c070253cf3a8ad82b6 [0,2,0,0,0,0|2,0,0]=4 4165 B12R0.18 CC(C)CC(CO)NC(=O)CCF 145afe5c5f27b81bdb3845f721a70d07 [0,2,0,0,0,0|2,0,0]=4 4166 B12R0.18 CC(C)CC(CO)NC(=O)CCO a205f2c038e5998670e74329cdf68855 [0,2,0,0,0,0|2,0,0]=4 4167 B12R0.18 CC(C)CC(CO)NC(=O)CCS b5d2aa81f6a5a3bdd28c13dd02d4beee [0,2,0,0,0,0|2,0,0]=4 4168 B12R0.18 CC(C)C[C@@H](CO)NC(=O)CCF 833b0426faeb284d23e64d06ea458f09 [0,2,0,0,0,0|2,0,0]=4 4169 B12R0.18 CC(C)C[C@@H](CO)NC(=O)CCO ce39d83a0f86ed4a01e90985d981d684 [0,2,0,0,0,0|2,0,0]=4 4170 B12R0.18 CC(C)C[C@@H](CO)NC(=O)CCS b330a84f6f01d94f6d9f7180d4e4a7c1 [0,2,0,0,0,0|2,0,0]=4 4171 B12R0.18 CC(C)C[C@H](CO)NC(=O)CCF 43e7e8a4005601f5ea9308a4f9f63174 [0,2,0,0,0,0|2,0,0]=4 4172 B12R0.18 CC(C)C[C@H](CO)NC(=O)CCO 19f925d6b51549a4f6483af43faf1de8 [0,2,0,0,0,0|2,0,0]=4 4173 B12R0.18 CC(C)C[C@H](CO)NC(=O)CCS f25a9a097b7601baeb1261e6e1bdba25 [0,2,0,0,0,0|2,0,0]=4 4174 B12R0.18 CCCC(=O)CN(CC)CC(C)C 7cbc2681c261bf25534ddf57dfa00434 [0,2,0,0,0,0|2,0,0]=4 4175 B12R0.18 CCCC(=O)NC(C#N)CC(C)C 0933200a32d1cf518d6309f6cfdeb13d [0,2,0,0,0,0|1,0,0]=3 4176 B12R0.18 CCCC(=O)NC(CC)CN(C)C c91bddf7aa0b2f8dd94d420978491737 [0,2,0,0,0,0|2,0,0]=4 4177 B12R0.18 CCCC(=O)NC(CO)CC(C)C 10c8edd6992a3478b725da154726a7b0 [0,2,0,0,0,0|1,0,0]=3 4178 B12R0.18 CCCC(=O)N[C@@H](CO)CC(C)C dd476794473a2c13aaa9106760d2c0ae [0,2,0,0,0,0|1,0,0]=3 4179 B12R0.18 CCCC(=O)N[C@H](CO)CC(C)C 59b760e824228c482f811ea3932b9535 [0,2,0,0,0,0|1,0,0]=3 4180 B12R0.18 CCCC(C)OC(C#N)CC(C)C 02ffce78fe44730cc05c0fbf3d72cff2 [0,2,0,0,0,0|1,0,1]=4 4181 B12R0.18 COCC(=O)NC(C#N)CC(C)C 5735fc0cc82185a06a2e94a01916bc58 [0,2,0,0,0,0|2,0,0]=4 4182 B12R0.18 COCC(=O)NC(CO)CC(C)C 4335eafa0d441b31bf735f99c5e04f13 [0,2,0,0,0,0|2,0,0]=4 4183 B12R0.18 COCC(=O)N[C@@H](CO)CC(C)C 2a27e7b86888e15b986dee181dcda0b9 [0,2,0,0,0,0|2,0,0]=4 4184 B12R0.18 COCC(=O)N[C@H](CO)CC(C)C 20e4d00d429d65d1ff2ee023bfab6feb [0,2,0,0,0,0|2,0,0]=4 4185 B12R0.18 CSCC(=O)NC(C#N)CC(C)C 975b522f8b1c985d84ae1da97ed17db1 [0,2,0,0,0,0|2,0,0]=4 4186 B12R0.18 CSCC(=O)NC(CO)CC(C)C e7b73abe703b470ab1e79fcca970d6c1 [0,2,0,0,0,0|2,0,0]=4 4187 B12R0.18 CSCC(=O)N[C@@H](CO)CC(C)C d708aead7c7f826d96729015d3ebcf0a [0,2,0,0,0,0|2,0,0]=4 4188 B12R0.18 CSCC(=O)N[C@H](CO)CC(C)C c8790a0639d62d5b78e119d11bc560ec [0,2,0,0,0,0|2,0,0]=4 4189 B12R0.20 CCCC(=S)OC(C)C(=O)C(C)C 21a12b02750c84c25df6344b1e312f60 [0,2,0,0,0,0|0,1,1]=4 4190 B12R0.68 CCC(C)CC(C)NC(=O)CCF 9e0766f0dddecdafc7a2319e5b1eb99f [0,2,0,0,0,0|2,0,0]=4 4191 B12R0.68 CCC(C)CC(C)NC(=O)CCO 8e5de00241251110bcbdf873f13eca12 [0,2,0,0,0,0|2,0,0]=4 4192 B12R0.68 CCC(C)CC(C)NC(=O)CCS 5f8287ff5d4caebbd814c6612473b05a [0,2,0,0,0,0|2,0,0]=4 4193 B12R0.68 CCC(C)CC(C)NC(=O)COC 5fcd9355b9565b310e375d1b3fb86ab8 [0,2,0,0,0,0|2,0,0]=4 4194 B12R0.68 CCC(C)CC(C)NC(=O)CSC 6742ebdcfdbec7ba3f22860f44b8e8d8 [0,2,0,0,0,0|2,0,0]=4 4195 B12R0.68 CCCC(=O)CN(C)CC(C)CO ebb9b922cb295f0480f54e9fcc448a7f [0,2,0,0,0,0|2,0,0]=4 4196 B12R0.68 CCCC(=O)NC(C)CC(C)CC 28f6462213302a6e4c608c11714efcf6 [0,2,0,0,0,0|1,0,0]=3 4197 B12R0.68 CCCC(C)OC(C)CC(C)OC bb93bce108507b4a0fe46dc466f3eed5 [0,2,0,0,0,0|1,0,1]=4 4198 B12R0.68 CCOC(=O)OC(C)NC(C)CC 629ef9fb5550a6ad715218d0b1272dc8 [0,2,0,0,0,0|2,0,0]=4 4199 B12R0.68 CCOC(=O)OC(C)NC(C)CO aabb0fe0fd9f5895f4d2699fe2eadc26 [0,2,0,0,0,0|2,0,0]=4 4200 B12R0.68 CCOC(=O)OC(C)N[C@@H](C)CC 0dbc871d83e2cda4ce91740d9b392fb4 [0,2,0,0,0,0|2,0,0]=4 4201 B12R0.68 CCOC(=O)OC(C)N[C@@H](C)CO 7cef501ef2f4c8fdd56e1e8089275457 [0,2,0,0,0,0|2,0,0]=4 4202 B12R0.68 CCOC(=O)OC(C)N[C@H](C)CC a6b6d0abb9255bee74f1fbbbd536194c [0,2,0,0,0,0|2,0,0]=4 4203 B12R0.68 CCOC(=O)OC(C)N[C@H](C)CO f3f73bdf13a0d65a58188b0bfaf908d1 [0,2,0,0,0,0|2,0,0]=4 4204 B12R0.68 CCOC(=O)OC(C)OC(C)CC 98c3a27ebf2b43a8575c2fdc32f235f3 [0,2,0,0,0,0|2,0,0]=4 4205 B12R0.68 CCOC(=O)OC(C)OC(C)CF 21514ea1c1db01b9403c3474d562c929 [0,2,0,0,0,0|2,0,0]=4 4206 B12R0.68 CCOC(=O)OC(C)OC(C)CS 6558d98ebde65d14026faeb69218bbc5 [0,2,0,0,0,0|2,0,0]=4 4207 B12R0.68 CCOC(=O)OC(C)O[C@@H](C)CC e4fc105602d87ed9f951f9e0dbed35bf [0,2,0,0,0,0|2,0,0]=4 4208 B12R0.68 CCOC(=O)OC(C)O[C@H](C)CC 260c918cb963b05a58f13fe03ae886dd [0,2,0,0,0,0|2,0,0]=4 4209 B12R0.68 CCOC(=O)OC(C)O[C@H](C)CS 854fb46c98e8c5ec9a11b3a4db35b69f [0,2,0,0,0,0|2,0,0]=4 4210 B12R0.78 CCCC(=O)CN(C)CC(C)(C)C a61adf053481474f6a08e73e51d8cfb8 [0,2,0,0,0,0|2,0,0]=4 4211 B12R0.78 CCCC(=O)CN(C)CC(C)(C)O 1c701bc041821e809ee3b5c93718d8e6 [0,2,0,0,0,0|2,0,0]=4 4212 B12R0.78 CCCC(C)OC(C)CC(C)(C)C ebd831889f8e4c020ff2f678df775340 [0,2,0,0,0,0|1,0,1]=4 4213 B12R0.78 CCCC(C)OC(C)CC(C)(C)S bd3eb96acf6cd60d77e261705a3c820b [0,2,0,0,0,0|1,0,1]=4 4214 B12R0.78 CCOC(=O)OC(C)NC(C)(C)C 6479f1c9e2e39f95760c3fc2391d4e38 [0,2,0,0,0,0|2,0,0]=4 4215 B12R0.191 CCCC(=O)C(=O)N(C)CC(C)C d1bb836e646fe1619a5e125fcb8f934e [0,2,0,0,0,0|2,0,0]=4 4216 B12R0.191 CCCC(=O)N(C)C(C)CC(C)O 2a216bbf77e78787413ddcb9a9f36e8d [0,2,0,0,0,0|2,0,0]=4 4217 B12R0.297 C#CC(CCC)OC(C)CC(C)C 21be595959de6bd87e14f44807c04a17 [0,2,0,0,0,0|1,0,1]=4 4218 B12R0.297 C=CC(CCC)OC(C)CC(C)C a6b2b87b8e0dd91dba7a12ce11a45614 [0,2,0,0,0,0|1,0,1]=4 4219 B12R0.297 CCCC(C#N)OC(C)CC(C)C de2e935a0d7bfa8598131527d2cb15c7 [0,2,0,0,0,0|1,0,1]=4 4220 B12R0.297 CCCC(CC)OC(C)CC(C)C 8b1caade4fc566077d08c266ef56282f [0,2,0,0,0,0|1,0,1]=4 4221 B12R0.297 CCCC(CC)O[C@@H](C)CC(C)C af3342e9f066920102e359917050702e [0,2,0,0,0,0|1,0,1]=4 4222 B12R0.297 CCCC(CC)O[C@H](C)CC(C)C 09c878292c3f2f739f612ca646287c88 [0,2,0,0,0,0|1,0,1]=4 4223 B12R0.297 CCC[C@@H](CC)OC(C)CC(C)C 6ce0830d78e8a84590e8b133eea7ab16 [0,2,0,0,0,0|1,0,1]=4 4224 B12R0.563 C=C(CC)C(=O)NC(C)CC(C)C e01f691ad3b8bb4b5392f88a63e19f80 [0,2,0,0,0,0|1,0,1]=4 4225 B12R0.563 CC(C)CC(C)NC(=O)C(O)CO 20a7f6f0792c922ad06872b91aaac9d4 [0,2,0,0,0,0|2,0,0]=4 4226 B12R0.563 CC(C)CC(C)NC(=O)[C@@H](O)CO 01b25c2abb4f09f719f5504f3a50f305 [0,2,0,0,0,0|2,0,0]=4 4227 B12R0.563 CC(C)CC(C)NC(=O)[C@H](O)CF 5a509c8bf7a917b6375900c94cab6969 [0,2,0,0,0,0|2,0,0]=4 4228 B12R0.563 CCC(=O)C(=O)NC(C)CC(C)C 002f96ce4c3ca5d7fc177f21664c7111 [0,2,0,0,0,0|1,0,1]=4 4229 B12R0.563 CCC(C)C(=O)CN(C)CC(C)C 8d56278452337f35fab2d44597065f53 [0,2,0,0,0,0|2,0,0]=4 4230 B12R0.563 CCC(C)C(C)OC(C)CC(C)C e37e91083dfaab910969f02ffed03306 [0,2,0,0,0,0|1,0,1]=4 4231 B12R0.563 CCC(O)C(=O)NC(C)CC(C)C 02d56cf28649a1671a930f1d9acad02d [0,2,0,0,0,0|1,0,0]=3 4232 B12R0.563 CCC(O)C(=O)NC(C)CC(C)O e4e54481873a627356a97bff7ba9b1bb [0,2,0,0,0,0|2,0,0]=4 4233 B12R0.563 CCC(O)C(=O)NC(C)CN(C)C eed7f43a8eb7bba1e712e447ffc72d00 [0,2,0,0,0,0|2,0,0]=4 4234 B12R0.563 CCC(O)C(=O)N[C@@H](C)CN(C)C add38de37dd35775d84f61cdc6e7ca3b [0,2,0,0,0,0|2,0,0]=4 4235 B12R0.563 CCC(O)C(=O)N[C@H](C)CN(C)C 79a03c8d5613707399cd29cdb8b2bd95 [0,2,0,0,0,0|2,0,0]=4 4236 B12R0.563 CCN(C)C(=O)CC(C)CC(C)C 5b0df09e8f6a0fe2943686e0b0136ebe [0,2,0,0,0,0|2,0,0]=4 4237 B12R0.563 CCN(C)C(=O)CC(O)CC(C)C c7a74b31d4933a965df476cbe384ce6c [0,2,0,0,0,0|2,0,0]=4 4238 B12R0.563 CCN(C)C(=O)NC(C)CC(C)C ea5580a84d4f68feec60e10dd4a92b75 [0,2,0,0,0,0|2,0,0]=4 4239 B12R0.563 CC[C@@H](O)C(=O)NC(C)CC(C)C 1696e0540ce5ac8678c33626a2553ee8 [0,2,0,0,0,0|1,0,0]=3 4240 B12R0.563 CC[C@@H](O)C(=O)NC(C)CC(C)O 6d56e10cdd1a6cb1b7cfc11986b02306 [0,2,0,0,0,0|2,0,0]=4 4241 B12R0.563 CC[C@@H](O)C(=O)NC(C)CN(C)C a8fb53caa462b830a1d4e35fbed15e92 [0,2,0,0,0,0|2,0,0]=4 4242 B12R0.563 CC[C@@H](O)C(=O)N[C@@H](C)CN(C)C f96d3387992cc5d6c9d22d779f2f9267 [0,2,0,0,0,0|2,0,0]=4 4243 B12R0.563 CC[C@@H](O)C(=O)N[C@H](C)CN(C)C 10d8b647d6370431a2618b987ead2d8b [0,2,0,0,0,0|2,0,0]=4 4244 B12R0.563 CC[C@H](O)C(=O)NC(C)CC(C)C 4c8fe59d0b678aed3402bc8a40849e3f [0,2,0,0,0,0|1,0,0]=3 4245 B12R0.563 CC[C@H](O)C(=O)NC(C)CC(C)O 6b4c2e6577c3d933bdf326ea02e885f6 [0,2,0,0,0,0|2,0,0]=4 4246 B12R0.563 CC[C@H](O)C(=O)NC(C)CN(C)C 636115b26c241b7dd2789566d6335580 [0,2,0,0,0,0|2,0,0]=4 4247 B12R0.563 CC[C@H](O)C(=O)N[C@@H](C)CN(C)C 8ccdd6317e65560230e7725504f9ce93 [0,2,0,0,0,0|2,0,0]=4 4248 B12R0.563 CC[C@H](O)C(=O)N[C@H](C)CN(C)C 345972b72047d247496fbffd4fa8ebde [0,2,0,0,0,0|2,0,0]=4 4249 B12R0.563 CC[C@H](S)C(=O)NC(C)CC(C)C e93b261bffffec58841c10cf97fa0d3e [0,2,0,0,0,0|1,0,0]=3 4250 B12R0.563 CC[C@H](S)C(=O)NC(C)CC(C)O 0cd4d51bb0814b81babe827db14ca332 [0,2,0,0,0,0|2,0,0]=4 4251 B12R0.563 CC[C@H](S)C(=O)NC(C)CN(C)C 4d92f8f7111b49cb3cd07204b14cd71b [0,2,0,0,0,0|2,0,0]=4 4252 B12R0.563 CC[C@H](S)C(=O)N[C@@H](C)CN(C)C 9887a09a1bb53827e2397e91035b9ce7 [0,2,0,0,0,0|2,0,0]=4 4253 B12R0.563 CC[C@H](S)C(=O)N[C@H](C)CN(C)C acfb890c28355904306310c47fd5b53e [0,2,0,0,0,0|2,0,0]=4 4254 B12R0.563 COC(C)C(=O)NC(C)CC(C)C 57abd78708bb551c60c4ba37d7e9c9e2 [0,2,0,0,0,0|2,0,0]=4 4255 B12R0.563 CO[C@@H](C)C(=O)NC(C)CC(C)C c2e179488bfb661f74aeeae5a467ca7b [0,2,0,0,0,0|2,0,0]=4 4256 B12R0.563 CO[C@H](C)C(=O)NC(C)CC(C)C 96f45fc8b747937a26f91f6c54ac97de [0,2,0,0,0,0|2,0,0]=4 4257 B12R0.563 CSC(C)C(=O)NC(C)CC(C)C f578e482afffa28f5ff83b22dd38ec33 [0,2,0,0,0,0|2,0,0]=4 4258 B12R0.744 CCCC(=O)NC(C)(C)CN(C)C da600c6c8f597798023b690cbf904d8b [0,2,0,0,0,0|2,0,0]=4 4259 B12R0.66 C=C(C)CC(=O)NCCC(C)(C)C c063875ca3e4723079bafe030a10eb63 [0,2,0,0,0,0|1,0,1]=4 4260 B12R0.66 C=C(C)CC(=O)NCCC(C)(C)F 7911fafccbddc854d76b63f5e58b38d0 [0,2,0,0,0,0|1,0,1]=4 4261 B12R0.66 C=C(C)CC(=O)NCCC(C)(C)O 3495d918db41bec8915c3d34b7295ea9 [0,2,0,0,0,0|1,0,1]=4 4262 B12R0.66 CC(=O)CC(=O)NCCC(C)(C)C 43f7a265ff9f8ce6bdbd32adef0ce80d [0,2,0,0,0,0|1,0,1]=4 4263 B12R0.66 CC(=O)CC(=O)NCCC(C)(C)F d8ece4725484f236c7ac9d5f0e7039ca [0,2,0,0,0,0|1,0,1]=4 4264 B12R0.66 CC(=O)CC(=O)NCCC(C)(C)O 9999d03f9ecec3ab8b32fb5215d6b8c3 [0,2,0,0,0,0|1,0,1]=4 4265 B12R0.66 CC(C)(C)CCNC(=O)CC(F)F ec8217757b1521511638a505fd6aa063 [0,2,0,0,0,0|2,0,0]=4 4266 B12R0.66 CC(C)(F)CCNC(=O)CC(F)F a98f875544f67d07a2d85e82e145ce0a [0,2,0,0,0,0|2,0,0]=4 4267 B12R0.66 CC(C)(O)CCNC(=O)CC(F)F adb217ac6b8200f0f811d5324694f90d [0,2,0,0,0,0|2,0,0]=4 4268 B12R0.66 CC(C)CC(=O)CNCC(C)(C)C 7204d576c48285746538b275eab1a724 [0,2,0,0,0,0|2,0,0]=4 4269 B12R0.66 CC(C)CC(=O)CNCC(C)(C)O 741c746a08b7db234637218b33d223e5 [0,2,0,0,0,0|2,0,0]=4 4270 B12R0.66 CC(C)CC(=O)COCC(C)(C)Br c8dc0e2a35edaaa34ab4da370b1abb13 [0,2,0,0,0,0|2,0,0]=4 4271 B12R0.66 CC(C)CC(=O)COCC(C)(C)C 5bc775fb4d83c7bf77eee0d410420386 [0,2,0,0,0,0|2,0,0]=4 4272 B12R0.66 CC(C)CC(=O)COCC(C)(C)F 2337c8ba55f283617ebb3efc815183c3 [0,2,0,0,0,0|2,0,0]=4 4273 B12R0.66 CC(C)CC(=O)COCC(C)(C)S 39d2e6cf96be9aa1dc85f2975e8eb193 [0,2,0,0,0,0|2,0,0]=4 4274 B12R0.66 CC(C)CC(=O)NCCC(C)(C)C 91e90358608dc0a43d6a9275edaccee0 [0,2,0,0,0,0|1,0,0]=3 4275 B12R0.66 CC(C)CC(=O)NCCC(C)(C)F 1cabff901f6a75273341444400198605 [0,2,0,0,0,0|1,0,0]=3 4276 B12R0.66 CC(C)CC(=O)NCCC(C)(C)O f464eaa820bc434adcf73be0112bb3b5 [0,2,0,0,0,0|1,0,0]=3 4277 B12R0.66 CC(C)CC(=O)OCNC(C)(C)C 0923db7aeaf75150a3194b5c7e6b5346 [0,2,0,0,0,0|1,0,0]=3 4278 B12R0.66 CC(C)CC(C)OCCC(C)(C)C beda39bf5e9e2677d933f2d45d975f85 [0,2,0,0,0,0|1,0,1]=4 4279 B12R0.66 CC(C)CC(C)OCCC(C)(C)O fe7a7d9140814413a3f40484c831d51c [0,2,0,0,0,0|1,0,1]=4 4280 B12R0.66 CC(C)CC(C)OCCC(C)(C)S 94edcd2414851067d287c7d02519f4b7 [0,2,0,0,0,0|1,0,1]=4 4281 B12R0.66 CC(C)C[C@@H](C)OCCC(C)(C)C ccbe59f37232d23dcd1f7a7bb1b44677 [0,2,0,0,0,0|1,0,1]=4 4282 B12R0.66 CC(C)C[C@@H](C)OCCC(C)(C)O 27c28a3ba8ee7e851c333fa56aa564e1 [0,2,0,0,0,0|1,0,1]=4 4283 B12R0.66 CC(C)C[C@H](C)OCCC(C)(C)C 2168a46ebf5a7cff5f96dd83b2da7dcf [0,2,0,0,0,0|1,0,1]=4 4284 B12R0.66 CC(C)C[C@H](C)OCCC(C)(C)O 94d478d4a33c97492c82f549d9644133 [0,2,0,0,0,0|1,0,1]=4 4285 B12R0.66 CC(C)OC(=O)OCNC(C)(C)C ae55f3bdae55156f768fd28153ef146e [0,2,0,0,0,0|2,0,0]=4 4286 B12R0.66 CC(O)CC(=O)NCCC(C)(C)C 8d2e43136b894ef2f60b9dac2dd0933b [0,2,0,0,0,0|1,0,0]=3 4287 B12R0.66 CC(O)CC(=O)NCCC(C)(C)F 92db53c49a5f624b6a505ce0fba6110c [0,2,0,0,0,0|1,0,0]=3 4288 B12R0.66 CC(O)CC(=O)NCCC(C)(C)O 0668d8368cffefba94622cbf59d64939 [0,2,0,0,0,0|1,0,0]=3 4289 B12R0.66 CN(C)CC(=O)NCCC(C)(C)C 6f81a576532a1b1fe5d5a2a80d05790e [0,2,0,0,0,0|2,0,0]=4 4290 B12R0.66 CN(C)CC(=O)NCCC(C)(C)F 4f82bea36db586ba6ff49913cf1cfced [0,2,0,0,0,0|2,0,0]=4 4291 B12R0.66 CN(C)CC(=O)NCCC(C)(C)O 5bec8ba07b5424a9384a162be8fd66ed [0,2,0,0,0,0|2,0,0]=4 4292 B12R0.66 C[C@@H](O)CC(=O)NCCC(C)(C)C 7e6eff33a254c2c05a507d14132978ea [0,2,0,0,0,0|1,0,0]=3 4293 B12R0.66 C[C@@H](O)CC(=O)NCCC(C)(C)F 37d8278186b91cd267df70e49f6d5c62 [0,2,0,0,0,0|1,0,0]=3 4294 B12R0.66 C[C@@H](O)CC(=O)NCCC(C)(C)O b150e32ead5e740e6a4b6b33579bed74 [0,2,0,0,0,0|1,0,0]=3 4295 B12R0.66 C[C@H](O)CC(=O)NCCC(C)(C)C 90b43b98d163f3f067d120971e1e760f [0,2,0,0,0,0|1,0,0]=3 4296 B12R0.66 C[C@H](O)CC(=O)NCCC(C)(C)F 3c290662d2d5683650c0f4a418891f56 [0,2,0,0,0,0|1,0,0]=3 4297 B12R0.66 C[C@H](O)CC(=O)NCCC(C)(C)O 4be76654aab07e806a8a45ac8fb893d2 [0,2,0,0,0,0|1,0,0]=3 4298 B12R0.140 CC(C)CCCC(=O)NC(C)(C)C affefc82a4bdbe9bce4a33c48a476a96 [0,2,0,0,0,0|2,0,0]=4 4299 B12R0.140 CC(C)CCNC(=O)CC(C)(C)Br 7d5f0e2c4aa7756d2ee7c06a27ff7d89 [0,2,0,0,0,0|1,0,0]=3 4300 B12R0.140 CC(C)CCNC(=O)CC(C)(C)C ece35f56bd6982b566cb896d163f4413 [0,2,0,0,0,0|1,0,0]=3 4301 B12R0.140 CC(C)CCNC(=O)CC(C)(C)Cl b47b6693fd344795fbdf0a37236f7583 [0,2,0,0,0,0|1,0,0]=3 4302 B12R0.140 CC(C)CCNC(=O)CC(C)(C)O a4d98e6316edb778e534bfd0ea759f5a [0,2,0,0,0,0|1,0,0]=3 4303 B12R0.140 CC(C)CCNC(=O)CC(C)(F)F 9bf5c012a5b2a036ffc16b06a169abb1 [0,2,0,0,0,0|1,0,0]=3 4304 B12R0.140 CC(C)CCNC(=O)CC(F)(F)F 5a5e001ec0d45de25e6449edf0efc4be [0,2,0,0,0,0|2,0,0]=4 4305 B12R0.140 CC(C)CCNC(=O)CS(=O)(=O)C c9359f9e3c9bd5118f361c803bbb48c7 [0,2,0,0,0,0|2,0,0]=4 4306 B12R0.140 CC(C)CCNC(=O)NC(C)(C)C a5e6de580ba8a6c4b26fadb004c733e6 [0,2,0,0,0,0|2,0,0]=4 4307 B12R0.140 CC(C)CCOC(C)CC(C)(C)C 84dab1a7026b82500f9aeba55aaca9ea [0,2,0,0,0,0|1,0,1]=4 4308 B12R0.140 CC(C)CCOC(C)CC(C)(C)S 95e66ad776aee9df69bf859df5c55122 [0,2,0,0,0,0|1,0,1]=4 4309 B12R0.140 CC(C)OCOC(=O)CC(C)(C)C 28f290d715dfe22124e6da2ffb107709 [0,2,0,0,0,0|1,0,0]=3 4310 B12R0.140 CC(C)OCOC(=O)OC(C)(C)C 759a3408087bfed38e7c6583cfc65a55 [0,2,0,0,0,0|2,0,0]=4 4311 B12R0.140 CC(O)CCNC(=O)CC(C)(C)Br b4abc7e5d5b7784d2ff8846955516896 [0,2,0,0,0,0|2,0,0]=4 4312 B12R0.140 CC(O)CCNC(=O)CC(C)(C)C 577e42ca9416d1cee07d919a759d443e [0,2,0,0,0,0|2,0,0]=4 4313 B12R0.140 CC(O)CCNC(=O)CC(C)(C)Cl a64b9f0223c1a617c948226521a7c2fc [0,2,0,0,0,0|2,0,0]=4 4314 B12R0.140 CC(O)CCNC(=O)CC(C)(C)O 5031629f829f75ddd60688a4c10be5c2 [0,2,0,0,0,0|2,0,0]=4 4315 B12R0.140 CC(O)CCNC(=O)CC(C)(F)F 12ad58bb7387cb19c0840c3e1466c8b6 [0,2,0,0,0,0|2,0,0]=4 4316 B12R0.140 CN(C)CCNC(=O)CC(C)(C)Br 35ea17101837a85878698f08bbe2f9e8 [0,2,0,0,0,0|2,0,0]=4 4317 B12R0.140 CN(C)CCNC(=O)CC(C)(C)C 4f921d60b6f15fd4914ff2a3aff5dc57 [0,2,0,0,0,0|2,0,0]=4 4318 B12R0.140 CN(C)CCNC(=O)CC(C)(C)Cl 565c180cc8930aa263d909ff3ffc819e [0,2,0,0,0,0|2,0,0]=4 4319 B12R0.140 CN(C)CCNC(=O)CC(C)(C)O 62aab63f9e43f5e5fe08b7d207f6c0fc [0,2,0,0,0,0|2,0,0]=4 4320 B12R0.140 CN(C)CCNC(=O)CC(C)(F)F 764ed174ba8e168ad3739230f9eb0eeb [0,2,0,0,0,0|2,0,0]=4 4321 B12R0.140 C[C@@H](O)CCNC(=O)CC(C)(C)Br 8df0898a02376ab56248e89b63e7f394 [0,2,0,0,0,0|2,0,0]=4 4322 B12R0.140 C[C@@H](O)CCNC(=O)CC(C)(C)C f70d8bb17323cc30e7be857a1adeb266 [0,2,0,0,0,0|2,0,0]=4 4323 B12R0.140 C[C@@H](O)CCNC(=O)CC(C)(C)Cl d66417a421b225d8afa4cb6f7ca0d6d0 [0,2,0,0,0,0|2,0,0]=4 4324 B12R0.140 C[C@@H](O)CCNC(=O)CC(C)(C)O d433177cbe01e8621d440bdc8b54c608 [0,2,0,0,0,0|2,0,0]=4 4325 B12R0.140 C[C@@H](O)CCNC(=O)CC(C)(F)F 487cd1b4a548d66739d6b8749cf8661f [0,2,0,0,0,0|2,0,0]=4 4326 B12R0.140 C[C@H](O)CCNC(=O)CC(C)(C)Br 99d22e4a330401713b27ffd88e76b647 [0,2,0,0,0,0|2,0,0]=4 4327 B12R0.140 C[C@H](O)CCNC(=O)CC(C)(C)C fd1ea26a4d2fc7632dde8af43e99e21f [0,2,0,0,0,0|2,0,0]=4 4328 B12R0.140 C[C@H](O)CCNC(=O)CC(C)(C)Cl 92aa70c10702137a779b3e93ce04e977 [0,2,0,0,0,0|2,0,0]=4 4329 B12R0.140 C[C@H](O)CCNC(=O)CC(C)(C)O 0183298a3edd827abe895f466f42acaf [0,2,0,0,0,0|2,0,0]=4 4330 B12R0.140 C[C@H](O)CCNC(=O)CC(C)(F)F 9d9631f2d3f96f3f8bcede69bdf82174 [0,2,0,0,0,0|2,0,0]=4 4331 B12R0.240 C#CC(C)NC(=O)CCCC(C)C c56bb5813eac8adcc51b1002642fb308 [0,2,0,0,0,0|2,0,0]=4 4332 B12R0.240 C#CC(C)NC(=O)NCCC(C)C aa85cd8c10b9ad32c080e29a435caa0f [0,2,0,0,0,0|2,0,0]=4 4333 B12R0.240 C#C[C@@H](C)NC(=O)CCCC(C)C fd59eed020d26d9d119c8480a2d352d0 [0,2,0,0,0,0|2,0,0]=4 4334 B12R0.240 C#C[C@@H](C)NC(=O)NCCC(C)C ad9a2b1adf7aa163318b15c5be6a4f70 [0,2,0,0,0,0|2,0,0]=4 4335 B12R0.240 C#C[C@H](C)NC(=O)CCCC(C)C 458ce8227d4c6e346bf08e931daab4bf [0,2,0,0,0,0|2,0,0]=4 4336 B12R0.240 C#C[C@H](C)NC(=O)NCCC(C)C 6fcae6f0b6640f48d19d3417a989d24f [0,2,0,0,0,0|2,0,0]=4 4337 B12R0.240 C=CC(C)CC(=O)NCCC(C)C 0dd7ff69840c604296410fdd4b5c3035 [0,2,0,0,0,0|1,0,0]=3 4338 B12R0.240 C=CC(C)CC(=O)NCCC(C)O 55c1b0b4e39bd4e4bf5842ada15512fb [0,2,0,0,0,0|2,0,0]=4 4339 B12R0.240 C=CC(C)CC(=O)NCCN(C)C 72e99aad463281f9f679a2792eb7af0d [0,2,0,0,0,0|2,0,0]=4 4340 B12R0.240 C=CC(C)CC(=O)NCC[C@@H](C)O 872bc73681c75bacfe90772fa4b9d140 [0,2,0,0,0,0|2,0,0]=4 4341 B12R0.240 C=CC(C)CC(=O)NCC[C@H](C)O 619b16f4356f732c6945104aa65200b6 [0,2,0,0,0,0|2,0,0]=4 4342 B12R0.240 C=CC(C)NC(=O)CCCC(C)C 624c836b8842986cd8298619a558cb25 [0,2,0,0,0,0|2,0,0]=4 4343 B12R0.240 C=CC(C)NC(=O)NCCC(C)C 83361c8909a747696ac20b298deecf4b [0,2,0,0,0,0|2,0,0]=4 4344 B12R0.240 CC(C#N)CC(=O)NCCN(C)C c346fe004cb4014675f5e0ad89b63f3e [0,2,0,0,0,0|2,0,0]=4 4345 B12R0.240 CC(C#N)CC(=O)NCC[C@@H](C)O bd5dafe1fd9f1f9e552839a838eaef7f [0,2,0,0,0,0|2,0,0]=4 4346 B12R0.240 CC(C#N)CC(=O)NCC[C@H](C)O 4f7b6603c21b1db675ab3847ebce7583 [0,2,0,0,0,0|2,0,0]=4 4347 B12R0.240 CC(C)CCCC(=O)NC(C)C#N d688bfd48501fbee9be1058827831cda [0,2,0,0,0,0|2,0,0]=4 4348 B12R0.240 CC(C)CCCC(=O)NC(C)CO a2867e5ed5c6e38db650991d0339abb8 [0,2,0,0,0,0|2,0,0]=4 4349 B12R0.240 CC(C)CCCC(=O)N[C@@H](C)CO 50388998668d54f3657788b227125fef [0,2,0,0,0,0|2,0,0]=4 4350 B12R0.240 CC(C)CCCC(=O)N[C@H](C)CO cc87491e24f2a747410decb13ec26f8d [0,2,0,0,0,0|2,0,0]=4 4351 B12R0.240 CC(C)CCNC(=O)CC(C)C#N fc785340d5489b9dd4de3dea80f193fa [0,2,0,0,0,0|1,0,0]=3 4352 B12R0.240 CC(C)CCNC(=O)NC(C)C#N fa984ae3e2a5b623256c6844b23912ef [0,2,0,0,0,0|2,0,0]=4 4353 B12R0.240 CC(C)CCNC(=O)NC(C)CO adeb79f7991f907740a41f958fb05e34 [0,2,0,0,0,0|2,0,0]=4 4354 B12R0.240 CC(C)CCNC(=O)N[C@@H](C)CO a6d8264bf2ea201f0b4c62f977252e91 [0,2,0,0,0,0|2,0,0]=4 4355 B12R0.240 CC(C)CCNC(=O)N[C@H](C)CO 5eea292b19d8853eadc9e2638ebc99cb [0,2,0,0,0,0|2,0,0]=4 4356 B12R0.240 CC(O)CCNC(=O)CC(C)C#N 58390cc8dba09686e4083bc68e05a713 [0,2,0,0,0,0|2,0,0]=4 4357 B12R0.240 CC/C(=C/C(=O)NCCC(C)C)/C fbe28d00537df008f6157092c27bda87 [0,2,0,0,0,0|1,0,1]=4 4358 B12R0.240 CC/C(=C\C(=O)NCCC(C)C)/C ce0ebee6db1ca2e860eb9b25aa6e6d5d [0,2,0,0,0,0|1,0,1]=4 4359 B12R0.240 CCC(=O)/C=C(\C)/OCCC(C)C 29963e45b9711aa602a9d711258ab93f [0,2,0,0,0,0|1,0,1]=4 4360 B12R0.240 CCC(C)CC(=O)NCCC(C)C 363bda787c82e38430cdfd6160c0f37e [0,2,0,0,0,0|1,0,0]=3 4361 B12R0.240 CCC(C)CC(=O)NCCC(C)O 9de94fd5da7247ce856de18bddca6091 [0,2,0,0,0,0|2,0,0]=4 4362 B12R0.240 CCC(C)CC(=O)NCCN(C)C 4d8fbd00f3c1d970a08b5ff2b3593698 [0,2,0,0,0,0|2,0,0]=4 4363 B12R0.240 CCC(C)CC(=O)NCC[C@@H](C)O 88505b086f5387a5d298be7629a22a6c [0,2,0,0,0,0|2,0,0]=4 4364 B12R0.240 CCC(C)CC(=O)NCC[C@H](C)O 07809e0f3ce2ecf820c0d6f907a6ffa7 [0,2,0,0,0,0|2,0,0]=4 4365 B12R0.240 CCC(C)NC(=O)/C=C/CC(C)C 6979d2c73f268b1198daa60394348053 [0,2,0,0,0,0|1,0,1]=4 4366 B12R0.240 CCC(C)NC(=O)CCCC(C)C 5c46b9abd8d3c4690183e064e8d2b8e4 [0,2,0,0,0,0|1,0,0]=3 4367 B12R0.240 CCC(C)NC(=O)CCCN(C)C a6620823235620316972406c900bf87a [0,2,0,0,0,0|2,0,0]=4 4368 B12R0.240 CCC(C)NC(=O)CCOC(C)C 14b3863ce31433ca1c343271ff126364 [0,2,0,0,0,0|2,0,0]=4 4369 B12R0.240 CCC(C)NC(=O)CCSC(C)C b1b72d73739d53a939faca77fb36448a [0,2,0,0,0,0|2,0,0]=4 4370 B12R0.240 CCC(C)NC(=O)CNCC(C)C 85f54c0151248ae1ead4dbdc7d10b147 [0,2,0,0,0,0|2,0,0]=4 4371 B12R0.240 CCC(C)NC(=O)COCC(C)C 0ab975a2bfe7c41148d266841418aea9 [0,2,0,0,0,0|2,0,0]=4 4372 B12R0.240 CCC(C)NC(=O)NCCC(C)C 5919fb302c77d5f6608ba62015c189ea [0,2,0,0,0,0|1,0,0]=3 4373 B12R0.240 CCC(C)NC(=O)NCCC(C)O 31e1705dbf8a6ef0d71d772a28771bac [0,2,0,0,0,0|2,0,0]=4 4374 B12R0.240 CCC(C)NC(=O)NCCN(C)C 10e9d046e4b1d2387834ab219aae3de3 [0,2,0,0,0,0|2,0,0]=4 4375 B12R0.240 CCC(C)NC(=O)NCC[C@@H](C)O b95e358520d96a1760f512aa7b3f2e9d [0,2,0,0,0,0|2,0,0]=4 4376 B12R0.240 CCC(C)NC(=O)NCC[C@H](C)O 7b89e72aa97c83df0aef9906f7200829 [0,2,0,0,0,0|2,0,0]=4 4377 B12R0.240 CCC(C)NC(=S)NCCC(C)C 4fcf27971d2d48d938d534c3dcea88f5 [0,2,0,0,0,0|1,1,0]=4 4378 B12R0.240 CCC(O)CC(=O)NCCC(C)C b746bd521fdd2410c17fa7d5142f9e38 [0,2,0,0,0,0|1,0,0]=3 4379 B12R0.240 CCC(O)CC(=O)NCCC(C)O a71af93adfd5223bfe2fde72c146dce3 [0,2,0,0,0,0|2,0,0]=4 4380 B12R0.240 CCC(O)CC(=O)NCCN(C)C 735c905aad773840e79b1ad08bde1091 [0,2,0,0,0,0|2,0,0]=4 4381 B12R0.240 CCC(O)CC(=O)NCC[C@@H](C)O 6af42266caf10b83541a853d8b8b81a5 [0,2,0,0,0,0|2,0,0]=4 4382 B12R0.240 CCC(O)CC(=O)NCC[C@H](C)O 7c2437afb158cab90cd865d21e1afa88 [0,2,0,0,0,0|2,0,0]=4 4383 B12R0.240 CCN(C)CC(=O)NCCC(C)C d5eb77cae286eec72533b82d4c301825 [0,2,0,0,0,0|1,0,0]=3 4384 B12R0.240 CCN(C)CC(=O)NCCC(C)O 7c0d171d64169ee7f915886f5860c760 [0,2,0,0,0,0|2,0,0]=4 4385 B12R0.240 CCN(C)CC(=O)NCCN(C)C 09696a72fd8c5f3021c8662370fcbe96 [0,2,0,0,0,0|2,0,0]=4 4386 B12R0.240 CCN(C)CC(=O)NCC[C@@H](C)O b997cb7d6bac5c22fc9ef2f32da93dcb [0,2,0,0,0,0|2,0,0]=4 4387 B12R0.240 CCN(C)CC(=O)NCC[C@H](C)O bdf9cde80709ab320275fad86c71d15b [0,2,0,0,0,0|2,0,0]=4 4388 B12R0.240 CC[C@@H](C)CC(=O)NCCC(C)C 618d21b3322573c1759a22f456d76b1e [0,2,0,0,0,0|1,0,0]=3 4389 B12R0.240 CC[C@@H](C)CC(=O)NCCC(C)O c7b6b03a0cf1b1b4e0140180e9fb10e2 [0,2,0,0,0,0|2,0,0]=4 4390 B12R0.240 CC[C@@H](C)CC(=O)NCCN(C)C 7ae2ec637eb2039d7e07594db9d9f6ab [0,2,0,0,0,0|2,0,0]=4 4391 B12R0.240 CC[C@@H](C)CC(=O)NCC[C@@H](C)O eff9a8273fada80307f89a80acbea2f8 [0,2,0,0,0,0|2,0,0]=4 4392 B12R0.240 CC[C@@H](C)CC(=O)NCC[C@H](C)O 0f5a4e74ddcdd2acb8168d7f0e8d23c0 [0,2,0,0,0,0|2,0,0]=4 4393 B12R0.240 CC[C@@H](C)NC(=O)/C=C/CC(C)C c8d29e3330c556e625a98b1f063a35bd [0,2,0,0,0,0|1,0,1]=4 4394 B12R0.240 CC[C@@H](C)NC(=O)CCCC(C)C 3d09344d4f3bc5a989940e29f130f2a5 [0,2,0,0,0,0|1,0,0]=3 4395 B12R0.240 CC[C@@H](C)NC(=O)CCCN(C)C 8ed71e8449eeaf9d9d4521eb09352fe3 [0,2,0,0,0,0|2,0,0]=4 4396 B12R0.240 CC[C@@H](C)NC(=O)CCOC(C)C f7a892c446162378a3d0c2b8b73633e0 [0,2,0,0,0,0|2,0,0]=4 4397 B12R0.240 CC[C@@H](C)NC(=O)CCSC(C)C c50671af67f464a973c3173432b17b56 [0,2,0,0,0,0|2,0,0]=4 4398 B12R0.240 CC[C@@H](C)NC(=O)COCC(C)C 43d0efd3b63cbed82930eb485916fe7d [0,2,0,0,0,0|2,0,0]=4 4399 B12R0.240 CC[C@@H](C)NC(=O)NCCC(C)C 546a53c737437564793bc27bcec9aeaa [0,2,0,0,0,0|1,0,0]=3 4400 B12R0.240 CC[C@@H](C)NC(=O)NCCC(C)O 9f0e55b4916c3aaf1f02de12d67f7a0f [0,2,0,0,0,0|2,0,0]=4 4401 B12R0.240 CC[C@@H](C)NC(=O)NCCN(C)C 7101b3eb68920232eba2d77b10b3ae3f [0,2,0,0,0,0|2,0,0]=4 4402 B12R0.240 CC[C@@H](C)NC(=O)NCC[C@@H](C)O 446c0938b47bc8c2aec8b9d0b67e89ea [0,2,0,0,0,0|2,0,0]=4 4403 B12R0.240 CC[C@@H](C)NC(=O)NCC[C@H](C)O dcacaefb6a06fb61af835eb2d7c886a2 [0,2,0,0,0,0|2,0,0]=4 4404 B12R0.240 CC[C@@H](C)NC(=S)NCCC(C)C 1c0c8e98e58f2ca9b43a6b0df0433260 [0,2,0,0,0,0|1,1,0]=4 4405 B12R0.240 CC[C@@H](O)CC(=O)NCCC(C)C 4d980c4b8e69e63f6e97f4e9832f3008 [0,2,0,0,0,0|1,0,0]=3 4406 B12R0.240 CC[C@@H](O)CC(=O)NCCC(C)O fd67caeb7a5ae1151ca7005fb23efe14 [0,2,0,0,0,0|2,0,0]=4 4407 B12R0.240 CC[C@@H](O)CC(=O)NCCN(C)C e706a1d33796e72146acec7c65e17e0b [0,2,0,0,0,0|2,0,0]=4 4408 B12R0.240 CC[C@@H](O)CC(=O)NCC[C@@H](C)O 93d42c1116adaef2e0837b15bd3f3aab [0,2,0,0,0,0|2,0,0]=4 4409 B12R0.240 CC[C@@H](O)CC(=O)NCC[C@H](C)O 83959b8db108b44520a49780c16eed25 [0,2,0,0,0,0|2,0,0]=4 4410 B12R0.240 CC[C@H](C)CC(=O)NCCC(C)C eda7eff9f36c6642f5d88cab65471673 [0,2,0,0,0,0|1,0,0]=3 4411 B12R0.240 CC[C@H](C)CC(=O)NCCC(C)O d02ab4c796632c419615456153536b4e [0,2,0,0,0,0|2,0,0]=4 4412 B12R0.240 CC[C@H](C)CC(=O)NCCN(C)C 37303887e7242e6308d51b6cc1c0189f [0,2,0,0,0,0|2,0,0]=4 4413 B12R0.240 CC[C@H](C)CC(=O)NCC[C@@H](C)O cf2dbd2427713a41f7d0972b6a84506b [0,2,0,0,0,0|2,0,0]=4 4414 B12R0.240 CC[C@H](C)CC(=O)NCC[C@H](C)O 375c68ececb7ad79112f826254e2d8a0 [0,2,0,0,0,0|2,0,0]=4 4415 B12R0.240 CC[C@H](C)NC(=O)/C=C/CC(C)C f5755da2bdb1e3e83ae01abb0f700627 [0,2,0,0,0,0|1,0,1]=4 4416 B12R0.240 CC[C@H](C)NC(=O)CCCC(C)C 5bf9c1dddd905c2d397176f310d2fd02 [0,2,0,0,0,0|1,0,0]=3 4417 B12R0.240 CC[C@H](C)NC(=O)CCCN(C)C b6ebeeb186ff6ab176c910adca6c01a5 [0,2,0,0,0,0|2,0,0]=4 4418 B12R0.240 CC[C@H](C)NC(=O)CCOC(C)C 0089168509f529e9dd0f8d23315567e3 [0,2,0,0,0,0|2,0,0]=4 4419 B12R0.240 CC[C@H](C)NC(=O)CCSC(C)C ab452634f53f068f902b61ced497b3da [0,2,0,0,0,0|2,0,0]=4 4420 B12R0.240 CC[C@H](C)NC(=O)COCC(C)C 8ca4e14165acca8e28f3d6e879208b76 [0,2,0,0,0,0|2,0,0]=4 4421 B12R0.240 CC[C@H](C)NC(=O)NCCC(C)C 5fbb9a49d5ff5a3d1a4c7d8fe1389651 [0,2,0,0,0,0|1,0,0]=3 4422 B12R0.240 CC[C@H](C)NC(=O)NCCC(C)O 61a181b05907af958fe11fbf76c6b657 [0,2,0,0,0,0|2,0,0]=4 4423 B12R0.240 CC[C@H](C)NC(=O)NCCN(C)C aa5bce7ecbf9e2f0310af3636b74174f [0,2,0,0,0,0|2,0,0]=4 4424 B12R0.240 CC[C@H](C)NC(=O)NCC[C@@H](C)O ec0a3e6f4ac905bd30e987635150dd0f [0,2,0,0,0,0|2,0,0]=4 4425 B12R0.240 CC[C@H](C)NC(=O)NCC[C@H](C)O ce3cd8fef8bfc8e60e5d01086d0361c2 [0,2,0,0,0,0|2,0,0]=4 4426 B12R0.240 CC[C@H](C)NC(=S)NCCC(C)C 83e95e843e9ed512840b51930d78a198 [0,2,0,0,0,0|1,1,0]=4 4427 B12R0.240 CC[C@H](O)CC(=O)NCCC(C)C af6c55281694b2ff715afc62a0e71d2d [0,2,0,0,0,0|1,0,0]=3 4428 B12R0.240 CC[C@H](O)CC(=O)NCCC(C)O e04dd26c2137efeb006dc3cd02266e53 [0,2,0,0,0,0|2,0,0]=4 4429 B12R0.240 CC[C@H](O)CC(=O)NCCN(C)C 97913c9e7a2ec2d5460e29e510652474 [0,2,0,0,0,0|2,0,0]=4 4430 B12R0.240 CC[C@H](O)CC(=O)NCC[C@@H](C)O 42d787ad98cd3abaeb3ebc7ae4e565ba [0,2,0,0,0,0|2,0,0]=4 4431 B12R0.240 CC[C@H](O)CC(=O)NCC[C@H](C)O e3c638394ec0048f224de18f3d6149da [0,2,0,0,0,0|2,0,0]=4 4432 B12R0.240 CNC(=O)CC(=O)NCCC(C)C 1938d3d1f2f70ec8249f4d8c5f233d7c [0,2,0,0,0,0|1,0,1]=4 4433 B12R0.240 COC(=O)CC(=O)NCCC(C)C 449317072bf5cd4fe215027eabf02843 [0,2,0,0,0,0|1,0,1]=4 4434 B12R0.240 COC(C)CC(=O)NCCC(C)C 32ce63ffbf3b9b8c5c61c0827275e644 [0,2,0,0,0,0|1,0,0]=3 4435 B12R0.240 COC(C)CC(=O)NCCC(C)O b70990413d053f769d736b9fe9321fbf [0,2,0,0,0,0|2,0,0]=4 4436 B12R0.240 COC(C)CC(=O)NCCN(C)C 825632a0632295cafea5e441416e83c2 [0,2,0,0,0,0|2,0,0]=4 4437 B12R0.240 COC(C)CC(=O)NCC[C@@H](C)O 2ba1f349afb0770dbc37033c56d61643 [0,2,0,0,0,0|2,0,0]=4 4438 B12R0.240 COC(C)CC(=O)NCC[C@H](C)O 3dbfba76a2ec69cbc825012f576145dd [0,2,0,0,0,0|2,0,0]=4 4439 B12R0.240 COC(C)CC(C)OCCC(C)C 69b5228b24126efdffcef139c9d1bbad [0,2,0,0,0,0|1,0,1]=4 4440 B12R0.241 C#CC(C)NCOC(=O)CC(C)C 165d89e9ab9c57ae707258d249b63fff [0,2,0,0,0,0|1,0,1]=4 4441 B12R0.241 C#CC(C)OCOC(=O)CC(C)C 4deeb16ec2d7e5c2d9f2ad338f424987 [0,2,0,0,0,0|1,0,1]=4 4442 B12R0.241 C#C[C@@H](C)NCOC(=O)CC(C)C 1dc069cc2a6f7116ece1cbd3ba1647b4 [0,2,0,0,0,0|1,0,1]=4 4443 B12R0.241 C#C[C@@H](C)OCOC(=O)CC(C)C 6000c16414b83acf1038536925d3fe18 [0,2,0,0,0,0|1,0,1]=4 4444 B12R0.241 C#C[C@H](C)NCOC(=O)CC(C)C 30434532d630d2ef353188f510aef82d [0,2,0,0,0,0|1,0,1]=4 4445 B12R0.241 C#C[C@H](C)OCOC(=O)CC(C)C c070794aa679290733fc0ea3762ef785 [0,2,0,0,0,0|1,0,1]=4 4446 B12R0.241 C=C(C)CC(=O)NCCC(C)CC d9719c6f1201ca7f9222cda8dcb3427e [0,2,0,0,0,0|1,0,1]=4 4447 B12R0.241 C=C(C)CC(=O)NCCC(C)CO c281f3787b51564563fa03fcc5a3fa78 [0,2,0,0,0,0|1,0,1]=4 4448 B12R0.241 C=C(C)CC(=O)NCC[C@@H](C)CO 67b924974db9dc697750d6ae6dc7ac3f [0,2,0,0,0,0|1,0,1]=4 4449 B12R0.241 C=CC(C)NCOC(=O)CC(C)C 33ed32a50e3a7ed5044c1627262318c6 [0,2,0,0,0,0|1,0,1]=4 4450 B12R0.241 C=CC(C)OCOC(=O)CC(C)C 7a1ddceb1ae96965f9f0f351d8eca364 [0,2,0,0,0,0|1,0,1]=4 4451 B12R0.241 C=C[C@H](C)OCOC(=O)CC(C)C 8699e6422a6ae1f14771f2256189ace5 [0,2,0,0,0,0|1,0,1]=4 4452 B12R0.241 CC(=O)CC(=O)NCCC(C)CO 926f506d949d5eb69f4e447cf3447df1 [0,2,0,0,0,0|1,0,1]=4 4453 B12R0.241 CC(=O)CC(=O)NCC[C@@H](C)CO 7a7cb6009f93d25c38473660ba3594d4 [0,2,0,0,0,0|1,0,1]=4 4454 B12R0.241 CC(C)CC(=O)CNCC(C)CO 7a2625c7fe9ce5fb076ee0123c8adcc3 [0,2,0,0,0,0|2,0,0]=4 4455 B12R0.241 CC(C)CC(=O)CNC[C@H](C)CO 11a3ed4972bf3d880e771c178130fb1d [0,2,0,0,0,0|2,0,0]=4 4456 B12R0.241 CC(C)CC(=O)NCCC(C)CO 7c20c2144355aca4608aecae8e298227 [0,2,0,0,0,0|1,0,0]=3 4457 B12R0.241 CC(C)CC(=O)NCCC(O)CO 986101c166766dee796c3d2c17cb58a1 [0,2,0,0,0,0|2,0,0]=4 4458 B12R0.241 CC(C)CC(=O)NCC[C@@H](C)CO 1bfa5cf0e13b957a91a5340a7d691266 [0,2,0,0,0,0|1,0,0]=3 4459 B12R0.241 CC(C)CC(=O)OCNC(C)C#N 0e54028f52519e7ae7b01f0fcf1269e3 [0,2,0,0,0,0|1,0,1]=4 4460 B12R0.241 CC(C)CC(=O)OCNC(C)CO 3be7238a1c417d27ea3d610b80f7620d [0,2,0,0,0,0|1,0,0]=3 4461 B12R0.241 CC(C)CC(=O)OCN[C@@H](C)CO be6356ca70e98dfc62492e1f510a5020 [0,2,0,0,0,0|1,0,0]=3 4462 B12R0.241 CC(C)CC(=O)OCN[C@H](C)CO 810845602d670de04dc3f48a57270c73 [0,2,0,0,0,0|1,0,0]=3 4463 B12R0.241 CC(C)CC(=O)OCOC(C)C=O 01e5acca520c76b7ac3fb31aaf59dd4c [0,2,0,0,0,0|1,0,1]=4 4464 B12R0.241 CC(C)CC(=O)OCOC(C)CF 92cdfc0a57ea6e223d60186081927550 [0,2,0,0,0,0|1,0,0]=3 4465 B12R0.241 CC(C)OC(=O)OCN[C@@H](C)CO 22c88653b2295dbca8bc3e0300387a0d [0,2,0,0,0,0|2,0,0]=4 4466 B12R0.241 CC(C)OC(=O)OCN[C@H](C)CO 81bc6a018081211187f113b407cf0290 [0,2,0,0,0,0|2,0,0]=4 4467 B12R0.241 CC(C)OC(=O)OCOC(C)CF be8938d0ec03db614ec367e9e5eaf727 [0,2,0,0,0,0|2,0,0]=4 4468 B12R0.241 CC(CO)CCNC(=O)CC(F)F 87625e46fa69d62abe7e493bda673b2f [0,2,0,0,0,0|2,0,0]=4 4469 B12R0.241 CC(CO)CCNC(=O)CN(C)C 046dec5c8eddc7f51b921990cf014b8c [0,2,0,0,0,0|2,0,0]=4 4470 B12R0.241 CC(CO)CCNC(=O)C[C@@H](C)O 13e9b3e8eb52e98e67e39ce64db861cf [0,2,0,0,0,0|1,0,0]=3 4471 B12R0.241 CC(CO)CCNC(=O)C[C@H](C)O e1b39c22b8ed1db6261661ef7f68ab4b [0,2,0,0,0,0|1,0,0]=3 4472 B12R0.241 CC(CO)NCOC(=O)OC(C)C 1b17ee9fc83d264069fac435033b7ca0 [0,2,0,0,0,0|2,0,0]=4 4473 B12R0.241 CC(O)CC(=O)NCCC(C)CO 700252b7e87bb5a7de50091d71d7277f [0,2,0,0,0,0|1,0,0]=3 4474 B12R0.241 CC(O)CC(=O)NCCC(O)CO adf8c9eb5ee2e1030cd7ac04f1e1dc99 [0,2,0,0,0,0|2,0,0]=4 4475 B12R0.241 CC(O)CC(=O)NCC[C@@H](C)CO 6eb275aa5f4b87fcf005c9468526f30d [0,2,0,0,0,0|1,0,0]=3 4476 B12R0.241 CCC(C)CCNC(=O)CC(=O)C 6ae71feae3ed592126062a4a155879ae [0,2,0,0,0,0|1,0,1]=4 4477 B12R0.241 CCC(C)CCNC(=O)CC(C)C 84168af550c09e30efc124175680d682 [0,2,0,0,0,0|1,0,0]=3 4478 B12R0.241 CCC(C)CCNC(=O)CC(C)O 26393f29ecb4d3e21e6bd0e93688b687 [0,2,0,0,0,0|1,0,0]=3 4479 B12R0.241 CCC(C)CCNC(=O)CC(F)F c0235bffb7506bb3e9cc2b80033f095c [0,2,0,0,0,0|2,0,0]=4 4480 B12R0.241 CCC(C)CCNC(=O)CN(C)C a63a21b2e12226262e87122c1ff32b0a [0,2,0,0,0,0|2,0,0]=4 4481 B12R0.241 CCC(C)CCNC(=O)C[C@@H](C)O a1340bfef5cc8f97d5967ba808b1db07 [0,2,0,0,0,0|1,0,0]=3 4482 B12R0.241 CCC(C)CCNC(=O)C[C@H](C)O bd5b9cfcc174cbbd5b43b88431a9ee76 [0,2,0,0,0,0|1,0,0]=3 4483 B12R0.241 CCC(C)CCOC(C)CC(C)C ff46a0fdfb58cad097f660e68a7fc2f9 [0,2,0,0,0,0|1,0,1]=4 4484 B12R0.241 CCC(C)CCO[C@@H](C)CC(C)C 752c26a46f95b286b6399129dae8ae11 [0,2,0,0,0,0|1,0,1]=4 4485 B12R0.241 CCC(C)CCO[C@H](C)CC(C)C 205a28f8692144ad16cf352423edc177 [0,2,0,0,0,0|1,0,1]=4 4486 B12R0.241 CCC(C)CNCC(=O)CC(C)C 235ea47bd253fe11e9d4a10a8dba3792 [0,2,0,0,0,0|2,0,0]=4 4487 B12R0.241 CCC(C)COCC(=O)CC(C)C 43c505939f67f2655341f7868f4331c3 [0,2,0,0,0,0|2,0,0]=4 4488 B12R0.241 CCC(C)NCOC(=O)CC(C)C b25521e4ebe1f7a66ba06d4b1d2da296 [0,2,0,0,0,0|1,0,0]=3 4489 B12R0.241 CCC(C)NCOC(=O)OC(C)C c57a48f30721a89055160ab7502ba344 [0,2,0,0,0,0|2,0,0]=4 4490 B12R0.241 CCC(C)OCOC(=O)CC(C)C 2ea5b7ecd5ce4918fd6ea0f610ad93f1 [0,2,0,0,0,0|1,0,0]=3 4491 B12R0.241 CCC(C)OCOC(=O)OC(C)C 58f936e946b2197640ab78bf40952d2f [0,2,0,0,0,0|2,0,0]=4 4492 B12R0.241 CCN(C)CCOC(=O)CC(=O)C bd99f20ebc2a09256a03d0bb1a7fd376 [0,2,0,0,0,0|1,0,1]=4 4493 B12R0.241 CC[C@@H](C)COCC(=O)CC(C)C 414318d8003ec6211942ccc9054eaa96 [0,2,0,0,0,0|2,0,0]=4 4494 B12R0.241 CC[C@@H](C)NCOC(=O)CC(C)C aa1c9142b9de5b8460787ec11b2225b7 [0,2,0,0,0,0|1,0,0]=3 4495 B12R0.241 CC[C@@H](C)NCOC(=O)OC(C)C 7a94b4cedec429349999ec1e7688a10a [0,2,0,0,0,0|2,0,0]=4 4496 B12R0.241 CC[C@@H](C)OCOC(=O)CC(C)C d755767f6eb049ff84b6ed2b2614069c [0,2,0,0,0,0|1,0,0]=3 4497 B12R0.241 CC[C@@H](C)OCOC(=O)OC(C)C 2fd67f42b3438586e949a0b97bd603c0 [0,2,0,0,0,0|2,0,0]=4 4498 B12R0.241 CC[C@H](C)CCOC(C)CC(C)C 9ddf1e8e928d78f8326d5d909709bad5 [0,2,0,0,0,0|1,0,1]=4 4499 B12R0.241 CC[C@H](C)CNCC(=O)CC(C)C 1202c95420800d57eb50190fd695b504 [0,2,0,0,0,0|2,0,0]=4 4500 B12R0.241 CC[C@H](C)COCC(=O)CC(C)C 8094fdb9d430675f2fde21db8b04a7a1 [0,2,0,0,0,0|2,0,0]=4 4501 B12R0.241 CC[C@H](C)NCOC(=O)CC(C)C 07a877f35f4f291bfe843018c74800e8 [0,2,0,0,0,0|1,0,0]=3 4502 B12R0.241 CC[C@H](C)NCOC(=O)OC(C)C 664c4a42c03cb2eae533e4842d885062 [0,2,0,0,0,0|2,0,0]=4 4503 B12R0.241 CC[C@H](C)OCOC(=O)CC(C)C 13cc4dc38219de0055edb7b611ffd991 [0,2,0,0,0,0|1,0,0]=3 4504 B12R0.241 CC[C@H](C)OCOC(=O)OC(C)C 4224e51bca558bf428b386447578dac9 [0,2,0,0,0,0|2,0,0]=4 4505 B12R0.241 COC(C)CCOC(C)CC(C)C 3290424bffd3643557eff8e1c09efb6e [0,2,0,0,0,0|1,0,1]=4 4506 B12R0.241 COC(C)COCC(=O)CC(C)C 7976d985d240605d93c5ab83019356ed [0,2,0,0,0,0|2,0,0]=4 4507 B12R0.241 CO[C@@H](C)CNCC(=O)CC(C)C 11c6b5589a84daadd46f0ef1c1359f19 [0,2,0,0,0,0|2,0,0]=4 4508 B12R0.241 CO[C@@H](C)COCC(=O)CC(C)C 28f9b45b47d74f5c300e0566b6b6f506 [0,2,0,0,0,0|2,0,0]=4 4509 B12R0.241 CO[C@H](C)CNCC(=O)CC(C)C 3217d0a6ec0bb3d5958b9e92e1896e7a [0,2,0,0,0,0|2,0,0]=4 4510 B12R0.241 CO[C@H](C)COCC(=O)CC(C)C b0c47d7e982644ace4e033cb974aa250 [0,2,0,0,0,0|2,0,0]=4 4511 B12R0.241 C[C@@H](CO)CCNC(=O)CC(F)F c2b352362aedbccd94758c599ccb362d [0,2,0,0,0,0|2,0,0]=4 4512 B12R0.241 C[C@@H](CO)CCNC(=O)CN(C)C dd7e96894a0126608ccfb5ce3343f1f5 [0,2,0,0,0,0|2,0,0]=4 4513 B12R0.241 C[C@@H](CO)CCNC(=O)C[C@@H](C)O 588e870658c150267fec26e885ca3067 [0,2,0,0,0,0|1,0,0]=3 4514 B12R0.241 C[C@@H](CO)CCNC(=O)C[C@H](C)O a72049bbf5b23dd37e482ea2f40b7d7b [0,2,0,0,0,0|1,0,0]=3 4515 B12R0.241 C[C@@H](O)CC(=O)NCCC(O)CO 0df0bbb25548cd8175b3b9f2ffb596f3 [0,2,0,0,0,0|2,0,0]=4 4516 B12R0.241 C[C@H](O)CC(=O)NCCC(O)CO 1efbacd3d08dc34f6996e7297e0a017c [0,2,0,0,0,0|2,0,0]=4 4517 B12R0.258 C=C(C)CC(=O)N(C)CCC(C)C a98695e6a8e0ea3d6cfda81dc7adba04 [0,2,0,0,0,0|1,0,1]=4 4518 B12R0.258 CC(=O)CC(=O)N(C)CCC(C)C 24916ac1f8cb6b745baf63c83eaf0abc [0,2,0,0,0,0|1,0,1]=4 4519 B12R0.258 CC(C)CC(=O)N(C)CCC(C)O 454d653bd01fd567d55262a7f60238ae [0,2,0,0,0,0|2,0,0]=4 4520 B12R0.258 CC(C)CC(=O)N(C)CCN(C)C cfeb67936ff85a22046d550f5ee6b2fa [0,2,0,0,0,0|2,0,0]=4 4521 B12R0.258 CC(C)CCN(C)C(=O)CC(C)C e5da19926366d60a38c398467a6511d9 [0,2,0,0,0,0|1,0,0]=3 4522 B12R0.258 CC(C)CCN(C)C(=O)CC(C)O 1eb58d4a3ff491c593427908cd1b96e2 [0,2,0,0,0,0|1,0,0]=3 4523 B12R0.258 CC(C)CCN(C)C(=O)CC(F)F 076aa3ab3ba8a98ac2cfbfbe51aecbaf [0,2,0,0,0,0|2,0,0]=4 4524 B12R0.258 CC(C)CCN(C)C(=O)CN(C)C f8b1ed06ee4b6c12cbc2f7e88a48af87 [0,2,0,0,0,0|2,0,0]=4 4525 B12R0.258 CC(C)CCN(C)C(=O)C[C@@H](C)O 5f30b520931b77d02abd1044a2fcdb5a [0,2,0,0,0,0|1,0,0]=3 4526 B12R0.258 CC(C)CCN(C)C(=O)C[C@H](C)O cd0a5a4b125374f3da28f00b0dba0d46 [0,2,0,0,0,0|1,0,0]=3 4527 B12R0.258 CC(C)CNC(=O)C(=O)CC(C)C 26ca7ff1e7f7ad92b615c1b69d3d4304 [0,2,0,0,0,0|2,0,0]=4 4528 B12R0.258 CC(O)CC(=O)N(C)CCN(C)C 035f3624fd7c79d37d190c517482bc07 [0,2,0,0,0,0|2,0,0]=4 4529 B12R0.258 CC(O)CCN(C)C(=O)CC(C)O 886a92ab55335f53e0818f598d36bbdb [0,2,0,0,0,0|2,0,0]=4 4530 B12R0.258 CC(O)CCN(C)C(=O)C[C@@H](C)O 8e696570870a829972d2b2944537399c [0,2,0,0,0,0|2,0,0]=4 4531 B12R0.258 CC(O)CCN(C)C(=O)C[C@H](C)O f7967cafb9ba33015efb2a5e2a6dbd0e [0,2,0,0,0,0|2,0,0]=4 4532 B12R0.258 C[C@@H](O)CC(=O)N(C)CCN(C)C 2e507973e672decb6339f4719514b8db [0,2,0,0,0,0|2,0,0]=4 4533 B12R0.258 C[C@H](O)CC(=O)N(C)CCN(C)C 8b4fbc62460e3c89cbd064dac88f0d65 [0,2,0,0,0,0|2,0,0]=4 4534 B12R0.535 C#CC(CC(C)C)OCCC(C)C 4e2ceda38302314e9c4917c1fb4b7d2e [0,2,0,0,0,0|1,0,1]=4 4535 B12R0.535 C=CC(CC(C)C)OCCC(C)C 8f5b8a9ef7c1805a3b6898b2f9c80b94 [0,2,0,0,0,0|1,0,1]=4 4536 B12R0.535 CC(C)CCOC(C#N)CC(C)C ee307954ed77ff5a657e5538017d985d [0,2,0,0,0,0|1,0,1]=4 4537 B12R0.686 CC(C)C(F)C(=O)NCCN(C)C eb145be818eede2c715d8e5d1c22e987 [0,2,0,0,0,0|2,0,0]=4 4538 B12R0.686 CC(C)C(F)C(=O)NCC[C@@H](C)O 0c4bf657c962ba57180ebcd25374a88e [0,2,0,0,0,0|2,0,0]=4 4539 B12R0.686 CC(C)C(F)C(=O)NCC[C@H](C)O 29abdf0c3dbf5e3ae1907848fb2828ba [0,2,0,0,0,0|2,0,0]=4 4540 B12R0.686 CC(C)C(O)C(=O)NCCN(C)C efd66639624ddef41ce9c69ef83273d2 [0,2,0,0,0,0|2,0,0]=4 4541 B12R0.686 CC(C)C(O)C(=O)NCC[C@@H](C)O eeaf7ce4d44acd1cc5d9af99b3780a98 [0,2,0,0,0,0|2,0,0]=4 4542 B12R0.686 CC(C)C(O)C(=O)NCC[C@H](C)O a68740de5f7189f400040ab6cb547f45 [0,2,0,0,0,0|2,0,0]=4 4543 B12R0.686 CC(C)CCNC(=O)C(=O)C(C)C b5da32c864fd86b02c9da8d42ba5479f [0,2,0,0,0,0|1,0,1]=4 4544 B12R0.686 CC(C)CCNC(=O)C(C)N(C)C 3c8dbaef67f93a57156ef872523d3516 [0,2,0,0,0,0|2,0,0]=4 4545 B12R0.686 CC(C)CCNC(=O)C(F)C(C)C 8dd4b90320e614dc6d32858288ec2e98 [0,2,0,0,0,0|1,0,0]=3 4546 B12R0.686 CC(C)CCNC(=O)C(O)C(C)C 21f34dce860bf52e31dbe68e26634032 [0,2,0,0,0,0|1,0,0]=3 4547 B12R0.686 CC(C)CCNC(=O)N(C)C(C)C da44c77eb9d7bc9a09b7f4db9c981cb2 [0,2,0,0,0,0|2,0,0]=4 4548 B12R0.686 CC(C)CCNC(=O)[C@@H](C)N(C)C 32451eac8d513de0fc24e1d0d109c331 [0,2,0,0,0,0|2,0,0]=4 4549 B12R0.686 CC(C)CCNC(=O)[C@@H](O)C(C)C 6f90b65242807ca76495ba581bf8b4e6 [0,2,0,0,0,0|1,0,0]=3 4550 B12R0.686 CC(C)CCNC(=O)[C@@H](O)[C@@H](C)O cf73775c9d10618a6f108fee9b3996c9 [0,2,0,0,0,0|1,0,0]=3 4551 B12R0.686 CC(C)CCNC(=O)[C@H](C)N(C)C 25a7604d54ab5a0a70d537cf95430cd2 [0,2,0,0,0,0|2,0,0]=4 4552 B12R0.686 CC(C)CCNC(=O)[C@H](O)C(C)C 16f1bc56f1c347072d00fb8384d9f00a [0,2,0,0,0,0|1,0,0]=3 4553 B12R0.686 CC(C)[C@@H](O)C(=O)NCCN(C)C db75852387d2593a82e79cbecf2d625c [0,2,0,0,0,0|2,0,0]=4 4554 B12R0.686 CC(C)[C@@H](O)C(=O)NCC[C@@H](C)O cb833a87ed43fb273e3c25ac3681354d [0,2,0,0,0,0|2,0,0]=4 4555 B12R0.686 CC(C)[C@@H](O)C(=O)NCC[C@H](C)O d70f761fe55e97a2e1526bec9546831d [0,2,0,0,0,0|2,0,0]=4 4556 B12R0.686 CC(C)[C@H](O)C(=O)NCCN(C)C b73332abfe8ec3d73ab0cf6feb51f2d1 [0,2,0,0,0,0|2,0,0]=4 4557 B12R0.686 CC(C)[C@H](O)C(=O)NCC[C@@H](C)O d2125004b2ba9866b5f4983060f0a8da [0,2,0,0,0,0|2,0,0]=4 4558 B12R0.686 CC(C)[C@H](O)C(=O)NCC[C@H](C)O 156a440c7de119b0a7a99ed56adbd7fa [0,2,0,0,0,0|2,0,0]=4 4559 B12R0.686 CC(O)CCNC(=O)C(F)C(C)C 1e87fcad2de8605dfdd929b35bab607c [0,2,0,0,0,0|2,0,0]=4 4560 B12R0.686 CC(O)CCNC(=O)C(O)C(C)C 5de6bfaa0919b833eb3d77086340fcfa [0,2,0,0,0,0|2,0,0]=4 4561 B12R0.686 CC(O)CCNC(=O)[C@@H](O)C(C)C acdd8528ae7b9deb5eb1edcf931e5cce [0,2,0,0,0,0|2,0,0]=4 4562 B12R0.686 CC(O)CCNC(=O)[C@@H](O)[C@@H](C)O 5435512a9c15d878efbe05b041de0940 [0,2,0,0,0,0|2,0,0]=4 4563 B12R0.686 CC(O)CCNC(=O)[C@H](O)C(C)C 1f6f6f91d770883bd38dd02a5f004bba [0,2,0,0,0,0|2,0,0]=4 4564 B12R0.686 C[C@@H](O)CCNC(=O)[C@@H](O)[C@@H](C)O 7c6aadf2aa28ce18db09e759a88737db [0,2,0,0,0,0|2,0,0]=4 4565 B12R0.686 C[C@@H](O)[C@H](O)C(=O)NCCN(C)C d07c3c5f212ecbd1c309bb1363156a3d [0,2,0,0,0,0|2,0,0]=4 4566 B12R0.686 C[C@H](O)CCNC(=O)[C@@H](O)[C@@H](C)O 03ab908b4dab67325ad7c9e7e37693a2 [0,2,0,0,0,0|2,0,0]=4 4567 B12R0.687 C=C(C)CC(=O)NCC(O)C(C)C c18a36089cd91b3bc05f89d99fdc1456 [0,2,0,0,0,0|1,0,1]=4 4568 B12R0.687 CC(=O)CC(=O)NCC(O)C(C)C dda757ab91dde5d5015b35dc93114c12 [0,2,0,0,0,0|1,0,1]=4 4569 B12R0.687 CC(C)C(O)CNC(=O)CC(F)F 7f4f7b8f884ff9d807b54a0e9941f983 [0,2,0,0,0,0|2,0,0]=4 4570 B12R0.687 CC(C)C(O)CNC(=O)CN(C)C 79aff6938b523ef354a4eb19f30824d1 [0,2,0,0,0,0|2,0,0]=4 4571 B12R0.687 CC(C)C(O)CNC(=O)C[C@@H](C)O a4509820cf217cdbe1ba4351c189278f [0,2,0,0,0,0|1,0,0]=3 4572 B12R0.687 CC(C)C(O)CNC(=O)C[C@H](C)O 164540c5f41713c3cb6294d7eeda157d [0,2,0,0,0,0|1,0,0]=3 4573 B12R0.687 CC(C)CC(=O)CNC(C)C(C)C ce1483b7096869d51e9114351dc4e925 [0,2,0,0,0,0|2,0,0]=4 4574 B12R0.687 CC(C)CC(=O)CN[C@@H](C)C(C)C 92b4902f1f23826b29c8d77d8ee1a8ec [0,2,0,0,0,0|2,0,0]=4 4575 B12R0.687 CC(C)CC(=O)CN[C@H](C)C(C)C eb1f327b63af90a428b405c0344ff4c7 [0,2,0,0,0,0|2,0,0]=4 4576 B12R0.687 CC(C)CC(=O)COC(C)C(C)C 20794200b712d909ea162eb20e876356 [0,2,0,0,0,0|2,0,0]=4 4577 B12R0.687 CC(C)CC(=O)CO[C@@H](C)C(C)C efcc92a98ea4b17cf388f02ab16deb3f [0,2,0,0,0,0|2,0,0]=4 4578 B12R0.687 CC(C)CC(=O)CO[C@H](C)C(C)C 7824a5ba6c38b01062a487cc06fd4de8 [0,2,0,0,0,0|2,0,0]=4 4579 B12R0.687 CC(C)CC(=O)NCC(C)N(C)C a8013aba2384a7f36e8cdb2bc8070d66 [0,2,0,0,0,0|2,0,0]=4 4580 B12R0.687 CC(C)CC(=O)NCC(O)C(C)C e84eb6d2f7adbdd924190b6cd06ecce4 [0,2,0,0,0,0|1,0,0]=3 4581 B12R0.687 CC(C)CC(=O)OCN(C)C(C)C 7fab9de2ce6df3f20b979be9aa9bb757 [0,2,0,0,0,0|1,0,0]=3 4582 B12R0.687 CC(C)CC(C)OCC(C)C(C)C 858c700bf312b3c71080bc0eaf7bbb2c [0,2,0,0,0,0|1,0,1]=4 4583 B12R0.687 CC(C)C[C@@H](C)OCC(C)C(C)C ff07aa24f4995683338ae3ab88406bb8 [0,2,0,0,0,0|1,0,1]=4 4584 B12R0.687 CC(C)C[C@H](C)OCC(C)C(C)C 93fab8a93fe8b88174b4dcb5370711e9 [0,2,0,0,0,0|1,0,1]=4 4585 B12R0.687 CC(C)OC(=O)OCN(C)C(C)C 70450062fc7257cbd6d7867fa7ca2f69 [0,2,0,0,0,0|2,0,0]=4 4586 B12R0.687 CC(CNC(=O)C[C@@H](C)O)N(C)C 1558002872d789ae09eaa4c868c2bde9 [0,2,0,0,0,0|2,0,0]=4 4587 B12R0.687 CC(CNC(=O)C[C@H](C)O)N(C)C 63301d69d05fe11a95f4c3ce2a552574 [0,2,0,0,0,0|2,0,0]=4 4588 B12R0.687 CC(O)CC(=O)NCC(C)N(C)C 6e1fbfedee5d1420824e0e5afef7b54c [0,2,0,0,0,0|2,0,0]=4 4589 B12R0.687 CC(O)CC(=O)NCC(O)C(C)C 660845df7bd22a24ff45879aa248228a [0,2,0,0,0,0|1,0,0]=3 4590 B12R0.164 CCCC(CCC)OCCC(C)C d036fc005d949d1048fdac7700007b06 [0,2,0,0,0,0|1,0,1]=4 4591 B12R0.229 C#CC(CCC)OCCC(C)CC 60ca4b958e1f2e537030d310ddcb380e [0,2,0,0,0,0|1,0,1]=4 4592 B12R0.229 C=CC(CCC)OCCC(C)CC 1982bf6a0f224ef130a3abf77834269e [0,2,0,0,0,0|1,0,1]=4 4593 B12R0.229 CCCC(C#N)OCCC(C)CC 0bb64d51ea06d4cfe3161c734ec13e5a [0,2,0,0,0,0|1,0,1]=4 4594 B12R0.229 CCCC(CC)OCCC(C)CC 5c4696c9062aa19f6bbc0f15706a78d8 [0,2,0,0,0,0|1,0,1]=4 4595 B12R0.229 CCCC(CC)OCCC(C)OC d3199f70c11c0946a192ec7c2ed00645 [0,2,0,0,0,0|1,0,1]=4 4596 B12R0.229 CCCC(CC)OCC[C@@H](C)CC 80c7905944403b76892289a2a401a053 [0,2,0,0,0,0|1,0,1]=4 4597 B12R0.229 CCC[C@@H](CC)OCCC(C)CC 072360ce420b1deab6457474090d3d79 [0,2,0,0,0,0|1,0,1]=4 4598 B12R0.230 C#CC(CCC)OCCC(C)(C)C 4965dc60f6ea69436c8f5d4416985296 [0,2,0,0,0,0|1,0,1]=4 4599 B12R0.230 C#CC(CCC)OCCC(C)(C)O 1fe52e20adb115b8054b42f78d364134 [0,2,0,0,0,0|1,0,1]=4 4600 B12R0.230 C=CC(CCC)OCCC(C)(C)C 6597bf478f6d8a39b8c7360e956d977e [0,2,0,0,0,0|1,0,1]=4 4601 B12R0.230 C=CC(CCC)OCCC(C)(C)O d1c8c818edc226f2f9dbb5298601d042 [0,2,0,0,0,0|1,0,1]=4 4602 B12R0.230 CCCC(C#N)OCCC(C)(C)C b2a5f81d4e87ba7683ba1e89e7a15a4b [0,2,0,0,0,0|1,0,1]=4 4603 B12R0.230 CCCC(C#N)OCCC(C)(C)O 033c042d6e73be6a207acb72522ed030 [0,2,0,0,0,0|1,0,1]=4 4604 B12R0.230 CCCC(CC)OCCC(C)(C)C 20136149e8fbc8c0a318807bf8295041 [0,2,0,0,0,0|1,0,1]=4 4605 B12R0.230 CCCC(CC)OCCC(C)(C)O c3ebba5c3bb560daa3d79a76dc89add4 [0,2,0,0,0,0|1,0,1]=4 4606 B12R0.230 CCCC(CC)OCCC(C)(C)S 6accb32baebe0a9ccc56581287f36df7 [0,2,0,0,0,0|1,0,1]=4 4607 B12R0.230 CCC[C@@H](CC)OCCC(C)(C)C 5b37f203eda03e598e377a166b0dc41e [0,2,0,0,0,0|1,0,1]=4 4608 B12R0.230 CCC[C@@H](CC)OCCC(C)(C)O e8cfdad14318ef144da6ba33da0b181b [0,2,0,0,0,0|1,0,1]=4 4609 B12R0.254 C#CC(CCCC)OCCC(C)C 431d38bb4269daff93d3a8a673349643 [0,2,0,0,0,0|1,0,1]=4 4610 B12R0.254 C=CC(CCCC)OCCC(C)C b4c37c12c55bf53af31c6b9ef186c264 [0,2,0,0,0,0|1,0,1]=4 4611 B12R0.254 CCCCC(CC)OCCC(C)C 320fe0605d7770bdcc547b11a47d1377 [0,2,0,0,0,0|1,0,1]=4 4612 B12R0.299 C#CC(CCC)OCC(C)C(C)C 2cb1183ea24c1b809c742e0e656a8495 [0,2,0,0,0,0|1,0,1]=4 4613 B12R0.299 C=CC(CCC)OCC(C)C(C)C 3f898faca713b389e91dfe1d10ba17fd [0,2,0,0,0,0|1,0,1]=4 4614 B12R0.299 CCCC(C#N)OCC(C)C(C)C 381d4d13ce223b1badd631508a4d6e29 [0,2,0,0,0,0|1,0,1]=4 4615 B12R0.299 CCCC(CC)OCC(C)C(C)C 0366dd02e1fa4715ac9609f16a5d5eb4 [0,2,0,0,0,0|1,0,1]=4 4616 B12R0.299 CCC[C@@H](CC)OCC(C)C(C)C feb00685f7ec96b89867fb1fd8d227cb [0,2,0,0,0,0|1,0,1]=4 4617 B12R0.397 CCCC(NCCC(C)C)C(=O)C efa8eb2b5c96bc74325a1033cf7f3bc2 [0,2,0,0,0,0|1,0,1]=4 4618 B12R0.397 CCCC(NCCC(C)C)C(=O)O 5ed80fb863c6c1f3540640fcc11569fc [0,2,0,0,0,0|1,0,1]=4 4619 B12R0.397 CCCC(OCCC(C)C)C(=O)C 57401f5e2c25c6422e961e36678e8da2 [0,2,0,0,0,0|0,0,1]=3 4620 B12R0.397 CCCC(OCCC(C)C)C(=O)N 127ad77d3b60f53e5c0f6dda15eda0b6 [0,2,0,0,0,0|0,0,1]=3 4621 B12R0.397 CCCC(OCCC(C)C)C(=O)O eab8f77ba0da1b852086b7bbe6e8bd64 [0,2,0,0,0,0|0,0,1]=3 4622 B12R0.397 CCCC(OCCC(C)C)C(C)C 1c8b7a6a27138d88bd01b6dcab43f419 [0,2,0,0,0,0|1,0,1]=4 4623 B12R0.397 CCCC(OCCN(C)C)C(=O)C c8643fc177a0f3af54a2dbaf6607a186 [0,2,0,0,0,0|1,0,1]=4 4624 B12R0.397 CCCC(OCCN(C)C)C(=O)N b59067eb0c21e2dfafb447b470b128b8 [0,2,0,0,0,0|1,0,1]=4 4625 B12R0.397 CCCC(OCOC(C)C)C(=O)N 2293a7dd7f8f42cc5bbcebc1a6590899 [0,2,0,0,0,0|1,0,1]=4 4626 B12R0.397 CCCC(OCOC(C)C)C(=O)O 66befe5245201983d0fb73ca6e3c9616 [0,2,0,0,0,0|1,0,1]=4 4627 B12R0.397 CCC[C@@H](NCCC(C)C)C(=O)O 3a44346e73eef93edf5311c489458098 [0,2,0,0,0,0|1,0,1]=4 4628 B12R0.397 CCC[C@@H](OCCC(C)C)C(=O)O 7909321d97116c4e4fe4269211c72766 [0,2,0,0,0,0|0,0,1]=3 4629 B12R0.397 CCC[C@@H](OCOC(C)C)C(=O)O c3cf9d2cc6d6ec4e68fa003175e16328 [0,2,0,0,0,0|1,0,1]=4 4630 B12R0.397 CCC[C@H](NCCC(C)C)C(=O)O f3570534098c2cf777caf78f3c8b330e [0,2,0,0,0,0|1,0,1]=4 4631 B12R0.397 CCC[C@H](OCCC(C)C)C(=O)O b08e0c0553120efb888897f0123fc67f [0,2,0,0,0,0|0,0,1]=3 4632 B12R0.397 CCC[C@H](OCOC(C)C)C(=O)O f2f6a08c23370c701e7a0b54336a2780 [0,2,0,0,0,0|1,0,1]=4 4633 B12R0.397 COCC(OCCC(C)C)C(=O)O c87a7ac5bd74344fe09e56fbc9fe6576 [0,2,0,0,0,0|1,0,1]=4 4634 B12R0.397 CSCC(OCCC(C)C)C(=O)O c65f3f72facc4b262a57c0c7ca9a5fd9 [0,2,0,0,0,0|1,0,1]=4 4635 B12R0.76 CCCC(=O)C(=O)NC(C)C(C)C c0280dc17a83a70dfde70eae4f2dece8 [0,2,0,0,0,0|2,0,0]=4 4636 B12R0.76 CCCC(=O)C(=O)N[C@@H](C)C(C)C a33c6f55980c29c1924c34e757a3771b [0,2,0,0,0,0|2,0,0]=4 4637 B12R0.76 CCCC(=O)C(=O)N[C@H](C)C(C)C 12084854ffc23fb4759b16cea4942f2e [0,2,0,0,0,0|2,0,0]=4 4638 B12R0.77 CCCC(=O)C(CC)NCC(C)C 744a170f1a1742075965707385fa9f9c [0,2,0,0,0,0|2,0,0]=4 4639 B12R0.77 CCCC(=O)C(CC)OCC(C)C 76fab7f387ef73402952ae45187f461e [0,2,0,0,0,0|2,0,0]=4 4640 B12R0.77 CCCC(=O)N(CC)CCN(C)C 12831fea3e2f1d6e264404bed8e53158 [0,2,0,0,0,0|2,0,0]=4 4641 B12R0.88 C=C(CC)C(=O)N(C)CCC(C)C 37e3ed040d04c060fa059fc4dc83db05 [0,2,0,0,0,0|1,0,1]=4 4642 B12R0.88 CC(C)CCN(C)C(=O)C(O)CO 3522fa892714ab2272183070e2267293 [0,2,0,0,0,0|2,0,0]=4 4643 B12R0.88 CC(C)CCN(C)C(=O)[C@@H](O)CO b660c2dd1912cbbf0dc166aef235cf25 [0,2,0,0,0,0|2,0,0]=4 4644 B12R0.88 CC(C)CCN(C)C(=O)[C@H](O)CF 29583c984e7efed5190b2f701f54f819 [0,2,0,0,0,0|2,0,0]=4 4645 B12R0.88 CCC(=O)C(=O)N(C)CCC(C)C 8f321e15f6232cc2ea19e022408d7b4e [0,2,0,0,0,0|1,0,1]=4 4646 B12R0.88 CCC(C)C(=O)C(=O)NCC(C)C 4adc07066afd9efdc77afc19c9589cf6 [0,2,0,0,0,0|2,0,0]=4 4647 B12R0.88 CCC(O)C(=O)N(C)CCC(C)C 402de4ed03e13b3216f2aae952a63eac [0,2,0,0,0,0|1,0,0]=3 4648 B12R0.88 CCC(O)C(=O)N(C)CCC(C)O 84cf21365b6c38c51c8eb4f828409094 [0,2,0,0,0,0|2,0,0]=4 4649 B12R0.88 CCC(O)C(=O)N(C)CCN(C)C d4db5f2be7c333475a7bb9f8fb47c9b5 [0,2,0,0,0,0|2,0,0]=4 4650 B12R0.88 CCN(C)C(=O)[C@@H](O)CCC(C)C bf70302d7d21242320f33320f0751368 [0,2,0,0,0,0|2,0,0]=4 4651 B12R0.88 CCN(C)C(=O)[C@H](O)CCC(C)C 901a7d54bc35a205b4a4d9c78fea37cb [0,2,0,0,0,0|2,0,0]=4 4652 B12R0.88 CC[C@@H](O)C(=O)N(C)CCC(C)C ab9f378f41606eb4a918f39379770a14 [0,2,0,0,0,0|1,0,0]=3 4653 B12R0.88 CC[C@@H](O)C(=O)N(C)CCC(C)O 9a435b6618f09c907b46c4aa2a1fc8be [0,2,0,0,0,0|2,0,0]=4 4654 B12R0.88 CC[C@@H](O)C(=O)N(C)CCN(C)C 9d3d131634c75421fd382f129ede0c5a [0,2,0,0,0,0|2,0,0]=4 4655 B12R0.88 CC[C@H](O)C(=O)N(C)CCC(C)C a167863ceb2f0877eabc064f13eb9739 [0,2,0,0,0,0|1,0,0]=3 4656 B12R0.88 CC[C@H](O)C(=O)N(C)CCC(C)O c2455410380095e29e131cfa35037ff7 [0,2,0,0,0,0|2,0,0]=4 4657 B12R0.88 CC[C@H](O)C(=O)N(C)CCN(C)C 2bcf3e1b62c2e284b1b77274ccc2cf5e [0,2,0,0,0,0|2,0,0]=4 4658 B12R0.88 CC[C@H](S)C(=O)N(C)CCC(C)C 2740382514396348a6a47e52cfe17066 [0,2,0,0,0,0|1,0,0]=3 4659 B12R0.88 CC[C@H](S)C(=O)N(C)CCC(C)O 128b025a9afc4b58b15c038c02024bb9 [0,2,0,0,0,0|2,0,0]=4 4660 B12R0.88 CC[C@H](S)C(=O)N(C)CCN(C)C 4f82d918370d3762fe797cc47279975c [0,2,0,0,0,0|2,0,0]=4 4661 B12R0.88 COC(C)C(=O)N(C)CCC(C)C c4c66afbd928f7fa381ceb11d6681144 [0,2,0,0,0,0|2,0,0]=4 4662 B12R0.88 CO[C@@H](C)C(=O)N(C)CCC(C)C 324def4dae0174b29ec53fa836d180d9 [0,2,0,0,0,0|2,0,0]=4 4663 B12R0.88 CO[C@H](C)C(=O)N(C)CCC(C)C 5ea7d44b270d4a778d5a604aee998ef5 [0,2,0,0,0,0|2,0,0]=4 4664 B12R0.88 CSC(C)C(=O)N(C)CCC(C)C 59fab85555b1c9ba6765e6bb35574b83 [0,2,0,0,0,0|2,0,0]=4 4665 B12R0.98 C#CCCC(=O)N(C)CCC(C)C f14f657d912f2626c1a3ee7c11caa060 [0,2,0,0,0,0|1,0,1]=4 4666 B12R0.98 C/C=C/CC(=O)N(C)CCC(C)C b9b3a3ac8827258a8545da9e69138bbf [0,2,0,0,0,0|1,0,1]=4 4667 B12R0.98 C=CCCC(=O)N(C)CCC(C)C dea4d4d3196ebab36d08c28ff70589a8 [0,2,0,0,0,0|1,0,1]=4 4668 B12R0.98 CC#CCC(=O)N(C)CCC(C)C 8b625d99a63c50e99c1413a94822dedd [0,2,0,0,0,0|1,0,1]=4 4669 B12R0.98 CC(C)CCN(C)C(=O)CCC#N 76a6d75c352933a7fd44f41303d35120 [0,2,0,0,0,0|1,0,1]=4 4670 B12R0.98 CC(C)CCN(C)C(=O)CCC=O a8533d23589b870c747c814ed22c9d53 [0,2,0,0,0,0|1,0,1]=4 4671 B12R0.98 CC(C)CCN(C)C(=O)CCCF f51d18290fbb2e27d9baf2843b27dce2 [0,2,0,0,0,0|1,0,0]=3 4672 B12R0.98 CC(C)CCN(C)C(=O)CCCS 9e9e106025946a6b04515a605c5ee1f6 [0,2,0,0,0,0|1,0,0]=3 4673 B12R0.98 CC(C)CCN(C)C(=O)NCCF 84be4fe4565b59d8b0f92f0168659b63 [0,2,0,0,0,0|2,0,0]=4 4674 B12R0.98 CC(C)CCN(C)C(=O)NCCN 3c13c3a076863885da7ba716cf453596 [0,2,0,0,0,0|2,0,0]=4 4675 B12R0.98 CC(C)CCN(C)C(=O)NCCO 2b3a8424bea523f6a27905dd58fa1844 [0,2,0,0,0,0|2,0,0]=4 4676 B12R0.98 CC(C)CCN(C)C(=O)NCCS f5904a8016a9cc98b7f98d94886b51c1 [0,2,0,0,0,0|2,0,0]=4 4677 B12R0.98 CC(C)CC[C@@H](O)C(=O)NCCF e0edf9635af6a4c6c1c565eb341e10ec [0,2,0,0,0,0|2,0,0]=4 4678 B12R0.98 CC(C)CC[C@@H](O)C(=O)NCCI cc261a48876bdb358bd8581ee31e38d3 [0,2,0,0,0,0|2,0,0]=4 4679 B12R0.98 CC(C)CC[C@@H](O)C(=O)NCCO db0e7ae3cacf995c160b040d23a86ea2 [0,2,0,0,0,0|2,0,0]=4 4680 B12R0.98 CC(C)CC[C@@H](O)C(=O)NCCS 120b7a8687c39925f7f142506a585d1f [0,2,0,0,0,0|2,0,0]=4 4681 B12R0.98 CC(C)CC[C@H](O)C(=O)NCCF 5a580afed59cf777899662bfbd8ecc0b [0,2,0,0,0,0|2,0,0]=4 4682 B12R0.98 CC(C)CC[C@H](O)C(=O)NCCI 270ac26166203e0e0afe03e8e6adcfb4 [0,2,0,0,0,0|2,0,0]=4 4683 B12R0.98 CC(C)CC[C@H](O)C(=O)NCCO 3a9f68196f6bd92e1fa3229fdf6818a4 [0,2,0,0,0,0|2,0,0]=4 4684 B12R0.98 CC(C)CC[C@H](O)C(=O)NCCS 7cf0482af969daded274875cdce7cda4 [0,2,0,0,0,0|2,0,0]=4 4685 B12R0.98 CC(O)CCN(C)C(=O)CCCF fbb525a9d2b4f70816b0fe62eedff10b [0,2,0,0,0,0|2,0,0]=4 4686 B12R0.98 CC(O)CCN(C)C(=O)CCCS 34cbb43efc71f5696bae4a6e3b443ae8 [0,2,0,0,0,0|2,0,0]=4 4687 B12R0.98 CC/C=C/C(=O)N(C)CCC(C)C 87cd6f9a69a1dcd88885f0c1ffbaf303 [0,2,0,0,0,0|1,0,1]=4 4688 B12R0.98 CC/C=C\C(=O)N(C)CCC(C)C bfb40112ac39c5bca8c808c0ddab12b3 [0,2,0,0,0,0|1,0,1]=4 4689 B12R0.98 CCC#CC(=O)N(C)CCC(C)C c3e39aed09eaf4967078c774d31ab96b [0,2,0,0,0,0|1,0,1]=4 4690 B12R0.98 CCC=CC(=O)N(C)CCC(C)C 410c691f9c8fdc875f1f8e6085340e29 [0,2,0,0,0,0|1,0,1]=4 4691 B12R0.98 CCCCC(=O)C(=O)NCC(C)C 9b92011d0f63e2cf98d23e61ab539843 [0,2,0,0,0,0|2,0,0]=4 4692 B12R0.98 CCCCC(=O)N(C)CCC(C)C 0c41c9af9610c8133a3e2807de8cdeed [0,2,0,0,0,0|1,0,0]=3 4693 B12R0.98 CCCCC(=O)N(C)CCC(C)O 77e20a9209fad03cf8b5c7240ba7961d [0,2,0,0,0,0|2,0,0]=4 4694 B12R0.98 CCCCC(=O)N(C)CCN(C)C b9a723b7a46c4c9c6e585e7f51d97b26 [0,2,0,0,0,0|2,0,0]=4 4695 B12R0.98 CCCNC(=O)C(=O)NCC(C)C 4714a868358a371874f98cb6d9bee4a9 [0,2,0,0,0,0|2,0,0]=4 4696 B12R0.98 CCCNC(=O)C(C)NCC(C)C ca21f8bd7cf3c315c9782aa21fb73e99 [0,2,0,0,0,0|2,0,0]=4 4697 B12R0.98 CCCNC(=O)C(C)OCC(C)C 6b2110492ee9af31debd1e121ecadab9 [0,2,0,0,0,0|2,0,0]=4 4698 B12R0.98 CCCNC(=O)C(O)CCN(C)C 012ff4a2a69449d4fe5765282ad6df23 [0,2,0,0,0,0|2,0,0]=4 4699 B12R0.98 CCCNC(=O)N(C)CCC(C)C 98b683e9735986cd54c4327520b64232 [0,2,0,0,0,0|1,0,0]=3 4700 B12R0.98 CCCNC(=O)N(C)CCC(C)O e7bcf3d04b2f6d8b126e60daae882e9e [0,2,0,0,0,0|2,0,0]=4 4701 B12R0.98 CCCNC(=O)N(C)CCN(C)C ade8ffa250d0487aa6ee656f75bb444a [0,2,0,0,0,0|2,0,0]=4 4702 B12R0.98 CCCNC(=O)[C@@H](O)CCC(C)C 1ac3c528d5b4a60d40354d0e0afbb76a [0,2,0,0,0,0|1,0,0]=3 4703 B12R0.98 CCCNC(=O)[C@H](O)CCC(C)C 17df1b177b5cf3f690a77a68e4c1f76a [0,2,0,0,0,0|1,0,0]=3 4704 B12R0.98 CCCNC(=S)N(C)CCC(C)C 2e655283be2076c1f165f9e6ce0fc8f3 [0,2,0,0,0,0|1,1,0]=4 4705 B12R0.98 CCCOC(=O)C(C)NCC(C)C 170e4edefd2189bfed4e3f1ed8239606 [0,2,0,0,0,0|2,0,0]=4 4706 B12R0.98 CCCOC(=O)C(C)OCC(C)C 2899b96ae869304be694cabde411874f [0,2,0,0,0,0|2,0,0]=4 4707 B12R0.98 CCCOC(=O)[C@H](C)NCC(C)C f63814775dace86fd52deae78e442dd6 [0,2,0,0,0,0|2,0,0]=4 4708 B12R0.98 CCCOC(=O)[C@H](C)OCC(C)C 8926c66afea2755546dbc7ca23e39e6b [0,2,0,0,0,0|2,0,0]=4 4709 B12R0.98 CCOCC(=O)N(C)CCC(C)C e8d07849988afd616f0d6098468b652b [0,2,0,0,0,0|1,0,0]=3 4710 B12R0.98 CCOCC(=O)N(C)CCC(C)O 82b6ac6e32ce8036196417cc4abda665 [0,2,0,0,0,0|2,0,0]=4 4711 B12R0.98 CCOCC(=O)N(C)CCN(C)C 21cdb7f9ab9478b73cc18274f9321df8 [0,2,0,0,0,0|2,0,0]=4 4712 B12R0.98 CCSCC(=O)N(C)CCC(C)C 28219c19754e6cdf1ea9ed0a9c081751 [0,2,0,0,0,0|1,0,0]=3 4713 B12R0.98 CCSCC(=O)N(C)CCC(C)O fb883b8a87bdc103e7278771c8b959ec [0,2,0,0,0,0|2,0,0]=4 4714 B12R0.98 CCSCC(=O)N(C)CCN(C)C d6006a024d5ed112f297633ab8f69e54 [0,2,0,0,0,0|2,0,0]=4 4715 B12R0.98 CN(C)CCN(C)C(=O)CCCF 49d5e33e6dafd19bb9bfe159ce3fbe5b [0,2,0,0,0,0|2,0,0]=4 4716 B12R0.98 CN(C)CCN(C)C(=O)CCCS 35da254c39f82a8cfd15f476225ef541 [0,2,0,0,0,0|2,0,0]=4 4717 B12R0.98 COCCC(=O)N(C)CCC(C)C 81441e3ba79ba8fe644f9340e9ad0fcf [0,2,0,0,0,0|1,0,0]=3 4718 B12R0.98 COCCC(=O)N(C)CCC(C)O 17ea523b394e6dbab23a1f9cec27d6ad [0,2,0,0,0,0|2,0,0]=4 4719 B12R0.98 COCCC(=O)N(C)CCN(C)C d3197c826f21ce850d557215dbed1861 [0,2,0,0,0,0|2,0,0]=4 4720 B12R0.98 CSCCC(=O)N(C)CCC(C)C ae243eed97fecee0c9c473b7b016c02a [0,2,0,0,0,0|1,0,0]=3 4721 B12R0.98 CSCCC(=O)N(C)CCC(C)O c12150d40d02426bcf8548ce36a1e439 [0,2,0,0,0,0|2,0,0]=4 4722 B12R0.98 CSCCC(=O)N(C)CCN(C)C 9b9c537d7de206755d842928f72a9da7 [0,2,0,0,0,0|2,0,0]=4 4723 B12R0.98 CSSCC(=O)N(C)CCC(C)C e732ad7b99bfff3737ee655bb8ad8c8f [0,2,0,0,0,0|2,0,0]=4 4724 B12R0.178 CCCC(=O)C(=O)NCC(C)(C)C 98c4ed790f65127963e32232443053c3 [0,2,0,0,0,0|2,0,0]=4 4725 B12R0.178 CCCC(=O)C(=O)NCC(C)(C)O 34abffa62fbf56094b4bb27c43964a69 [0,2,0,0,0,0|2,0,0]=4 4726 B12R0.178 CCCC(=O)N(C)CCC(C)(C)C b3c03d9f3888866ceb974e08fe3c2e9f [0,2,0,0,0,0|1,0,0]=3 4727 B12R0.178 CCCC(=O)N(C)CCC(C)(C)O 03c480ef5e744a06b7638b1f0fb8d469 [0,2,0,0,0,0|1,0,0]=3 4728 B12R0.178 CN(CCC(C)(C)C)C(=O)CCF 1cfd9a7d0d6e9c50b4ee40d8f4c48aae [0,2,0,0,0,0|2,0,0]=4 4729 B12R0.178 CN(CCC(C)(C)C)C(=O)CCO 16b714b88aa6ba710c4ba0fc3802ad6a [0,2,0,0,0,0|2,0,0]=4 4730 B12R0.178 CN(CCC(C)(C)C)C(=O)CCS 4d87122565474796aebc41cdeebeb0f4 [0,2,0,0,0,0|2,0,0]=4 4731 B12R0.178 CN(CCC(C)(C)O)C(=O)CCF 6904f8cc806b1bb159f35b6d50e517ce [0,2,0,0,0,0|2,0,0]=4 4732 B12R0.178 CN(CCC(C)(C)O)C(=O)CCO eaf0941f3d1bcd4816b5e99dfc1fc1d5 [0,2,0,0,0,0|2,0,0]=4 4733 B12R0.178 CN(CCC(C)(C)O)C(=O)CCS 93d021b7bb8a1b71c7a48a8f675a9b13 [0,2,0,0,0,0|2,0,0]=4 4734 B12R0.178 COCC(=O)N(C)CCC(C)(C)C 8f482392ae38ffed29d40a39e83df4b1 [0,2,0,0,0,0|2,0,0]=4 4735 B12R0.178 COCC(=O)N(C)CCC(C)(C)O 82ebd2eb13a711be09feb02738c64cb6 [0,2,0,0,0,0|2,0,0]=4 4736 B12R0.178 CSCC(=O)N(C)CCC(C)(C)C 5a8047d6051be3e0cb9c50f634a3681a [0,2,0,0,0,0|2,0,0]=4 4737 B12R0.178 CSCC(=O)N(C)CCC(C)(C)O dee69aeb12826a198d2f33f02d54507a [0,2,0,0,0,0|2,0,0]=4 4738 B12R0.193 CCCC(=O)C(=O)NCC(C)CC d5ea47a58681836b302c58509fab755f [0,2,0,0,0,0|2,0,0]=4 4739 B12R0.193 CCCC(=O)C(=O)NCC(C)CO 7970ea703c5e7d768d480953c2225373 [0,2,0,0,0,0|2,0,0]=4 4740 B12R0.193 CCCC(=O)C(=O)NC[C@@H](C)CC 3ecc388c8511c652b6eb2cc4c75d02f7 [0,2,0,0,0,0|2,0,0]=4 4741 B12R0.193 CCCC(=O)C(=O)NC[C@@H](C)OC dcb7d853e7f85e4f8ea99933d9a21504 [0,2,0,0,0,0|2,0,0]=4 4742 B12R0.193 CCCC(=O)C(=O)NC[C@H](C)CO bb2b07d064c8adfb558f436ba2932ec5 [0,2,0,0,0,0|2,0,0]=4 4743 B12R0.193 CCCC(=O)C(=O)NC[C@H](C)OC 89736973f5775732d7355e9d1f481a19 [0,2,0,0,0,0|2,0,0]=4 4744 B12R0.193 CCCC(=O)N(C)CCN(C)CC e48c7c75a17ffeb5787c2075499e48f0 [0,2,0,0,0,0|2,0,0]=4 4745 B12R0.16 CC(C)(C)C(O)CNC(=O)CCF edff57f75e527d46c06206c743f86c66 [0,2,0,0,0,0|2,0,0]=4 4746 B12R0.16 CC(C)(C)C(O)CNC(=O)CCO 7b26699578956ad65acfd4044252b751 [0,2,0,0,0,0|2,0,0]=4 4747 B12R0.16 CC(C)(C)C(O)CNC(=O)CCS bd73e976c9f1ebc0523cba61f7e3f2a1 [0,2,0,0,0,0|2,0,0]=4 4748 B12R0.16 CC(C)(O)C(O)CNC(=O)CCF 32962725fcf06a7cf0c0868d2d6c240f [0,2,0,0,0,0|2,0,0]=4 4749 B12R0.16 CC(C)(O)C(O)CNC(=O)CCO a6ed259c063f06b288e65a74ee2f4c28 [0,2,0,0,0,0|2,0,0]=4 4750 B12R0.16 CC(C)(O)C(O)CNC(=O)CCS 1debe11f932d132a46da6be382dfdfd1 [0,2,0,0,0,0|2,0,0]=4 4751 B12R0.16 CC(C)(O)[C@@H](F)CNC(=O)CCF 30e7c3c08153be8ee900ee512c8b41d0 [0,2,0,0,0,0|2,0,0]=4 4752 B12R0.16 CC(C)(O)[C@@H](F)CNC(=O)CCO d0f0ab68a71f204bd5bb62d0999c7ad4 [0,2,0,0,0,0|2,0,0]=4 4753 B12R0.16 CC(C)(O)[C@@H](F)CNC(=O)CCS 6fd72d9d34d07e22fc730bd1f437eba6 [0,2,0,0,0,0|2,0,0]=4 4754 B12R0.16 CC(C)(O)[C@H](F)CNC(=O)CCF cba2255eddbbef4ee7c12198923fe847 [0,2,0,0,0,0|2,0,0]=4 4755 B12R0.16 CC(C)(O)[C@H](F)CNC(=O)CCO a213406b5db470094a800c067809481e [0,2,0,0,0,0|2,0,0]=4 4756 B12R0.16 CC(C)(O)[C@H](F)CNC(=O)CCS 9889865fd582aa783e3c587e52aca85b [0,2,0,0,0,0|2,0,0]=4 4757 B12R0.16 CCCC(=O)CNC(C)C(C)(C)O a834ab499e5fbddfcc1960bca8202fed [0,2,0,0,0,0|2,0,0]=4 4758 B12R0.16 CCCC(=O)CN[C@@H](C)C(C)(C)O 6eed981e10078584957055bc8b73d831 [0,2,0,0,0,0|2,0,0]=4 4759 B12R0.16 CCCC(=O)CN[C@H](C)C(C)(C)O 43cf75a223eb7557bf4e3058bcbab7e8 [0,2,0,0,0,0|2,0,0]=4 4760 B12R0.16 CCCC(=O)NCC(=O)C(C)(C)C 9e31255c8529a546ee99d2418c3d3db9 [0,2,0,0,0,0|1,0,1]=4 4761 B12R0.16 CCCC(=O)NCC(O)C(C)(C)C 79ca8e74f27287b2d901abe01550033d [0,2,0,0,0,0|1,0,0]=3 4762 B12R0.16 CCCC(=O)NCC(O)C(C)(C)O 0c8a0c22b21a687e4343ca95522ec062 [0,2,0,0,0,0|1,0,0]=3 4763 B12R0.16 CCCC(=O)NC[C@@H](F)C(C)(C)O 41bae5bad0833f6d00ab66299038ae49 [0,2,0,0,0,0|1,0,0]=3 4764 B12R0.16 CCCC(=O)NC[C@H](F)C(C)(C)O 609034bac9742e4a94d4924fa12739aa [0,2,0,0,0,0|1,0,0]=3 4765 B12R0.16 CCCC(=O)OCN(C)C(C)(C)C 728d91d559adcd4f3be40fcc1889b53f [0,2,0,0,0,0|1,0,0]=3 4766 B12R0.16 CCCC(=S)OCC(=O)C(C)(C)C d0f78275ff82928206064eb37c38f060 [0,2,0,0,0,0|0,1,1]=4 4767 B12R0.16 CCCC(=S)OCC(=O)C(C)(C)O 3712ac76ea31f013036799dd4570723f [0,2,0,0,0,0|0,1,1]=4 4768 B12R0.16 CCCC(C)OCC(C)C(C)(C)C 4321ca4d7d50cb4c61d96c0a006cfbc9 [0,2,0,0,0,0|1,0,1]=4 4769 B12R0.16 CCOC(=O)OCN(C)C(C)(C)C 24a0b942d1d95a4670140de2fd9ef6b3 [0,2,0,0,0,0|2,0,0]=4 4770 B12R0.16 CCSC(=O)OCN(C)C(C)(C)C 3bce27e01e36cce236694c47ba2a5983 [0,2,0,0,0,0|2,0,0]=4 4771 B12R0.16 COCC(=O)NCC(O)C(C)(C)C b231b345e9c6c166d06de6927ba5507c [0,2,0,0,0,0|2,0,0]=4 4772 B12R0.16 COCC(=O)NCC(O)C(C)(C)O 228df99d42361129bd784e8c8d332f91 [0,2,0,0,0,0|2,0,0]=4 4773 B12R0.16 COCC(=O)NC[C@@H](F)C(C)(C)O bfa62d54bd23d3a23d31d08b157876d6 [0,2,0,0,0,0|2,0,0]=4 4774 B12R0.16 COCC(=O)NC[C@H](F)C(C)(C)O 9400dbbd26a25326f2b63fc056c1e8a5 [0,2,0,0,0,0|2,0,0]=4 4775 B12R0.16 CSCC(=O)NCC(O)C(C)(C)C e20c4913ab7b5a31742bef0a70cda7f6 [0,2,0,0,0,0|2,0,0]=4 4776 B12R0.16 CSCC(=O)NCC(O)C(C)(C)O abcd53f7453ab2fe3de0ee72fb0293e5 [0,2,0,0,0,0|2,0,0]=4 4777 B12R0.16 CSCC(=O)NC[C@@H](F)C(C)(C)O 2ff59671f84feaa540483983ac24f53d [0,2,0,0,0,0|2,0,0]=4 4778 B12R0.16 CSCC(=O)NC[C@H](F)C(C)(C)O 9242ee23981b1cf33951941a9394439c [0,2,0,0,0,0|2,0,0]=4 4779 B12R0.17 C#CC(OCC(=O)CCC)C(C)C 82055e25d5c18389ffee83a8d1b3999f [0,2,0,0,0,0|2,0,0]=4 4780 B12R0.17 C=CC(OCC(=O)CCC)C(C)C 877b7b29fbe873fbd625cddeead7ad23 [0,2,0,0,0,0|2,0,0]=4 4781 B12R0.17 CC(C)C(CO)CNC(=O)CCF ecf11b3db9929e1c8a0f6ebd6a0be6ab [0,2,0,0,0,0|2,0,0]=4 4782 B12R0.17 CC(C)C(CO)CNC(=O)CCO 784673dd171da5459c6271b467ffa73f [0,2,0,0,0,0|2,0,0]=4 4783 B12R0.17 CC(C)C(CO)CNC(=O)CCS d3ff9cf7fdbabba1f83eb0b90e994880 [0,2,0,0,0,0|2,0,0]=4 4784 B12R0.17 CCCC(=O)CNC(CC)C(C)C 47111d84ac20f635cfc59e293a1b1eaa [0,2,0,0,0,0|2,0,0]=4 4785 B12R0.17 CCCC(=O)CNC(CO)C(C)C 77837f64bc68dee0d30b261fa1977a5c [0,2,0,0,0,0|2,0,0]=4 4786 B12R0.17 CCCC(=O)CN[C@@H](CO)C(C)C c4002e6e48a2cda31f0c213082d02d4c [0,2,0,0,0,0|2,0,0]=4 4787 B12R0.17 CCCC(=O)CN[C@H](CO)C(C)C 4378ffc849ad939b2102353b17228c4f [0,2,0,0,0,0|2,0,0]=4 4788 B12R0.17 CCCC(=O)COC(C#N)C(C)C b95dc07a3485029585c80bb03b0817a7 [0,2,0,0,0,0|2,0,0]=4 4789 B12R0.17 CCCC(=O)COC(CC)C(C)C e940154fe68c524c23fd7cc34d27ae41 [0,2,0,0,0,0|2,0,0]=4 4790 B12R0.17 CCCC(=O)NCC(CC)N(C)C 7733ea476050490cc2a648b393fe0878 [0,2,0,0,0,0|2,0,0]=4 4791 B12R0.17 CCCC(=O)NCC(CO)C(C)C 5bb3a5c6714829a2c84cf1d974ba92a7 [0,2,0,0,0,0|1,0,0]=3 4792 B12R0.17 CCCC(=O)OCN(CC)C(C)C ac1fc26dcff1e9769a315100165725f3 [0,2,0,0,0,0|1,0,0]=3 4793 B12R0.17 CCCC(C)OCC(CC)C(C)C b87f5ba93fdde44289d538549bafce46 [0,2,0,0,0,0|1,0,1]=4 4794 B12R0.17 CCCC(C)OC[C@H](OC)C(C)C d01141946aaa8e139c340b4cc9ca0794 [0,2,0,0,0,0|1,0,1]=4 4795 B12R0.17 CCSC(=O)OCN(CC)C(C)C 764907f433b95cbb7ac94b36534b9754 [0,2,0,0,0,0|2,0,0]=4 4796 B12R0.17 COCC(=O)NCC(CO)C(C)C 62e058c115a66a0cc100945f82de9b8a [0,2,0,0,0,0|2,0,0]=4 4797 B12R0.17 CSCC(=O)NCC(CO)C(C)C ec94723a73b66260d9b8b12f60d49d68 [0,2,0,0,0,0|2,0,0]=4 4798 B12R0.48 C#CCCC(=O)NCC(O)C(C)C fca045ed5ac052222ca18c6684b0e21f [0,2,0,0,0,0|1,0,1]=4 4799 B12R0.48 C/C=C/CC(=O)NCC(O)C(C)C c9049494674b3d027eaac06aab98376e [0,2,0,0,0,0|1,0,1]=4 4800 B12R0.48 C=CCCC(=O)NCC(O)C(C)C fa367bc750e78827b8e05b80ff5e3118 [0,2,0,0,0,0|1,0,1]=4 4801 B12R0.48 CC#CCC(=O)NCC(O)C(C)C d7e922f93d0d11937998a6ad832b9464 [0,2,0,0,0,0|1,0,1]=4 4802 B12R0.48 CC(C)C(O)CNC(=O)CCC#N a9d5c30b1e0f4ff29660aa9b49d28fbf [0,2,0,0,0,0|1,0,1]=4 4803 B12R0.48 CC(C)C(O)CNC(=O)CCC=O f6a2c9a86b6a862dcd33165d68740062 [0,2,0,0,0,0|1,0,1]=4 4804 B12R0.48 CC(C)C(O)CNC(=O)CCCF 24c41070778bf55ff344c7f5f5cb23fe [0,2,0,0,0,0|1,0,0]=3 4805 B12R0.48 CC(C)C(O)CNC(=O)CCCS d083d742b4363d9c68826b43dbccffdd [0,2,0,0,0,0|1,0,0]=3 4806 B12R0.48 CC(C)C(O)CNC(=O)NCCF 4816556de6dbd7da438d834c643b0030 [0,2,0,0,0,0|2,0,0]=4 4807 B12R0.48 CC(C)C(O)CNC(=O)NCCN fd1b8284aff7a942d5d29bde490712f4 [0,2,0,0,0,0|2,0,0]=4 4808 B12R0.48 CC(C)C(O)CNC(=O)NCCO 945eb230930d2f9ec5d59a074c8e7b83 [0,2,0,0,0,0|2,0,0]=4 4809 B12R0.48 CC(C)C(O)CNC(=O)NCCS 8a2ecc3e8bc0be62993cf662b3a3e587 [0,2,0,0,0,0|2,0,0]=4 4810 B12R0.48 CC(CNC(=O)CCCF)N(C)C c9053d49a335111b0bc97f75e5127604 [0,2,0,0,0,0|2,0,0]=4 4811 B12R0.48 CC(CNC(=O)CCCS)N(C)C 027bd2791200b00f0db70a1b791dd0f9 [0,2,0,0,0,0|2,0,0]=4 4812 B12R0.48 CC/C=C/C(=O)NCC(O)C(C)C 1057d82d264be516d73c4ffcc060b69e [0,2,0,0,0,0|1,0,1]=4 4813 B12R0.48 CC/C=C\C(=O)NCC(O)C(C)C 518be5438a6cd960806379500d91ee5d [0,2,0,0,0,0|1,0,1]=4 4814 B12R0.48 CCC#CC(=O)NCC(O)C(C)C 40cfeaa3484e37ff0750add83ee6a9f7 [0,2,0,0,0,0|1,0,1]=4 4815 B12R0.48 CCC=CC(=O)NCC(O)C(C)C f00b747c33098af3bf14577303d71afb [0,2,0,0,0,0|1,0,1]=4 4816 B12R0.48 CCCCC(=O)NCC(C)N(C)C 0e839faa6c5688b709d5e960d2b6e484 [0,2,0,0,0,0|2,0,0]=4 4817 B12R0.48 CCCCC(=O)NCC(O)C(C)C 79b9499d455b41e044ea64d3848290be [0,2,0,0,0,0|1,0,0]=3 4818 B12R0.48 CCCCC(=O)OCN(C)C(C)C a4e31bb9b38fb2ea59713ee9a08bacc5 [0,2,0,0,0,0|1,0,0]=3 4819 B12R0.48 CCCCC(C)OCC(C)C(C)C 8ea40fb156f1df58ab8dc633af6c45f3 [0,2,0,0,0,0|1,0,1]=4 4820 B12R0.48 CCCC[C@@H](C)OCC(C)C(C)C 93d1ab1f8bf95b37142325a88f1bc875 [0,2,0,0,0,0|1,0,1]=4 4821 B12R0.48 CCCC[C@H](C)OCC(C)C(C)C 05cad3b725aac5bc1eec2f48dc569030 [0,2,0,0,0,0|1,0,1]=4 4822 B12R0.48 CCCNC(=O)CCC(=O)C(C)C 378c82929d896073b230553b269c926d [0,2,0,0,0,0|1,0,1]=4 4823 B12R0.48 CCCNC(=O)CNC(C)C(C)C 5850edd762ddf281881f92c601a7ed91 [0,2,0,0,0,0|2,0,0]=4 4824 B12R0.48 CCCNC(=O)CN[C@@H](C)C(C)C 28ffd68d6662bfb919496b9a4204db35 [0,2,0,0,0,0|2,0,0]=4 4825 B12R0.48 CCCNC(=O)CN[C@H](C)C(C)C 0cd3674680b75cc14dffb8907a7f7b85 [0,2,0,0,0,0|2,0,0]=4 4826 B12R0.48 CCCNC(=O)COC(C)C(C)C 9dfca60cf5706994ee32937425afc00d [0,2,0,0,0,0|2,0,0]=4 4827 B12R0.48 CCCNC(=O)CO[C@@H](C)C(C)C 9f82b13b4f624304c7f171e0ed3ce9e7 [0,2,0,0,0,0|2,0,0]=4 4828 B12R0.48 CCCNC(=O)CO[C@H](C)C(C)C fd5e8e9263285aefe516b429c75649eb [0,2,0,0,0,0|2,0,0]=4 4829 B12R0.48 CCCNC(=O)NCC(C)N(C)C 8c69378616c1b017ac8edf325cc787e1 [0,2,0,0,0,0|2,0,0]=4 4830 B12R0.48 CCCNC(=O)NCC(O)C(C)C 95b00f0edfcedc68d5014847c619607f [0,2,0,0,0,0|1,0,0]=3 4831 B12R0.48 CCCNC(=S)NCC(O)C(C)C add2ecea1ef20d2c177623dec57d7e50 [0,2,0,0,0,0|1,1,0]=4 4832 B12R0.48 CCCOC(=O)CNC(C)C(C)C 44d2879f012c8cd4eabae8de5139e0fc [0,2,0,0,0,0|2,0,0]=4 4833 B12R0.48 CCCOC(=O)CN[C@@H](C)C(C)C 7ebda4d39eedeb1bb936a4e4ce59fd31 [0,2,0,0,0,0|2,0,0]=4 4834 B12R0.48 CCCOC(=O)CN[C@H](C)C(C)C 42e6a90ac39523612de4df1ee18fabc5 [0,2,0,0,0,0|2,0,0]=4 4835 B12R0.48 CCCOC(=O)COC(C)C(C)C d1006f0c2af912eafa26cf43e031feb7 [0,2,0,0,0,0|2,0,0]=4 4836 B12R0.48 CCCOC(=O)CO[C@@H](C)C(C)C 46b36c25d033a0cd91f5f500b1e3fb82 [0,2,0,0,0,0|2,0,0]=4 4837 B12R0.48 CCCOC(=O)CO[C@H](C)C(C)C 2614b5bda7adce26ef7281916dd8da4e [0,2,0,0,0,0|2,0,0]=4 4838 B12R0.48 CCCOC(=O)OCN(C)C(C)C 8fb339bb8a35331423ff76bd681d7d99 [0,2,0,0,0,0|1,0,0]=3 4839 B12R0.48 CCOCC(=O)NCC(C)N(C)C c504ab54286a84c0d7fcc033b049dd8f [0,2,0,0,0,0|2,0,0]=4 4840 B12R0.48 CCOCC(=O)NCC(O)C(C)C 23933141e5d8bf2a9a5fc5fb2f00f164 [0,2,0,0,0,0|1,0,0]=3 4841 B12R0.48 CCOCC(C)OCC(C)C(C)C bd73cc7fa8d93be5dac5233f9729e732 [0,2,0,0,0,0|1,0,1]=4 4842 B12R0.48 CCSCC(=O)NCC(C)N(C)C 634783820c357303bfd71ef066172329 [0,2,0,0,0,0|2,0,0]=4 4843 B12R0.48 CCSCC(=O)NCC(O)C(C)C 4d661499e4d99ec8e5a18bdb7ab7abd6 [0,2,0,0,0,0|1,0,0]=3 4844 B12R0.48 COCCC(=O)NCC(C)N(C)C af4f5b6dcb457b7c383924f58c1c51aa [0,2,0,0,0,0|2,0,0]=4 4845 B12R0.48 COCCC(=O)NCC(O)C(C)C 91e1a46eca64004fd5ada95f6ba7310a [0,2,0,0,0,0|1,0,0]=3 4846 B12R0.48 COCCC(C)OCC(C)C(C)C 56c0df3f2dcac5033d80510a8ad68f8d [0,2,0,0,0,0|1,0,1]=4 4847 B12R0.48 CSCCC(=O)CNC(C)C(C)C b51d3fabeced19ae3ee0d564a412db3d [0,2,0,0,0,0|2,0,0]=4 4848 B12R0.48 CSCCC(=O)CN[C@@H](C)C(C)C 5636c4083131055518d482e1db88c2eb [0,2,0,0,0,0|2,0,0]=4 4849 B12R0.48 CSCCC(=O)CN[C@H](C)C(C)C 69c5e95d1693dbf0fa1f734ce4edf7cb [0,2,0,0,0,0|2,0,0]=4 4850 B12R0.48 CSCCC(=O)COC(C)C(C)C 915701f2dcebd48d9394a177e280b41d [0,2,0,0,0,0|2,0,0]=4 4851 B12R0.48 CSCCC(=O)CO[C@@H](C)C(C)C 02bfc302a5b3d194503a4dc06e0cf814 [0,2,0,0,0,0|2,0,0]=4 4852 B12R0.48 CSCCC(=O)CO[C@H](C)C(C)C 44768238601ff8f216418bd0de49398f [0,2,0,0,0,0|2,0,0]=4 4853 B12R0.48 CSCCC(=O)NCC(C)N(C)C 97183a725ab5cddebedcc6ebf43d968e [0,2,0,0,0,0|2,0,0]=4 4854 B12R0.48 CSCCC(=O)NCC(O)C(C)C a781bde3e38a80a230aba2da84b7b9af [0,2,0,0,0,0|1,0,0]=3 4855 B12R0.48 CSCCC(C)OCC(C)C(C)C b27ff3d4288817feb5088ffbef9ea616 [0,2,0,0,0,0|1,0,1]=4 4856 B12R0.48 CSSCC(=O)NCC(O)C(C)C b72d696dcd42ac8e8d713a9ff1c39701 [0,2,0,0,0,0|2,0,0]=4 4857 B12R0.79 CCCC(=O)CNC(C)C(C)CC e652f3f68ef9c19a44f5c46be23b2d3b [0,2,0,0,0,0|2,0,0]=4 4858 B12R0.79 CCCC(=O)COC(C)C(C)CC f0807fa9510d1fc467d694d83aa00668 [0,2,0,0,0,0|2,0,0]=4 4859 B12R0.79 CCCC(=O)COC(C)C(C)OC 7ad567d71a31a0744923b7e72973ec3c [0,2,0,0,0,0|2,0,0]=4 4860 B12R0.79 CCCC(=O)OCN(C)C(C)CC 04730f2efbbd7ead367a94575fbe3257 [0,2,0,0,0,0|1,0,0]=3 4861 B12R0.79 CCCC(=S)OCC(=O)C(C)CC 81a65d98ee265fe3d81bee225e1948d4 [0,2,0,0,0,0|0,1,1]=4 4862 B12R0.79 CCOC(=O)OCN(C)C(C)CC 3457ba114810fdf6e61a53e662bd7f3f [0,2,0,0,0,0|2,0,0]=4 4863 B12R0.79 CCSC(=O)OCN(C)C(C)CC 67ed160c535016e071ceb606806bf985 [0,2,0,0,0,0|2,0,0]=4 4864 B12R0.79 CCSC(=O)OCN(C)C(C)CO e0a537b5ebcf4bdd628c8763e8d43b06 [0,2,0,0,0,0|2,0,0]=4 4865 B12R0.79 CCSC(=O)OCN(C)[C@@H](C)CO b7734dd4b1f8844b8e64f9aa30da6ace [0,2,0,0,0,0|2,0,0]=4 4866 B12R0.79 CCSC(=O)OCN(C)[C@H](C)CO 9f0a4b58245a0cf73134ecf4b5090034 [0,2,0,0,0,0|2,0,0]=4 4867 B12R0.236 C=C(CC)C(=O)NCC(O)C(C)C 7b9702a780e6494f999fdb10e1d146ea [0,2,0,0,0,0|1,0,1]=4 4868 B12R0.236 CC(C)C(O)CNC(=O)C(O)CO 798af3fb03496f6b1723fe81d8ce0a03 [0,2,0,0,0,0|2,0,0]=4 4869 B12R0.236 CC(C)C(O)CNC(=O)[C@@H](O)CO 16c4db6d486f32785bbdffebf494a4dc [0,2,0,0,0,0|2,0,0]=4 4870 B12R0.236 CC(C)C(O)CNC(=O)[C@H](O)CF 904ca94e7a5c7fc74254227a122f7b38 [0,2,0,0,0,0|2,0,0]=4 4871 B12R0.236 CCC(=O)C(=O)NCC(O)C(C)C 1907ccb9a669a3e558462243aa62927b [0,2,0,0,0,0|1,0,1]=4 4872 B12R0.236 CCC(C)C(=O)CNC(C)C(C)C eb90feb71966f6d8454b63c4bde27d8d [0,2,0,0,0,0|2,0,0]=4 4873 B12R0.236 CCC(C)C(=O)CN[C@@H](C)C(C)C 8dee64731bf3188488d601dbc00d1358 [0,2,0,0,0,0|2,0,0]=4 4874 B12R0.236 CCC(C)C(=O)CN[C@H](C)C(C)C 991e05ad1a81b2bd45cfa6dc6b38c8b9 [0,2,0,0,0,0|2,0,0]=4 4875 B12R0.236 CCC(C)C(=O)COC(C)C(C)C 5d26e7a1275eecf4f7a931a58e3438a2 [0,2,0,0,0,0|2,0,0]=4 4876 B12R0.236 CCC(C)C(=O)CO[C@@H](C)C(C)C e8099791644924206fce3e31a9b2ebe6 [0,2,0,0,0,0|2,0,0]=4 4877 B12R0.236 CCC(C)C(=O)CO[C@H](C)C(C)C b7ea9d73a3a374293b20ced0d2d854d4 [0,2,0,0,0,0|2,0,0]=4 4878 B12R0.236 CCC(C)C(C)OCC(C)C(C)C 91f1c44a0f3d66e5e457c8d4922db811 [0,2,0,0,0,0|1,0,1]=4 4879 B12R0.236 CCC(O)C(=O)NCC(C)N(C)C eee93b60d21a457ed808dea7dccf02be [0,2,0,0,0,0|2,0,0]=4 4880 B12R0.236 CCC(O)C(=O)NCC(O)C(C)C 18e2b081f9ae37bd39d396522e28cd1c [0,2,0,0,0,0|1,0,0]=3 4881 B12R0.236 CCN(C)C(=O)NCC(O)C(C)C a61f1af1b88f1495e2ba832b81d38801 [0,2,0,0,0,0|2,0,0]=4 4882 B12R0.236 CC[C@@H](O)C(=O)NCC(C)N(C)C 0b3ad166fdc065242f8eee01968a0b7e [0,2,0,0,0,0|2,0,0]=4 4883 B12R0.236 CC[C@@H](O)C(=O)NCC(O)C(C)C fef80b4012ee433fd699d458d4aef0c2 [0,2,0,0,0,0|1,0,0]=3 4884 B12R0.236 CC[C@H](O)C(=O)NCC(C)N(C)C e494edf393b87e2aec2560ca75c38cff [0,2,0,0,0,0|2,0,0]=4 4885 B12R0.236 CC[C@H](O)C(=O)NCC(O)C(C)C bc51769aba17f8b4660a34136e15c058 [0,2,0,0,0,0|1,0,0]=3 4886 B12R0.236 CC[C@H](S)C(=O)NCC(C)N(C)C c87b6f749f9c0fe94a46b39228fb5e43 [0,2,0,0,0,0|2,0,0]=4 4887 B12R0.236 CC[C@H](S)C(=O)NCC(O)C(C)C 2ebbdeba02e2d0cf0201b01bee56ab04 [0,2,0,0,0,0|1,0,0]=3 4888 B12R0.236 COC(C)C(=O)NCC(O)C(C)C d008ec7945d5b55ed414263369e969a3 [0,2,0,0,0,0|2,0,0]=4 4889 B12R0.236 CO[C@@H](C)C(=O)NCC(O)C(C)C ebb9e7698270d5934a1abf48b4e8c83e [0,2,0,0,0,0|2,0,0]=4 4890 B12R0.236 CO[C@H](C)C(=O)NCC(O)C(C)C b6e9e214848bbd3a714436444946c5fc [0,2,0,0,0,0|2,0,0]=4 4891 B12R0.236 CSC(C)C(=O)NCC(O)C(C)C 9caad24d6c8aedbdb1a9573042ed4fce [0,2,0,0,0,0|2,0,0]=4 4892 B12R0.266 CCCC(=O)CNC(C)(C)C(C)C d75aa6858f77a16c46745f1f6c36ad86 [0,2,0,0,0,0|2,0,0]=4 4893 B12R0.266 CCCC(=O)NCC(C)(C)C(C)O aa005df325b66c5284981bec630d34a1 [0,2,0,0,0,0|2,0,0]=4 4894 B12R0.266 CCCC(=O)NCC(C)(C)N(C)C a998fc655359696f9f36f71323acc33a [0,2,0,0,0,0|2,0,0]=4 4895 B12R0.266 CCCC(=S)OCC(C)(C)C(C)C 14fdfc66e41f364903a6da9b60cd3876 [0,2,0,0,0,0|0,1,0]=3 4896 B12R0.266 CCCC(C)OCC(C)(C)C(C)C cf5d017e3bc5782e05b1658f78a42b24 [0,2,0,0,0,0|1,0,1]=4 4897 B12R0.266 CCC[C@@H](C)OCC(C)(C)C(C)C ddf6b50db8bcbb5f277f4370c0473906 [0,2,0,0,0,0|1,0,1]=4 4898 B12R0.266 CCC[C@H](C)OCC(C)(C)C(C)C c11b88c5ad45785ed0dbde79e231c552 [0,2,0,0,0,0|1,0,1]=4 4899 B12R0.90 C=C(CC)C(=O)NCCC(C)(C)C ea7b4f8ebc8d7a825b575035de1568b0 [0,2,0,0,0,0|1,0,1]=4 4900 B12R0.90 C=C(CC)C(=O)NCCC(C)(C)F 7fb680ef3a56a84592dcb99349fe7744 [0,2,0,0,0,0|1,0,1]=4 4901 B12R0.90 C=C(CC)C(=O)NCCC(C)(C)O e9250d92d9132807412d58fcae0cb224 [0,2,0,0,0,0|1,0,1]=4 4902 B12R0.90 CC(C)(C)CCNC(=O)C(O)CO 31a6e2c30b31f40793be41eaa8a11c6c [0,2,0,0,0,0|2,0,0]=4 4903 B12R0.90 CC(C)(C)CCNC(=O)[C@@H](O)CO 86f0fdc29c8096ea28d0912e33a58c4b [0,2,0,0,0,0|2,0,0]=4 4904 B12R0.90 CC(C)(C)CCNC(=O)[C@H](O)CF 1b17db7d10518c60d5368bd85466a8b7 [0,2,0,0,0,0|2,0,0]=4 4905 B12R0.90 CC(C)(F)CCNC(=O)C(O)CO d7d805476b486e530ba92af5c18e4e1f [0,2,0,0,0,0|2,0,0]=4 4906 B12R0.90 CC(C)(F)CCNC(=O)[C@@H](O)CO 9e4d47918cbb0816c93f0ebfe853646c [0,2,0,0,0,0|2,0,0]=4 4907 B12R0.90 CC(C)(F)CCNC(=O)[C@H](O)CF 3cf7cfd88658d91376bc19facdbf1ffb [0,2,0,0,0,0|2,0,0]=4 4908 B12R0.90 CC(C)(O)CCNC(=O)C(O)CO 1742cb4259abccee3e9bc7997214665d [0,2,0,0,0,0|2,0,0]=4 4909 B12R0.90 CC(C)(O)CCNC(=O)[C@@H](O)CO 4f38f5f436af5a8007bfc80d13b7320f [0,2,0,0,0,0|2,0,0]=4 4910 B12R0.90 CC(C)(O)CCNC(=O)[C@H](O)CF e44b7fca6b62a0555177ad0acda2d4c1 [0,2,0,0,0,0|2,0,0]=4 4911 B12R0.90 CCC(=O)C(=O)NCCC(C)(C)C 52377bb57efa92ed760651bb32bea647 [0,2,0,0,0,0|1,0,1]=4 4912 B12R0.90 CCC(=O)C(=O)NCCC(C)(C)F 86fb8069b5ee619f80e412ff2c88b6f6 [0,2,0,0,0,0|1,0,1]=4 4913 B12R0.90 CCC(=O)C(=O)NCCC(C)(C)O b42c7c8f208edbd9421b226893b585f5 [0,2,0,0,0,0|1,0,1]=4 4914 B12R0.90 CCC(C)C(=O)CNCC(C)(C)C 96666bd677b6101125d1c57ef2412688 [0,2,0,0,0,0|2,0,0]=4 4915 B12R0.90 CCC(C)C(=O)CNCC(C)(C)O 6c4a52722ed95754eb19a3249b8e5a61 [0,2,0,0,0,0|2,0,0]=4 4916 B12R0.90 CCC(C)C(=O)COCC(C)(C)Br a6260b0e11907fe3f8fa7ce8a448f239 [0,2,0,0,0,0|2,0,0]=4 4917 B12R0.90 CCC(C)C(=O)COCC(C)(C)C e45c19ddc2a7bcce017a703b46e4b95e [0,2,0,0,0,0|2,0,0]=4 4918 B12R0.90 CCC(C)C(=O)COCC(C)(C)F 2341b19ca703c2fde5e58566cfa4e10f [0,2,0,0,0,0|2,0,0]=4 4919 B12R0.90 CCC(C)C(=O)COCC(C)(C)S 01f23cbfbd4181f98dd0324053682ab7 [0,2,0,0,0,0|2,0,0]=4 4920 B12R0.90 CCC(C)C(C)OCCC(C)(C)C 60b704c144dde901cd54ae15170026c9 [0,2,0,0,0,0|1,0,1]=4 4921 B12R0.90 CCC(C)C(C)OCCC(C)(C)O 7a7fb60ddbab43ce2be98f3788170d48 [0,2,0,0,0,0|1,0,1]=4 4922 B12R0.90 CCC(O)C(=O)NCCC(C)(C)C 04ba84b6c776906ba37e339708b928a4 [0,2,0,0,0,0|1,0,0]=3 4923 B12R0.90 CCC(O)C(=O)NCCC(C)(C)F a34c28318bf533f8856986be18ae7a42 [0,2,0,0,0,0|1,0,0]=3 4924 B12R0.90 CCC(O)C(=O)NCCC(C)(C)O 97ca36b9107f0191cec5f3aaf63a74c2 [0,2,0,0,0,0|1,0,0]=3 4925 B12R0.90 CCN(C)C(=O)CCCC(C)(C)C ccc4341edc05b13310a1f35e234a2217 [0,2,0,0,0,0|2,0,0]=4 4926 B12R0.90 CCN(C)C(=O)NCCC(C)(C)C fcec31ba4308cb96556872e2f638e606 [0,2,0,0,0,0|2,0,0]=4 4927 B12R0.90 CCN(C)C(=O)NCCC(C)(C)F a57d70ed49a6ad1092e57b81bd4cf9c2 [0,2,0,0,0,0|2,0,0]=4 4928 B12R0.90 CCN(C)C(=O)NCCC(C)(C)O fbadf443f1678f46025dfe70301de65c [0,2,0,0,0,0|2,0,0]=4 4929 B12R0.90 CC[C@@H](O)C(=O)NCCC(C)(C)C cb8ac1b2efe1339ead82b842ac8d4285 [0,2,0,0,0,0|1,0,0]=3 4930 B12R0.90 CC[C@@H](O)C(=O)NCCC(C)(C)F dd1d38b386d9dd3434d74edae8ef42a3 [0,2,0,0,0,0|1,0,0]=3 4931 B12R0.90 CC[C@@H](O)C(=O)NCCC(C)(C)O 86ffb64b5994637ad368e9158610e4d3 [0,2,0,0,0,0|1,0,0]=3 4932 B12R0.90 CC[C@H](O)C(=O)NCCC(C)(C)C 376e0786f6a3dde679ee221319233491 [0,2,0,0,0,0|1,0,0]=3 4933 B12R0.90 CC[C@H](O)C(=O)NCCC(C)(C)F b3cf53480eaf3f693a671a9b3ff721df [0,2,0,0,0,0|1,0,0]=3 4934 B12R0.90 CC[C@H](O)C(=O)NCCC(C)(C)O 490a8c523b18636e4cd8363c2f0ef8f8 [0,2,0,0,0,0|1,0,0]=3 4935 B12R0.90 CC[C@H](S)C(=O)NCCC(C)(C)C 507b9ab18c11d987e4022878a83cd0a1 [0,2,0,0,0,0|1,0,0]=3 4936 B12R0.90 CC[C@H](S)C(=O)NCCC(C)(C)F dac2686c340f7a9759b0ec661a328801 [0,2,0,0,0,0|1,0,0]=3 4937 B12R0.90 CC[C@H](S)C(=O)NCCC(C)(C)O aaa271026925e3eb881069a34e95d1da [0,2,0,0,0,0|1,0,0]=3 4938 B12R0.90 COC(C)C(=O)NCCC(C)(C)C 6a73d88ddf2d3a89d27589d94802862a [0,2,0,0,0,0|2,0,0]=4 4939 B12R0.90 COC(C)C(=O)NCCC(C)(C)F eda60294b0798a5d48012bdfa2ed46e9 [0,2,0,0,0,0|2,0,0]=4 4940 B12R0.90 COC(C)C(=O)NCCC(C)(C)O c4f6a8aff64da3e2b13eab13055fcf47 [0,2,0,0,0,0|2,0,0]=4 4941 B12R0.90 CO[C@@H](C)C(=O)NCCC(C)(C)C 026587cd8555092e82c0e33ca204c76e [0,2,0,0,0,0|2,0,0]=4 4942 B12R0.90 CO[C@@H](C)C(=O)NCCC(C)(C)F 68ccbcfd4adb6b8f884fdd9b9940fa38 [0,2,0,0,0,0|2,0,0]=4 4943 B12R0.90 CO[C@@H](C)C(=O)NCCC(C)(C)O b912ef794a9acdf772fc210a3069be4f [0,2,0,0,0,0|2,0,0]=4 4944 B12R0.90 CO[C@H](C)C(=O)NCCC(C)(C)C e3062683d3984d3381b80b3166c2e691 [0,2,0,0,0,0|2,0,0]=4 4945 B12R0.90 CO[C@H](C)C(=O)NCCC(C)(C)F 770f82737112eebab0c233e2efda2890 [0,2,0,0,0,0|2,0,0]=4 4946 B12R0.90 CO[C@H](C)C(=O)NCCC(C)(C)O 0f4411b57b672e8935823b83aa90f320 [0,2,0,0,0,0|2,0,0]=4 4947 B12R0.90 CSC(C)C(=O)NCCC(C)(C)C 984dc0d9d426c66707ad47a07a7beb33 [0,2,0,0,0,0|2,0,0]=4 4948 B12R0.90 CSC(C)C(=O)NCCC(C)(C)F 3224510ecc3b1e8ac1ed9ac6a2525017 [0,2,0,0,0,0|2,0,0]=4 4949 B12R0.90 CSC(C)C(=O)NCCC(C)(C)O d99f745b957fdf87981c6c2b2534dc06 [0,2,0,0,0,0|2,0,0]=4 4950 B12R0.156 C=C(CC)C(=O)NCCC(C)CC 595ef3d2da0b36ee09d97f06fb66377c [0,2,0,0,0,0|1,0,1]=4 4951 B12R0.156 C=C(CC)C(=O)NCCC(C)CO 971d6d929639ffe488df0131e1bc1348 [0,2,0,0,0,0|1,0,1]=4 4952 B12R0.156 C=C(CC)C(=O)NCC[C@@H](C)CO cfbf887f4a55828dcf075099d9f327bc [0,2,0,0,0,0|1,0,1]=4 4953 B12R0.156 CC(CO)CCNC(=O)C(O)CO df56f88d41e0fcbc538d3c8b817d2ba8 [0,2,0,0,0,0|2,0,0]=4 4954 B12R0.156 CC(CO)CCNC(=O)[C@@H](O)CO 549c80c98bde8ac0df351090d760004f [0,2,0,0,0,0|2,0,0]=4 4955 B12R0.156 CC(CO)CCNC(=O)[C@H](O)CF 37f21ed121236dd1c58f270bcc274ada [0,2,0,0,0,0|2,0,0]=4 4956 B12R0.156 CCC(=O)C(=O)NCCC(C)CC dcc431fda44ef0a065a751f8a15c32bf [0,2,0,0,0,0|1,0,1]=4 4957 B12R0.156 CCC(=O)C(=O)NCCC(C)CO bcfb100e236820c16fa6def4005394ec [0,2,0,0,0,0|1,0,1]=4 4958 B12R0.156 CCC(=O)C(=O)NCC[C@@H](C)CO 351839b808dcb7a859f0f06a03fd05d4 [0,2,0,0,0,0|1,0,1]=4 4959 B12R0.156 CCC(C)C(=O)CNCC(C)CO 340ca4b5cb197ae4871dbd3d9e19dd4c [0,2,0,0,0,0|2,0,0]=4 4960 B12R0.156 CCC(C)C(=O)CNC[C@@H](C)CC 9cfd7dadf8ff6d4c536f79a43f9f28ad [0,2,0,0,0,0|2,0,0]=4 4961 B12R0.156 CCC(C)C(=O)CNC[C@@H](C)OC 114300f1b3d2ea9649b4d12b6660de69 [0,2,0,0,0,0|2,0,0]=4 4962 B12R0.156 CCC(C)C(=O)CNC[C@H](C)CO 438ab7135feb4fbff97ebeb896b3f411 [0,2,0,0,0,0|2,0,0]=4 4963 B12R0.156 CCC(C)C(=O)CNC[C@H](C)OC 49bf312601377d7f053e922e677f5a31 [0,2,0,0,0,0|2,0,0]=4 4964 B12R0.156 CCC(C)C(=O)COCC(C)OC 6cc9d2ac03b1d5e16cf5ea28c57b6d96 [0,2,0,0,0,0|2,0,0]=4 4965 B12R0.156 CCC(C)C(=O)COC[C@@H](C)CC 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CCC(C)CCNC(=O)[C@@H](O)CC debe5bc3ad480fa79add4d3413a33ef2 [0,2,0,0,0,0|1,0,0]=3 4977 B12R0.156 CCC(C)CCNC(=O)[C@@H](O)CO 53527b3da1e247c7b3c726d113e2e3d1 [0,2,0,0,0,0|2,0,0]=4 4978 B12R0.156 CCC(C)CCNC(=O)[C@@H](S)CC 53d1892fb2c795673eb7bc814f73efb0 [0,2,0,0,0,0|1,0,0]=3 4979 B12R0.156 CCC(C)CCNC(=O)[C@H](C)OC 58891b5b67d024a864b17f1b8e165cff [0,2,0,0,0,0|2,0,0]=4 4980 B12R0.156 CCC(C)CCNC(=O)[C@H](O)CC c26da02056e57b491cba2eb18c199078 [0,2,0,0,0,0|1,0,0]=3 4981 B12R0.156 CCC(C)CCNC(=O)[C@H](O)CF 5406be9456b3adb73cd19e5fbe38e809 [0,2,0,0,0,0|2,0,0]=4 4982 B12R0.156 CCC(C)CCOC(C)C(C)CC fa33ade54b1b7915f649baaa718481a8 [0,2,0,0,0,0|1,0,1]=4 4983 B12R0.156 CCC(C)CNCC(=O)C(C)CC bee7a1169b6b7d5642358c88a0af2d3a [0,2,0,0,0,0|2,0,0]=4 4984 B12R0.156 CCC(C)COCC(=O)C(C)CC a9769fed76ddf593fd62ec83bc4370ba [0,2,0,0,0,0|2,0,0]=4 4985 B12R0.156 CCC(O)C(=O)NCCC(C)CO 08a6484610384a3451831e8072c69c0e [0,2,0,0,0,0|1,0,0]=3 4986 B12R0.156 CCC(O)C(=O)NCCC(O)CO 8a090fee9c29af5e2f44da96ba773227 [0,2,0,0,0,0|2,0,0]=4 4987 B12R0.156 CCC(O)C(=O)NCC[C@@H](C)CO 324ce113c05cc8bd1b1cbe51dd11cee4 [0,2,0,0,0,0|1,0,0]=3 4988 B12R0.156 CCN(C)C(=O)NCCC(C)CO 4ac948e069477a0fae86b5919d4eab12 [0,2,0,0,0,0|2,0,0]=4 4989 B12R0.156 CCN(C)C(=O)NCC[C@@H](C)CO 5380d9892e2f48ed3df5367fee72b968 [0,2,0,0,0,0|2,0,0]=4 4990 B12R0.156 CC[C@@H](O)C(=O)NCCC(C)CO f360da054b52904958d64dc977ef6239 [0,2,0,0,0,0|1,0,0]=3 4991 B12R0.156 CC[C@@H](O)C(=O)NCCC(O)CO 2f2e04f2aa4ff536c84a1b09d28c7252 [0,2,0,0,0,0|2,0,0]=4 4992 B12R0.156 CC[C@@H](O)C(=O)NCC[C@@H](C)CO ddbe6ff28319197be17f71c0dc86309b [0,2,0,0,0,0|1,0,0]=3 4993 B12R0.156 CC[C@H](O)C(=O)NCCC(C)CO 8685698ad1ab17c691c5c7e53cb7fb19 [0,2,0,0,0,0|1,0,0]=3 4994 B12R0.156 CC[C@H](O)C(=O)NCCC(O)CO accb2eb07e5fb9bf9fcb31c89129e8ea [0,2,0,0,0,0|2,0,0]=4 4995 B12R0.156 CC[C@H](O)C(=O)NCC[C@@H](C)CO 0ba67cf438cef62adb19717dc90f41e3 [0,2,0,0,0,0|1,0,0]=3 4996 B12R0.156 CC[C@H](S)C(=O)NCCC(C)CO dc58432cf62d69d235c770ab4a4f3f64 [0,2,0,0,0,0|1,0,0]=3 4997 B12R0.156 CC[C@H](S)C(=O)NCCC(O)CO 147cc32e30138ba1f56c2a0719004d7a [0,2,0,0,0,0|2,0,0]=4 4998 B12R0.156 CC[C@H](S)C(=O)NCC[C@@H](C)CO a7d70c4be12c0fe4b3cefe93497b36ea [0,2,0,0,0,0|1,0,0]=3 4999 B12R0.156 COC(C)C(=O)NCCC(C)CO 568aeb22cc6c44f0a6e9f2f98799d3c6 [0,2,0,0,0,0|2,0,0]=4 5000 B12R0.156 COC(C)C(=O)NCC[C@@H](C)CO d6edcd5155361a3de63bc0a3c3b47b03 [0,2,0,0,0,0|2,0,0]=4 5001 B12R0.156 CO[C@@H](C)C(=O)NCCC(C)CO a0e2b0eec73ea877e0d78ee33bfa49e1 [0,2,0,0,0,0|2,0,0]=4 5002 B12R0.156 CO[C@@H](C)C(=O)NCC[C@@H](C)CO a18976426888d1791cb1af2ed53788bf [0,2,0,0,0,0|2,0,0]=4 5003 B12R0.156 CO[C@H](C)C(=O)NCCC(C)CO a359eeabb8806ca9e18fd26c72eedf77 [0,2,0,0,0,0|2,0,0]=4 5004 B12R0.156 CO[C@H](C)C(=O)NCC[C@@H](C)CO 11fe7c7aab02f2187de88d4a19ecb234 [0,2,0,0,0,0|2,0,0]=4 5005 B12R0.156 CSC(C)C(=O)NCCC(C)CO efa6967e0d6b16d1a411a049d6dfb481 [0,2,0,0,0,0|2,0,0]=4 5006 B12R0.156 CSC(C)C(=O)NCC[C@@H](C)CO a983427a82aaf71da5d7354ec5fc27d5 [0,2,0,0,0,0|2,0,0]=4 5007 B12R0.156 C[C@@H](CO)CCNC(=O)C(O)CO aaa084e3bcf708c82e2c9cafeea87181 [0,2,0,0,0,0|2,0,0]=4 5008 B12R0.156 C[C@@H](CO)CCNC(=O)[C@@H](O)CO f1acb56edad361e1644bf72e38d2ddd1 [0,2,0,0,0,0|2,0,0]=4 5009 B12R0.156 C[C@@H](CO)CCNC(=O)[C@H](O)CF 2b76dfb0f65a0a19a4643a5c08804b91 [0,2,0,0,0,0|2,0,0]=4 5010 B12R0.349 CCC(C)(C)C(C)OCCC(C)C f4e70a3fd893b398882a9030532464ae [0,2,0,0,0,0|1,0,1]=4 5011 B12R0.349 CCC(F)(F)C(=O)NCCC(C)C 0cb2196215dd1252e4de21649d4dcbc3 [0,2,0,0,0,0|1,0,0]=3 5012 B12R0.349 CCC(F)(F)C(=O)NCCC(C)O 93ea51678dd0ff3d6b3aba2ca7f7160a [0,2,0,0,0,0|2,0,0]=4 5013 B12R0.349 CCC(F)(F)C(=O)NCCN(C)C d9b2f6aeb3801fe43295e8498f282722 [0,2,0,0,0,0|2,0,0]=4 5014 B12R0.349 CCC(F)(F)C(=O)NCC[C@@H](C)O 832281a13af81ac143ea030053f22a5d [0,2,0,0,0,0|2,0,0]=4 5015 B12R0.349 CCC(F)(F)C(=O)NCC[C@H](C)O 084a129d7b2c1942cf6fca3b51e575e8 [0,2,0,0,0,0|2,0,0]=4 5016 B12R0.677 C/C=C(/CC)\C(=O)NCCC(C)C adb6290e05ddaa44d5206fe97f3d269d [0,2,0,0,0,0|1,0,1]=4 5017 B12R0.677 C/C=C(\CC)/C(=O)NCCC(C)C bcb37c95bfa328d0abc815b6217fe84f [0,2,0,0,0,0|1,0,1]=4 5018 B12R0.677 CC=C(CC)C(=O)NCCC(C)C f32cea597138523aedc9d2acdcd0cfe5 [0,2,0,0,0,0|1,0,1]=4 5019 B12R0.677 CCC(CC)C(=O)OCOC(C)C 8572ff03d7bf15b19aaba64e2ecb0a34 [0,2,0,0,0,0|1,0,0]=3 5020 B12R0.677 CCC(CC)C(C)OCCC(C)C df4c3dd42875bfa93d8220b99737f587 [0,2,0,0,0,0|1,0,1]=4 5021 B12R0.677 CCC(OC)C(=O)NCCC(C)C bd3ba2ea1aa4f76ed22dfd663442b881 [0,2,0,0,0,0|1,0,0]=3 5022 B12R0.677 CCC(OC)C(=O)NCCC(C)O 07bbf785e0b0cfd7e52ef2ed12943d75 [0,2,0,0,0,0|2,0,0]=4 5023 B12R0.677 CCC(OC)C(=O)NCCN(C)C 7a939e2f54d650f0aa191d2b1d621831 [0,2,0,0,0,0|2,0,0]=4 5024 B12R0.677 CCC(OC)C(=O)NCC[C@@H](C)O b2250a064d62d600ab26d9a396fff2c7 [0,2,0,0,0,0|2,0,0]=4 5025 B12R0.677 CCC(OC)C(=O)NCC[C@H](C)O b2245a7aaa6c33d3412021a34de23c5b [0,2,0,0,0,0|2,0,0]=4 5026 B12R0.677 COC(OC)C(=O)NCCC(C)C 1e6d167472699be42aa70110267ba745 [0,2,0,0,0,0|2,0,0]=4 5027 B12R0.44 C=C(C)CCC(=O)NCCC(C)C 878b40c33acd7a053b2070701fdcedff [0,2,0,0,0,0|1,0,0]=3 5028 B12R0.44 C=C(C)CCC(=O)NCCC(C)O 52857a37ff3a3708e90ad6271d348eca [0,2,0,0,0,0|2,0,0]=4 5029 B12R0.44 C=C(C)CCC(=O)NCCN(C)C 8b9f0d409c8e16df9a1577329e462763 [0,2,0,0,0,0|2,0,0]=4 5030 B12R0.44 C=C(C)CCC(=O)NCC[C@@H](C)O a5c9472ab0859a69aa937543431344f0 [0,2,0,0,0,0|2,0,0]=4 5031 B12R0.44 C=C(C)CCC(=O)NCC[C@H](C)O 3f9c0a5570d03c0fabc95cf7b99e854a [0,2,0,0,0,0|2,0,0]=4 5032 B12R0.44 C=C(C)CNC(=O)CCCC(C)C 44f44639134d06121171a35df7342cf0 [0,2,0,0,0,0|1,0,1]=4 5033 B12R0.44 C=C(C)CNC(=O)NCCC(C)C da72097cf136755d9c3ad780f1656331 [0,2,0,0,0,0|1,0,1]=4 5034 B12R0.44 CC(=CCC(=O)NCCC(C)C)C cd1abc7095d7d0689843e259a59524b9 [0,2,0,0,0,0|1,0,1]=4 5035 B12R0.44 CC(=O)CCC(=O)NCCC(C)C 02c76093862c741aaa7cb75eecf27fde [0,2,0,0,0,0|1,0,0]=3 5036 B12R0.44 CC(=O)CCC(=O)NCCC(C)O 73195aebc81e7c07e07fad53d3754ee5 [0,2,0,0,0,0|2,0,0]=4 5037 B12R0.44 CC(=O)CCC(=O)NCCN(C)C 650e973df97995ab926c2e6f83fdfa0d [0,2,0,0,0,0|2,0,0]=4 5038 B12R0.44 CC(=O)CCC(=O)NCC[C@@H](C)O fec2a5b3473977478f6b336a8a1fad0a [0,2,0,0,0,0|2,0,0]=4 5039 B12R0.44 CC(=O)CCC(=O)NCC[C@H](C)O 896863744dd8166fbece20b8d26d9141 [0,2,0,0,0,0|2,0,0]=4 5040 B12R0.44 CC(=O)CNC(=O)CCCC(C)C 0eec13a599b470190907639cb26e69fd [0,2,0,0,0,0|1,0,1]=4 5041 B12R0.44 CC(=O)CNC(=O)NCCC(C)C d81d51d9459d58b6b5a71c2a9cf21de8 [0,2,0,0,0,0|1,0,1]=4 5042 B12R0.44 CC(=O)NCC(=O)NCCC(C)C 806ffd1d03960ac50e5783f7a1d846fb [0,2,0,0,0,0|1,0,1]=4 5043 B12R0.44 CC(=O)OCC(=O)NCCC(C)C cefc705db0bdc8708d003afc4d4fe328 [0,2,0,0,0,0|1,0,1]=4 5044 B12R0.44 CC(=O)SCC(=O)NCCC(C)C 1ee77097853115db8b22be119de05b3a [0,2,0,0,0,0|1,0,1]=4 5045 B12R0.44 CC(=S)NCC(=O)NCCC(C)C 578dbd58b9db6b1af2ee0b6f5344300b [0,2,0,0,0,0|1,0,1]=4 5046 B12R0.44 CC(C)/C=C/C(=O)NCCC(C)C 95715ab1e3cca4ce5de2c59e15cd8a81 [0,2,0,0,0,0|1,0,1]=4 5047 B12R0.44 CC(C)C/C=C/C(=O)NCC(C)C e92ba8661e368a4222f6af8f34c2c0fb [0,2,0,0,0,0|1,0,1]=4 5048 B12R0.44 CC(C)C/C=C/C(=O)NCC(C)O 6711959af121c890330d9d9fc3c82eb6 [0,2,0,0,0,0|1,0,1]=4 5049 B12R0.44 CC(C)C/C=C/C(=O)NC[C@@H](C)O 8bea10552e0d124b5c24f31012e053fd [0,2,0,0,0,0|1,0,1]=4 5050 B12R0.44 CC(C)C/C=C/C(=O)NC[C@H](C)O 399750eac9c74a4479a67643923914a2 [0,2,0,0,0,0|1,0,1]=4 5051 B12R0.44 CC(C)CCC(=O)NCCC(C)O 14778feda4fcf908b296d14c3f396077 [0,2,0,0,0,0|2,0,0]=4 5052 B12R0.44 CC(C)CCC(=O)NCCN(C)C c06f11bfffb2337acf9fd52ededb2a59 [0,2,0,0,0,0|2,0,0]=4 5053 B12R0.44 CC(C)CCC(=O)NCC[C@@H](C)O 495a6fb75dbd431b9f6d5f1e0ea5454d [0,2,0,0,0,0|2,0,0]=4 5054 B12R0.44 CC(C)CCC(=O)NCC[C@H](C)O e9ed81c8f6b964fa5a784c892e9fcfde [0,2,0,0,0,0|2,0,0]=4 5055 B12R0.44 CC(C)CCCC(=O)NCC(C)C 9433a2d36707dbbeba9dc4fb34f3a7b4 [0,2,0,0,0,0|1,0,0]=3 5056 B12R0.44 CC(C)CCCC(=O)NCC(C)O fe227a15d7912faea9b9945dba99471b [0,2,0,0,0,0|1,0,0]=3 5057 B12R0.44 CC(C)CCCC(=O)NCC(F)F 9b918a50a6e948354462fb0f266062e3 [0,2,0,0,0,0|2,0,0]=4 5058 B12R0.44 CC(C)CCCC(=O)NC[C@@H](C)O bd12a2480c517f03c3273c4fdf97f5bb [0,2,0,0,0,0|1,0,0]=3 5059 B12R0.44 CC(C)CCCC(=O)NC[C@H](C)O 530973866e92bad3a61411d729040c75 [0,2,0,0,0,0|1,0,0]=3 5060 B12R0.44 CC(C)CCNC(=O)CCC(=O)N e91771d2a176fb7a683e520862b7ce10 [0,2,0,0,0,0|1,0,1]=4 5061 B12R0.44 CC(C)CCNC(=O)CCC(C)C a51e610a4f662ad5c618ab698297e102 [0,2,0,0,0,0|1,0,0]=3 5062 B12R0.44 CC(C)CCNC(=O)CCC(C)O 44f69cd8599f28a5c657d89ecd0bf2ff [0,2,0,0,0,0|1,0,0]=3 5063 B12R0.44 CC(C)CCNC(=O)CCC(C)S 5a7556e8ac1232ce6713793599ad2f26 [0,2,0,0,0,0|1,0,0]=3 5064 B12R0.44 CC(C)CCNC(=O)CCC(F)F 6a49160da94ca5bd0f68290a29846413 [0,2,0,0,0,0|1,0,0]=3 5065 B12R0.44 CC(C)CCNC(=O)CCN(C)C 35cb73d5b712e6471cb5b06794a3b881 [0,2,0,0,0,0|1,0,0]=3 5066 B12R0.44 CC(C)CCNC(=O)CCS(=O)C c532f4a7c026e9c373428b88b1dedba1 [0,2,0,0,0,0|1,0,0]=3 5067 B12R0.44 CC(C)CCNC(=O)CC[C@H](C)S 0bc97c37028883b6264b742531139719 [0,2,0,0,0,0|1,0,0]=3 5068 B12R0.44 CC(C)CCNC(=O)CC[N+](=O)[O-] 120a1f908c0f0abc98444c82785ca2b1 [0,2,0,0,0,0|2,0,0]=4 5069 B12R0.44 CC(C)CCNC(=O)COC(C)C 371fd52c8730fb2956e68ed73fb61794 [0,2,0,0,0,0|1,0,0]=3 5070 B12R0.44 CC(C)CCNC(=O)COC(F)F 054491f94fdcf22289589bbc152d2211 [0,2,0,0,0,0|2,0,0]=4 5071 B12R0.44 CC(C)CCNC(=O)CSC(C)C 5f648cb7b571d4279f19ea21a9eb596f [0,2,0,0,0,0|1,0,0]=3 5072 B12R0.44 CC(C)CCNC(=O)CSC(F)F 0fdc47a4fb303e95e12c2e6c70a1ae05 [0,2,0,0,0,0|2,0,0]=4 5073 B12R0.44 CC(C)CCNC(=O)NCC(C)C d3f8d3930fca27c7e242cf54afc8055b [0,2,0,0,0,0|1,0,0]=3 5074 B12R0.44 CC(C)CCNC(=O)NCC(C)O c39c584f70a67fee9ea0de0a67530ec1 [0,2,0,0,0,0|1,0,0]=3 5075 B12R0.44 CC(C)CCNC(=O)NCC(F)F 0a9a542e5c31507575105ce8d7f2602c [0,2,0,0,0,0|2,0,0]=4 5076 B12R0.44 CC(C)CCNC(=O)NC[C@@H](C)O f7a665c95b684d59c65ebd87e8fea8e5 [0,2,0,0,0,0|1,0,0]=3 5077 B12R0.44 CC(C)CCNC(=O)NC[C@H](C)O a9d0413b686c73697b52e9506a3078bc [0,2,0,0,0,0|1,0,0]=3 5078 B12R0.44 CC(C)CCNC(=S)NCC(C)C 2b2db1fbc09e84b7e9020109e9bea147 [0,2,0,0,0,0|1,1,0]=4 5079 B12R0.44 CC(C)CCNC(=S)NCC(C)O 507b87b65a5bd5b8fb46d5498a3a422a [0,2,0,0,0,0|1,1,0]=4 5080 B12R0.44 CC(C)CCNC(=S)NC[C@@H](C)O 3e21eb22941c8d4f70e3048f32f508ef [0,2,0,0,0,0|1,1,0]=4 5081 B12R0.44 CC(C)CCNC(=S)NC[C@H](C)O c2f9bde645488637aaa3ab40cedc610b [0,2,0,0,0,0|1,1,0]=4 5082 B12R0.44 CC(C)CCOC(C)CCC(C)C e5387a27b648858579643337a26c6a82 [0,2,0,0,0,0|1,0,1]=4 5083 B12R0.44 CC(C)CCOC(C)CCN(C)C 6d8676f9813860825a87c4dc2a428ca1 [0,2,0,0,0,0|1,0,1]=4 5084 B12R0.44 CC(C)CCOC(C)COC(C)C 91cb66e4489a8ff7c17f4958ac3b4f17 [0,2,0,0,0,0|1,0,1]=4 5085 B12R0.44 CC(C)CCO[C@@H](C)COC(C)C dcccc821e5d1b78f44b266b7bd3b4c62 [0,2,0,0,0,0|1,0,1]=4 5086 B12R0.44 CC(C)CNC(=O)CCCN(C)C 9d94185eb67543e6a7d1eb83d5621d75 [0,2,0,0,0,0|2,0,0]=4 5087 B12R0.44 CC(C)CNC(=O)CCOC(C)C 7a1f510559ab4c458bee7aff767191af [0,2,0,0,0,0|2,0,0]=4 5088 B12R0.44 CC(C)CNC(=O)CCSC(C)C c0bf0dd1f8d03c1424fbfb6566f9aecf [0,2,0,0,0,0|2,0,0]=4 5089 B12R0.44 CC(C)CNC(=O)COCC(C)C b5beca305d9c4b9a7bd8431f8ec1bad7 [0,2,0,0,0,0|2,0,0]=4 5090 B12R0.44 CC(C)CNC(=O)NCCC(C)O e6932514a3da74120b201874a8abbc81 [0,2,0,0,0,0|2,0,0]=4 5091 B12R0.44 CC(C)CNC(=O)NCCN(C)C 2e6abdbc6010305cc7638fd187ad1acc [0,2,0,0,0,0|2,0,0]=4 5092 B12R0.44 CC(C)CNC(=O)NCC[C@@H](C)O 4a369ae24a8fc60c288ca772a5acf600 [0,2,0,0,0,0|2,0,0]=4 5093 B12R0.44 CC(C)CNC(=O)NCC[C@H](C)O 3ec863643663bc449b4f70cbf502a43f [0,2,0,0,0,0|2,0,0]=4 5094 B12R0.44 CC(C)CNCC(=O)NCC(C)C 32b23ab91ce102938a4f1dd558acbbff [0,2,0,0,0,0|2,0,0]=4 5095 B12R0.44 CC(C)COCC(=O)NCC(C)O 90d7143c149ba7cab2f0b45bcca46bc5 [0,2,0,0,0,0|2,0,0]=4 5096 B12R0.44 CC(C)COCC(=O)NC[C@@H](C)O 24c251136ac3154f1b6b2905b59068b8 [0,2,0,0,0,0|2,0,0]=4 5097 B12R0.44 CC(C)COCC(=O)NC[C@H](C)O bec9849069240649debc58a1a765bd8e [0,2,0,0,0,0|2,0,0]=4 5098 B12R0.44 CC(C)OCC(=O)NCCN(C)C de4528fdcd3ced4c83d50b09418d1443 [0,2,0,0,0,0|2,0,0]=4 5099 B12R0.44 CC(C)OCC(=O)NCC[C@@H](C)O 519acbcd0306e2878e7d47f6c4d3c06f [0,2,0,0,0,0|2,0,0]=4 5100 B12R0.44 CC(C)OCC(=O)NCC[C@H](C)O f97a9afa20c76d7d8d761e90c65ee2b5 [0,2,0,0,0,0|2,0,0]=4 5101 B12R0.44 CC(C)OCCC(=O)NC[C@@H](C)O 6bdd1198203259849499f70b3096a831 [0,2,0,0,0,0|2,0,0]=4 5102 B12R0.44 CC(C)OCCC(=O)NC[C@H](C)O 9c5ec4191fb3908473408941de7e7dc5 [0,2,0,0,0,0|2,0,0]=4 5103 B12R0.44 CC(C)SCC(=O)NCCN(C)C 3820dc364fb8dcdcf382399561f96280 [0,2,0,0,0,0|2,0,0]=4 5104 B12R0.44 CC(C)SCC(=O)NCC[C@@H](C)O c541d342282aa56a858e138d15a78940 [0,2,0,0,0,0|2,0,0]=4 5105 B12R0.44 CC(C)SCC(=O)NCC[C@H](C)O f4674e22d547d99b0eecc97fe2cadb3f [0,2,0,0,0,0|2,0,0]=4 5106 B12R0.44 CC(C)SCCC(=O)NC[C@@H](C)O aada3d1bf856841af2e531a62d6dbc06 [0,2,0,0,0,0|2,0,0]=4 5107 B12R0.44 CC(C)SCCC(=O)NC[C@H](C)O e56ed61b5fafb36c55b82a9ee7080228 [0,2,0,0,0,0|2,0,0]=4 5108 B12R0.44 CC(O)CCC(=O)NCCN(C)C 89f93d1d1ec208081c99fa016fc5267d [0,2,0,0,0,0|2,0,0]=4 5109 B12R0.44 CC(O)CCC(=O)NCC[C@@H](C)O 79951079d11ec43ed87612b39b07fb38 [0,2,0,0,0,0|2,0,0]=4 5110 B12R0.44 CC(O)CCC(=O)NCC[C@H](C)O 04cff8c90ba1c74404170116f94fc86d [0,2,0,0,0,0|2,0,0]=4 5111 B12R0.44 CC(O)CCNC(=O)CCC(C)O 9e7db5542a7e9510b1e7e9351aab54e5 [0,2,0,0,0,0|2,0,0]=4 5112 B12R0.44 CC(O)CCNC(=O)CCC(C)S b71085d8a2b7e37ad7408b65418e19de [0,2,0,0,0,0|2,0,0]=4 5113 B12R0.44 CC(O)CCNC(=O)CCC(F)F 10956961eadd774c5a9f45bf1d51b18a [0,2,0,0,0,0|2,0,0]=4 5114 B12R0.44 CC(O)CCNC(=O)CCN(C)C 12e1f0bc48b3eae63b3404582d815a91 [0,2,0,0,0,0|2,0,0]=4 5115 B12R0.44 CC(O)CCNC(=O)CCS(=O)C 2ecbfe547cab592f6c42cccae45505e4 [0,2,0,0,0,0|2,0,0]=4 5116 B12R0.44 CC(O)CCNC(=O)CC[C@H](C)S 4939bcebd08b4e36680c0691578d65b2 [0,2,0,0,0,0|2,0,0]=4 5117 B12R0.44 CC(O)CCNC(=O)COC(C)C 7414634922d5d44542f8ec66f4a85d31 [0,2,0,0,0,0|2,0,0]=4 5118 B12R0.44 CC(O)CCNC(=O)CSC(C)C 7e9ad56162f4d445cf07b9f764ba3e8b [0,2,0,0,0,0|2,0,0]=4 5119 B12R0.44 CC(O)CCNC(=O)NCC(C)O 7fe0d047cfdc783bbb68526c93f62137 [0,2,0,0,0,0|2,0,0]=4 5120 B12R0.44 CC(O)CCNC(=O)NC[C@@H](C)O 1876eee7e3ed0c0cb1b22a5c2db76c59 [0,2,0,0,0,0|2,0,0]=4 5121 B12R0.44 CC(O)CCNC(=O)NC[C@H](C)O 5b00236eb5d64c705847f304ca4acb70 [0,2,0,0,0,0|2,0,0]=4 5122 B12R0.44 CC(O)CNC(=O)CCCN(C)C 24f73d62d305409e810ce55ace1b3cd9 [0,2,0,0,0,0|2,0,0]=4 5123 B12R0.44 CC(O)CNC(=O)CCOC(C)C 8e868723afd2a6692406bcf533d4d4c2 [0,2,0,0,0,0|2,0,0]=4 5124 B12R0.44 CC(O)CNC(=O)CCSC(C)C bea6f6eafeabb1bc91cfc8e5274e90b1 [0,2,0,0,0,0|2,0,0]=4 5125 B12R0.44 CC(O)CNC(=O)NCCN(C)C 8ba93dc957228767f7de55649c71b046 [0,2,0,0,0,0|2,0,0]=4 5126 B12R0.44 CC(O)CNC(=O)NCC[C@@H](C)O 3353207071376af2019a554e02143321 [0,2,0,0,0,0|2,0,0]=4 5127 B12R0.44 CC(O)CNC(=O)NCC[C@H](C)O c14dfbfcc316f9f0910c397a40e0d372 [0,2,0,0,0,0|2,0,0]=4 5128 B12R0.44 CC(S)CCC(=O)NCCN(C)C efb74da0c4232758084d3255ce28708a [0,2,0,0,0,0|2,0,0]=4 5129 B12R0.44 CC(S)CCC(=O)NCC[C@@H](C)O 5e068765e4f21d87f54e0dd6f6e983ae [0,2,0,0,0,0|2,0,0]=4 5130 B12R0.44 CC(S)CCC(=O)NCC[C@H](C)O 8e52b35f5a77c59d09acbb27779128a8 [0,2,0,0,0,0|2,0,0]=4 5131 B12R0.44 CN(C)CCNC(=O)CCC(F)F 62db8349114a8f91f5c7d0730ef74c18 [0,2,0,0,0,0|2,0,0]=4 5132 B12R0.44 CN(C)CCNC(=O)CCN(C)C 2d4b098bcf48df7c1bcb9cd654d4f47c [0,2,0,0,0,0|2,0,0]=4 5133 B12R0.44 CN(C)CCNC(=O)CCS(=O)C 57e26dd645d0a5922e4018071893cc41 [0,2,0,0,0,0|2,0,0]=4 5134 B12R0.44 C[C@@H](O)CCNC(=O)CCC(F)F 690090d064867dd542c24a780b5c2091 [0,2,0,0,0,0|2,0,0]=4 5135 B12R0.44 C[C@@H](O)CCNC(=O)CCN(C)C 5638b6d2994c2b41191417480d2f95f4 [0,2,0,0,0,0|2,0,0]=4 5136 B12R0.44 C[C@@H](O)CCNC(=O)CCS(=O)C 29424638d67a1bcebd9fd42d0ed831b0 [0,2,0,0,0,0|2,0,0]=4 5137 B12R0.44 C[C@@H](O)CCNC(=O)NC[C@@H](C)O b27d23fc152797098280dc6dea70944b [0,2,0,0,0,0|2,0,0]=4 5138 B12R0.44 C[C@@H](O)CNC(=O)CCCN(C)C 2c5d8fbe2f97cbf7cc08af01443ae720 [0,2,0,0,0,0|2,0,0]=4 5139 B12R0.44 C[C@@H](O)CNC(=O)NCCN(C)C 18aaf70a9a965dd5249cf38fcdc6087b [0,2,0,0,0,0|2,0,0]=4 5140 B12R0.44 C[C@H](O)CCNC(=O)CCC(F)F b08c9f6d017f193bca7afbeffdc9a22a [0,2,0,0,0,0|2,0,0]=4 5141 B12R0.44 C[C@H](O)CCNC(=O)CCN(C)C bf31d6e69bdad698db40f25316792fa7 [0,2,0,0,0,0|2,0,0]=4 5142 B12R0.44 C[C@H](O)CCNC(=O)CCS(=O)C 0b30af6113c5230a2ee39ee7eba1b2f9 [0,2,0,0,0,0|2,0,0]=4 5143 B12R0.44 C[C@H](O)CCNC(=O)CC[C@H](C)S a67017375ebf58cfecee4b619b8625b8 [0,2,0,0,0,0|2,0,0]=4 5144 B12R0.44 C[C@H](O)CCNC(=O)NC[C@@H](C)O 460b08896b5e7ed860831ebbfeb536a8 [0,2,0,0,0,0|2,0,0]=4 5145 B12R0.44 C[C@H](O)CCNC(=O)NC[C@H](C)O 7d9949988af7e524d0adfe9dea01f561 [0,2,0,0,0,0|2,0,0]=4 5146 B12R0.44 C[C@H](O)CNC(=O)CCCN(C)C 27929dfcba0946c725dbc3143cb16dee [0,2,0,0,0,0|2,0,0]=4 5147 B12R0.44 C[C@H](O)CNC(=O)NCCN(C)C e05fdc38f213a177914155ba01ab0981 [0,2,0,0,0,0|2,0,0]=4 5148 B12R0.44 C[C@H](O)CNC(=O)NCC[C@@H](C)O d60a15d364075507afa340824ad268dc [0,2,0,0,0,0|2,0,0]=4 5149 B12R0.44 C[C@H](S)CCC(=O)NCCN(C)C 22b48ed7a7cb3e90c1def4b4a1602805 [0,2,0,0,0,0|2,0,0]=4 5150 B12R0.44 C[C@H](S)CCC(=O)NCC[C@@H](C)O c101f080c6726e16743ae3fcc84d77bd [0,2,0,0,0,0|2,0,0]=4 5151 B12R0.102 C#CC(C)NCOC(=O)CCCC 7db5a5894499253a8ae41eff1a10a13c [0,2,0,0,0,0|1,0,1]=4 5152 B12R0.102 C#CC(C)NCOC(=O)OCCC 18bcdbc6f0f995b5729bd5c2bc5a906d [0,2,0,0,0,0|1,0,1]=4 5153 B12R0.102 C#CC(C)OCOC(=O)CCCC dae3034d0f35bc183b207a396b2d77fb [0,2,0,0,0,0|1,0,1]=4 5154 B12R0.102 C#CC(C)OCOC(=O)OCCC a87a721321121b0f00a63a52ddb0c20e [0,2,0,0,0,0|1,0,1]=4 5155 B12R0.102 C#CCCC(=O)NCCC(C)CC 425b1576e785f599070689df7fd16692 [0,2,0,0,0,0|1,0,1]=4 5156 B12R0.102 C#CCCC(=O)NCCC(C)CO 2de959fca383a9e5d8019a89688ebb8c [0,2,0,0,0,0|1,0,1]=4 5157 B12R0.102 C#CCCC(=O)NCC[C@@H](C)CO 261b022901b0039be0f2cfdc501247db [0,2,0,0,0,0|1,0,1]=4 5158 B12R0.102 C#C[C@@H](C)NCOC(=O)CCCC 713effdd63c5bf6798dc436e15b6390d [0,2,0,0,0,0|1,0,1]=4 5159 B12R0.102 C#C[C@@H](C)NCOC(=O)OCCC bdd93713845e25d753e059b51c2ab673 [0,2,0,0,0,0|1,0,1]=4 5160 B12R0.102 C#C[C@@H](C)OCOC(=O)CCCC 0a26881ab37e92b3e96c36d5b9ff21c4 [0,2,0,0,0,0|1,0,1]=4 5161 B12R0.102 C#C[C@@H](C)OCOC(=O)OCCC b95315074652c899011e5298c5c47118 [0,2,0,0,0,0|1,0,1]=4 5162 B12R0.102 C#C[C@H](C)NCOC(=O)CCCC b9635f1f2e6d32a3c11e5f4cae97ee03 [0,2,0,0,0,0|1,0,1]=4 5163 B12R0.102 C#C[C@H](C)NCOC(=O)OCCC 35f2e67def32a736cba2fbb07811c7a4 [0,2,0,0,0,0|1,0,1]=4 5164 B12R0.102 C#C[C@H](C)OCOC(=O)CCCC 65e0a4c28e73c469d9682dd681cb80b7 [0,2,0,0,0,0|1,0,1]=4 5165 B12R0.102 C#C[C@H](C)OCOC(=O)OCCC db1861bb961a130a5a050789793e1908 [0,2,0,0,0,0|1,0,1]=4 5166 B12R0.102 C/C=C/CC(=O)NCCC(C)CC 9b8b143b1969ac92aa2847eac4dcce3a [0,2,0,0,0,0|1,0,1]=4 5167 B12R0.102 C/C=C/CC(=O)NCCC(C)CO 5ea16ba43d164ac1d7eb92dd79d2bb7f [0,2,0,0,0,0|1,0,1]=4 5168 B12R0.102 C/C=C/CC(=O)NCC[C@@H](C)CO 8da4bb0b7faa37124553ea62cbda59ae [0,2,0,0,0,0|1,0,1]=4 5169 B12R0.102 C=CC(C)NCOC(=O)CCCC d4e042dd395f05644a2b3fadcdf2bc39 [0,2,0,0,0,0|1,0,1]=4 5170 B12R0.102 C=CC(C)NCOC(=O)OCCC 3f81a8224befb8df9d7bda1f8f64b0af [0,2,0,0,0,0|1,0,1]=4 5171 B12R0.102 C=CC(C)OCOC(=O)CCCC 84f28b5fbcab9b0fe6d5a09f195993c0 [0,2,0,0,0,0|1,0,1]=4 5172 B12R0.102 C=CC(C)OCOC(=O)OCCC 843b46ecbed0bd637d12a7c2db88f248 [0,2,0,0,0,0|1,0,1]=4 5173 B12R0.102 C=CCCC(=O)NCCC(C)CC 6eada0756c2663cfacb47b5f3bc0af6c [0,2,0,0,0,0|1,0,1]=4 5174 B12R0.102 C=CCCC(=O)NCCC(C)CO a44082c638c98d49c44969bac1749ede [0,2,0,0,0,0|1,0,1]=4 5175 B12R0.102 C=CCCC(=O)NCC[C@@H](C)CO 8311f481453a5a68852f298765daff19 [0,2,0,0,0,0|1,0,1]=4 5176 B12R0.102 C=C[C@H](C)OCOC(=O)CCCC 2924668b660105f99fe4bfea0e3a1626 [0,2,0,0,0,0|1,0,1]=4 5177 B12R0.102 C=C[C@H](C)OCOC(=O)OCCC 7dca50346447d8035cae4807644fa51a [0,2,0,0,0,0|1,0,1]=4 5178 B12R0.102 CC#CCC(=O)NCCC(C)CC 5b26d916e3508017b6b08a1a90f0cd03 [0,2,0,0,0,0|1,0,1]=4 5179 B12R0.102 CC#CCC(=O)NCCC(C)CO 2c652f35bcaa3143820b51196ce38815 [0,2,0,0,0,0|1,0,1]=4 5180 B12R0.102 CC#CCC(=O)NCC[C@@H](C)CO c301cbee6772a7a50a4503d41d2adb9d [0,2,0,0,0,0|1,0,1]=4 5181 B12R0.102 CC(CO)CCNC(=O)CCC#N 7c106c983f40d3f590e4368fbbef0078 [0,2,0,0,0,0|1,0,1]=4 5182 B12R0.102 CC(CO)CCNC(=O)CCC=O 479b971e5cb13c141cd5b827ea755460 [0,2,0,0,0,0|1,0,1]=4 5183 B12R0.102 CC(CO)CCNC(=O)CCCF 484fa11ef887279770b8bc3d08c9cbb1 [0,2,0,0,0,0|1,0,0]=3 5184 B12R0.102 CC(CO)CCNC(=O)CCCS 6f1b814570cdb2d2262d6ad7e13f928a [0,2,0,0,0,0|1,0,0]=3 5185 B12R0.102 CC(CO)CCNC(=O)NCCF e08c70a4df710eb5a5b57fad6a5853e8 [0,2,0,0,0,0|2,0,0]=4 5186 B12R0.102 CC(CO)CCNC(=O)NCCN dd3324a9db83d4a9e4eceab96c06d2c5 [0,2,0,0,0,0|2,0,0]=4 5187 B12R0.102 CC(CO)CCNC(=O)NCCO b587d12db0685a5b5acca5fe9dc21323 [0,2,0,0,0,0|2,0,0]=4 5188 B12R0.102 CC(CO)CCNC(=O)NCCS dce49a8a1876bb29b382d6e359ffc335 [0,2,0,0,0,0|2,0,0]=4 5189 B12R0.102 CC/C=C/C(=O)NCCC(C)CC 9cb74c9c55c4b0038cb442a0db896f54 [0,2,0,0,0,0|1,0,1]=4 5190 B12R0.102 CC/C=C/C(=O)NCCC(C)CO dd618302cc87154d9277705fd35131b4 [0,2,0,0,0,0|1,0,1]=4 5191 B12R0.102 CC/C=C/C(=O)NCC[C@@H](C)CO b5db3cf7e025f438fd179b6b1e37279d [0,2,0,0,0,0|1,0,1]=4 5192 B12R0.102 CC/C=C\C(=O)NCCC(C)CC 2a2bdb41d5016490d51c55527e451f75 [0,2,0,0,0,0|1,0,1]=4 5193 B12R0.102 CC/C=C\C(=O)NCCC(C)CO 3233df7b1374f670b50a02b00dfdd341 [0,2,0,0,0,0|1,0,1]=4 5194 B12R0.102 CC/C=C\C(=O)NCC[C@@H](C)CO 91347bfec1fcd461c8d62857b959d189 [0,2,0,0,0,0|1,0,1]=4 5195 B12R0.102 CCC#CC(=O)NCCC(C)CC 828cb2accd13887f594e49ad452eded9 [0,2,0,0,0,0|1,0,1]=4 5196 B12R0.102 CCC#CC(=O)NCCC(C)CO 8f86b9e1aac715e22b603390a2318419 [0,2,0,0,0,0|1,0,1]=4 5197 B12R0.102 CCC#CC(=O)NCC[C@@H](C)CO a16011a2b56b0f74542e9209d1b9be7f [0,2,0,0,0,0|1,0,1]=4 5198 B12R0.102 CCC(C)CCCC(=O)NCCBr 095a1cff7185270e0838885293e7d521 [0,2,0,0,0,0|2,0,0]=4 5199 B12R0.102 CCC(C)CCCC(=O)NCCF 47846ade57715c14591e16ac69af9dea [0,2,0,0,0,0|2,0,0]=4 5200 B12R0.102 CCC(C)CCCC(=O)NCCI dd3ab5b3f64526ff1f14989c08f7b55c [0,2,0,0,0,0|2,0,0]=4 5201 B12R0.102 CCC(C)CCCC(=O)NCCO 0b4f42a8a2cf5341f8036296e8ebc3cd [0,2,0,0,0,0|2,0,0]=4 5202 B12R0.102 CCC(C)CCCC(=O)NCCS 0a52fff91e0587ad6f9074c05b667950 [0,2,0,0,0,0|2,0,0]=4 5203 B12R0.102 CCC(C)CCNC(=O)CCC#N 8be1ea2858a60bd0e83fd1e0ec2d3739 [0,2,0,0,0,0|1,0,1]=4 5204 B12R0.102 CCC(C)CCNC(=O)CCC=O f4605a8137dd858875c65df9749a1746 [0,2,0,0,0,0|1,0,1]=4 5205 B12R0.102 CCC(C)CCNC(=O)CCCF 9a17f1f931f2104e39a8e613c133be64 [0,2,0,0,0,0|1,0,0]=3 5206 B12R0.102 CCC(C)CCNC(=O)CCCS 40dff8918d538d24ee069214a3af73d7 [0,2,0,0,0,0|1,0,0]=3 5207 B12R0.102 CCC(C)CCNC(=O)CCOC a44de6d4a8d32122a33bd453bf85ae19 [0,2,0,0,0,0|1,0,0]=3 5208 B12R0.102 CCC(C)CCNC(=O)CCSC 6edf7b18823512935d0930adcefee25d [0,2,0,0,0,0|1,0,0]=3 5209 B12R0.102 CCC(C)CCNC(=O)CSSC 3d812d8b27b15e9f92cb2b98a5009aa2 [0,2,0,0,0,0|2,0,0]=4 5210 B12R0.102 CCC(C)CCNC(=O)NCCF 8aab774176ff6245eb29af8093fc1448 [0,2,0,0,0,0|2,0,0]=4 5211 B12R0.102 CCC(C)CCNC(=O)NCCN 1ddaca81f4e614145fd0938cd377fbdc [0,2,0,0,0,0|2,0,0]=4 5212 B12R0.102 CCC(C)CCNC(=O)NCCO d13fe0789c0f96794244e0f6472d5c3e [0,2,0,0,0,0|2,0,0]=4 5213 B12R0.102 CCC(C)CCNC(=O)NCCS 49db7a35e5f28ba15f2bda451fae571e [0,2,0,0,0,0|2,0,0]=4 5214 B12R0.102 CCC(C)CCOC(C)CCOC ebd0726a24bd08e68307ced1d14f18f0 [0,2,0,0,0,0|1,0,1]=4 5215 B12R0.102 CCC(C)CCOC(C)CCSC 57daf5f1fe1f4954aef11a2c95b1ee31 [0,2,0,0,0,0|1,0,1]=4 5216 B12R0.102 CCC(C)CNCC(=O)CCSC aba84d3b33646c7d8408dff8248c608b [0,2,0,0,0,0|2,0,0]=4 5217 B12R0.102 CCC(C)COCC(=O)CCSC 5a3ce4035bca6de49f2e8d3c04b098f5 [0,2,0,0,0,0|2,0,0]=4 5218 B12R0.102 CCC=CC(=O)NCCC(C)CC 5ec3d8c8a2a52df802f6dcbf8e865c54 [0,2,0,0,0,0|1,0,1]=4 5219 B12R0.102 CCC=CC(=O)NCCC(C)CO 001486e2e898e7c607403f875b5fecc4 [0,2,0,0,0,0|1,0,1]=4 5220 B12R0.102 CCC=CC(=O)NCC[C@@H](C)CO cbe1c84e26a0dcf49ea59b495a7cec14 [0,2,0,0,0,0|1,0,1]=4 5221 B12R0.102 CCCCC(=O)NCCC(C)CC 4f52569bb623d7f775801ee22b5dd215 [0,2,0,0,0,0|1,0,0]=3 5222 B12R0.102 CCCCC(=O)NCCC(C)CO 5e2035af1b9cf5b3ad3e9bb748d9d252 [0,2,0,0,0,0|1,0,0]=3 5223 B12R0.102 CCCCC(=O)NCCC(O)CO 24690e6bb904f590614a7a8240da0ced [0,2,0,0,0,0|2,0,0]=4 5224 B12R0.102 CCCCC(=O)NCC[C@@H](C)CO d3bcb3d3997876d0eaa24754af811d20 [0,2,0,0,0,0|1,0,0]=3 5225 B12R0.102 CCCCC(=O)OCNC(C)C#N 544714cc60f7a4cf018288303f133c14 [0,2,0,0,0,0|1,0,1]=4 5226 B12R0.102 CCCCC(=O)OCNC(C)CO df4181a8205fbed91e8ba492e8778d11 [0,2,0,0,0,0|1,0,0]=3 5227 B12R0.102 CCCCC(=O)OCN[C@@H](C)CO 021910a6ce9670f8089c92ee2a0208dc [0,2,0,0,0,0|1,0,0]=3 5228 B12R0.102 CCCCC(=O)OCN[C@H](C)CO f47320c8d63a9d6a2f6345ac8e7fe79e [0,2,0,0,0,0|1,0,0]=3 5229 B12R0.102 CCCCC(=O)OCOC(C)C=O 9ceac89646bb1cc41e1299b470e9f1e4 [0,2,0,0,0,0|1,0,1]=4 5230 B12R0.102 CCCCC(=O)OCOC(C)CC 0457cc5379377c62c69654ef906d7882 [0,2,0,0,0,0|1,0,0]=3 5231 B12R0.102 CCCCC(=O)OCOC(C)CF b9d3c5352679d53a49947383a070e018 [0,2,0,0,0,0|1,0,0]=3 5232 B12R0.102 CCCCC(=O)OCO[C@@H](C)CC 941a8a6f02825443379a92f0d33b4e68 [0,2,0,0,0,0|1,0,0]=3 5233 B12R0.102 CCCCC(=O)OCO[C@H](C)CC fa459134ab25a7d5a1e347714e81ffec [0,2,0,0,0,0|1,0,0]=3 5234 B12R0.102 CCCCC(C)OCCC(C)CC a61d0a1377f7e4c233edb9e02e4f8572 [0,2,0,0,0,0|1,0,1]=4 5235 B12R0.102 CCCCC(C)OCCC(C)OC b0b04a13c895652cbc197523ff110074 [0,2,0,0,0,0|1,0,1]=4 5236 B12R0.102 CCCCC(C)OCC[C@@H](C)CC a3e95d6edccd3f5dbc29e29abf7d8aee [0,2,0,0,0,0|1,0,1]=4 5237 B12R0.102 CCCC[C@@H](C)OCCC(C)CC b26e718bcd971548d977b1cb4f5a9638 [0,2,0,0,0,0|1,0,1]=4 5238 B12R0.102 CCCC[C@H](C)OCCC(C)CC 470f663349389678df0157bed5df6136 [0,2,0,0,0,0|1,0,1]=4 5239 B12R0.102 CCCNC(=O)CCCC(C)CC 5f07022bdfedacfc51c3a7f7a1097226 [0,2,0,0,0,0|1,0,0]=3 5240 B12R0.102 CCCNC(=O)CCCC(O)CO 114599b45222067e007a1434bf966552 [0,2,0,0,0,0|2,0,0]=4 5241 B12R0.102 CCCNC(=O)CCCN(C)CC 499e2d2c74349cfae6461b3c3be04711 [0,2,0,0,0,0|2,0,0]=4 5242 B12R0.102 CCCNC(=O)CNCC(C)CC c7d050cefd9773b43d811e9fe45bc962 [0,2,0,0,0,0|2,0,0]=4 5243 B12R0.102 CCCNC(=O)CNCC(C)CO 57bd769c853a2259d5d604518cda0855 [0,2,0,0,0,0|2,0,0]=4 5244 B12R0.102 CCCNC(=O)CNCC(C)OC f72ab4ee979ad0b1de9d9ed9310df95f [0,2,0,0,0,0|2,0,0]=4 5245 B12R0.102 CCCNC(=O)CNC[C@@H](C)CC 743f3429fe5160d519918a358a1ab12a [0,2,0,0,0,0|2,0,0]=4 5246 B12R0.102 CCCNC(=O)CNC[C@@H](C)CO e658ff15bd8b682c6b05caefcbe0c707 [0,2,0,0,0,0|2,0,0]=4 5247 B12R0.102 CCCNC(=O)CNC[C@@H](C)OC a3effca595d17d9cad27a2668c553d4a [0,2,0,0,0,0|2,0,0]=4 5248 B12R0.102 CCCNC(=O)CNC[C@H](C)CC 0987f0241775c56d413ef3d311cdd088 [0,2,0,0,0,0|2,0,0]=4 5249 B12R0.102 CCCNC(=O)CNC[C@H](C)CO 4edda69af6916de5f5580103a702c8f8 [0,2,0,0,0,0|2,0,0]=4 5250 B12R0.102 CCCNC(=O)CNC[C@H](C)OC 058ce0cad87be1d0bd03d784c2887386 [0,2,0,0,0,0|2,0,0]=4 5251 B12R0.102 CCCNC(=O)COCC(C)CC 2a1e9bdd100448a42cf961013e371f63 [0,2,0,0,0,0|2,0,0]=4 5252 B12R0.102 CCCNC(=O)COCC(C)OC b7fbd1c0a21a07c762c142c97d965572 [0,2,0,0,0,0|2,0,0]=4 5253 B12R0.102 CCCNC(=O)COC[C@@H](C)CC 746a0ccbc80b2f03cea15e7437a2ab65 [0,2,0,0,0,0|2,0,0]=4 5254 B12R0.102 CCCNC(=O)COC[C@@H](C)OC 430e8675c74e5bcb68f05e08cfd2feac [0,2,0,0,0,0|2,0,0]=4 5255 B12R0.102 CCCNC(=O)COC[C@H](C)CC ed60da0041bc873bcc24c6ff59958c62 [0,2,0,0,0,0|2,0,0]=4 5256 B12R0.102 CCCNC(=O)COC[C@H](C)OC c5eef827f532efdbb9dcb236cc804665 [0,2,0,0,0,0|2,0,0]=4 5257 B12R0.102 CCCNC(=O)NCCC(C)CC b35acf027356ff7995ff8b1d372ec683 [0,2,0,0,0,0|1,0,0]=3 5258 B12R0.102 CCCNC(=O)NCCC(C)CO 14dadc5359e5a798f7e66c9eef32ab6d [0,2,0,0,0,0|1,0,0]=3 5259 B12R0.102 CCCNC(=O)NCCC(O)CO 251fe261339115adbc199f24f026434c [0,2,0,0,0,0|2,0,0]=4 5260 B12R0.102 CCCNC(=O)NCC[C@@H](C)CO 5135aea1aebbc236175bff804d4a893e [0,2,0,0,0,0|1,0,0]=3 5261 B12R0.102 CCCNC(=S)NCCC(C)CC 2489fac057f261725238d765e4e0f508 [0,2,0,0,0,0|1,1,0]=4 5262 B12R0.102 CCCNC(=S)NCCC(C)CO 5587ef511820357a06dcb477b341a017 [0,2,0,0,0,0|1,1,0]=4 5263 B12R0.102 CCCNC(=S)NCC[C@@H](C)CO d1890346c03b43671992be888431baa2 [0,2,0,0,0,0|1,1,0]=4 5264 B12R0.102 CCCOC(=O)CCOC(C)CC 19e0038b42890ca21ea46c8192401969 [0,2,0,0,0,0|2,0,0]=4 5265 B12R0.102 CCCOC(=O)CNCC(C)CC 1132b7f89ad758024981f29495d4d279 [0,2,0,0,0,0|2,0,0]=4 5266 B12R0.102 CCCOC(=O)CNCC(C)CO e62aa33d8dc0c9921bf66e7c63a41175 [0,2,0,0,0,0|2,0,0]=4 5267 B12R0.102 CCCOC(=O)CNC[C@@H](C)CC 96a55438ede02281d7b7e05fcf0b8b2e [0,2,0,0,0,0|2,0,0]=4 5268 B12R0.102 CCCOC(=O)CNC[C@@H](C)OC 0a008d840347d5111ce867849a5a7005 [0,2,0,0,0,0|2,0,0]=4 5269 B12R0.102 CCCOC(=O)CNC[C@H](C)CO a5077dcd386b257f6ca9dee8c0d04361 [0,2,0,0,0,0|2,0,0]=4 5270 B12R0.102 CCCOC(=O)CNC[C@H](C)OC 43c488240c2bb852459421f8e1153e34 [0,2,0,0,0,0|2,0,0]=4 5271 B12R0.102 CCCOC(=O)COCC(C)CC 627027b241f3196bd7925a25b615e010 [0,2,0,0,0,0|2,0,0]=4 5272 B12R0.102 CCCOC(=O)COCC(C)OC 03abf72159602a8532796cfa410303e6 [0,2,0,0,0,0|2,0,0]=4 5273 B12R0.102 CCCOC(=O)COC[C@@H](C)CC 58c93d1c7873f31ad88efb43266d594b [0,2,0,0,0,0|2,0,0]=4 5274 B12R0.102 CCCOC(=O)COC[C@@H](C)OC 22296be3e80b222629293c8b288a0487 [0,2,0,0,0,0|2,0,0]=4 5275 B12R0.102 CCCOC(=O)COC[C@H](C)CC e36ca0e50b404bc3448d25ae6bb9dc7e [0,2,0,0,0,0|2,0,0]=4 5276 B12R0.102 CCCOC(=O)COC[C@H](C)OC 778927330e7a5cae244d9148768a3f49 [0,2,0,0,0,0|2,0,0]=4 5277 B12R0.102 CCCOC(=O)OCNC(C)C#N d1bb91154863005047ef57c17c7825b0 [0,2,0,0,0,0|1,0,1]=4 5278 B12R0.102 CCCOC(=O)OCNC(C)CC 4183f2f365a416b889b1574932ad9c2c [0,2,0,0,0,0|1,0,0]=3 5279 B12R0.102 CCCOC(=O)OCNC(C)CO bd3c641981777d60b0689e5fd535ff4d [0,2,0,0,0,0|1,0,0]=3 5280 B12R0.102 CCCOC(=O)OCN[C@@H](C)CC 1a35b2cf6c652fb0c72e456b117fb72a [0,2,0,0,0,0|1,0,0]=3 5281 B12R0.102 CCCOC(=O)OCN[C@@H](C)CO a71c7e7f7f1b1e2d3b388e1d524190a9 [0,2,0,0,0,0|1,0,0]=3 5282 B12R0.102 CCCOC(=O)OCN[C@H](C)CC f178b81e79b7fc175a19e64247140878 [0,2,0,0,0,0|1,0,0]=3 5283 B12R0.102 CCCOC(=O)OCN[C@H](C)CO 1f334dc9a9a200186ab7f2631f0d3ece [0,2,0,0,0,0|1,0,0]=3 5284 B12R0.102 CCCOC(=O)OCOC(C)C=O c421168bd8890fd013e16b9e7b4f1c56 [0,2,0,0,0,0|1,0,1]=4 5285 B12R0.102 CCOCC(=O)NCCC(C)CC dcfe821ec39561aa68ead1e2b701b71f [0,2,0,0,0,0|1,0,0]=3 5286 B12R0.102 CCOCC(=O)NCCC(C)CO 71c1cb302f6ff143131e179721e8bf60 [0,2,0,0,0,0|1,0,0]=3 5287 B12R0.102 CCOCC(=O)NCCC(O)CO 9b0f7027c8abbbae06a7ed8857e281fe [0,2,0,0,0,0|2,0,0]=4 5288 B12R0.102 CCOCC(=O)NCC[C@@H](C)CO 6b98797fa44538a53bc2e825fd59c599 [0,2,0,0,0,0|1,0,0]=3 5289 B12R0.102 CCOCC(C)OCCC(C)CC d2888ae88d7d031d9018f7c0d18bd547 [0,2,0,0,0,0|1,0,1]=4 5290 B12R0.102 CCSCC(=O)NCCC(C)CC 034027570cb4f6dd4b5618e2cab5d942 [0,2,0,0,0,0|1,0,0]=3 5291 B12R0.102 CCSCC(=O)NCCC(C)CO 4498b6af5f783125b5149c38be2cedce [0,2,0,0,0,0|1,0,0]=3 5292 B12R0.102 CCSCC(=O)NCCC(O)CO 2d7da3d0d749619e9a7b7e063886ae86 [0,2,0,0,0,0|2,0,0]=4 5293 B12R0.102 CCSCC(=O)NCC[C@@H](C)CO aa9bf3be0d6d53ffef6de8c77a322f8c [0,2,0,0,0,0|1,0,0]=3 5294 B12R0.102 CC[C@@H](C)COCC(=O)CCSC 7069f155f551688645d4d196cb61ed0a [0,2,0,0,0,0|2,0,0]=4 5295 B12R0.102 CC[C@H](C)CNCC(=O)CCSC b68c2e0fbb9f59329bbc3075d49a6be9 [0,2,0,0,0,0|2,0,0]=4 5296 B12R0.102 CC[C@H](C)COCC(=O)CCSC 161be4a5926f8dd849ae20c01661d418 [0,2,0,0,0,0|2,0,0]=4 5297 B12R0.102 COC(C)COCC(=O)CCSC 71cd456f63c85de4f6cc0645a8885446 [0,2,0,0,0,0|2,0,0]=4 5298 B12R0.102 COCCC(=O)NCCC(C)CO 2b163ece13a60e8bb9c200035df59227 [0,2,0,0,0,0|1,0,0]=3 5299 B12R0.102 COCCC(=O)NCCC(O)CO db4c36bffc57408c4196730cc476feb2 [0,2,0,0,0,0|2,0,0]=4 5300 B12R0.102 COCCC(=O)NCC[C@@H](C)CO 777047ee56ec6a2ae417fb2dfb997155 [0,2,0,0,0,0|1,0,0]=3 5301 B12R0.102 CO[C@@H](C)CNCC(=O)CCSC 078b55d5f3c6e4cb68212cf7cf900a30 [0,2,0,0,0,0|2,0,0]=4 5302 B12R0.102 CO[C@@H](C)COCC(=O)CCSC ef3e8b6741dbc66ed146173a85abf074 [0,2,0,0,0,0|2,0,0]=4 5303 B12R0.102 CO[C@H](C)CNCC(=O)CCSC f47e8d78b18749e96892d4905320c511 [0,2,0,0,0,0|2,0,0]=4 5304 B12R0.102 CO[C@H](C)COCC(=O)CCSC c8169fc94b2e16132e09e2131a81176f [0,2,0,0,0,0|2,0,0]=4 5305 B12R0.102 CSCCC(=O)CNCC(C)CO bd079e774fed7071fb1141b2846d92b9 [0,2,0,0,0,0|2,0,0]=4 5306 B12R0.102 CSCCC(=O)CNC[C@H](C)CO 246c0e3d51129aa954004f71f60bab2e [0,2,0,0,0,0|2,0,0]=4 5307 B12R0.102 CSCCC(=O)NCCC(C)CO 7068ef3d96faf4ec99004847d5f13dfa [0,2,0,0,0,0|1,0,0]=3 5308 B12R0.102 CSCCC(=O)NCCC(O)CO f6ee66bb949ceb2a9ee25eaa15dda5ac [0,2,0,0,0,0|2,0,0]=4 5309 B12R0.102 CSCCC(=O)NCC[C@@H](C)CO ff01be9340257b7e7f99730101281529 [0,2,0,0,0,0|1,0,0]=3 5310 B12R0.102 CSSCC(=O)NCCC(C)CO 3616b17dc382064422014c56eca15a5b [0,2,0,0,0,0|2,0,0]=4 5311 B12R0.102 CSSCC(=O)NCC[C@@H](C)CO ba79f845d6bc5e35ab59495fd445b85f [0,2,0,0,0,0|2,0,0]=4 5312 B12R0.102 C[C@@H](CO)CCNC(=O)CCC#N 260f70c0d95a5a4bc636b1ce1107296c [0,2,0,0,0,0|1,0,1]=4 5313 B12R0.102 C[C@@H](CO)CCNC(=O)CCC=O 4cdcea958dec0f835c95f1134080ca5f [0,2,0,0,0,0|1,0,1]=4 5314 B12R0.102 C[C@@H](CO)CCNC(=O)CCCF 1a9ac6766aefc487621d62f862a11871 [0,2,0,0,0,0|1,0,0]=3 5315 B12R0.102 C[C@@H](CO)CCNC(=O)CCCS c20f3084b8487cb2279d4ef3795b6477 [0,2,0,0,0,0|1,0,0]=3 5316 B12R0.102 C[C@@H](CO)CCNC(=O)NCCF 0a59ea5f6771a0ef76b4c4039bd2c4e0 [0,2,0,0,0,0|2,0,0]=4 5317 B12R0.102 C[C@@H](CO)CCNC(=O)NCCN a62b6b013890a04c57bffdcfe024bbb2 [0,2,0,0,0,0|2,0,0]=4 5318 B12R0.102 C[C@@H](CO)CCNC(=O)NCCO c7f603ef70483fac10cf55170b385037 [0,2,0,0,0,0|2,0,0]=4 5319 B12R0.102 C[C@@H](CO)CCNC(=O)NCCS 9631b46fa61181c30d51af575e7cd937 [0,2,0,0,0,0|2,0,0]=4 5320 B12R0.102 O=C(CCCF)NCCC(O)CO a988a7f08974bff96a863127c45876d3 [0,2,0,0,0,0|2,0,0]=4 5321 B12R0.102 O=C(CCCS)NCCC(O)CO 22246dee3cf91c05e745bbfd8aeaddd2 [0,2,0,0,0,0|2,0,0]=4 5322 B12R0.104 C#CCCC(=O)NCCC(C)(C)C 530408d99edf687e875e4ea2194fbf1e [0,2,0,0,0,0|1,0,1]=4 5323 B12R0.104 C#CCCC(=O)NCCC(C)(C)F 4e674c77de0ea1c064ff85e60da006d8 [0,2,0,0,0,0|1,0,1]=4 5324 B12R0.104 C#CCCC(=O)NCCC(C)(C)O b87944e4af4907a7c6dbc6a5547b926c [0,2,0,0,0,0|1,0,1]=4 5325 B12R0.104 C/C=C/CC(=O)NCCC(C)(C)C fca57c912aedc31565fa846128e1c282 [0,2,0,0,0,0|1,0,1]=4 5326 B12R0.104 C/C=C/CC(=O)NCCC(C)(C)F 5aef17d48c25f2cf97ac8b0cd96f19fe [0,2,0,0,0,0|1,0,1]=4 5327 B12R0.104 C/C=C/CC(=O)NCCC(C)(C)O 610edd82e454edf55c5f1b67f7e1b898 [0,2,0,0,0,0|1,0,1]=4 5328 B12R0.104 C=CCCC(=O)NCCC(C)(C)C 513c18f616c78b54e7d9d41423354cca [0,2,0,0,0,0|1,0,1]=4 5329 B12R0.104 C=CCCC(=O)NCCC(C)(C)F 55b340f8ce78e25558142331f1a196e3 [0,2,0,0,0,0|1,0,1]=4 5330 B12R0.104 C=CCCC(=O)NCCC(C)(C)O e4000f99d24cd0de4b2cfe3f9b9a9242 [0,2,0,0,0,0|1,0,1]=4 5331 B12R0.104 CC#CCC(=O)NCCC(C)(C)C 78c5ff3cf1d961f9fa64a18de9b08374 [0,2,0,0,0,0|1,0,1]=4 5332 B12R0.104 CC#CCC(=O)NCCC(C)(C)F f4427b994c8e599408715ad5ce150aed [0,2,0,0,0,0|1,0,1]=4 5333 B12R0.104 CC#CCC(=O)NCCC(C)(C)O ae4602aa028aec8ec8b5d6378bac56b0 [0,2,0,0,0,0|1,0,1]=4 5334 B12R0.104 CC(C)(C)CCCC(=O)NCCBr d0d84f78162bfd1f35bc7a8dc5b0a8e4 [0,2,0,0,0,0|2,0,0]=4 5335 B12R0.104 CC(C)(C)CCCC(=O)NCCF 1194996d7efb992d46006ae533e2b436 [0,2,0,0,0,0|2,0,0]=4 5336 B12R0.104 CC(C)(C)CCCC(=O)NCCI 4e707dc822d043271e435a37e4829eeb [0,2,0,0,0,0|2,0,0]=4 5337 B12R0.104 CC(C)(C)CCCC(=O)NCCO f976ce60815705cf2f6974b61b557c72 [0,2,0,0,0,0|2,0,0]=4 5338 B12R0.104 CC(C)(C)CCCC(=O)NCCS c1f03c6bd2e84e48ee5a14fb358c7edc [0,2,0,0,0,0|2,0,0]=4 5339 B12R0.104 CC(C)(C)CCNC(=O)CCC#N 951966a97334a3edc1ba84b46317c5ec [0,2,0,0,0,0|1,0,1]=4 5340 B12R0.104 CC(C)(C)CCNC(=O)CCC=O 48c93c0b6f2cbcadaa307b4885f23eda [0,2,0,0,0,0|1,0,1]=4 5341 B12R0.104 CC(C)(C)CCNC(=O)CCCF 136b3eecea747764ce6d79a55eacffc0 [0,2,0,0,0,0|1,0,0]=3 5342 B12R0.104 CC(C)(C)CCNC(=O)CCCS 68a838123d421536efe113f0bc6d6db7 [0,2,0,0,0,0|1,0,0]=3 5343 B12R0.104 CC(C)(C)CCNC(=O)NCCF 98f3994dc218e7f60586a607b2112878 [0,2,0,0,0,0|2,0,0]=4 5344 B12R0.104 CC(C)(C)CCNC(=O)NCCN 3ea6b33417a52a348abde92dd8fb661b [0,2,0,0,0,0|2,0,0]=4 5345 B12R0.104 CC(C)(C)CCNC(=O)NCCO 87621a4e02228c2138419eacbd56487f [0,2,0,0,0,0|2,0,0]=4 5346 B12R0.104 CC(C)(C)CCNC(=O)NCCS 4a0ddf0d62bbea31067440a1daaf969d [0,2,0,0,0,0|2,0,0]=4 5347 B12R0.104 CC(C)(F)CCNC(=O)CCC#N 9f9d0d59d35f7f768e2259e53716a011 [0,2,0,0,0,0|1,0,1]=4 5348 B12R0.104 CC(C)(F)CCNC(=O)CCC=O f0fc99ed1b966a8fc628d7bebbe22d92 [0,2,0,0,0,0|1,0,1]=4 5349 B12R0.104 CC(C)(F)CCNC(=O)CCCF 42799714f5a71e4d37966cfbc7973da9 [0,2,0,0,0,0|1,0,0]=3 5350 B12R0.104 CC(C)(F)CCNC(=O)CCCS 259a2519a8fb5e860c6718e6c9ffb53c [0,2,0,0,0,0|1,0,0]=3 5351 B12R0.104 CC(C)(F)CCNC(=O)NCCF 9796abc0f3371b78c6550a52d7421fb2 [0,2,0,0,0,0|2,0,0]=4 5352 B12R0.104 CC(C)(F)CCNC(=O)NCCN ab36b52759c54e48239497a32b92108b [0,2,0,0,0,0|2,0,0]=4 5353 B12R0.104 CC(C)(F)CCNC(=O)NCCO a288e613d9c9792bfe934829bc8bc82a [0,2,0,0,0,0|2,0,0]=4 5354 B12R0.104 CC(C)(F)CCNC(=O)NCCS e4387b00f9c0b198a83edb2b3bb509c2 [0,2,0,0,0,0|2,0,0]=4 5355 B12R0.104 CC(C)(O)CCNC(=O)CCC#N 9b93003cba87db284174663a6fba5a85 [0,2,0,0,0,0|1,0,1]=4 5356 B12R0.104 CC(C)(O)CCNC(=O)CCC=O e2842b08cf2a55a84ee4f307f5d31ff9 [0,2,0,0,0,0|1,0,1]=4 5357 B12R0.104 CC(C)(O)CCNC(=O)CCCF b21d0ba68393cde8fb947d47eb0fd82c [0,2,0,0,0,0|1,0,0]=3 5358 B12R0.104 CC(C)(O)CCNC(=O)CCCS ff8940f795a3a7cf9f0e4bbaddb3f6bc [0,2,0,0,0,0|1,0,0]=3 5359 B12R0.104 CC(C)(O)CCNC(=O)NCCF a96b3c24159009ffec06269c293f978d [0,2,0,0,0,0|2,0,0]=4 5360 B12R0.104 CC(C)(O)CCNC(=O)NCCN e15b787e8641485552533646d6bf247f [0,2,0,0,0,0|2,0,0]=4 5361 B12R0.104 CC(C)(O)CCNC(=O)NCCO a3ee423946d5214cdbafe15381ec3992 [0,2,0,0,0,0|2,0,0]=4 5362 B12R0.104 CC(C)(O)CCNC(=O)NCCS 5a2a3c190e9905b63c3a9a15f18e02fe [0,2,0,0,0,0|2,0,0]=4 5363 B12R0.104 CC/C=C/C(=O)NCCC(C)(C)C 27c6373b18d3092f237f99ebe05094e6 [0,2,0,0,0,0|1,0,1]=4 5364 B12R0.104 CC/C=C/C(=O)NCCC(C)(C)F 178a9316f6b427a9a7b383b1d4d757d7 [0,2,0,0,0,0|1,0,1]=4 5365 B12R0.104 CC/C=C/C(=O)NCCC(C)(C)O c04151b314997fad46c41e4af6e58f8e [0,2,0,0,0,0|1,0,1]=4 5366 B12R0.104 CC/C=C\C(=O)NCCC(C)(C)C 0b4f3b2f4141c511552c6cb575b43acc [0,2,0,0,0,0|1,0,1]=4 5367 B12R0.104 CC/C=C\C(=O)NCCC(C)(C)F c1dc4302edfc574faa1f3ce7d4b5c87f [0,2,0,0,0,0|1,0,1]=4 5368 B12R0.104 CC/C=C\C(=O)NCCC(C)(C)O 2effb28766e1c11410077a3defbeff11 [0,2,0,0,0,0|1,0,1]=4 5369 B12R0.104 CCC#CC(=O)NCCC(C)(C)C 396a22552fb784e9e737618aa10ff2b9 [0,2,0,0,0,0|1,0,1]=4 5370 B12R0.104 CCC#CC(=O)NCCC(C)(C)F bf9a55128988e4e1aaeb98ab3bd046ea [0,2,0,0,0,0|1,0,1]=4 5371 B12R0.104 CCC#CC(=O)NCCC(C)(C)O 7f829fde9f63e78592a626c9fc138c88 [0,2,0,0,0,0|1,0,1]=4 5372 B12R0.104 CCC=CC(=O)NCCC(C)(C)C c730406d534b40a7328bbc54c7f8d06a [0,2,0,0,0,0|1,0,1]=4 5373 B12R0.104 CCC=CC(=O)NCCC(C)(C)F 678486ab13a422caceb1ed07d1d3264c [0,2,0,0,0,0|1,0,1]=4 5374 B12R0.104 CCC=CC(=O)NCCC(C)(C)O 4790ab640238684fe723cddad532855b [0,2,0,0,0,0|1,0,1]=4 5375 B12R0.104 CCCCC(=O)NCCC(C)(C)C 8e6dffd29741883ce8f4dcb95c8d277f [0,2,0,0,0,0|1,0,0]=3 5376 B12R0.104 CCCCC(=O)NCCC(C)(C)F ad9ee3259e036e8ad00b63393992966b [0,2,0,0,0,0|1,0,0]=3 5377 B12R0.104 CCCCC(=O)NCCC(C)(C)O d05e834bc82331bd296007c9a6bcc3b7 [0,2,0,0,0,0|1,0,0]=3 5378 B12R0.104 CCCCC(=O)OCNC(C)(C)C 5c9754b93ccda3e5f1badc1e6f61b637 [0,2,0,0,0,0|1,0,0]=3 5379 B12R0.104 CCCCC(C)OCCC(C)(C)C d4796021ab605a1e7f8e80c48d1c39d5 [0,2,0,0,0,0|1,0,1]=4 5380 B12R0.104 CCCCC(C)OCCC(C)(C)O 74f2468bfae219cfd8c41b6278979ff5 [0,2,0,0,0,0|1,0,1]=4 5381 B12R0.104 CCCCC(C)OCCC(C)(C)S d2e2e7c3888096f1adc0f6f397d5a5b5 [0,2,0,0,0,0|1,0,1]=4 5382 B12R0.104 CCCC[C@@H](C)OCCC(C)(C)C cf3283f9f2a04fdd0bf8753cc1f9c408 [0,2,0,0,0,0|1,0,1]=4 5383 B12R0.104 CCCC[C@@H](C)OCCC(C)(C)O dcc954c71bbb70533b108bbfc24bc160 [0,2,0,0,0,0|1,0,1]=4 5384 B12R0.104 CCCC[C@H](C)OCCC(C)(C)C c80dc636753193633f1d75436515a9ce [0,2,0,0,0,0|1,0,1]=4 5385 B12R0.104 CCCC[C@H](C)OCCC(C)(C)O bd5b37eeef591ab5d780692412c05cf5 [0,2,0,0,0,0|1,0,1]=4 5386 B12R0.104 CCCNC(=O)CCCC(C)(C)C 73d9549b08b5df5c2e137a54b93119cd [0,2,0,0,0,0|1,0,0]=3 5387 B12R0.104 CCCNC(=O)CCOC(C)(C)C cad11008a1c3f28438cf17c7db49f857 [0,2,0,0,0,0|2,0,0]=4 5388 B12R0.104 CCCNC(=O)CNCC(C)(C)C 41b48602543bcfa31b81179d52584b38 [0,2,0,0,0,0|2,0,0]=4 5389 B12R0.104 CCCNC(=O)CNCC(C)(C)F 544af66e43eaec1132a109f61a820949 [0,2,0,0,0,0|2,0,0]=4 5390 B12R0.104 CCCNC(=O)CNCC(C)(C)O a744314275aa09f5443e69b90424c37a [0,2,0,0,0,0|2,0,0]=4 5391 B12R0.104 CCCNC(=O)COCC(C)(C)Br 4a935745fbf5ad8c1c1b52f749c97551 [0,2,0,0,0,0|2,0,0]=4 5392 B12R0.104 CCCNC(=O)COCC(C)(C)C 90173d95aadc4448bb9fc935c98fb2fb [0,2,0,0,0,0|2,0,0]=4 5393 B12R0.104 CCCNC(=O)COCC(C)(C)F de7db411763303cd701db63e107a5df6 [0,2,0,0,0,0|2,0,0]=4 5394 B12R0.104 CCCNC(=O)COCC(C)(C)S f81a7beb7406a70c0391aea52130e052 [0,2,0,0,0,0|2,0,0]=4 5395 B12R0.104 CCCNC(=O)NCCC(C)(C)C c3faaf72158c59335ad13b13f99fa87e [0,2,0,0,0,0|1,0,0]=3 5396 B12R0.104 CCCNC(=O)NCCC(C)(C)F 98ffb628fe3649fd60d244d14bc74712 [0,2,0,0,0,0|1,0,0]=3 5397 B12R0.104 CCCNC(=O)NCCC(C)(C)O 484e2eab6624695368aacfce57280b06 [0,2,0,0,0,0|1,0,0]=3 5398 B12R0.104 CCCNC(=S)NCCC(C)(C)C a8ce6f0f048caa9c8763608c60b35878 [0,2,0,0,0,0|1,1,0]=4 5399 B12R0.104 CCCNC(=S)NCCC(C)(C)F 37dea2f3535f7098eb7b4035fa9e8e2a [0,2,0,0,0,0|1,1,0]=4 5400 B12R0.104 CCCNC(=S)NCCC(C)(C)O 268cfbf43f6c5e894ad6379017593813 [0,2,0,0,0,0|1,1,0]=4 5401 B12R0.104 CCCOC(=O)CNCC(C)(C)C 128ef33e258e1bf5b298ecc7ccdc2b5b [0,2,0,0,0,0|2,0,0]=4 5402 B12R0.104 CCCOC(=O)CNCC(C)(C)O e67b6a882ba6b1973e686afcec640dd5 [0,2,0,0,0,0|2,0,0]=4 5403 B12R0.104 CCCOC(=O)COCC(C)(C)Br 92741a9edf60ff82f181fb66ef1fa177 [0,2,0,0,0,0|2,0,0]=4 5404 B12R0.104 CCCOC(=O)COCC(C)(C)C be1017212be04f93d4e997a4ca85c53b [0,2,0,0,0,0|2,0,0]=4 5405 B12R0.104 CCCOC(=O)COCC(C)(C)F 40279b9787ff40a1e1f3e56e517fa853 [0,2,0,0,0,0|2,0,0]=4 5406 B12R0.104 CCCOC(=O)COCC(C)(C)S 9d942e26619578c338cde1e522e1a28f [0,2,0,0,0,0|2,0,0]=4 5407 B12R0.104 CCCOC(=O)OCNC(C)(C)C ac614d6a665c5df24f0bccb149ff7946 [0,2,0,0,0,0|1,0,0]=3 5408 B12R0.104 CCOCC(=O)NCCC(C)(C)C 8f8f7d92004cb891fe4773bee0ec58c4 [0,2,0,0,0,0|1,0,0]=3 5409 B12R0.104 CCOCC(=O)NCCC(C)(C)F ffba6d84843d4882dd36354d0b8d92c9 [0,2,0,0,0,0|1,0,0]=3 5410 B12R0.104 CCOCC(=O)NCCC(C)(C)O d6124d67942ca05d66ec4aa8219ef254 [0,2,0,0,0,0|1,0,0]=3 5411 B12R0.104 CCOCC(C)OCCC(C)(C)C c2a5e22bcaf77683f18f8ef1cb264443 [0,2,0,0,0,0|1,0,1]=4 5412 B12R0.104 CCOCC(C)OCCC(C)(C)O 1e95850f06e4535a59ee6a58019aac51 [0,2,0,0,0,0|1,0,1]=4 5413 B12R0.104 CCSCC(=O)NCCC(C)(C)C a1292e1be36981133ee92b16d9c778c7 [0,2,0,0,0,0|1,0,0]=3 5414 B12R0.104 CCSCC(=O)NCCC(C)(C)F 7f6df97542235b19b9eeb21f5d4f819a [0,2,0,0,0,0|1,0,0]=3 5415 B12R0.104 CCSCC(=O)NCCC(C)(C)O da67f6feabbb7dc884e089963bd3d8e1 [0,2,0,0,0,0|1,0,0]=3 5416 B12R0.104 COCCC(=O)NCCC(C)(C)C dfc4b75b95f079b8e8196b13c2640e36 [0,2,0,0,0,0|1,0,0]=3 5417 B12R0.104 COCCC(=O)NCCC(C)(C)F b4a5b41c95ab22db82a2e5c0268d9bd8 [0,2,0,0,0,0|1,0,0]=3 5418 B12R0.104 COCCC(=O)NCCC(C)(C)O a0d24c1b952fa66a03c37ee9c03bb296 [0,2,0,0,0,0|1,0,0]=3 5419 B12R0.104 COCCC(C)OCCC(C)(C)C 6ed4f0e9d8258a850cacebb88efaaacf [0,2,0,0,0,0|1,0,1]=4 5420 B12R0.104 COCCC(C)OCCC(C)(C)O 8bed342507edcf3ad5a86bd203de3c72 [0,2,0,0,0,0|1,0,1]=4 5421 B12R0.104 CSCCC(=O)CNCC(C)(C)C cde5376b2d0fb3925ab20a2c36f5f8a4 [0,2,0,0,0,0|2,0,0]=4 5422 B12R0.104 CSCCC(=O)CNCC(C)(C)O df22ec395016a8568e7ea2cdc5dd7170 [0,2,0,0,0,0|2,0,0]=4 5423 B12R0.104 CSCCC(=O)COCC(C)(C)Br 9dd6486e33695a73ca6347979eb768d8 [0,2,0,0,0,0|2,0,0]=4 5424 B12R0.104 CSCCC(=O)COCC(C)(C)C 07b0c8448c54ff8eb8cec1aa397ca218 [0,2,0,0,0,0|2,0,0]=4 5425 B12R0.104 CSCCC(=O)COCC(C)(C)F 3d9bde1cc1aab9b9987c36fc98a1e5bd [0,2,0,0,0,0|2,0,0]=4 5426 B12R0.104 CSCCC(=O)COCC(C)(C)S b6096d230f05111c1ae788caa5ae90a4 [0,2,0,0,0,0|2,0,0]=4 5427 B12R0.104 CSCCC(=O)NCCC(C)(C)C 813d853730ddb1b86b13b12a280bc528 [0,2,0,0,0,0|1,0,0]=3 5428 B12R0.104 CSCCC(=O)NCCC(C)(C)F 6e58d63a9913248d8e53c967739f674e [0,2,0,0,0,0|1,0,0]=3 5429 B12R0.104 CSCCC(=O)NCCC(C)(C)O 4c97b4050b6ca46c8a6d6f50ee53c58a [0,2,0,0,0,0|1,0,0]=3 5430 B12R0.104 CSCCC(C)OCCC(C)(C)C 85f7a63d736b4b3bd12e5025177cb67b [0,2,0,0,0,0|1,0,1]=4 5431 B12R0.104 CSCCC(C)OCCC(C)(C)O cf613de61d5b04f34512b42815a03633 [0,2,0,0,0,0|1,0,1]=4 5432 B12R0.104 CSSCC(=O)NCCC(C)(C)C 60a1e6e7b397ed57eb649f4b18c20702 [0,2,0,0,0,0|2,0,0]=4 5433 B12R0.104 CSSCC(=O)NCCC(C)(C)F 1e76eaf42d5ef386e7eb77a6b7f21c76 [0,2,0,0,0,0|2,0,0]=4 5434 B12R0.104 CSSCC(=O)NCCC(C)(C)O 7ea810ac90e49eb0ca0675fc446cd16f [0,2,0,0,0,0|2,0,0]=4 5435 B12R0.233 C#CCCCC(=O)NCCC(C)C d19b3f028c90ccb7b7b1cf6b92d829a4 [0,2,0,0,0,0|1,0,0]=3 5436 B12R0.233 C#CCCCC(=O)NCCC(C)O ebc58b0ea55a31ffac549fcf731590b9 [0,2,0,0,0,0|2,0,0]=4 5437 B12R0.233 C#CCCCC(=O)NCCN(C)C e4a72d969b33b6907d6685d95c8153ac [0,2,0,0,0,0|2,0,0]=4 5438 B12R0.233 C#CCCCC(=O)NCC[C@@H](C)O 39800d6505e1a83f8fb867f234a93919 [0,2,0,0,0,0|2,0,0]=4 5439 B12R0.233 C#CCCCC(=O)NCC[C@H](C)O a7d83d42efa40539e881b48e2cb88e11 [0,2,0,0,0,0|2,0,0]=4 5440 B12R0.233 C#CCCNC(=O)CCCC(C)C 106f3fb2d21f38f2d6e6dae137b29014 [0,2,0,0,0,0|1,0,1]=4 5441 B12R0.233 C#CCCNC(=O)NCCC(C)C 20b4f3e38f05f7f551f8a4cc27617e7f [0,2,0,0,0,0|1,0,1]=4 5442 B12R0.233 C#CCNCC(=O)NCCC(C)C 7b73eca7ed4866d557a844538b7459e0 [0,2,0,0,0,0|1,0,1]=4 5443 B12R0.233 C#CCOCC(=O)NCCC(C)C 0faf4a20b09f2c7c47d5bfb2e066ad95 [0,2,0,0,0,0|1,0,1]=4 5444 B12R0.233 C=CCCCC(=O)NCCC(C)C 3d703301e60b4181f77b3eb4b56b62fd [0,2,0,0,0,0|1,0,0]=3 5445 B12R0.233 C=CCCCC(=O)NCCC(C)O 0cb72a8e9448094642b78f075fdbe66d [0,2,0,0,0,0|2,0,0]=4 5446 B12R0.233 C=CCCCC(=O)NCCN(C)C a09b4ec209fbe7d11f8e12de7db12418 [0,2,0,0,0,0|2,0,0]=4 5447 B12R0.233 C=CCCCC(=O)NCC[C@@H](C)O bb3dbd0c012b6153bd97086ffc184aff [0,2,0,0,0,0|2,0,0]=4 5448 B12R0.233 C=CCCCC(=O)NCC[C@H](C)O c75a69a8a68a89cdff8c6f8872369557 [0,2,0,0,0,0|2,0,0]=4 5449 B12R0.233 C=CCCC[C@H](C)OCCC(C)C 649d5e6904f9aad990577a3a1cdd0aaa [0,2,0,0,0,0|1,0,1]=4 5450 B12R0.233 C=CCCNC(=O)CCCC(C)C 07e74e1cde2a44152ff6f7e4453a022e [0,2,0,0,0,0|1,0,1]=4 5451 B12R0.233 C=CCCNC(=O)NCCC(C)C eac8e7b053c5a63d79c06bb36dd870c5 [0,2,0,0,0,0|1,0,1]=4 5452 B12R0.233 C=CCOCC(=O)NCCC(C)C 39ba5eaf7449f407ec24ab141c964a53 [0,2,0,0,0,0|1,0,1]=4 5453 B12R0.233 C=CCSCC(=O)NCCC(C)C 1dce239b4c5af2f1feb17fd6734d08d2 [0,2,0,0,0,0|1,0,1]=4 5454 B12R0.233 CC#CCCC(=O)NCCC(C)C f88430a424e352f749d8c5a24d64428e [0,2,0,0,0,0|1,0,0]=3 5455 B12R0.233 CC#CCCC(=O)NCCC(C)O 6c068db52829af1ec3b6f1f628382577 [0,2,0,0,0,0|2,0,0]=4 5456 B12R0.233 CC#CCCC(=O)NCCN(C)C ee6f94f186c4561eae24773e9800e26a [0,2,0,0,0,0|2,0,0]=4 5457 B12R0.233 CC#CCCC(=O)NCC[C@@H](C)O 5a9f47980dff8a1133998eb661b5d036 [0,2,0,0,0,0|2,0,0]=4 5458 B12R0.233 CC#CCCC(=O)NCC[C@H](C)O 573171318269b4ba964c80bd4e7f9bf6 [0,2,0,0,0,0|2,0,0]=4 5459 B12R0.233 CC#CCNC(=O)CCCC(C)C 5c02f1b3297f4daf3839203793d8c57e [0,2,0,0,0,0|1,0,1]=4 5460 B12R0.233 CC#CCNC(=O)NCCC(C)C 8a207515afea95e6373f16ae285e39dc [0,2,0,0,0,0|1,0,1]=4 5461 B12R0.233 CC(C)C/C=C/C(=O)NCCCCl b16edf078d9562a4f22ecbb463ddffaf [0,2,0,0,0,0|1,0,1]=4 5462 B12R0.233 CC(C)C/C=C/C(=O)NCCCO 1e536a4ccb3cbb3143232f71436ef931 [0,2,0,0,0,0|1,0,1]=4 5463 B12R0.233 CC(C)CCCC(=O)NCCC#N e29a710d2dca9fc1905a844248f50152 [0,2,0,0,0,0|1,0,1]=4 5464 B12R0.233 CC(C)CCCC(=O)NCCCCl 88762c39ad265d299882b063f61fbad1 [0,2,0,0,0,0|1,0,0]=3 5465 B12R0.233 CC(C)CCCC(=O)NCCCO c20f612ce356641c28a2adb62f9dd742 [0,2,0,0,0,0|1,0,0]=3 5466 B12R0.233 CC(C)CCCC(=O)NCCON 8842ca458e64a71c8fd649f0120136bc [0,2,0,0,0,0|2,0,0]=4 5467 B12R0.233 CC(C)CCNC(=O)C#CCCO 289f25320845709441836b19e4696669 [0,2,0,0,0,0|1,0,1]=4 5468 B12R0.233 CC(C)CCNC(=O)CCCC#N 12c0d89b1209b250f4d71f19ee8150d3 [0,2,0,0,0,0|1,0,0]=3 5469 B12R0.233 CC(C)CCNC(=O)CCCC=O 4978f4b3c2978a933a0e05d0c2b33ddb [0,2,0,0,0,0|1,0,0]=3 5470 B12R0.233 CC(C)CCNC(=O)CCCCF bc0e19aaf411e10d31980935b61ede78 [0,2,0,0,0,0|1,0,0]=3 5471 B12R0.233 CC(C)CCNC(=O)CCCCO 37aef05490c0471e10b9d8e2fc1e95ee [0,2,0,0,0,0|1,0,0]=3 5472 B12R0.233 CC(C)CCNC(=O)CCCCS 8b7408ccc876b2a039fdbc34216209be [0,2,0,0,0,0|1,0,0]=3 5473 B12R0.233 CC(C)CCNC(=O)CNCC#N 64a257d9c077221fc91183ff6ab13ebd [0,2,0,0,0,0|1,0,1]=4 5474 B12R0.233 CC(C)CCNC(=O)CNCCBr 888a73c71a1bb1c5779883a98e529813 [0,2,0,0,0,0|1,0,0]=3 5475 B12R0.233 CC(C)CCNC(=O)CNCCF 3df83bb13e105b6ede51237b75c190ba [0,2,0,0,0,0|1,0,0]=3 5476 B12R0.233 CC(C)CCNC(=O)CNCCI 174e72805bfaf817fffdde2ef12693ed [0,2,0,0,0,0|1,0,0]=3 5477 B12R0.233 CC(C)CCNC(=O)CNCCO a1454ff27bb3e4fd01268397d72cd44f [0,2,0,0,0,0|1,0,0]=3 5478 B12R0.233 CC(C)CCNC(=O)CNCCS 10237950d348eee36d4ceda573eea93e [0,2,0,0,0,0|1,0,0]=3 5479 B12R0.233 CC(C)CCNC(=O)COCC#N c985b3573a7d650b9f3610562f084d92 [0,2,0,0,0,0|1,0,1]=4 5480 B12R0.233 CC(C)CCNC(=O)COCCF 0726752135094a3a788e71a50f80a248 [0,2,0,0,0,0|1,0,0]=3 5481 B12R0.233 CC(C)CCNC(=O)COCCO d115bc061278485f5307dd35c8ba38e7 [0,2,0,0,0,0|1,0,0]=3 5482 B12R0.233 CC(C)CCNC(=O)COCCS 41d391ef074fdf259fdd26ea80580e1d [0,2,0,0,0,0|1,0,0]=3 5483 B12R0.233 CC(C)CCNC(=O)CSCC#N e69a8818ed3eb1da4e165746bfcfcab1 [0,2,0,0,0,0|1,0,1]=4 5484 B12R0.233 CC(C)CCNC(=O)NCCC#N f0fc72a139ec035e368ae8a9804c075d [0,2,0,0,0,0|1,0,1]=4 5485 B12R0.233 CC(C)CCNC(=O)NCCCN a9a48d7ae345604821049565e5d00207 [0,2,0,0,0,0|1,0,0]=3 5486 B12R0.233 CC(C)CCNC(=O)NCCCO ff89a5acf7cc382904838a43707e944d [0,2,0,0,0,0|1,0,0]=3 5487 B12R0.233 CC(C)CCNC(=O)NCCON 10023e1a5b0b5e1d97504411e0d979c5 [0,2,0,0,0,0|2,0,0]=4 5488 B12R0.233 CC(C)CCNC(=S)NCCCN 39a6ea1ee8a976f3bf7f814f81dd2928 [0,2,0,0,0,0|1,1,0]=4 5489 B12R0.233 CC(C)CCNC(=S)NCCCO 98bfc4ee3532b58e8008d0523f17c46c [0,2,0,0,0,0|1,1,0]=4 5490 B12R0.233 CC(C)COCC(=O)NCCCCl 6f6d9d9ab57a29bd39f78357453d0ab3 [0,2,0,0,0,0|2,0,0]=4 5491 B12R0.233 CC(C)COCC(=O)NCCCO 989e8c7ca974bcdcaa61fbf03e9f0ba8 [0,2,0,0,0,0|2,0,0]=4 5492 B12R0.233 CC(C)OCCC(=O)NCCCCl b92eec2c388745a78c95b658455c9881 [0,2,0,0,0,0|2,0,0]=4 5493 B12R0.233 CC(C)OCCC(=O)NCCCO 28f807e02b92daafdbcc95512b2857c9 [0,2,0,0,0,0|2,0,0]=4 5494 B12R0.233 CC(C)SCCC(=O)NCCCCl a52953c4de744108292faeaaf04d9737 [0,2,0,0,0,0|2,0,0]=4 5495 B12R0.233 CC(C)SCCC(=O)NCCCO 3a441f308f6eec645c716b7d5142f402 [0,2,0,0,0,0|2,0,0]=4 5496 B12R0.233 CC(O)CCNC(=O)CCCC#N 073c59af7404833f0d0bcbf0758c2596 [0,2,0,0,0,0|2,0,0]=4 5497 B12R0.233 CC(O)CCNC(=O)CCCC=O 6a583ccc075247df707ed43a1a599f8b [0,2,0,0,0,0|2,0,0]=4 5498 B12R0.233 CC(O)CCNC(=O)CCCCF c6b91d36c62c0a43ee1f2a8025d44419 [0,2,0,0,0,0|2,0,0]=4 5499 B12R0.233 CC(O)CCNC(=O)CCCCO fc96ba5d1d490fb10314450eee30c14d [0,2,0,0,0,0|2,0,0]=4 5500 B12R0.233 CC(O)CCNC(=O)CCCCS 553e3ed68e6b9537662e3b1106bbd8ec [0,2,0,0,0,0|2,0,0]=4 5501 B12R0.233 CC(O)CCNC(=O)COCCO 323c2175ccff18152afe6d5dc9d5dc54 [0,2,0,0,0,0|2,0,0]=4 5502 B12R0.233 CC(O)CCNC(=O)COCCS 43d5372f189c3c9368fa49e6d9384205 [0,2,0,0,0,0|2,0,0]=4 5503 B12R0.233 CC(O)CCNC(=O)NCCCN 6b3de715bc4691278f4d6432200a2ab1 [0,2,0,0,0,0|2,0,0]=4 5504 B12R0.233 CC(O)CCNC(=O)NCCCO eb27376ea903d991866191d29e48a552 [0,2,0,0,0,0|2,0,0]=4 5505 B12R0.233 CC/C=C/CC(=O)NCCC(C)C e902a2d119267a7885775a653d63c474 [0,2,0,0,0,0|1,0,0]=3 5506 B12R0.233 CC/C=C/CC(=O)NCCC(C)O 884d6730a8d615b94b471ca32df07e6c [0,2,0,0,0,0|2,0,0]=4 5507 B12R0.233 CC/C=C/CC(=O)NCCN(C)C 373148985cbb4a40259d2b038966638d [0,2,0,0,0,0|2,0,0]=4 5508 B12R0.233 CC/C=C/CC(=O)NCC[C@@H](C)O 42c9db8d1920f05b1f52caa0a3e563e6 [0,2,0,0,0,0|2,0,0]=4 5509 B12R0.233 CC/C=C/CC(=O)NCC[C@H](C)O 30ebc6cececbc62267ec9fb7e000f01a [0,2,0,0,0,0|2,0,0]=4 5510 B12R0.233 CC/C=C\CC(=O)NCCC(C)C e5dcd8164e0669bb04bfdfc46ce63c69 [0,2,0,0,0,0|1,0,0]=3 5511 B12R0.233 CC/C=C\CC(=O)NCCC(C)O f13f2134ff0a2c8761c4296db12bf221 [0,2,0,0,0,0|2,0,0]=4 5512 B12R0.233 CC/C=C\CC(=O)NCCN(C)C dd5b2216c509d78dc9d6131ef43bd289 [0,2,0,0,0,0|2,0,0]=4 5513 B12R0.233 CC/C=C\CC(=O)NCC[C@@H](C)O 9d1af94e71a948265a697b50578f437a [0,2,0,0,0,0|2,0,0]=4 5514 B12R0.233 CC/C=C\CC(=O)NCC[C@H](C)O d00eaa5558788f13e6200dd38d631324 [0,2,0,0,0,0|2,0,0]=4 5515 B12R0.233 CC=CCCC(=O)NCCC(C)C 4d5f5ddbeb711263f88696f76e4173f4 [0,2,0,0,0,0|1,0,0]=3 5516 B12R0.233 CC=CCCC(=O)NCCC(C)O f890580bef310b0d924c31d9ec0797df [0,2,0,0,0,0|2,0,0]=4 5517 B12R0.233 CC=CCCC(=O)NCCN(C)C ccaf998f2876c0899e66154523fe1b81 [0,2,0,0,0,0|2,0,0]=4 5518 B12R0.233 CC=CCCC(=O)NCC[C@@H](C)O d6515c0646a2346d38a274926f707390 [0,2,0,0,0,0|2,0,0]=4 5519 B12R0.233 CC=CCCC(=O)NCC[C@H](C)O 0917eae188f4645846684b10d99d3db7 [0,2,0,0,0,0|2,0,0]=4 5520 B12R0.233 CC=CCNC(=O)CCCC(C)C 32e591bb8a0f1a5a95a20282da2c5114 [0,2,0,0,0,0|1,0,1]=4 5521 B12R0.233 CC=CCNC(=O)NCCC(C)C 45be3f2eb5dedbe1cf669d2696d42120 [0,2,0,0,0,0|1,0,1]=4 5522 B12R0.233 CCC#CCC(C)OCCC(C)C 8956abd3347b671edcff0c5fd3c1038f [0,2,0,0,0,0|1,0,1]=4 5523 B12R0.233 CCC/C=C/C(=O)NCCC(C)C 9e2c9b0fc08bafa0ba641acd055c9ac4 [0,2,0,0,0,0|1,0,0]=3 5524 B12R0.233 CCC/C=C/C(=O)NCCC(C)O a58113306e10e74efca9707310fe7330 [0,2,0,0,0,0|2,0,0]=4 5525 B12R0.233 CCC/C=C/C(=O)NCCN(C)C 6c9a2a79c49fe4c4c08060ed2926f786 [0,2,0,0,0,0|2,0,0]=4 5526 B12R0.233 CCC/C=C/C(=O)NCC[C@@H](C)O 6e939d298c85788de88a39b7696d316b [0,2,0,0,0,0|2,0,0]=4 5527 B12R0.233 CCC/C=C/C(=O)NCC[C@H](C)O f76dc1f187e930fd9c52c6ec6dd97261 [0,2,0,0,0,0|2,0,0]=4 5528 B12R0.233 CCC=CCC(=O)NCCC(C)C a8a0fafaa2442d66f0fe64a2177ae2af [0,2,0,0,0,0|1,0,0]=3 5529 B12R0.233 CCC=CCC(=O)NCCC(C)O a8d7767421561a501c22e4936aad7861 [0,2,0,0,0,0|2,0,0]=4 5530 B12R0.233 CCC=CCC(=O)NCCN(C)C 2ca84039407892a69046282affedf22c [0,2,0,0,0,0|2,0,0]=4 5531 B12R0.233 CCC=CCC(=O)NCC[C@@H](C)O c5054bd7e9c5dca909775a642b52b12e [0,2,0,0,0,0|2,0,0]=4 5532 B12R0.233 CCC=CCC(=O)NCC[C@H](C)O 98f728fec51df6d5a4e0ddfb838bcc11 [0,2,0,0,0,0|2,0,0]=4 5533 B12R0.233 CCCC#CC(=O)NCCC(C)C aba0541a3a32ebe01d71423d34605e06 [0,2,0,0,0,0|1,0,0]=3 5534 B12R0.233 CCCC#CC(=O)NCCC(C)O c9879d47b0b68ea588fc0cb9e92ab2a6 [0,2,0,0,0,0|2,0,0]=4 5535 B12R0.233 CCCC#CC(=O)NCCN(C)C 82d9190d55c59582e1439ee6780d3480 [0,2,0,0,0,0|2,0,0]=4 5536 B12R0.233 CCCC#CC(=O)NCC[C@@H](C)O 4cc3a0dca068c1fc31d26acf766ee45a [0,2,0,0,0,0|2,0,0]=4 5537 B12R0.233 CCCC#CC(=O)NCC[C@H](C)O 9a14843e46f1846c57dbd876c15ff852 [0,2,0,0,0,0|2,0,0]=4 5538 B12R0.233 CCCC=CC(=O)NCCC(C)C 9eca056cc6659f52d393388f9c73c926 [0,2,0,0,0,0|1,0,0]=3 5539 B12R0.233 CCCC=CC(=O)NCCC(C)O 0302c3f40f16d79a119656288bcf39b7 [0,2,0,0,0,0|2,0,0]=4 5540 B12R0.233 CCCC=CC(=O)NCCN(C)C 5572c2e2e7eaed4015aa7447e3e91f3e [0,2,0,0,0,0|2,0,0]=4 5541 B12R0.233 CCCC=CC(=O)NCC[C@@H](C)O 52dc7c00e608c664654afa54a9cbd952 [0,2,0,0,0,0|2,0,0]=4 5542 B12R0.233 CCCC=CC(=O)NCC[C@H](C)O 0b539eddac77bd29f7550bc109ddc571 [0,2,0,0,0,0|2,0,0]=4 5543 B12R0.233 CCCCCC(=O)CNCC(C)C 2f8ffa9b1e7428d9610d9c9792423e52 [0,2,0,0,0,0|2,0,0]=4 5544 B12R0.233 CCCCCC(=O)COCC(C)C 27a79f1baef076d63996803cc7e04320 [0,2,0,0,0,0|2,0,0]=4 5545 B12R0.233 CCCCCC(=O)NCCC(C)C de5d4775851c3f556e0a37cd69bd6694 [0,2,0,0,0,0|1,0,0]=3 5546 B12R0.233 CCCCCC(=O)NCCC(C)O 7f60771b66ae1bec642b09c0c06b499c [0,2,0,0,0,0|2,0,0]=4 5547 B12R0.233 CCCCCC(=O)NCCN(C)C e3528ee47645cff7ade846a5a12c3ed5 [0,2,0,0,0,0|2,0,0]=4 5548 B12R0.233 CCCCCC(=O)NCC[C@@H](C)O f61ba65d8dcacaf44bfbb83aa992ca7d [0,2,0,0,0,0|2,0,0]=4 5549 B12R0.233 CCCCCC(=O)NCC[C@H](C)O c876e519826877ab888e09489622daa0 [0,2,0,0,0,0|2,0,0]=4 5550 B12R0.233 CCCCCC(=O)OCOC(C)C 90c7ba95c11a934d21db25600c8d1a97 [0,2,0,0,0,0|1,0,0]=3 5551 B12R0.233 CCCCCC(C)OCCC(C)C c52701f546739edbc5422405b5075256 [0,2,0,0,0,0|1,0,1]=4 5552 B12R0.233 CCCCC[C@@H](C)OCCC(C)C b605bfe2311a91cb1ab8ad3b09e7b3bc [0,2,0,0,0,0|1,0,1]=4 5553 B12R0.233 CCCCC[C@H](C)OCCC(C)C 1fbf45b04ff7ed87d7ca616d67fccaff [0,2,0,0,0,0|1,0,1]=4 5554 B12R0.233 CCCCNC(=O)/C=C/CC(C)C 4c1cdaee1f0b84576ac43e4e774010e6 [0,2,0,0,0,0|1,0,1]=4 5555 B12R0.233 CCCCNC(=O)CCCC(C)C 0965007a9c047a85020048af373a262d [0,2,0,0,0,0|1,0,0]=3 5556 B12R0.233 CCCCNC(=O)CCCN(C)C 94b6d3bbc88655c0e134ff208518b1ea [0,2,0,0,0,0|2,0,0]=4 5557 B12R0.233 CCCCNC(=O)CCOC(C)C 64a466e693c8d5e9be5d02fa3d238246 [0,2,0,0,0,0|2,0,0]=4 5558 B12R0.233 CCCCNC(=O)CCSC(C)C e64f717443aa5b8af4509f8138fe793d [0,2,0,0,0,0|2,0,0]=4 5559 B12R0.233 CCCCNC(=O)CNCC(C)C 43b513730af4549e4a2644555575af12 [0,2,0,0,0,0|2,0,0]=4 5560 B12R0.233 CCCCNC(=O)COCC(C)C 6deb7b6201689d1dd5e9a7d407985ef9 [0,2,0,0,0,0|2,0,0]=4 5561 B12R0.233 CCCCNC(=O)NCCC(C)C 0d4b76b405ba08e28ac6933883b83adf [0,2,0,0,0,0|1,0,0]=3 5562 B12R0.233 CCCCNC(=O)NCCC(C)O 8e5661c4799481cb779586081058d0ed [0,2,0,0,0,0|2,0,0]=4 5563 B12R0.233 CCCCNC(=O)NCCN(C)C 01459eb6c81a99c9e0b84c693553a10e [0,2,0,0,0,0|2,0,0]=4 5564 B12R0.233 CCCCNC(=O)NCC[C@@H](C)O 78144d3107e1577bb145768ea57329e1 [0,2,0,0,0,0|2,0,0]=4 5565 B12R0.233 CCCCNC(=O)NCC[C@H](C)O 28ceddf3670b7e60886667a11de28c9b [0,2,0,0,0,0|2,0,0]=4 5566 B12R0.233 CCCCNC(=S)NCCC(C)C 20bcb369fee07c53e19ce672782813eb [0,2,0,0,0,0|1,1,0]=4 5567 B12R0.233 CCCCOC(=O)CNCC(C)C 18ee55af0f5e4989b08d6d06dff65834 [0,2,0,0,0,0|2,0,0]=4 5568 B12R0.233 CCCCOC(=O)COCC(C)C 2b79ec7d20e1e6de673410cca3ca7180 [0,2,0,0,0,0|2,0,0]=4 5569 B12R0.233 CCCCOC(=O)OCOC(C)C 8cccdd920479090c478f3560e8ca657e [0,2,0,0,0,0|1,0,0]=3 5570 B12R0.233 CCCNCC(=O)NCCC(C)C 4c6729a39c4bb8f3b3ed46607e6d781b [0,2,0,0,0,0|1,0,0]=3 5571 B12R0.233 CCCOCC(=O)NCCC(C)C 9f3040ada95e987a25a60d091b7ee155 [0,2,0,0,0,0|1,0,0]=3 5572 B12R0.233 CCCOCC(=O)NCCC(C)O ad3f2c49e83a2bfc5474f1a9c9282295 [0,2,0,0,0,0|2,0,0]=4 5573 B12R0.233 CCCOCC(=O)NCCN(C)C 5b73d387835cbab7e95d2f805685109f [0,2,0,0,0,0|2,0,0]=4 5574 B12R0.233 CCCOCC(=O)NCC[C@@H](C)O f67869fd04a7f96ae43e9cee97ae3ce9 [0,2,0,0,0,0|2,0,0]=4 5575 B12R0.233 CCCOCC(=O)NCC[C@H](C)O 3118ed4f273c513d65cbac6bef4aaaa6 [0,2,0,0,0,0|2,0,0]=4 5576 B12R0.233 CCCOCC(C)OCCC(C)C 21ac25f6de34fa5e59bce4dc66e00790 [0,2,0,0,0,0|1,0,1]=4 5577 B12R0.233 CCCSCC(=O)NCCC(C)C 24e8fe4a60f6ee2d5f4357fbf4c2332c [0,2,0,0,0,0|1,0,0]=3 5578 B12R0.233 CCCSCC(=O)NCCC(C)O e7acda73f9a77b9ebd64703f898404d7 [0,2,0,0,0,0|2,0,0]=4 5579 B12R0.233 CCCSCC(=O)NCCN(C)C 37082b4e15b2e73c5cef553e3cb8d339 [0,2,0,0,0,0|2,0,0]=4 5580 B12R0.233 CCCSCC(=O)NCC[C@@H](C)O 5ee2981a70455c8b37a5188490b182d0 [0,2,0,0,0,0|2,0,0]=4 5581 B12R0.233 CCCSCC(=O)NCC[C@H](C)O 8ccdfd7fcd9776ac001fa5bd6926bec0 [0,2,0,0,0,0|2,0,0]=4 5582 B12R0.233 CCO/C=C/C(=O)NCCC(C)C 5d7e80c00fae19f302d9afe22478fcdd [0,2,0,0,0,0|1,0,1]=4 5583 B12R0.233 CCOC/C=C(\C)/CCCC(C)C a95aa8b84cfed5a75294efb32aaba1c0 [0,2,0,0,0,0|2,0,0]=4 5584 B12R0.233 CCOC=CC(=O)NCCC(C)C 9795f8c9ce92addc62953c9cd92b0838 [0,2,0,0,0,0|1,0,1]=4 5585 B12R0.233 CCOCCC(=O)NCCC(C)C 6af07abbb3e20b7f03d7eded7e846581 [0,2,0,0,0,0|1,0,0]=3 5586 B12R0.233 CCOCCC(=O)NCCC(C)O 779ea8a6c5cee2c4bcc3f75e8227c326 [0,2,0,0,0,0|2,0,0]=4 5587 B12R0.233 CCOCCC(=O)NCCN(C)C 093e35c33373fd7ed9b08e781c5fcca9 [0,2,0,0,0,0|2,0,0]=4 5588 B12R0.233 CCOCCC(=O)NCC[C@@H](C)O 85b3309015541d5b28d97b3336b92e63 [0,2,0,0,0,0|2,0,0]=4 5589 B12R0.233 CCOCCC(=O)NCC[C@H](C)O f8b2075d522488f08aa96a4c8ca0af72 [0,2,0,0,0,0|2,0,0]=4 5590 B12R0.233 CCSCCC(=O)NCCC(C)C 213cc1d924c0e9194a1330d78bd891fe [0,2,0,0,0,0|1,0,0]=3 5591 B12R0.233 CCSCCC(=O)NCCC(C)O e40ab069d458728608bb81d31c928380 [0,2,0,0,0,0|2,0,0]=4 5592 B12R0.233 CCSCCC(=O)NCCN(C)C 51153a982401114700fd3edeb26be517 [0,2,0,0,0,0|2,0,0]=4 5593 B12R0.233 CCSCCC(=O)NCC[C@@H](C)O 4768ec63e576cb2a1eb46363ab96bf4a [0,2,0,0,0,0|2,0,0]=4 5594 B12R0.233 CCSCCC(=O)NCC[C@H](C)O f4db411571c27ae32e6b108f445ccd38 [0,2,0,0,0,0|2,0,0]=4 5595 B12R0.233 CN(C)CCCC(=O)NCCCCl 229fdfd35f0b70238a9735542b09a5e3 [0,2,0,0,0,0|2,0,0]=4 5596 B12R0.233 CN(C)CCCC(=O)NCCCO 235109ebfde1185be6cc0d75efff4e33 [0,2,0,0,0,0|2,0,0]=4 5597 B12R0.233 CN(C)CCNC(=O)CCCC#N 74ea09955ccdfe910a2a95ecb1d6a26e [0,2,0,0,0,0|2,0,0]=4 5598 B12R0.233 CN(C)CCNC(=O)CCCC=O 211afa6b77d397055628682669c4934c [0,2,0,0,0,0|2,0,0]=4 5599 B12R0.233 CN(C)CCNC(=O)CCCCF 941ca64a37f51e3539ea672958bb567f [0,2,0,0,0,0|2,0,0]=4 5600 B12R0.233 CN(C)CCNC(=O)CCCCO df12d993f13cefcf259f0f88261928fe [0,2,0,0,0,0|2,0,0]=4 5601 B12R0.233 CN(C)CCNC(=O)CCCCS 3f78cfe1d94635f1543a87c00893408d [0,2,0,0,0,0|2,0,0]=4 5602 B12R0.233 CN(C)CCNC(=O)COCCO 5c36ec2dd3134f28faaea260382d37d3 [0,2,0,0,0,0|2,0,0]=4 5603 B12R0.233 CN(C)CCNC(=O)COCCS 7b0cb3aa5e5e702bc0d1554e1230dccc [0,2,0,0,0,0|2,0,0]=4 5604 B12R0.233 CN(C)CCNC(=O)NCCCN 72cc27d93a03be6d18ef983568f92bb7 [0,2,0,0,0,0|2,0,0]=4 5605 B12R0.233 CN(C)CCNC(=O)NCCCO 8325f8a8ead7c4a4970b6c6ef5537635 [0,2,0,0,0,0|2,0,0]=4 5606 B12R0.233 COC/C=C/C(=O)NCCC(C)C df4bd3ff02fc8aae46fa155f00a7cb19 [0,2,0,0,0,0|1,0,1]=4 5607 B12R0.233 COCC#CC(=O)NCCC(C)C b1bb5be628d130afacc3094f2d8f9688 [0,2,0,0,0,0|1,0,1]=4 5608 B12R0.233 COCC=CC(=O)NCCC(C)C 8153a46e4f8281e495fea0fbffd4591f [0,2,0,0,0,0|1,0,1]=4 5609 B12R0.233 COCCCC(=O)NCCC(C)C 073e9422ca46ccf64126e3e1f16edd8c [0,2,0,0,0,0|1,0,0]=3 5610 B12R0.233 COCCCC(=O)NCCC(C)O 1a8949da1b7f88ba3660bfd31df0701d [0,2,0,0,0,0|2,0,0]=4 5611 B12R0.233 COCCCC(=O)NCCN(C)C 6aa830f37aa664fafe70f78ced0e14c4 [0,2,0,0,0,0|2,0,0]=4 5612 B12R0.233 COCCCC(=O)NCC[C@@H](C)O 1a0fa5cb47deb2c60cd05f6fc65bbe16 [0,2,0,0,0,0|2,0,0]=4 5613 B12R0.233 COCCCC(=O)NCC[C@H](C)O c806fc4dc7aeeb15c88bc45bbac897d3 [0,2,0,0,0,0|2,0,0]=4 5614 B12R0.233 COCCNC(=O)/C=C/CC(C)C abcc27e38d13a6bce6f0e01356684857 [0,2,0,0,0,0|1,0,1]=4 5615 B12R0.233 COCCNC(=O)CCCC(C)C 9d5331a5406a618142dafc16193236d4 [0,2,0,0,0,0|1,0,0]=3 5616 B12R0.233 COCCNC(=O)CCCN(C)C 9c9d9db952095f01ae83d77eb731cf54 [0,2,0,0,0,0|2,0,0]=4 5617 B12R0.233 COCCNC(=O)CCOC(C)C 80f101909398e7626269cb015383dd5b [0,2,0,0,0,0|2,0,0]=4 5618 B12R0.233 COCCNC(=O)CCSC(C)C 982e62334da99cc5162b0a575e83130a [0,2,0,0,0,0|2,0,0]=4 5619 B12R0.233 COCCNC(=O)CNCC(C)C 72150697976b4e4bf442cc2c6b5f232f [0,2,0,0,0,0|2,0,0]=4 5620 B12R0.233 COCCNC(=O)COCC(C)C 8b7b5c34925bcf19d3d69f004d956045 [0,2,0,0,0,0|2,0,0]=4 5621 B12R0.233 COCCNC(=O)NCCC(C)C 9a87504c4fb83966f8b36a2c5b2fa6b8 [0,2,0,0,0,0|1,0,0]=3 5622 B12R0.233 COCCNC(=O)NCCC(C)O 82318fa6658e7173a0ba1fbed55b825d [0,2,0,0,0,0|2,0,0]=4 5623 B12R0.233 COCCNC(=O)NCCN(C)C fd241ede4e928479d69406f0e3e3b20f [0,2,0,0,0,0|2,0,0]=4 5624 B12R0.233 COCCNC(=O)NCC[C@@H](C)O 1b99a3565376f15dbdd23d55fe3b94e0 [0,2,0,0,0,0|2,0,0]=4 5625 B12R0.233 COCCNC(=O)NCC[C@H](C)O 45822785e2a487967a1f97c3f7ff7e41 [0,2,0,0,0,0|2,0,0]=4 5626 B12R0.233 COCCNC(=S)NCCC(C)C e820ed000fea5a758763479e01eefc6b [0,2,0,0,0,0|1,1,0]=4 5627 B12R0.233 COCCOC(=O)CNCC(C)C 5e0b6daf7642b58115ffa12751e9a31e [0,2,0,0,0,0|2,0,0]=4 5628 B12R0.233 COCCOC(=O)COCC(C)C d5c7c21f859ca32c21d012b34200fbe4 [0,2,0,0,0,0|2,0,0]=4 5629 B12R0.233 COCOCC(=O)NCCC(C)C 8a944cf1bb4d0676b2b634cfb6e0dc69 [0,2,0,0,0,0|1,0,0]=3 5630 B12R0.233 CSCCCC(=O)NCCC(C)C 4b5d5b3409ce52118b06bb4af80cc6f1 [0,2,0,0,0,0|1,0,0]=3 5631 B12R0.233 CSCCCC(=O)NCCC(C)O de6ff54ef59b83861bf253a1578b5980 [0,2,0,0,0,0|2,0,0]=4 5632 B12R0.233 CSCCCC(=O)NCCN(C)C d44178e5171040d08863d901947b2d19 [0,2,0,0,0,0|2,0,0]=4 5633 B12R0.233 CSCCCC(=O)NCC[C@@H](C)O 45e436cbb52e40656a978a83fb7ce47b [0,2,0,0,0,0|2,0,0]=4 5634 B12R0.233 CSCCCC(=O)NCC[C@H](C)O e16c879f2c235e4d9cf5d14b16b4ffd9 [0,2,0,0,0,0|2,0,0]=4 5635 B12R0.233 CSCCNC(=O)/C=C/CC(C)C e0b76bb176bf59ccad9a41932b401979 [0,2,0,0,0,0|1,0,1]=4 5636 B12R0.233 CSCCNC(=O)CCCC(C)C a0e2d6a236574048a00b2020e11c8f86 [0,2,0,0,0,0|1,0,0]=3 5637 B12R0.233 CSCCNC(=O)CCCN(C)C d5a24f0713c6e0f8e9235b6e97079e20 [0,2,0,0,0,0|2,0,0]=4 5638 B12R0.233 CSCCNC(=O)CCOC(C)C e33f893c76a4cf057d5db0baf9cc5c88 [0,2,0,0,0,0|2,0,0]=4 5639 B12R0.233 CSCCNC(=O)CCSC(C)C 1c6460e8fb2946300403040e113603aa [0,2,0,0,0,0|2,0,0]=4 5640 B12R0.233 CSCCNC(=O)COCC(C)C 0270ba33bdc323a42eade3deba5252a3 [0,2,0,0,0,0|2,0,0]=4 5641 B12R0.233 CSCCNC(=O)NCCC(C)C b0c1104c39c5c76f238018dfe7214498 [0,2,0,0,0,0|1,0,0]=3 5642 B12R0.233 CSCCNC(=O)NCCC(C)O 2923a10681a4285100a63a6e7903947a [0,2,0,0,0,0|2,0,0]=4 5643 B12R0.233 CSCCNC(=O)NCCN(C)C 6bb7f32064ac3c322ff048502d4d3084 [0,2,0,0,0,0|2,0,0]=4 5644 B12R0.233 CSCCNC(=O)NCC[C@@H](C)O acbf1f05eae44ef48818f2fe7d7c51fc [0,2,0,0,0,0|2,0,0]=4 5645 B12R0.233 CSCCNC(=O)NCC[C@H](C)O db62c43310d694df02a67e3f2e036c91 [0,2,0,0,0,0|2,0,0]=4 5646 B12R0.233 CSCCNC(=S)NCCC(C)C 841ae6ab9a3654e380956c87fda31a86 [0,2,0,0,0,0|1,1,0]=4 5647 B12R0.233 CSSCCC(=O)NCCC(C)C efa415c94f0c7817c8fdb0edab7a7417 [0,2,0,0,0,0|1,0,0]=3 5648 B12R0.233 CSSCCC(=O)NCCC(C)O 2b85f0a2b88f47a70b467637db9617c1 [0,2,0,0,0,0|2,0,0]=4 5649 B12R0.233 CSSCCC(=O)NCCN(C)C 1da21e635a3c0d7e0004059abe9eb1bd [0,2,0,0,0,0|2,0,0]=4 5650 B12R0.233 CSSCCC(=O)NCC[C@@H](C)O eba39e1796e4d65d20d5aa9e64f8db6d [0,2,0,0,0,0|2,0,0]=4 5651 B12R0.233 CSSCCC(=O)NCC[C@H](C)O cc481cf2175caa571b6c81e9893f9cfa [0,2,0,0,0,0|2,0,0]=4 5652 B12R0.233 C[C@@H](O)CCNC(=O)CCCC#N c758365732f252a8eac7371b89f548cc [0,2,0,0,0,0|2,0,0]=4 5653 B12R0.233 C[C@@H](O)CCNC(=O)CCCC=O 8c34c9208c06b9654e2525a8cfa80b98 [0,2,0,0,0,0|2,0,0]=4 5654 B12R0.233 C[C@@H](O)CCNC(=O)CCCCF 052111f53ea44694adf27c25f96fb287 [0,2,0,0,0,0|2,0,0]=4 5655 B12R0.233 C[C@@H](O)CCNC(=O)CCCCO 57c70db0a9df69fc17d68739b1e8fc90 [0,2,0,0,0,0|2,0,0]=4 5656 B12R0.233 C[C@@H](O)CCNC(=O)CCCCS 5d49fbeb2ff588cb9bd569051128c5e5 [0,2,0,0,0,0|2,0,0]=4 5657 B12R0.233 C[C@@H](O)CCNC(=O)COCCO 3389f035a8030a3564ba544ce6293ee3 [0,2,0,0,0,0|2,0,0]=4 5658 B12R0.233 C[C@@H](O)CCNC(=O)COCCS 7d21fc08ace771c5ea27119222d2846c [0,2,0,0,0,0|2,0,0]=4 5659 B12R0.233 C[C@@H](O)CCNC(=O)NCCCN 24d205ae1506a5f5365ccd07085641ef [0,2,0,0,0,0|2,0,0]=4 5660 B12R0.233 C[C@@H](O)CCNC(=O)NCCCO 0089ca314d468a9f1a4e898c848f81e4 [0,2,0,0,0,0|2,0,0]=4 5661 B12R0.233 C[C@H](O)CCNC(=O)CCCC#N 2cd1a9a1917ed8d1d5cd1e35d60b8abe [0,2,0,0,0,0|2,0,0]=4 5662 B12R0.233 C[C@H](O)CCNC(=O)CCCC=O ecc8f4ff390ba9a271b2adeff47bf6a0 [0,2,0,0,0,0|2,0,0]=4 5663 B12R0.233 C[C@H](O)CCNC(=O)CCCCF 137bc9fb5f9f424b50bc64cd96c2f069 [0,2,0,0,0,0|2,0,0]=4 5664 B12R0.233 C[C@H](O)CCNC(=O)CCCCO 3b9dc55dd1087997e2b6aa917b2c78d9 [0,2,0,0,0,0|2,0,0]=4 5665 B12R0.233 C[C@H](O)CCNC(=O)CCCCS 53973a03515d1da5c3a3a7a033c533d0 [0,2,0,0,0,0|2,0,0]=4 5666 B12R0.233 C[C@H](O)CCNC(=O)COCCO d693f5a35a2c67162de7502dfc5336f8 [0,2,0,0,0,0|2,0,0]=4 5667 B12R0.233 C[C@H](O)CCNC(=O)COCCS 5ba008ba1e78a3a0f4b409f1dfb672f4 [0,2,0,0,0,0|2,0,0]=4 5668 B12R0.233 C[C@H](O)CCNC(=O)NCCCN 555f01fd8b74762d9fc3f3c706ccc2ba [0,2,0,0,0,0|2,0,0]=4 5669 B12R0.233 C[C@H](O)CCNC(=O)NCCCO 987b69e5424b1a055a5a319f56eb8479 [0,2,0,0,0,0|2,0,0]=4 5670 B12R0.265 C#CC(CC)OCOC(=O)CCC 6b379529c21b8d10162ec8645eeb2f6e [0,2,0,0,0,0|1,0,1]=4 5671 B12R0.265 C=CC(CC)OCOC(=O)CCC de790f2eb8c32865688086bf503dea89 [0,2,0,0,0,0|1,0,1]=4 5672 B12R0.265 C=C[C@@H](CO)NCOC(=O)CCC 7fb12e6a856d6531acb62d694879bc5e [0,2,0,0,0,0|1,0,1]=4 5673 B12R0.265 CCC(CC)CCNC(=O)CCF 160db127152754e46b3991a2a6ddd9c9 [0,2,0,0,0,0|2,0,0]=4 5674 B12R0.265 CCC(CC)CCNC(=O)CCO 01bc0b21a910894dbd7f41bb8c317e41 [0,2,0,0,0,0|2,0,0]=4 5675 B12R0.265 CCC(CC)CCNC(=O)CCS 9089a5ac3d1e633fcfd005d1a7c34b1b [0,2,0,0,0,0|2,0,0]=4 5676 B12R0.265 CCC(CC)CCNC(=O)COC 61b7fe17ba21b4575046c60e1def9af4 [0,2,0,0,0,0|2,0,0]=4 5677 B12R0.265 CCC(CC)CCNC(=O)CSC 365cbf3d3cfeeaa9a07e59fbe3bfad56 [0,2,0,0,0,0|2,0,0]=4 5678 B12R0.265 CCCC(=O)CNCC(CC)CC e371b9bcb9745b36c6f44c7ab735c648 [0,2,0,0,0,0|2,0,0]=4 5679 B12R0.265 CCCC(=O)CNCC(CC)CO 64bd11a2e8bcdfb2320d6447b0738a5e [0,2,0,0,0,0|2,0,0]=4 5680 B12R0.265 CCCC(=O)CNCC(CO)CO 9d6ac5b69d0b626117e2f2fdc953ea38 [0,2,0,0,0,0|2,0,0]=4 5681 B12R0.265 CCCC(=O)CNCC(OC)OC 37cd2d153bff7a66576d7b649f77f1ee [0,2,0,0,0,0|2,0,0]=4 5682 B12R0.265 CCCC(=O)CNC[C@H](CO)OC 691267c7a9ebd79f80dce85f2f2f0245 [0,2,0,0,0,0|2,0,0]=4 5683 B12R0.265 CCCC(=O)COCC(CBr)CBr e02dabd679fb30cbdb94b377b60de73d [0,2,0,0,0,0|2,0,0]=4 5684 B12R0.265 CCCC(=O)COCC(CC)CC e89c7bb385eb9d1a9d7a8e762e12df91 [0,2,0,0,0,0|2,0,0]=4 5685 B12R0.265 CCCC(=O)COCC(CC)OC 6e233643b7b43c653d9f428480e2c6c4 [0,2,0,0,0,0|2,0,0]=4 5686 B12R0.265 CCCC(=O)COCC(OC)OC a140c73b0c723ee3014311dad7e86138 [0,2,0,0,0,0|2,0,0]=4 5687 B12R0.265 CCCC(=O)NCCC(CC)CC 6a60f9c889aa096eb5242ef716e00e9b [0,2,0,0,0,0|1,0,0]=3 5688 B12R0.265 CCCC(=O)NCCC(CO)CO dcc6dfb076e827f8ed05b48e4e074650 [0,2,0,0,0,0|1,0,0]=3 5689 B12R0.265 CCCC(=O)NCCC(OC)OC dc28ea97fd229118fd2e3ee35776e90b [0,2,0,0,0,0|1,0,0]=3 5690 B12R0.265 CCCC(=O)NCCN(CC)CC 63508abde2d8a8d698a26c073e701b29 [0,2,0,0,0,0|2,0,0]=4 5691 B12R0.265 CCCC(=O)OCNC(CC)CC 6143bef6f4db6b3e7d5a18d06ab79ef2 [0,2,0,0,0,0|1,0,0]=3 5692 B12R0.265 CCCC(=O)OCNC(CC)CO a4e293d112fde9c4b82292a5bbf71933 [0,2,0,0,0,0|1,0,0]=3 5693 B12R0.265 CCCC(=O)OCNC(CO)CO d7df1e66d939d9693e85e075b4bc05fa [0,2,0,0,0,0|1,0,0]=3 5694 B12R0.265 CCCC(=O)OCN[C@@H](CC)CO 4cd80d0d22c849ea0e2e54d50049edc3 [0,2,0,0,0,0|1,0,0]=3 5695 B12R0.265 CCCC(=O)OCN[C@H](CC)CO b5ae34e73729612a1418b4e0441f0ac9 [0,2,0,0,0,0|1,0,0]=3 5696 B12R0.265 CCCC(=O)OCOC(CBr)CBr 3e939ac81bcf8cea534c5adf7c74b514 [0,2,0,0,0,0|1,0,0]=3 5697 B12R0.265 CCCC(=O)OCOC(CC)CC 7fa9cfbafc955a018301e9f53c6cb545 [0,2,0,0,0,0|1,0,0]=3 5698 B12R0.265 CCCC(=O)OCOC(CCl)CBr a65bb2951ee0754e741ae1d0128983e2 [0,2,0,0,0,0|1,0,0]=3 5699 B12R0.265 CCCC(=O)OCOC(CCl)CCl 291db14237446e7ddf5a4048f7c7710d [0,2,0,0,0,0|1,0,0]=3 5700 B12R0.265 CCCC(=O)OCOC(CF)CF 8a5749d6f7fa3ab452e53db684ebd0a4 [0,2,0,0,0,0|1,0,0]=3 5701 B12R0.265 CCCC(=O)OCO[C@@H](CCl)CI 2f48a46d9d1026c1767d7fe812e0bc98 [0,2,0,0,0,0|1,0,0]=3 5702 B12R0.265 CCCC(=O)OCO[C@H](CCl)CI 6e241dcc9d704c1f8b2390d515d68547 [0,2,0,0,0,0|1,0,0]=3 5703 B12R0.265 CCCC(=S)OCCC(OC)OC 6b4b60cceccafdc6f56214f3f64d50e7 [0,2,0,0,0,0|0,1,0]=3 5704 B12R0.265 CCCC(C)OCCC(OC)OC 678133474129f9413e6a444cce299359 [0,2,0,0,0,0|1,0,1]=4 5705 B12R0.265 CCC[C@@H](C)OCCC(OC)OC d5f2dfcc367b61d942ba1202ea2a2911 [0,2,0,0,0,0|1,0,1]=4 5706 B12R0.265 CCC[C@H](C)OCCC(OC)OC d31ec7823b3a8d001fcba856d97846da [0,2,0,0,0,0|1,0,1]=4 5707 B12R0.265 CCOC(=O)OCNC(CC)CC fa9635ca4f0a6091f7c38392fd9f2db8 [0,2,0,0,0,0|2,0,0]=4 5708 B12R0.265 CCOC(=O)OCNC(CC)CO b40b732d37fbef15deb4be8c19c3b9f0 [0,2,0,0,0,0|2,0,0]=4 5709 B12R0.265 CCOC(=O)OCNC(CO)CO 64c72c1b6a1e7ac8fd01c6325d5543e4 [0,2,0,0,0,0|2,0,0]=4 5710 B12R0.265 CCOC(=O)OCN[C@@H](CC)CO 498643e2c07ecf6b035f5dc435e5bc07 [0,2,0,0,0,0|2,0,0]=4 5711 B12R0.265 CCOC(=O)OCN[C@H](CC)CO 0a3246bcfe91c7c623a9f27fe64ebea4 [0,2,0,0,0,0|2,0,0]=4 5712 B12R0.265 CCOC(=O)OCOC(CBr)CBr ae9644594df0be5f341cb0cbfeb0b96c [0,2,0,0,0,0|2,0,0]=4 5713 B12R0.265 CCOC(=O)OCOC(CC)CC ead9f4f9a988dbc6ae711041c62b3525 [0,2,0,0,0,0|2,0,0]=4 5714 B12R0.265 CCOC(=O)OCOC(CCl)CBr 2423264f0da828958060bb1061d8a656 [0,2,0,0,0,0|2,0,0]=4 5715 B12R0.265 CCOC(=O)OCOC(CCl)CCl 643600f8840652a31e1f07527bf09960 [0,2,0,0,0,0|2,0,0]=4 5716 B12R0.265 CCOC(=O)OCOC(CF)CF 33e85fe8e463cc339b7ac646a8b83325 [0,2,0,0,0,0|2,0,0]=4 5717 B12R0.265 CCOC(=O)OCO[C@@H](CCl)CI ef87ce6631d6de1967693c05f054e6e2 [0,2,0,0,0,0|2,0,0]=4 5718 B12R0.265 CCOC(=O)OCO[C@H](CCl)CI ab967cc7e00ed00ffdae0c65ffcc5733 [0,2,0,0,0,0|2,0,0]=4 5719 B12R0.265 CCSC(=O)OCNC(CC)CC cd24d341695c092def9d13dbf84e22af [0,2,0,0,0,0|2,0,0]=4 5720 B12R0.265 CCSC(=O)OCNC(CC)CO bf95d730834d13563309f7d60fde4b4e [0,2,0,0,0,0|2,0,0]=4 5721 B12R0.265 CCSC(=O)OCNC(CO)CO 28bf1e02de92d1f9942734e39924ceb7 [0,2,0,0,0,0|2,0,0]=4 5722 B12R0.265 CCSC(=O)OCN[C@@H](CC)CO 856ccca3ecccb55bc3a1df63aafaa28b [0,2,0,0,0,0|2,0,0]=4 5723 B12R0.265 CCSC(=O)OCN[C@H](CC)CO 40ae8a5bbc40ab4f5377c3d3423ea3f2 [0,2,0,0,0,0|2,0,0]=4 5724 B12R0.265 CCSC(=O)OCOC(CBr)CBr c7c8f73e3b0419218218da0f5a18602e [0,2,0,0,0,0|2,0,0]=4 5725 B12R0.265 CCSC(=O)OCOC(CC)CC 6c294a867b32dc104da37645c30fa882 [0,2,0,0,0,0|2,0,0]=4 5726 B12R0.265 CCSC(=O)OCOC(CCl)CBr ffb82492ca6eec1cba76de326c068a7e [0,2,0,0,0,0|2,0,0]=4 5727 B12R0.265 CCSC(=O)OCOC(CCl)CCl 9b4b286ba97e97959867204c2f4b1381 [0,2,0,0,0,0|2,0,0]=4 5728 B12R0.265 CCSC(=O)OCO[C@@H](CCl)CI ef2eed69a3c23641978c0355f08315ca [0,2,0,0,0,0|2,0,0]=4 5729 B12R0.265 CCSC(=O)OCO[C@H](CCl)CI ade1a2a359445173479cbbd7f73d1868 [0,2,0,0,0,0|2,0,0]=4 5730 B12R0.265 COC(CCNC(=O)CCF)OC bf5742a9828f65cb0bc71bba50ae49e8 [0,2,0,0,0,0|2,0,0]=4 5731 B12R0.265 COC(CCNC(=O)CCO)OC 11ecee1a760173402504b5fabe2683bb [0,2,0,0,0,0|2,0,0]=4 5732 B12R0.265 COC(CCNC(=O)CCS)OC 85d944ee2aabe70d571c9a9787097e8f [0,2,0,0,0,0|2,0,0]=4 5733 B12R0.265 COC(CCNC(=O)CSC)OC 65684a59c30625a277454ffbfdf55342 [0,2,0,0,0,0|2,0,0]=4 5734 B12R0.265 COCC(=O)NCCC(CO)CO 18d6a9d272ffd4ea9d284b2a46220983 [0,2,0,0,0,0|2,0,0]=4 5735 B12R0.265 COCC(=O)NCCC(OC)OC 25d12168b8004850dfd693e668567d44 [0,2,0,0,0,0|2,0,0]=4 5736 B12R0.265 CSCC(=O)NCCC(CO)CO cd40d8f2d974e1cf08ddb1c34a6cdffb [0,2,0,0,0,0|2,0,0]=4 5737 B12R0.265 O=C(CCF)NCCC(CO)CO 3c646c63bb121424cd18f526f0d2abe4 [0,2,0,0,0,0|2,0,0]=4 5738 B12R0.265 O=C(CCO)NCCC(CO)CO 29e79784e115271ce12bf2b8258d4550 [0,2,0,0,0,0|2,0,0]=4 5739 B12R0.265 O=C(CCS)NCCC(CO)CO 32d90e3f46f527f9991d8854054557f0 [0,2,0,0,0,0|2,0,0]=4 5740 B12R0.285 C/C=C/C(C)OCOC(=O)CCC 65e8d9fafb152faf34c2e158cb8f1c7e [0,2,0,0,0,0|1,0,0]=3 5741 B12R0.285 C/C=C/C(C)OCOC(=O)OCC f2b12ab55523d8669460dc70bf4290de [0,2,0,0,0,0|2,0,0]=4 5742 B12R0.285 C/C=C/C(C)OCOC(=O)SCC 7767fd5bc4e0541cca7fcf2b01e5c153 [0,2,0,0,0,0|2,0,0]=4 5743 B12R0.285 C=CCC(C)COCC(=O)CCC cb39b42108156fc21e494b28253406b0 [0,2,0,0,0,0|2,0,0]=4 5744 B12R0.285 C=CCC(C)OCOC(=O)CCC bc6f8607f6a4ed0aca82cfe902334297 [0,2,0,0,0,0|1,0,0]=3 5745 B12R0.285 C=CCC(C)OCOC(=O)SCC 48d22e6c98582c7795fa770690e70628 [0,2,0,0,0,0|2,0,0]=4 5746 B12R0.285 C=CC[C@@H](C)OCOC(=O)CCC a4b3428dde6153fa7ef76d3ab1ffc384 [0,2,0,0,0,0|1,0,0]=3 5747 B12R0.285 C=CC[C@@H](C)OCOC(=O)SCC ef8d11b90df822fa88063a363d33e363 [0,2,0,0,0,0|2,0,0]=4 5748 B12R0.285 C=CC[C@H](C)OCOC(=O)CCC 0061e65e8c4607aeb66752adea377e37 [0,2,0,0,0,0|1,0,0]=3 5749 B12R0.285 C=CC[C@H](C)OCOC(=O)SCC aee24f4215405ee57aef87c01c86c92c [0,2,0,0,0,0|2,0,0]=4 5750 B12R0.285 CC#CC(C)OCOC(=O)CCC 34577271a283b0ba8c7f66b1e7b0b4cf [0,2,0,0,0,0|1,0,0]=3 5751 B12R0.285 CC#CC(C)OCOC(=O)OCC 29b6833076454a41d77840a9daa6b29c [0,2,0,0,0,0|2,0,0]=4 5752 B12R0.285 CC#CC(C)OCOC(=O)SCC d4dcb841a92a0aa7230234124b17bc89 [0,2,0,0,0,0|2,0,0]=4 5753 B12R0.285 CC=CC(C)OCOC(=O)CCC 2728a9e5723b74dea6488092779e1a21 [0,2,0,0,0,0|1,0,0]=3 5754 B12R0.285 CC=CC(C)OCOC(=O)OCC 2575ec38a031c13a52bd14fa8507b553 [0,2,0,0,0,0|2,0,0]=4 5755 B12R0.285 CC=CC(C)OCOC(=O)SCC afc24faf78486cc558f90523a085d5c6 [0,2,0,0,0,0|2,0,0]=4 5756 B12R0.285 CCCC(=O)CNCC(C)CCO 3987a6ac1b3eeca638cd8e6f0f30e0c3 [0,2,0,0,0,0|2,0,0]=4 5757 B12R0.285 CCCC(=O)CNCC(C)OCC 81d5b48e13645fbdc149f2398885dbb7 [0,2,0,0,0,0|2,0,0]=4 5758 B12R0.285 CCCC(=O)COCC(C)CCC 237b4c5c2de3179e1709d47b26f3f0c3 [0,2,0,0,0,0|2,0,0]=4 5759 B12R0.285 CCCC(=O)COCC(C)COC d6c902045f1ccb7f3351f81ea6abca12 [0,2,0,0,0,0|2,0,0]=4 5760 B12R0.285 CCCC(=O)COCC(C)OCC 4531bde7c4c6c0bc52bf39f1be549fe1 [0,2,0,0,0,0|2,0,0]=4 5761 B12R0.285 CCCC(=O)COC[C@@H](C)COC fb5904437517365856a576c424daa4a3 [0,2,0,0,0,0|2,0,0]=4 5762 B12R0.285 CCCC(=O)NCCN(C)CCO 8c8ccb5787e70d06a0b3f4a73b4c85a4 [0,2,0,0,0,0|2,0,0]=4 5763 B12R0.285 CCCC(=O)OCOC(C)CSC a14fad0daa47b75d9d58b8d905685a4c [0,2,0,0,0,0|1,0,0]=3 5764 B12R0.285 CCCC(C)CCOC(C)CCC 3f8e8b3d54af4d23f9067cc7d344de7d [0,2,0,0,0,0|1,0,1]=4 5765 B12R0.285 CCCC(C)NCOC(=O)OCC b72eea28cf13a6e6d23b20ee6c3f7cd9 [0,2,0,0,0,0|2,0,0]=4 5766 B12R0.285 CCCC(C)NCOC(=O)SCC 4b02bee3f88ebb3d513895f191548f2e [0,2,0,0,0,0|2,0,0]=4 5767 B12R0.285 CCCC(C)OCOC(=O)SCC 750e958548e470b69e0eb272d56e6e17 [0,2,0,0,0,0|2,0,0]=4 5768 B12R0.285 CCC[C@@H](C)OCOC(=O)SCC 998326df5e7c2ac2268817708e6d27ac [0,2,0,0,0,0|2,0,0]=4 5769 B12R0.285 CCC[C@H](C)NCOC(=O)OCC cb4603adaa36440d45ff80ade2cb3f58 [0,2,0,0,0,0|2,0,0]=4 5770 B12R0.285 CCC[C@H](C)NCOC(=O)SCC 59e7c4ecc4c6645a479c55c9040526dd [0,2,0,0,0,0|2,0,0]=4 5771 B12R0.285 CCC[C@H](C)OCOC(=O)SCC c7edebe00fc799b6528828770f5fd5f8 [0,2,0,0,0,0|2,0,0]=4 5772 B12R0.285 CCOC(=O)OCNC(C)CC#N 2b2452ee166ecee12fb962ad44ab18a3 [0,2,0,0,0,0|2,0,0]=4 5773 B12R0.285 CCOC(=O)OCNC(C)CCO 3a76041e551c5e7f6ae974efb677dfa7 [0,2,0,0,0,0|2,0,0]=4 5774 B12R0.285 CCOC(=O)OCNC(C)COC d7e0cc747fc9f515bddd8ee37fb3e72c [0,2,0,0,0,0|2,0,0]=4 5775 B12R0.285 CCOC(=O)OCN[C@@H](C)CCO 152fa9de6c72831623f7ad2c440fb907 [0,2,0,0,0,0|2,0,0]=4 5776 B12R0.285 CCOC(=O)OCN[C@@H](C)COC cbf50c16c0ed30eac46095edac5e3e88 [0,2,0,0,0,0|2,0,0]=4 5777 B12R0.285 CCOC(=O)OCN[C@H](C)CCO d8229f30d5b363655f1412c7ecfc6613 [0,2,0,0,0,0|2,0,0]=4 5778 B12R0.285 CCOC(=O)OCN[C@H](C)COC fd0986513f3b902784f033d8f5cf0b55 [0,2,0,0,0,0|2,0,0]=4 5779 B12R0.285 CCSC(=O)OCNC(C)CC#N 4ed519f358fc25bd40529d066a69e324 [0,2,0,0,0,0|2,0,0]=4 5780 B12R0.285 CCSC(=O)OCNC(C)CCO 76600b6d6f0a93925f63535589691119 [0,2,0,0,0,0|2,0,0]=4 5781 B12R0.285 CCSC(=O)OCNC(C)COC b783530511aff6cfe099a0d51d089ede [0,2,0,0,0,0|2,0,0]=4 5782 B12R0.285 CCSC(=O)OCN[C@@H](C)CCO daa4afe42cc4432216c305c71dbe9483 [0,2,0,0,0,0|2,0,0]=4 5783 B12R0.285 CCSC(=O)OCN[C@@H](C)COC 6cc916837c4d1af7edb842d505fc00da [0,2,0,0,0,0|2,0,0]=4 5784 B12R0.285 CCSC(=O)OCN[C@H](C)CCO c88c08d163dcc33f1fb9a1d240ba4f0b [0,2,0,0,0,0|2,0,0]=4 5785 B12R0.285 CCSC(=O)OCN[C@H](C)COC 825c6ac300fbbaef037b0aa2ef3c20b4 [0,2,0,0,0,0|2,0,0]=4 5786 B12R0.285 CCSC(=O)OCOC(C)COC 2c55a56ba71994a237b4332b25664143 [0,2,0,0,0,0|2,0,0]=4 5787 B12R0.285 CCSC(=O)OCOC(C)CSC fa9779495af71415de8daa589a6ce164 [0,2,0,0,0,0|2,0,0]=4 5788 B12R0.285 CCSC(=O)OCO[C@@H](C)COC 0442640a04b81b14472e03344b3d0be4 [0,2,0,0,0,0|2,0,0]=4 5789 B12R0.285 CCSC(=O)OCO[C@H](C)COC 80d811131b16087c1e4bf1864c96ed57 [0,2,0,0,0,0|2,0,0]=4 5790 B12R0.573 C#CC(C)(C)COCC(=O)CCC affcf486e88281c5be18d190f01af191 [0,2,0,0,0,0|2,0,0]=4 5791 B12R0.573 C#CC(C)(C)NCOC(=O)CCC 1e6172a12434f24649a56d571c998560 [0,2,0,0,0,0|1,0,0]=3 5792 B12R0.573 C#CC(C)(C)NCOC(=O)OCC 5575ba6e92693014e3d8fb47f37c571c [0,2,0,0,0,0|2,0,0]=4 5793 B12R0.573 C#CC(C)(C)NCOC(=O)SCC 270d4b5502c8ad52b06b82be078db9c0 [0,2,0,0,0,0|2,0,0]=4 5794 B12R0.573 C=CC(C)(C)COCC(=O)CCC 67b5ba0d4f89233f8125bf24eed2c665 [0,2,0,0,0,0|2,0,0]=4 5795 B12R0.573 CCCC(=O)CNCC(C)(C)C#N 7eeccd0ede0848fb8d5cbed86edf9225 [0,2,0,0,0,0|2,0,0]=4 5796 B12R0.573 CCCC(=O)CNCC(C)(C)CC 6849fe5b681f11a96bcac0da16d0c076 [0,2,0,0,0,0|2,0,0]=4 5797 B12R0.573 CCCC(=O)CNCC(C)(C)CF cd72b3041e436e8774ebdb7e5636a1a7 [0,2,0,0,0,0|2,0,0]=4 5798 B12R0.573 CCCC(=O)CNCC(C)(C)CO 7d4cca70527131b973d6582650c00a70 [0,2,0,0,0,0|2,0,0]=4 5799 B12R0.573 CCCC(=O)CNCC(C)(C)OC 6b7a546bedd6094540e7c686882247a0 [0,2,0,0,0,0|2,0,0]=4 5800 B12R0.573 CCCC(=O)CNCC(C)(O)CC 4b1620e12049fd14e9e45815cd858ead [0,2,0,0,0,0|2,0,0]=4 5801 B12R0.573 CCCC(=O)COCC(C)(C)C#N cccc903a58467319950057256ba1a68f [0,2,0,0,0,0|2,0,0]=4 5802 B12R0.573 CCCC(=O)COCC(C)(C)C=O 1d395198a2d353f84aaf613fc2690522 [0,2,0,0,0,0|2,0,0]=4 5803 B12R0.573 CCCC(=O)COCC(C)(C)CF 2845c7516470caa6e921dfe5fedecb14 [0,2,0,0,0,0|2,0,0]=4 5804 B12R0.573 CCCC(=O)COCC(C)(C)OC fcec680fc89fa95c957174a57389d6c9 [0,2,0,0,0,0|2,0,0]=4 5805 B12R0.573 CCCC(=O)NCCC(C)(C)OC 53345c77d3030d0591276e995e5d08fd [0,2,0,0,0,0|1,0,0]=3 5806 B12R0.573 CCCC(=O)NCCC(F)(F)CO 78dd6a36bd50a922db40d01503278657 [0,2,0,0,0,0|2,0,0]=4 5807 B12R0.573 CCCC(=O)OCNC(C)(C)C#N 4589e1f5f45f313f6d3ec404b7d0b9b7 [0,2,0,0,0,0|1,0,0]=3 5808 B12R0.573 CCCC(=O)OCNC(C)(C)CF 1b1ef5105b9db56f4990d91f2df04450 [0,2,0,0,0,0|1,0,0]=3 5809 B12R0.573 CCCC(=O)OCNC(C)(C)CO 690ff5b2e66412a7f4f47c8d7bfd7340 [0,2,0,0,0,0|1,0,0]=3 5810 B12R0.573 CCCC(=S)OCCC(C)(C)CC fd8c6e68adee792e140e3cc68665826a [0,2,0,0,0,0|0,1,0]=3 5811 B12R0.573 CCCC(C)OCCC(C)(C)C#N 9fd355caceb7bb28b43424ed2537907f [0,2,0,0,0,0|1,0,1]=4 5812 B12R0.573 CCCC(C)OCCC(C)(C)CC 0fc57d7b29f64efc4fbe10ff324ec3dd [0,2,0,0,0,0|1,0,1]=4 5813 B12R0.573 CCCC(C)OCCC(C)(C)OC b5101a09cec1d0c2b63af5a2eaf609a5 [0,2,0,0,0,0|1,0,1]=4 5814 B12R0.573 CCC[C@@H](C)OCCC(C)(C)CC c6a06e93c21b849297cee4f7f464d3b0 [0,2,0,0,0,0|1,0,1]=4 5815 B12R0.573 CCC[C@H](C)OCCC(C)(C)CC 268ebdd2bf0d976a40de1c5938d445fb [0,2,0,0,0,0|1,0,1]=4 5816 B12R0.573 CCOC(=O)OCNC(C)(C)C#N be9cccb70bbc39736573a42af1daa853 [0,2,0,0,0,0|2,0,0]=4 5817 B12R0.573 CCOC(=O)OCNC(C)(C)CF 33debecb41c7e32362ce36db7e4ab4f7 [0,2,0,0,0,0|2,0,0]=4 5818 B12R0.573 CCOC(=O)OCNC(C)(C)CO 64e06b0740dfdb7f964bcf3b63688ce6 [0,2,0,0,0,0|2,0,0]=4 5819 B12R0.573 CCSC(=O)OCNC(C)(C)C#N a616f3e2fc6b02c4219bed305f7f151c [0,2,0,0,0,0|2,0,0]=4 5820 B12R0.573 CCSC(=O)OCNC(C)(C)CC 22d714223836602f17cf4f326d885732 [0,2,0,0,0,0|2,0,0]=4 5821 B12R0.573 CCSC(=O)OCNC(C)(C)CF c993656f7cf1c932294c03717c2e9583 [0,2,0,0,0,0|2,0,0]=4 5822 B12R0.573 CCSC(=O)OCNC(C)(C)CO 0cf929c3cb8b3e7d41462b7f282cec5f [0,2,0,0,0,0|2,0,0]=4 5823 B12R0.573 COC(C)(C)CCNC(=O)CCF 12cae68e46d1a382d3a266198e3ad944 [0,2,0,0,0,0|2,0,0]=4 5824 B12R0.573 COC(C)(C)CCNC(=O)CCO 1d5b8c90155f3fa04fddbc650b050015 [0,2,0,0,0,0|2,0,0]=4 5825 B12R0.573 COC(C)(C)CCNC(=O)CCS 627ae4ee4d504c8a93552181deeb644f [0,2,0,0,0,0|2,0,0]=4 5826 B12R0.573 COC(C)(C)CCNC(=O)CSC dd91ad5ed941f75c8a1e2e2e9523fd65 [0,2,0,0,0,0|2,0,0]=4 5827 B12R0.573 COCC(=O)NCCC(C)(C)OC b658e60b88d2effad76d9b217b139713 [0,2,0,0,0,0|2,0,0]=4 5828 B10R1.14 CC1CCN(C1)C(=O)CF eee3614fc75613643f47ba71d44a38e8 [1,0,0,1,0,0|2,0,0]=4 5829 B10R1.14 CC1CCN(C1)C(=O)CO 7aaa36349c5fd51854587f309c23a605 [1,0,0,1,0,0|2,0,0]=4 5830 B10R1.14 CC1CCN(C1)C(=O)CS b70a9ddfe1852f7cb082342f3f38fd10 [1,0,0,1,0,0|2,0,0]=4 5831 B10R1.14 CCC(=O)N1CCC(C1)C 94b30cd6a8e58bae117bb6e3dcc06174 [1,0,0,1,0,0|1,0,0]=3 5832 B10R1.14 CCC(=O)N1CCC(C1)F 5c3b4bf29a734e2923fb30f622365626 [1,0,0,1,0,0|2,0,0]=4 5833 B10R1.14 CCC(=O)N1CCC(C1)O ade558f395a96a93d6936791ca1f7c88 [1,0,0,1,0,0|2,0,0]=4 5834 B10R1.14 CCC(=O)N1CCN(C1)C e55701d3a5a451b7cee5b15f592826b8 [1,0,0,1,0,0|2,0,0]=4 5835 B10R1.14 CCC(=O)N1CC[C@@H](C1)F 9909b1db5af0b92583486aa5bb126b43 [1,0,0,1,0,0|2,0,0]=4 5836 B10R1.14 CCC(=O)N1CC[C@@H](C1)O 1344c504c0d268c21bb6080c5d390fb4 [1,0,0,1,0,0|2,0,0]=4 5837 B10R1.14 CCC(=O)N1CC[C@H](C1)F f3f39d2681d5f19bc993bd4b83b191d5 [1,0,0,1,0,0|2,0,0]=4 5838 B10R1.14 CCC(=O)N1CC[C@H](C1)O dd0bb0c2d1d036d617da37ca11528082 [1,0,0,1,0,0|2,0,0]=4 5839 B10R1.54 CC(C)OC1CCC(=O)C1 013dcfc334419b3e0a078d8a1b20d585 [1,0,0,1,0,0|2,0,0]=4 5840 B10R1.117 CC(C)COC1CCC1=O 558a6072da058795dec9aa4425f836f1 [1,0,0,1,0,0|2,0,0]=4 5841 B10R1.117 CC(C)OCC1CCC1=O 27c8b5263e6f70baf557d991f4764c31 [1,0,0,1,0,0|2,0,0]=4 5842 B10R1.127 CC(C)CCOC1CCC1 5b9d93b74b97b0191d14a7acfde75647 [1,0,0,1,0,0|1,0,1]=4 5843 B10R1.150 CCC(=O)NC1CC(C1)F 5a7baf291a2ba32b08efd08fa079e293 [1,0,0,1,0,0|2,0,0]=4 5844 B10R1.150 CCC(=O)NC1CC(C1)O 861e8c2541dd7a71751c5b2614c841d0 [1,0,0,1,0,0|2,0,0]=4 5845 B10R1.150 CCC(=O)NC1CN(C1)C 37190d58d72197eecb160372f0f31478 [1,0,0,1,0,0|2,0,0]=4 5846 B10R1.150 CCC(=O)N[C@H]1C[C@@H](C1)F a1a612c1c7342e37bfec93dc346f5ea0 [1,0,0,1,0,0|2,0,0]=4 5847 B10R1.150 CCC(=O)N[C@H]1C[C@@H](C1)O 8371a9737d2c42ba66796dabb017a210 [1,0,0,1,0,0|2,0,0]=4 5848 B10R1.150 CCC(=O)N[C@H]1C[C@H](C1)F f27fc38e5b4216c5ec15e3f1dfb03375 [1,0,0,1,0,0|2,0,0]=4 5849 B10R1.150 CCC(=O)N[C@H]1C[C@H](C1)O 8e749a9e13b5e9c91ee403d1ff5a5859 [1,0,0,1,0,0|2,0,0]=4 5850 B10R1.150 CCC(C)OC1CC(C1)C 796257ac915fcd057e3b290feb92f43b [1,0,0,1,0,0|1,0,1]=4 5851 B10R1.153 CCC(=O)CNCC1CC1 225dd7071931edcd77c79a2aa26556ee [1,0,0,1,0,0|2,0,0]=4 5852 B10R1.153 CCC(=O)COCC1CC1 f372fe9dbfb81be46e380f625d46fa2f [1,0,0,1,0,0|2,0,0]=4 5853 B10R1.153 CCC(=O)NCCC1CC1 33e3033af4fba57487732378a5fcb4ef [1,0,0,1,0,0|1,0,0]=3 5854 B10R1.153 CCC(=O)NCCN1CC1 c31d4f1adf334324b217ef2c46bac2bb [1,0,0,1,0,0|2,0,0]=4 5855 B10R1.153 CCC(=O)OCNC1CC1 835b28a15ba2b1b22d8064550b4fe2e7 [1,0,0,1,0,0|1,0,0]=3 5856 B10R1.153 CCC(=O)OCOC1CC1 2be77a0a323225616728c544de625037 [1,0,0,1,0,0|1,0,0]=3 5857 B10R1.153 CCC(C)OCCC1CC1 2578d42f2fb2648199a124294c040837 [1,0,0,1,0,0|1,0,1]=4 5858 B10R1.153 CC[C@@H](C)OCCC1CC1 45d0df1b4330dbbcdb4b0cd0822b0970 [1,0,0,1,0,0|1,0,1]=4 5859 B10R1.153 CC[C@H](C)OCCC1CC1 9c153a701e07208b3e62024321dac3da [1,0,0,1,0,0|1,0,1]=4 5860 B10R1.153 COC(=O)OCNC1CC1 75715a0b98a8d32102994bc825d16190 [1,0,0,1,0,0|2,0,0]=4 5861 B10R1.153 COC(=O)OCOC1CC1 78a958bf7ca9667f5865d4fcd33ac5e2 [1,0,0,1,0,0|2,0,0]=4 5862 B10R1.153 O=C(CF)NCCC1CC1 5b6a53513570c70f77aa1d84ec34ffe5 [1,0,0,1,0,0|2,0,0]=4 5863 B10R1.153 O=C(CO)NCCC1CC1 71cb6be8b40da6c6238c227fde6bac04 [1,0,0,1,0,0|2,0,0]=4 5864 B10R1.153 O=C(CS)NCCC1CC1 96a4df900069bb27e565008dd8ce014d [1,0,0,1,0,0|2,0,0]=4 5865 B10R1.206 CCC(=O)CNC1CC1C a215456e67d8a1089d8750c074cdb2ed [1,0,0,1,0,0|2,0,0]=4 5866 B10R1.206 CCC(C)OCC1CC1C 5b62d8db7f7032b57d7f88f35d77858d [1,0,0,1,0,0|1,0,1]=4 5867 B10R1.206 CCC(C)OC[C@@H]1C[C@@H]1C b7da233983cb19e3f2c56d976903273d [1,0,0,1,0,0|1,0,1]=4 5868 B10R1.206 CCC(C)OC[C@@H]1C[C@H]1C b7697466b1507918d43bfee94db7bd45 [1,0,0,1,0,0|1,0,1]=4 5869 B10R1.206 CCC(C)OC[C@H]1C[C@@H]1C 46abb4ce75360a0a016055d93ab9d9f0 [1,0,0,1,0,0|1,0,1]=4 5870 B10R1.428 CC1(CC1NC(=O)CF)C 6893ee20f42b6d433f4d4af9e008dec3 [1,0,0,1,0,0|2,0,0]=4 5871 B10R1.428 CC1(CC1NC(=O)CO)C ae21f24bba70e4f7cfbdd57d7e30f0ae [1,0,0,1,0,0|2,0,0]=4 5872 B10R1.428 CC1(CC1NC(=O)CS)C 8804f0662b3abebf38683acff8d5b6fb [1,0,0,1,0,0|2,0,0]=4 5873 B10R1.428 CC1(C[C@@H]1NC(=O)CF)C 2a2c56ca51fcaba7174265feb1e81a6e [1,0,0,1,0,0|2,0,0]=4 5874 B10R1.428 CC1(C[C@@H]1NC(=O)CO)C 3a2a59e0d1f2ca57401f3768ccf8f23d [1,0,0,1,0,0|2,0,0]=4 5875 B10R1.428 CC1(C[C@@H]1NC(=O)CS)C 19be3e75ebebe8d97f8856a5dac430f4 [1,0,0,1,0,0|2,0,0]=4 5876 B10R1.428 CC1(C[C@H]1NC(=O)CF)C c68ab1b62826282404a8abd45904834e [1,0,0,1,0,0|2,0,0]=4 5877 B10R1.428 CC1(C[C@H]1NC(=O)CO)C cf9ce7b9ac4b187cf43612d87fdfeda9 [1,0,0,1,0,0|2,0,0]=4 5878 B10R1.428 CC1(C[C@H]1NC(=O)CS)C 6f088d76a488191b3ae3c1584fa9ed05 [1,0,0,1,0,0|2,0,0]=4 5879 B10R1.428 CCC(=O)CN1CC1(C)C a9a22a7c9f60753aa81a6e364a7a204f [1,0,0,1,0,0|2,0,0]=4 5880 B10R1.428 CCC(=O)NC1CC1(C)C 192aa7efdbbef7fd5ae8d2ca90a62936 [1,0,0,1,0,0|1,0,0]=3 5881 B10R1.428 CCC(=O)N[C@@H]1CC1(C)C 14cbf73a41b5cf3ce43330634c532643 [1,0,0,1,0,0|1,0,0]=3 5882 B10R1.428 CCC(=O)N[C@H]1CC1(C)C 4a51b8c62c3ace1634a3f77c10c3b375 [1,0,0,1,0,0|1,0,0]=3 5883 B10R1.428 CCC(C)OC1CC1(C)C 734b0c48978dcb4b1fc1934d816cb893 [1,0,0,1,0,0|1,0,1]=4 5884 B10R1.428 CC[C@@H](C)OC1CC1(C)C 5d33cadede5d9daf69c5c67738f5dc73 [1,0,0,1,0,0|1,0,1]=4 5885 B10R1.428 CC[C@H](C)OC1CC1(C)C 5e77a90ed920d1eeac5d66c3119ab78d [1,0,0,1,0,0|1,0,1]=4 5886 B10R1.10 CCCN1CCCC(C1)C 10722657823b505b789ed627a8c61fd8 [1,0,0,1,0,0|2,0,0]=4 5887 B10R1.10 CCCN1CCC[C@@H](C1)C 42accd0af676748aeef95475de04bd47 [1,0,0,1,0,0|2,0,0]=4 5888 B10R1.10 CCCN1CCC[C@H](C1)C 3fdfd8108804c0fcef74b387a8d79dff [1,0,0,1,0,0|2,0,0]=4 5889 B10R1.16 CCCCN1CCC(C1)C abcd4eb07501d0ef1eabf170b98b1f20 [1,0,0,1,0,0|1,0,1]=4 5890 B10R1.16 CCCNC1CCC(C1)C 8e1eee1cf19b8113d412d0e1b4ce9dc5 [1,0,0,1,0,0|2,0,0]=4 5891 B10R1.16 CCCOC1CCC(C1)C 4c3271bf295e1e813aee802c80b0bc80 [1,0,0,1,0,0|2,0,0]=4 5892 B10R1.18 CC(C)NC1C=CCCC1 32f8e6bfed2394037a4f01187327ad39 [1,0,0,1,0,0|2,0,0]=4 5893 B10R1.18 CC(C)OC1C=CCCC1 0bab099b544e073222e10dd3e508df9c [1,0,0,1,0,0|2,0,0]=4 5894 B10R1.18 CC(C)OC1CCCCO1 cd0775eac08e04c38cddc5a061e10e3a [1,0,0,1,0,0|1,0,1]=4 5895 B10R1.24 CC1CC(C1)OCCCF 5e18fdb497281ec0717a31faae9940d9 [1,0,0,1,0,0|1,0,1]=4 5896 B10R1.24 CC1CC(C1)OCCCS a1953735110da53ec104bac8093c328c [1,0,0,1,0,0|1,0,1]=4 5897 B10R1.24 CCCCOC1CC(C1)C 46172388f175220efff660177940dadb [1,0,0,1,0,0|0,0,1]=3 5898 B10R1.24 CCCCOC1CC(C1)F b697fc0c5e24dccec9e198376fc6ffbb [1,0,0,1,0,0|1,0,1]=4 5899 B10R1.24 CCCCOC1CN(C1)C d6917525821e9919d431ba4c112c9a14 [1,0,0,1,0,0|1,0,1]=4 5900 B10R1.24 CCCCO[C@H]1C[C@@H](C1)F 1c8d57d0e3a86703db873e341ad2a242 [1,0,0,1,0,0|1,0,1]=4 5901 B10R1.24 CCCCO[C@H]1C[C@H](C1)F f145977abb5b763d5495c8b01ed6f759 [1,0,0,1,0,0|1,0,1]=4 5902 B10R1.24 CCCNCC1CC(C1)C d3df9a21db6a0cdb8d4016b1b7a01fb4 [1,0,0,1,0,0|2,0,0]=4 5903 B10R1.24 CCCOCC1CC(C1)C bf64edb922f5bed09bc73c12f18ebfce [1,0,0,1,0,0|2,0,0]=4 5904 B10R1.24 CCCOC[C@H]1C[C@@H](C1)C 8e841ac166ade47b486466a7d174692c [1,0,0,1,0,0|2,0,0]=4 5905 B10R1.24 CCOCOC1CC(C1)C 9fd8f1859e518fb6ad55916d89225e37 [1,0,0,1,0,0|1,0,1]=4 5906 B10R1.24 COCCOC1CC(C1)C fa9f999f63405e6c1ed4abe366d267a6 [1,0,0,1,0,0|1,0,1]=4 5907 B10R1.24 CSCCOC1CC(C1)C 4fdf3226f85f5f08b015a215cc89b6e3 [1,0,0,1,0,0|1,0,1]=4 5908 B10R1.56 CC1CC1COCCCF 64607611a92bef51919bed92743a0954 [1,0,0,1,0,0|1,0,1]=4 5909 B10R1.56 CC1CC1COCCCS 6fad5cfa4cd1e1eeeccc31d20f944b8b [1,0,0,1,0,0|1,0,1]=4 5910 B10R1.56 CCCCOCC1CC1C 76dca24a45b0211a32b89fd0da7d3d49 [1,0,0,1,0,0|0,0,1]=3 5911 B10R1.56 CCCCOC[C@@H]1C[C@@H]1C 3d265a80cae5744f6b90eee155c1997f [1,0,0,1,0,0|0,0,1]=3 5912 B10R1.56 CCCCOC[C@@H]1C[C@@H]1F d30e3d89239f0bd84919e06256d74fe2 [1,0,0,1,0,0|1,0,1]=4 5913 B10R1.56 CCCCOC[C@@H]1C[C@H]1C b5a95c5a449f0e8559d0b59df572755a [1,0,0,1,0,0|0,0,1]=3 5914 B10R1.56 CCCCOC[C@@H]1C[C@H]1F 191b6e168d8e4dbaaf1040a0e908a372 [1,0,0,1,0,0|1,0,1]=4 5915 B10R1.56 CCCCOC[C@H]1C[C@@H]1C b5c4a716f2aeb88529724d8ef1b39cb0 [1,0,0,1,0,0|0,0,1]=3 5916 B10R1.56 CCCCOC[C@H]1C[C@@H]1F 8f817d281efff73883558cb492e35e79 [1,0,0,1,0,0|1,0,1]=4 5917 B10R1.56 CCCCOC[C@H]1C[C@H]1F 680d4b82e044e57b90b8d25359c50c36 [1,0,0,1,0,0|1,0,1]=4 5918 B10R1.56 CCOCOCC1CC1C 2977c25e2bb0d1ecc4f67f62947e30b0 [1,0,0,1,0,0|1,0,1]=4 5919 B10R1.56 CCOCOC[C@@H]1C[C@@H]1C 0cfe7cc689a92518db6e34ca4f2cf990 [1,0,0,1,0,0|1,0,1]=4 5920 B10R1.56 CCOCOC[C@@H]1C[C@H]1C 1d6d9fe03a3e94765eb457c2bd65c0f3 [1,0,0,1,0,0|1,0,1]=4 5921 B10R1.56 CCOCOC[C@H]1C[C@@H]1C baecefb1e9034f35fe8d5a39ac82825f [1,0,0,1,0,0|1,0,1]=4 5922 B10R1.56 COCCOCC1CC1C ed3be569db03409a8da41c9fbed7fd38 [1,0,0,1,0,0|1,0,1]=4 5923 B10R1.56 COCCOC[C@@H]1C[C@@H]1C f6727809291d634cd1677dba8489dbbe [1,0,0,1,0,0|1,0,1]=4 5924 B10R1.56 COCCOC[C@@H]1C[C@H]1C 7d2d3d856247d49bf71a411626363084 [1,0,0,1,0,0|1,0,1]=4 5925 B10R1.56 COCCOC[C@H]1C[C@@H]1C e1c537fecd316a06f59bfe75bcca2ab1 [1,0,0,1,0,0|1,0,1]=4 5926 B10R1.56 CSCCOCC1CC1C 831a6bcacba03e5173545ae568320e5f [1,0,0,1,0,0|1,0,1]=4 5927 B10R1.56 CSCCOC[C@@H]1C[C@@H]1C 738f7d734fad4117f60e5605c73ac13e [1,0,0,1,0,0|1,0,1]=4 5928 B10R1.56 CSCCOC[C@@H]1C[C@H]1C e54a62f240f7579a47384db39fb6b867 [1,0,0,1,0,0|1,0,1]=4 5929 B10R1.56 CSCCOC[C@H]1C[C@@H]1C ab831ea7ad350b8104f05441ee071a5d [1,0,0,1,0,0|1,0,1]=4 5930 B10R1.56 C[C@@H]1C[C@H]1COCCCF 2f5699fed17e2512a7e9ef4e3f3b8529 [1,0,0,1,0,0|1,0,1]=4 5931 B10R1.56 C[C@@H]1C[C@H]1COCCCS de73439ee68fa1f6b7a46653a7d18a61 [1,0,0,1,0,0|1,0,1]=4 5932 B10R1.56 C[C@H]1C[C@@H]1COCCCF e612ed25c32733638e74cd72e6791ec8 [1,0,0,1,0,0|1,0,1]=4 5933 B10R1.56 C[C@H]1C[C@@H]1COCCCS ad5dc82e3f89013ddab98758ee3f9c55 [1,0,0,1,0,0|1,0,1]=4 5934 B10R1.56 C[C@H]1C[C@H]1COCCCF fbe82e5336a20d4c74586c234f0dcbdd [1,0,0,1,0,0|1,0,1]=4 5935 B10R1.56 C[C@H]1C[C@H]1COCCCS f0e80629a019cfda7a3f2dba15aa75d0 [1,0,0,1,0,0|1,0,1]=4 5936 B10R1.66 CC(C)OCC1=CCCC1 dce9071adb96386a977242dfea3b1445 [1,0,0,1,0,0|2,0,0]=4 5937 B10R1.126 CC(C)CCCNC1CC1 9141cc53c889c33c57614d7631012715 [1,0,0,1,0,0|2,0,0]=4 5938 B10R1.126 CC(C)CCCOC1CC1 ca0c1ccde5dd6e35a83f6820bf1c6325 [1,0,0,1,0,0|2,0,0]=4 5939 B10R1.126 CC(C)CCNCC1CC1 52abe102acd5efb5ad9dd76d9bba97d8 [1,0,0,1,0,0|1,0,1]=4 5940 B10R1.126 CC(C)CCOCC1CC1 050a8292a0c30fdb570df01b67ca4d41 [1,0,0,1,0,0|0,0,1]=3 5941 B10R1.126 CC(C)OC/C=C/C1CC1 94d04f2296a348b8f4d23d21884ab9f2 [1,0,0,1,0,0|2,0,0]=4 5942 B10R1.126 CC(C)OCOCC1CC1 5ad31ae78984b2c03b77362514d2c158 [1,0,0,1,0,0|1,0,1]=4 5943 B10R1.126 CN(C)CCOCC1CC1 97fae989f942c0fe256463f08619362b [1,0,0,1,0,0|1,0,1]=4 5944 B10R1.133 CCCN1CCCC1(C)C 4390ec7bafda06fa8a34b52c0f7f628f [1,0,0,1,0,0|2,0,0]=4 5945 B10R1.141 CCCOC1CCC1(C)C ef86c9423b65b5d4b4872678bd58ab3c [1,0,0,1,0,0|2,0,0]=4 5946 B10R1.177 CCC/C=C/CNC1CC1 edb58d59572674cb67aefb973557902b [1,0,0,1,0,0|2,0,0]=4 5947 B10R1.177 CCC/C=C/COC1CC1 382f23974dd20a1518d1f00f5271a1ab [1,0,0,1,0,0|2,0,0]=4 5948 B10R1.177 CCC/C=C\CNC1CC1 c2380d1bc1589aa650cdc38b2c2b9d7a [1,0,0,1,0,0|2,0,0]=4 5949 B10R1.177 CCC/C=C\COC1CC1 1d9efd858c0dc4ab1aa7d3712bee0f52 [1,0,0,1,0,0|2,0,0]=4 5950 B10R1.177 CCCCNCCC1CC1 158c02666a48abc7fe9ea46078bf1036 [1,0,0,1,0,0|1,0,1]=4 5951 B10R1.177 CCCCOCCC1CC1 ec58c6ee84426d7d0244452963d49311 [1,0,0,1,0,0|0,0,1]=3 5952 B10R1.177 CCCCOCCN1CC1 093ed7f947f21cbf0dd40339577c9b40 [1,0,0,1,0,0|1,0,1]=4 5953 B10R1.177 CCCCOCNC1CC1 ec662359ae6cef349af3aec163fa6c48 [1,0,0,1,0,0|1,0,1]=4 5954 B10R1.177 CCCCOCOC1CC1 ceec6acd9a089fc281edfe61886983a1 [1,0,0,1,0,0|1,0,1]=4 5955 B10R1.177 CCCOCCCC1CC1 e0007007b99d583354fd403d2e374709 [1,0,0,1,0,0|2,0,0]=4 5956 B10R1.177 CCOCOCCC1CC1 65a53cb45bb91d38b082664ecccc2d23 [1,0,0,1,0,0|1,0,1]=4 5957 B10R1.177 COCCOCCC1CC1 ca1d81a50912319f0beabc602e6f3bdf [1,0,0,1,0,0|1,0,1]=4 5958 B10R1.177 CSCCOCCC1CC1 ea069ac9238784ad28902bf4c2ec63e8 [1,0,0,1,0,0|1,0,1]=4 5959 B10R1.177 FCCCOCCC1CC1 d5ec878639c24d78883dba584ee94035 [1,0,0,1,0,0|1,0,1]=4 5960 B10R1.177 SCCCOCCC1CC1 602c8aa830392eec0f4b645f316ac81f [1,0,0,1,0,0|1,0,1]=4 5961 B10R1.375 CC1(CC1OCCCF)C 58da6c8c770f1034630d7db97a56c7ed [1,0,0,1,0,0|1,0,1]=4 5962 B10R1.375 CC1(CC1OCCCS)C afe4bc7b0b3b182ec0648b13748cd9e3 [1,0,0,1,0,0|1,0,1]=4 5963 B10R1.375 CCCCNC1CC1(C)C 6853f78e86bc5fa4dfd28ef47492defe [1,0,0,1,0,0|1,0,1]=4 5964 B10R1.375 CCCCN[C@@H]1CC1(C)C 052483af7b451ad0769e0570eb1eadc6 [1,0,0,1,0,0|1,0,1]=4 5965 B10R1.375 CCCCN[C@H]1CC1(C)C a1d02e35f1296000482e5a76cc3410a0 [1,0,0,1,0,0|1,0,1]=4 5966 B10R1.375 CCCCOC1CC1(C)C 281978d552040ed3dca23a3224c15652 [1,0,0,1,0,0|0,0,1]=3 5967 B10R1.375 CCCNC[C@@H]1CC1(C)C 294250f611309902c4872b15927d3ce5 [1,0,0,1,0,0|2,0,0]=4 5968 B10R1.375 CCCNC[C@H]1CC1(C)C c14f8895f2d1f7ccf264b110193e6e73 [1,0,0,1,0,0|2,0,0]=4 5969 B10R1.375 CCCOCC1CC1(C)C 7d9f25b3a29dd3e68efd55083b7f9d19 [1,0,0,1,0,0|2,0,0]=4 5970 B10R1.375 CCCOC[C@@H]1CC1(C)C 4e8ff0f6fb5094e5574d4face7062785 [1,0,0,1,0,0|2,0,0]=4 5971 B10R1.375 CCCOC[C@H]1CC1(C)C 3f4d7056544c6d1fcfaf36b490653e04 [1,0,0,1,0,0|2,0,0]=4 5972 B10R1.375 COCCOC1CC1(C)C 1bc14638c119ad6554164d0c4a387f85 [1,0,0,1,0,0|1,0,1]=4 5973 B10R1.375 CSCCOC1CC1(C)C 93da5b3d1eabccd36498b3e71e2cde09 [1,0,0,1,0,0|1,0,1]=4 5974 B10R1.11 CCCC(=O)N1CCSC1 8dfd5ac124c54a6a084f595d8f226cbf [1,0,0,1,0,0|2,0,0]=4 5975 B10R1.21 CCCCOC1CCCC1 d3b2f759259425b9c2ce9a0394e69cde [1,0,0,1,0,0|1,0,1]=4 5976 B10R1.21 CCCCOC1CCCO1 0895124ff10908b56ac50a853beca9be [1,0,0,1,0,0|0,0,2]=4 5977 B10R1.29 CCCNC1CCCC1=O 92270db65b4e768bf74c060f3ddca1d2 [1,0,0,1,0,0|2,0,0]=4 5978 B10R1.29 CCCOC1CCCC1=O 6b93fa99d3716532fe6b9fa26488dd4e [1,0,0,1,0,0|2,0,0]=4 5979 B10R1.29 CCOCC1CCCC1=O 4cec2785468e0a623009b869bd6f12fe [1,0,0,1,0,0|2,0,0]=4 5980 B10R1.29 CCOCN1CCCC1=O f60cc8131648e9114d88fd2170c106e5 [1,0,0,1,0,0|2,0,0]=4 5981 B10R1.130 CC1CC(=O)OC1OCF ac6e85627809bc178a13143d54146eb8 [1,0,0,1,0,0|2,0,0]=4 5982 B10R1.130 CCOC1OC(=O)CC1C 22b073b912a7a81eddef47f0e7d21a3e [1,0,0,1,0,0|1,0,0]=3 5983 B10R1.136 CC1CC1NC(=O)CCF 8ec1a58ea62a564ecbee3d9c8cb765dc [1,0,0,1,0,0|2,0,0]=4 5984 B10R1.136 CC1CC1NC(=O)CCO 561216ba61ce477c05dfefcfcf00d2c6 [1,0,0,1,0,0|2,0,0]=4 5985 B10R1.136 CC1CC1NC(=O)CCS ae45eb11c914e93c0c158a86e41ce277 [1,0,0,1,0,0|2,0,0]=4 5986 B10R1.136 CCCC(=O)NC1CC1C ee33d40872cf1582a3c6feb3e9e8aed2 [1,0,0,1,0,0|1,0,0]=3 5987 B10R1.136 CCCC(=O)N[C@@H]1C[C@H]1F 095211dfac9049bf9c1e338463eb5e32 [1,0,0,1,0,0|2,0,0]=4 5988 B10R1.136 CCCC(=O)N[C@H]1C[C@@H]1F 13cd51d9078ea1a8fc31f3b62a1eb321 [1,0,0,1,0,0|2,0,0]=4 5989 B10R1.136 CCCC(=O)N[C@H]1C[C@H]1F e547aaa2b2bee2648b09bb96d0029ddc [1,0,0,1,0,0|2,0,0]=4 5990 B10R1.136 COCC(=O)NC1CC1C 92f83d5d1381830a0ab0604683cc36e1 [1,0,0,1,0,0|2,0,0]=4 5991 B10R1.136 CSCC(=O)NC1CC1C ba2cf214c967d40cac19756dcf4eef0c [1,0,0,1,0,0|2,0,0]=4 5992 B10R1.137 CCCC(=O)CN1CCC1 24fe087184be8f9be6e072c76760aca2 [1,0,0,1,0,0|2,0,0]=4 5993 B10R1.137 CCCC(=O)NC1CCC1 b7b9c515753a161abcc35b56dc974d47 [1,0,0,1,0,0|1,0,0]=3 5994 B10R1.137 CCCC(=O)NC1COC1 d9cebcf9c5a1fd910bbc66cad4c36e4f [1,0,0,1,0,0|2,0,0]=4 5995 B10R1.137 CCCC(=S)OC1CCC1 19af20377097808ca4f4afecabaf05f6 [1,0,0,1,0,0|0,1,0]=3 5996 B10R1.137 CCCC(=S)OC1COC1 60d06f8e1a261242dc99ff0636224b61 [1,0,0,1,0,0|1,1,0]=4 5997 B10R1.137 CCCC(C)OC1CCC1 49f9ed9f68fba79800ec0af7aca68f9d [1,0,0,1,0,0|1,0,1]=4 5998 B10R1.137 CCC[C@@H](C)OC1CCC1 e403969b5729f20c9ca50aaa8f611c74 [1,0,0,1,0,0|1,0,1]=4 5999 B10R1.137 CCC[C@H](C)OC1CCC1 65784cdf0cea1a3b9c66fe7db47426a7 [1,0,0,1,0,0|1,0,1]=4 6000 B10R1.137 COCC(=O)NC1CCC1 021cc1760cef5fbbfdeea6c17d703021 [1,0,0,1,0,0|2,0,0]=4 6001 B10R1.137 CSCC(=O)NC1CCC1 7f7f08cd00dd009f2edce9608a21d002 [1,0,0,1,0,0|2,0,0]=4 6002 B10R1.137 O=C(CCF)NC1CCC1 6a895cb18deb8c45ebd3576b4b8e2b9a [1,0,0,1,0,0|2,0,0]=4 6003 B10R1.137 O=C(CCO)NC1CCC1 772bb70e8d7bbf8b62dfee48a2a3fc26 [1,0,0,1,0,0|2,0,0]=4 6004 B10R1.137 O=C(CCS)NC1CCC1 d9e451254376543d56ee834335d68a4b [1,0,0,1,0,0|2,0,0]=4 6005 B10R1.138 CCCC(=O)CNC1CC1 048d80387365d525195329babc27cce2 [1,0,0,1,0,0|2,0,0]=4 6006 B10R1.138 CCCC(=O)COC1CC1 438c7e34265a771a1084b127eefcabef [1,0,0,1,0,0|2,0,0]=4 6007 B10R1.138 CCCC(=O)NCC1CC1 69d46f73451a9cbf30af6f8f9e8feabc [1,0,0,1,0,0|1,0,0]=3 6008 B10R1.138 CCCC(=S)OCC1CC1 bbbadc8ebd81785f951589f1e9964807 [1,0,0,1,0,0|0,1,0]=3 6009 B10R1.138 CCCC(C)OCC1CC1 83106f88842b04c9c115e2cb921248bb [1,0,0,1,0,0|1,0,1]=4 6010 B10R1.138 CCC[C@@H](C)OCC1CC1 4e6dd22b0adf2dbd96835953d1b6b62c [1,0,0,1,0,0|1,0,1]=4 6011 B10R1.138 CCC[C@H](C)OCC1CC1 44d7ec6ef7a19cc6239949812f912fe4 [1,0,0,1,0,0|1,0,1]=4 6012 B10R1.138 COCC(=O)NCC1CC1 0cb863726a4cfb3f0d4077678e060c57 [1,0,0,1,0,0|2,0,0]=4 6013 B10R1.138 CSCC(=O)NCC1CC1 31c2e420572cb2c01592fbcc2f0785c6 [1,0,0,1,0,0|2,0,0]=4 6014 B10R1.138 O=C(CCF)NCC1CC1 e46f90bf74e57e315aa36dc9b5c200cc [1,0,0,1,0,0|2,0,0]=4 6015 B10R1.138 O=C(CCO)NCC1CC1 597cdf2a4a9a6bb1f280933977cf8ad5 [1,0,0,1,0,0|2,0,0]=4 6016 B10R1.138 O=C(CCS)NCC1CC1 4e5f728b0304c384365749f290226aca [1,0,0,1,0,0|2,0,0]=4 6017 B10R1.186 CCCCOC(C)C1CC1 0edf255b71499ff21caa95b06bc6f048 [1,0,0,1,0,0|1,0,1]=4 6018 B10R1.186 CCCCO[C@@H](C)C1CC1 5714623b0775045bd8bb78334c8add2f [1,0,0,1,0,0|1,0,1]=4 6019 B10R1.186 CCCCO[C@H](C)C1CC1 06fef1180c01d8ce8e0dac9bd42ee881 [1,0,0,1,0,0|1,0,1]=4 6020 B10R1.186 CCCNCC(=O)C1CC1 58e5e8e925a365c978dc73e48d014f51 [1,0,0,1,0,0|2,0,0]=4 6021 B10R1.186 CCCOCC(=O)C1CC1 efdba3cbc9d794b929d4839adbce022d [1,0,0,1,0,0|2,0,0]=4 6022 B10R1.1 CCCN1CCC(CC1)C 86d98128819ac83d185f65fd41c22438 [0,0,0,1,1,0|2,0,0]=4 6023 B10R1.82 CC(C)COC1CC(C1)C efbbba61c596a198b0495b3a6f748d95 [0,0,0,1,1,0|1,0,1]=4 6024 B10R1.95 CCCN1CCC(C1)(C)C d740397c32f7efad75f18990153af4b4 [0,0,0,1,1,0|2,0,0]=4 6025 B10R1.113 CC(C)N1CCCC(=O)C1 68d41201ab078f64eb64f8bf262cabc1 [0,0,0,1,1,0|1,0,0]=3 6026 B10R1.113 CC(C)N1CCNC(=O)C1 4cbfb834f301ca15ca9d3d9f621d8746 [0,0,0,1,1,0|2,0,0]=4 6027 B10R1.113 CC(C)N1CCOC(=O)C1 8aa7e803f7ef2f776de242d3abd6b117 [0,0,0,1,1,0|2,0,0]=4 6028 B10R1.140 CCCC(=O)N1CC(C1)F b8b939372782401947f06c8134701c1c [0,0,0,1,1,0|2,0,0]=4 6029 B10R1.140 CCCC(=O)N1CC(C1)O 0709067cf8e63fb50a96db8946b6b067 [0,0,0,1,1,0|2,0,0]=4 6030 B10R1.211 CC(C)CCN(C)C1CC1 303b0ddd5160180b1ec1c79b74e0bd6d [0,0,0,1,1,0|2,0,0]=4 6031 B10R1.211 CC(C)COC(C)C1CC1 e68429ad5eab6fc707fe612c4fd6d3f5 [0,0,0,1,1,0|1,0,1]=4 6032 B10R1.211 CC(C)CO[C@@H](C)C1CC1 d4863f7e0459c08428f97a368ba7b050 [0,0,0,1,1,0|1,0,1]=4 6033 B10R1.211 CC(C)CO[C@H](C)C1CC1 a8b3f305bf4305a118ac92898e32f99e [0,0,0,1,1,0|1,0,1]=4 6034 B10R1.211 CC(C)OCC(=O)C1CC1 18b83ea17aa064c720fd2f6259d4d3b7 [0,0,0,1,1,0|1,0,0]=3 6035 B10R1.400 CC1(CN1C(=O)CCF)C 25deb13dcf42a4b3d52c61268ecdefa6 [0,0,0,1,1,0|2,0,0]=4 6036 B10R1.400 CC1(CN1C(=O)CCO)C bf4f452f1b1c2a0d60b7ab6bfd59515d [0,0,0,1,1,0|2,0,0]=4 6037 B10R1.400 CCCN(C)C1CC1(C)C 8004c3ca71cf885bc96c71c4a329e60f [0,0,0,1,1,0|2,0,0]=4 6038 B10R1.400 COCC(=O)N1CC1(C)C 9f7dc71e627219acc84934e30261e38c [0,0,0,1,1,0|2,0,0]=4 6039 B10R1.400 CSCC(=O)N1CC1(C)C 25172f5f4d46dea7c37d5ae7565a10a7 [0,0,0,1,1,0|2,0,0]=4 6040 B12R1.17 CC1CCCN(C1)C(=O)CCF 7aaca7493e479264e4aebd2be9d49db0 [0,0,0,1,0,1|2,0,0]=4 6041 B12R1.17 CC1CCCN(C1)C(=O)CCO 696849668a1f05a367eb4846d4d0af64 [0,0,0,1,0,1|2,0,0]=4 6042 B12R1.17 CC1CCCN(C1)C(=O)CCS 95fb504bd15fe74f8fb8481c415d1df3 [0,0,0,1,0,1|2,0,0]=4 6043 B12R1.17 CC1CN(CCO1)C(=O)CCF a3f56ae433362d2c382eb5094f56d3a3 [0,0,0,1,0,1|2,0,0]=4 6044 B12R1.17 CC1CN(CCO1)C(=O)CCO 5e691a9b1d8f68d0273c05794835ffb4 [0,0,0,1,0,1|2,0,0]=4 6045 B12R1.17 CC1CN(CCO1)C(=O)CCS fd1deefa01481e2a8d403084eab101a6 [0,0,0,1,0,1|2,0,0]=4 6046 B12R1.17 CCCC(=O)N1CCCC(C1)C d3490d77f1a4355f31d4999dc6949e28 [0,0,0,1,0,1|1,0,0]=3 6047 B12R1.17 CCCC(=O)N1CCCC(C1)F 70c950222567ec92c2a19ef4bb0f1f8b [0,0,0,1,0,1|2,0,0]=4 6048 B12R1.17 CCCC(=O)N1CCCC(C1)O 315e67c3dcc4f80dd0f05c64b6352338 [0,0,0,1,0,1|2,0,0]=4 6049 B12R1.17 CCCC(=O)N1CCC[C@@H](C1)C d4e3d7c5da457c8ce2729e9f6b70190c [0,0,0,1,0,1|1,0,0]=3 6050 B12R1.17 CCCC(=O)N1CCC[C@@H](C1)F a99e16dd1de6efb202e69647198913e4 [0,0,0,1,0,1|2,0,0]=4 6051 B12R1.17 CCCC(=O)N1CCC[C@@H](C1)O 7e806b85c2d858e0aa2c84ab43f00763 [0,0,0,1,0,1|2,0,0]=4 6052 B12R1.17 CCCC(=O)N1CCC[C@H](C1)C 48f1fd0a020c841c82c0c01324940fda [0,0,0,1,0,1|1,0,0]=3 6053 B12R1.17 CCCC(=O)N1CCC[C@H](C1)F 8322c68a9821000257ef719055da5769 [0,0,0,1,0,1|2,0,0]=4 6054 B12R1.17 CCCC(=O)N1CCC[C@H](C1)O f8eb4b584f3427619393c163031b1cf8 [0,0,0,1,0,1|2,0,0]=4 6055 B12R1.17 CCCC(=O)N1CCOC(C1)C 38a550aea32ac6e6f044b43bed843a6e [0,0,0,1,0,1|1,0,0]=3 6056 B12R1.17 CCCC(=O)N1CCO[C@@H](C1)C fe8d268aac9972115ccc944b3244e081 [0,0,0,1,0,1|1,0,0]=3 6057 B12R1.17 CCCC(=O)N1CCO[C@H](C1)C bc2429eb959189b2b49eb6fc581551b9 [0,0,0,1,0,1|1,0,0]=3 6058 B12R1.17 COCC(=O)N1CCCC(C1)C 6ffbbb6bc13be24120723d9d8f398a1b [0,0,0,1,0,1|2,0,0]=4 6059 B12R1.17 COCC(=O)N1CCC[C@@H](C1)C 2505c3a95b058c2d3575b68f6d262174 [0,0,0,1,0,1|2,0,0]=4 6060 B12R1.17 COCC(=O)N1CCC[C@H](C1)C 4daea61403694fdd414fbe7b6ecd7914 [0,0,0,1,0,1|2,0,0]=4 6061 B12R1.17 COCC(=O)N1CCOC(C1)C 0381d328196b991c2ebb807c754c1429 [0,0,0,1,0,1|2,0,0]=4 6062 B12R1.17 COCC(=O)N1CCO[C@@H](C1)C d70d965a4fc3b7d1e6aaf80d958a515a [0,0,0,1,0,1|2,0,0]=4 6063 B12R1.17 COCC(=O)N1CCO[C@H](C1)C 0b8766e08fb7cfeedb788599f476513c [0,0,0,1,0,1|2,0,0]=4 6064 B12R1.17 CSCC(=O)N1CCCC(C1)C d1a2303fec7bc78cb342e3d089b11fb9 [0,0,0,1,0,1|2,0,0]=4 6065 B12R1.17 CSCC(=O)N1CCC[C@@H](C1)C c3bb1711c280268138fa56eeb39573bf [0,0,0,1,0,1|2,0,0]=4 6066 B12R1.17 CSCC(=O)N1CCC[C@H](C1)C 5b5e800f7f5ab7d7d3b2e89179fe3c4d [0,0,0,1,0,1|2,0,0]=4 6067 B12R1.17 CSCC(=O)N1CCOC(C1)C e536919c70096629e24eca24837d4075 [0,0,0,1,0,1|2,0,0]=4 6068 B12R1.17 CSCC(=O)N1CCO[C@@H](C1)C 29bc18e93c7e6e958b705359d8884345 [0,0,0,1,0,1|2,0,0]=4 6069 B12R1.17 CSCC(=O)N1CCO[C@H](C1)C 44a3b6ed1c810f99adf6975356d0ea24 [0,0,0,1,0,1|2,0,0]=4 6070 B12R1.17 C[C@@H]1CCCN(C1)C(=O)CCF 95f4f508385c520e58a3bde05413cc22 [0,0,0,1,0,1|2,0,0]=4 6071 B12R1.17 C[C@@H]1CCCN(C1)C(=O)CCO 73d700a807639fa1f17b8a40c1e0a68b [0,0,0,1,0,1|2,0,0]=4 6072 B12R1.17 C[C@@H]1CCCN(C1)C(=O)CCS 7c847f4b6391119203daa6ef59b27ee0 [0,0,0,1,0,1|2,0,0]=4 6073 B12R1.17 C[C@@H]1CN(CCO1)C(=O)CCF 36d321de13ca7079bd81b965cac9b817 [0,0,0,1,0,1|2,0,0]=4 6074 B12R1.17 C[C@@H]1CN(CCO1)C(=O)CCO 036f8d9261d432d0c84431b3283d5637 [0,0,0,1,0,1|2,0,0]=4 6075 B12R1.17 C[C@@H]1CN(CCO1)C(=O)CCS df1a6c1353748bbef7da8d6d959b64a1 [0,0,0,1,0,1|2,0,0]=4 6076 B12R1.17 C[C@H]1CCCN(C1)C(=O)CCF a604c8f5e8733a76ed99d0150a0235bd [0,0,0,1,0,1|2,0,0]=4 6077 B12R1.17 C[C@H]1CCCN(C1)C(=O)CCO 49aa86cc22f8dc652748594cf62fc534 [0,0,0,1,0,1|2,0,0]=4 6078 B12R1.17 C[C@H]1CCCN(C1)C(=O)CCS 0a754ea7a755bd5cfc400133f9811c42 [0,0,0,1,0,1|2,0,0]=4 6079 B12R1.17 C[C@H]1CN(CCO1)C(=O)CCF 950dfa662f0bb7d06af6dc715a25f704 [0,0,0,1,0,1|2,0,0]=4 6080 B12R1.17 C[C@H]1CN(CCO1)C(=O)CCO be758b6ddd875d9c3211edb3831a822e [0,0,0,1,0,1|2,0,0]=4 6081 B12R1.17 C[C@H]1CN(CCO1)C(=O)CCS 47bf43e16ec0b1018f7941840c5d4e57 [0,0,0,1,0,1|2,0,0]=4 6082 B12R1.31 CC1CCC(C1)NC(=O)CCF 9b5317fb513c52861a33865d93f511b6 [0,0,0,1,0,1|2,0,0]=4 6083 B12R1.31 CCCC(=O)CN1CCC(C1)C ef5c1621be171b9f655faf7bf0a8cf26 [0,0,0,1,0,1|1,0,0]=3 6084 B12R1.31 CCCC(=O)CN1CCC(C1)F a85b57091022f175c8598ae111ff1eeb [0,0,0,1,0,1|2,0,0]=4 6085 B12R1.31 CCCC(=O)CN1CCC(C1)O 0680d8eb1d02aeb3676cdcbd3735eb90 [0,0,0,1,0,1|2,0,0]=4 6086 B12R1.31 CCCC(=O)CN1CCN(C1)C e5ed018dd19b012834e295b20479caca [0,0,0,1,0,1|2,0,0]=4 6087 B12R1.31 CCCC(=O)CN1CC[C@@H](C1)F 04faaed433ab3ce06658f2fb3db274db [0,0,0,1,0,1|2,0,0]=4 6088 B12R1.31 CCCC(=O)CN1CC[C@@H](C1)O 4822ece2fe3e1d1376c0bbf2489c525a [0,0,0,1,0,1|2,0,0]=4 6089 B12R1.31 CCCC(=O)CN1CC[C@H](C1)F 7b227149de51315b4a983e0b8a1e6c14 [0,0,0,1,0,1|2,0,0]=4 6090 B12R1.31 CCCC(=O)CN1CC[C@H](C1)O 0851209af277feb8e153ec07721a867f [0,0,0,1,0,1|2,0,0]=4 6091 B12R1.31 CCCC(=O)NC1CCC(C1)O fb0614719f38074bca513561a0aed976 [0,0,0,1,0,1|2,0,0]=4 6092 B12R1.31 CCCC(=O)NC1CCN(C1)C 09ddf9278221d0c700280a4810f48fb3 [0,0,0,1,0,1|2,0,0]=4 6093 B12R1.31 CCCC(=O)N[C@@H]1CCN(C1)C 1baaca8fa67f8378a23ea1c902046fba [0,0,0,1,0,1|2,0,0]=4 6094 B12R1.31 CCCC(=O)N[C@@H]1CC[C@@H](C1)O 5e9f7c138388e1b473c14caac0cdbc54 [0,0,0,1,0,1|2,0,0]=4 6095 B12R1.31 CCCC(=O)N[C@@H]1CC[C@H](C1)O 474d6c6a977a902f14e6f7f80a8e132b [0,0,0,1,0,1|2,0,0]=4 6096 B12R1.31 CCCC(=O)N[C@H]1CCN(C1)C 5d07c64b466f21372e0db06e9ba86b85 [0,0,0,1,0,1|2,0,0]=4 6097 B12R1.31 CCCC(=O)N[C@H]1CC[C@@H](C1)O 05a28e9d75aa04ea5adcaaaa059ba9eb [0,0,0,1,0,1|2,0,0]=4 6098 B12R1.31 CCCC(=O)N[C@H]1CC[C@H](C1)O efa6fa74c15c1168c1fdda0ee9257c19 [0,0,0,1,0,1|2,0,0]=4 6099 B12R1.31 CCCC(=S)OC1CCN(C1)C 70fba5c675076c5706f7cbf39bdc7dfc [0,0,0,1,0,1|1,1,0]=4 6100 B12R1.31 CCCC(=S)OC1COC(C1)C a29311b8c54f554c25dda4fdce480ce4 [0,0,0,1,0,1|0,1,0]=3 6101 B12R1.31 CCCC(=S)O[C@@H]1CCN(C1)C 97c61489b203c7338661cd4a72f37bd1 [0,0,0,1,0,1|1,1,0]=4 6102 B12R1.31 CCCC(=S)O[C@H]1CCN(C1)C 754f30e532b2f38a4ed7bcbbce94a731 [0,0,0,1,0,1|1,1,0]=4 6103 B12R1.31 CCCC(C)OC1CCC(C1)C e43ab73ec363812030398ff72215e589 [0,0,0,1,0,1|1,0,1]=4 6104 B12R1.31 CCCC(C)OC1COC(C1)C c093c195207ed2492ddb877ee09b17ff [0,0,0,1,0,1|1,0,1]=4 6105 B12R1.31 CCC[C@@H](C)OC1COC(C1)C d884917c2bda09bf0da22c1a6087611b [0,0,0,1,0,1|1,0,1]=4 6106 B12R1.31 CCC[C@H](C)OC1COC(C1)C ed9ee3fca2a226007ce4581d8ca707d2 [0,0,0,1,0,1|1,0,1]=4 6107 B12R1.31 CCNC(=O)CN1CCC(C1)C 135190ac6887f37d13a3a199860b5541 [0,0,0,1,0,1|2,0,0]=4 6108 B12R1.31 CCOC(=O)CN1CCC(C1)C fdd3125981afeda5502b369f754c1ac2 [0,0,0,1,0,1|2,0,0]=4 6109 B12R1.31 COCC(=O)CN1CCC(C1)C f137b6f80d1f15cc2f48e380b6b11213 [0,0,0,1,0,1|2,0,0]=4 6110 B12R1.31 COCC(=O)NC1CCC(C1)C e40c63275385c69315d4a85459ffb949 [0,0,0,1,0,1|2,0,0]=4 6111 B12R1.87 CCC1C(=O)NCCN1C(C)C 4f8935aed114f6250bc709483c7e96ec [0,0,0,1,0,1|1,0,0]=3 6112 B12R1.130 C=C(C)CCOC1CCCC1=O e253b16e352f920ba8fed5458cac9902 [0,0,0,1,0,1|0,0,2]=4 6113 B12R1.130 CC(=CCOC1CCCC1=O)C ceee3ccb8b3b91955bdba9f309dbbd23 [0,0,0,1,0,1|0,0,2]=4 6114 B12R1.130 CC(=O)CCOC1CCCC1=O 2e7bd6e0d76e424877ed4b699dbab07f [0,0,0,1,0,1|1,0,1]=4 6115 B12R1.130 CC(C)CCNC1CCNC1=O 6010d1c0ffb9d2a600e3b4fafc444a00 [0,0,0,1,0,1|2,0,0]=4 6116 B12R1.130 CC(C)CCNC1CCSC1=O 103a90f4bff20d5ea97319076acb6efa [0,0,0,1,0,1|2,0,0]=4 6117 B12R1.130 CC(C)CCN[C@@H]1CCNC1=O fb5ac5530ccfc06018077e3667f2435f [0,0,0,1,0,1|2,0,0]=4 6118 B12R1.130 CC(C)CCN[C@@H]1CCOC1=O c09c12997d768a5daff7a2ab9afaf0cb [0,0,0,1,0,1|2,0,0]=4 6119 B12R1.130 CC(C)CCN[C@H]1CCNC1=O e2ee2f5a2f0dbd9a8a7f7150ae2cb0fc [0,0,0,1,0,1|2,0,0]=4 6120 B12R1.130 CC(C)CCN[C@H]1CCOC1=O 1bf9e2a006f8a3a7c45df2650f2af18d [0,0,0,1,0,1|2,0,0]=4 6121 B12R1.130 CC(C)CCOC1=CCCC1=O 2637f67eef11bc7f161a220f35c132a2 [0,0,0,1,0,1|0,0,1]=3 6122 B12R1.130 CC(C)CCOC1CCC=C1Br d8bc739c808a74be0148229bcd51f07f [0,0,0,1,0,1|1,0,1]=4 6123 B12R1.130 CC(C)CCOC1CCCC1=O d88d313049e0fc1e3ac7c43d24fe8987 [0,0,0,1,0,1|0,0,0]=2 6124 B12R1.130 CC(C)CCOC1CCCC1C 55ddd67b205cc87f9d8a4ecc513d91dd [0,0,0,1,0,1|1,0,1]=4 6125 B12R1.130 CC(C)CCOC1CCNC1=O a05aff6c6f13cd4326868c54f6e4d070 [0,0,0,1,0,1|1,0,0]=3 6126 B12R1.130 CC(C)CCOC1CCOC1=O 065e18202b2f34de1057468333896f35 [0,0,0,1,0,1|1,0,0]=3 6127 B12R1.130 CC(C)CCO[C@@H]1CCC[C@@H]1C e59c1323e858c9c3d2bf317c0fd61c74 [0,0,0,1,0,1|1,0,1]=4 6128 B12R1.130 CC(C)CCO[C@@H]1CCC[C@H]1C 74ebbbf15f3e4aaeaaad525df6ba374f [0,0,0,1,0,1|1,0,1]=4 6129 B12R1.130 CC(C)CCO[C@@H]1CCC[C@H]1F 2c063e2512bbdb35ff7912c9bbbcf3a8 [0,0,0,1,0,1|1,0,1]=4 6130 B12R1.130 CC(C)CCO[C@@H]1CCNC1=O a54d603fac3787e4a4ce24323548ab65 [0,0,0,1,0,1|1,0,0]=3 6131 B12R1.130 CC(C)CCO[C@@H]1CCOC1=O c2d3462c271558473f00cc0272c3b08b [0,0,0,1,0,1|1,0,0]=3 6132 B12R1.130 CC(C)CCO[C@H]1CCC[C@@H]1C 3ee8196bc72337edf7e94b77c0a3b3da [0,0,0,1,0,1|1,0,1]=4 6133 B12R1.130 CC(C)CCO[C@H]1CCC[C@H]1C c90c234a52c37dcb8b6930ea70082dd0 [0,0,0,1,0,1|1,0,1]=4 6134 B12R1.130 CC(C)CCO[C@H]1CCNC1=O 1111438da6256b69439fb10c744783e1 [0,0,0,1,0,1|1,0,0]=3 6135 B12R1.130 CC(C)CCO[C@H]1CCOC1=O 5f5dd73230da64fb75eff32b1531c985 [0,0,0,1,0,1|1,0,0]=3 6136 B12R1.130 CC(C)CNCC1CCNC1=O a2eca1be7d86c0097f8178a6ac468d9f [0,0,0,1,0,1|2,0,0]=4 6137 B12R1.130 CC(C)CNCN1CCCC1=O 3d7f9c82541f967bda6cb9060827ff6a [0,0,0,1,0,1|1,0,0]=3 6138 B12R1.130 CC(C)COCC1=CCCC1=O 74103484ca788ffb0f18dcf55f659c73 [0,0,0,1,0,1|1,0,1]=4 6139 B12R1.130 CC(C)COCC1CCCC1=O f792d4269ccf6c55fef908e464db1764 [0,0,0,1,0,1|1,0,0]=3 6140 B12R1.130 CC(C)COCC1CCNC1=O 9cf45521b583ea4a72a7329bc85bc252 [0,0,0,1,0,1|2,0,0]=4 6141 B12R1.130 CC(C)COCN1CCCC1=O 2efb7815a06de04306e859cf532dfa48 [0,0,0,1,0,1|1,0,0]=3 6142 B12R1.130 CC(C)NCCN1CCCC1=O 65f715d23a0174875563ea472b9f55f9 [0,0,0,1,0,1|1,0,0]=3 6143 B12R1.130 CC(C)NCCN1CCNC1=O ffd2f90f76c271be0871583854903877 [0,0,0,1,0,1|2,0,0]=4 6144 B12R1.130 CC(C)OCCC1CCNC1=O f1fd900f82d46e0c5dbf7aad328fe586 [0,0,0,1,0,1|2,0,0]=4 6145 B12R1.130 CC(C)OCCN1CCCC1=O 5d0fe27852e2ed1c7cf3f31290c24bc3 [0,0,0,1,0,1|1,0,0]=3 6146 B12R1.130 CC(C)OCCN1CCNC1=O fbf4b79c5dda12f0e99d47dd12358a04 [0,0,0,1,0,1|2,0,0]=4 6147 B12R1.130 CC(C)OCOC1=CCCC1=O 4f6eb1d63a1faedb6b53917a0d350d19 [0,0,0,1,0,1|1,0,1]=4 6148 B12R1.130 CC(C)OCOC1CCNC1=O f13772b475ae62eff787ce0ef00e8d4e [0,0,0,1,0,1|2,0,0]=4 6149 B12R1.130 CC(C)OCO[C@@H]1CCNC1=O fa68e680651c42576b62c44ae4963017 [0,0,0,1,0,1|2,0,0]=4 6150 B12R1.130 CC(C)OCO[C@H]1CCNC1=O b7f3ffeaf5a6ca1b9152830caa8e02ba [0,0,0,1,0,1|2,0,0]=4 6151 B12R1.130 CC(F)COCN1CCCC1=O e2f82f047cbe8fa69d0ffaafaacfa51c [0,0,0,1,0,1|2,0,0]=4 6152 B12R1.130 CC(O)CNCN1CCCC1=O 1c237ab01eb51417404ddf5874166f88 [0,0,0,1,0,1|2,0,0]=4 6153 B12R1.130 CC(S)COCN1CCCC1=O 8171c271757a8ee7dfc1a6e87405da2d [0,0,0,1,0,1|2,0,0]=4 6154 B12R1.130 CN(C)CCOC1=CCCC1=O c2b296678913f0d08187bf42b5537532 [0,0,0,1,0,1|1,0,1]=4 6155 B12R1.130 CN(C)CCOC1CCCC1=O afd80a3dc01018d86565bb1e345373b7 [0,0,0,1,0,1|1,0,0]=3 6156 B12R1.130 CN(C)CCOC1CCNC1=O 7eee8530e73d38b8da17ba4cc75fc4be [0,0,0,1,0,1|2,0,0]=4 6157 B12R1.130 CN(C)CCOC1CCOC1=O 15ecf86851f04d7b59c61a966ed08690 [0,0,0,1,0,1|2,0,0]=4 6158 B12R1.130 CN(C)CCO[C@@H]1CCNC1=O 739f6b0ea7f5d2adadc4293384304323 [0,0,0,1,0,1|2,0,0]=4 6159 B12R1.130 CN(C)CCO[C@@H]1CCOC1=O 89978c2e53df61e6fb8d8bae128f8a51 [0,0,0,1,0,1|2,0,0]=4 6160 B12R1.130 CN(C)CCO[C@H]1CCNC1=O cb3457db97428dc00dd2ed2a831a8d09 [0,0,0,1,0,1|2,0,0]=4 6161 B12R1.130 CN(C)CCO[C@H]1CCOC1=O 17310c1c2613668500220e36d17d9de2 [0,0,0,1,0,1|2,0,0]=4 6162 B12R1.130 CN(C)COCC1CCCC1=O 8ad4fb43b06b453210e8afce0c78f490 [0,0,0,1,0,1|2,0,0]=4 6163 B12R1.130 CN(C)COCN1CCCC1=O b944ba029a746c17681d01503adac167 [0,0,0,1,0,1|2,0,0]=4 6164 B12R1.130 CS(=O)CCOC1CCCC1=O 7cd75cba36604253d23bfee778bd4c7a [0,0,0,1,0,1|2,0,0]=4 6165 B12R1.130 C[C@@H](F)COCN1CCCC1=O c0f163addeb7a35087c45a9350887fb8 [0,0,0,1,0,1|2,0,0]=4 6166 B12R1.130 C[C@@H](O)CNCN1CCCC1=O 5287f7ffa7eb0f05aca0dfb8f1c70be3 [0,0,0,1,0,1|2,0,0]=4 6167 B12R1.130 C[C@H](F)COCN1CCCC1=O 78ceb3170e7b571b163ba976dae35972 [0,0,0,1,0,1|2,0,0]=4 6168 B12R1.130 C[C@H](O)CNCN1CCCC1=O b924ee89b23affbb04a85d4a2bc82e48 [0,0,0,1,0,1|2,0,0]=4 6169 B12R1.130 O=C1CCCC1OCCC(F)F 4dfd53bed0c8373ed84b0f153cc42593 [0,0,0,1,0,1|2,0,0]=4 6170 B12R1.220 CC(C)CCCOC1CC(C1)C bc11c588125a7b9bc3b69db00075e2af [0,0,0,1,0,1|1,0,1]=4 6171 B12R1.220 CC(C)CCOCC1CC(C1)C 37539a932e905cf5da4758b43d294cd1 [0,0,0,1,0,1|1,0,1]=4 6172 B12R1.220 CC(C)CCOC[C@H]1C[C@@H](C1)C 263c1d63854f21bf7ea1b95525e5b7ff [0,0,0,1,0,1|1,0,1]=4 6173 B12R1.220 CC1CC(C1)OCCOC(C)C e13f5f9690ce5f0ed302895ed45cb600 [0,0,0,1,0,1|1,0,1]=4 6174 B12R1.220 CC1CC(C1)OCCSC(C)C 871d045f2412ec331e6a90aed7233a43 [0,0,0,1,0,1|1,0,1]=4 6175 B12R1.226 CC(C)CCN1CCCC(=O)C1 a830a54d7502cdb7a8d1d4f3c1814ed8 [0,0,0,1,0,1|1,0,0]=3 6176 B12R1.226 CC(C)CCN1CCNC(=O)C1 d32e13f3f1ed03a3c76f50f734ff63b4 [0,0,0,1,0,1|2,0,0]=4 6177 B12R1.226 CC(C)CCN1CCOC(=O)C1 e3cdc8e0f5faaf112122261f6b908fc3 [0,0,0,1,0,1|2,0,0]=4 6178 B12R1.226 CC(C)CNC1CCCC(=O)C1 c04d3cac56f15411c34bc5dc448e32a6 [0,0,0,1,0,1|1,0,0]=3 6179 B12R1.226 CC(C)CNC1CCNC(=O)C1 cadb5ba3fd22fddb134b7395130f1b66 [0,0,0,1,0,1|2,0,0]=4 6180 B12R1.226 CC(C)CN[C@@H]1CCNC(=O)C1 ae29e59063d9c7dd20338b065609abc7 [0,0,0,1,0,1|2,0,0]=4 6181 B12R1.226 CC(C)CN[C@H]1CCNC(=O)C1 007ec514e6d8fe1ec8803cb837a8150b [0,0,0,1,0,1|2,0,0]=4 6182 B12R1.226 CC(C)COC1=CC(=O)CCC1 6e841d1e84d5f6db65bcb74df7031274 [0,0,0,1,0,1|1,0,1]=4 6183 B12R1.226 CC(C)COC1CCCC(=O)C1 40de33f5f91a93c281e6a10897222e6f [0,0,0,1,0,1|1,0,0]=3 6184 B12R1.226 CC(C)COC1CCNC(=O)C1 e6d0b707fb00df0d2114d9af27be9381 [0,0,0,1,0,1|2,0,0]=4 6185 B12R1.226 CC(C)CO[C@@H]1CCNC(=O)C1 e5fdbd7c01b1218c60ab96c6197374f0 [0,0,0,1,0,1|2,0,0]=4 6186 B12R1.226 CC(C)CO[C@H]1CCNC(=O)C1 6769264bf7d3d085b9a69ba9ef05ac81 [0,0,0,1,0,1|2,0,0]=4 6187 B12R1.226 CC(C)NCC1CCCC(=O)N1 dbc11154bde39ec7fe9017b59ee30dea [0,0,0,1,0,1|1,0,0]=3 6188 B12R1.226 CC(C)NCC1CCNC(=O)C1 7f7d175767f31628d7db9722aa343954 [0,0,0,1,0,1|2,0,0]=4 6189 B12R1.226 CC(C)OCC1CCCC(=O)C1 c7210364458c9cb6e1b32b7682bb772a [0,0,0,1,0,1|1,0,0]=3 6190 B12R1.226 CC(C)OCC1CCCC(=O)N1 033ee7da4e7de3285d99dfed2a22b570 [0,0,0,1,0,1|1,0,0]=3 6191 B12R1.226 CC(C)OCC1CCNC(=O)C1 9f3f4314713d7ecaf42f62826d4ee4e5 [0,0,0,1,0,1|2,0,0]=4 6192 B12R1.226 CC(C)OCC1COCC(=O)N1 c7c47fdde06306c7369738fe0406ebe8 [0,0,0,1,0,1|2,0,0]=4 6193 B12R1.226 CC(C)OCN1CCCC(=O)C1 c643fae93133fbd20fa5b49bdf4bca72 [0,0,0,1,0,1|2,0,0]=4 6194 B12R1.226 CC(C)OC[C@@H]1CCCC(=O)N1 4bdda04af8846d2ec6ae9f9a0da4048e [0,0,0,1,0,1|1,0,0]=3 6195 B12R1.226 CC(C)OC[C@@H]1COCC(=O)N1 52e01ed6e0ddaf5dc3aafd8a9891c387 [0,0,0,1,0,1|2,0,0]=4 6196 B12R1.226 CC(C)OC[C@H]1CCCC(=O)N1 e1950809fe61f656568bb84b34475e28 [0,0,0,1,0,1|1,0,0]=3 6197 B12R1.226 CC(C)OC[C@H]1COCC(=O)N1 8ffcfb903ea4cacc4ab29fb2efb24297 [0,0,0,1,0,1|2,0,0]=4 6198 B12R1.226 CC(O)CCN1CCCC(=O)C1 8105f0c5fac9fcbfb9b4f75863e4cf6b [0,0,0,1,0,1|2,0,0]=4 6199 B12R1.226 CC(O)CNC1CCCC(=O)C1 0f7085393e2563cee3541728d027a532 [0,0,0,1,0,1|2,0,0]=4 6200 B12R1.226 CC1=CC(CCC1)OCC(C)C b3098ebf342ff4734f9fc6636861a802 [0,0,0,1,0,1|2,0,0]=4 6201 B12R1.226 CN(C)CCN1CCCC(=O)C1 86cafc6e0ebbb64be6d4dc9ab5853b66 [0,0,0,1,0,1|2,0,0]=4 6202 B12R1.226 CN(C)COC1CCCC(=O)C1 f8abc1d467777af24b13b71e390df19d [0,0,0,1,0,1|2,0,0]=4 6203 B12R1.226 C[C@@H](O)CNC1CCCC(=O)C1 6216f22f5bb7760e6d94729726e2b8fd [0,0,0,1,0,1|2,0,0]=4 6204 B12R1.226 C[C@H](O)CNC1CCCC(=O)C1 8f87c196c4710af1c495c93202cc4b48 [0,0,0,1,0,1|2,0,0]=4 6205 B12R1.233 CC(C)OC1CCC(=O)CC1C 18beb762311a949943fac8cebc95469c [0,0,0,1,0,1|1,0,0]=3 6206 B12R1.233 CC(C)OC1CCC(=O)NC1C 2ca386400125d5ecaf041486b3cdfa35 [0,0,0,1,0,1|2,0,0]=4 6207 B12R1.255 CC(C)CCCOC1CCCC1 4b8f1f37b87b0335211d3231961aadc9 [0,0,0,1,0,1|1,0,1]=4 6208 B12R1.255 CC(C)CCCOC1CCCO1 6580db3bf17a8833c31b1cbd4a4b8177 [0,0,0,1,0,1|0,0,2]=4 6209 B12R1.255 CC(C)CCNCC1=CCCC1 a83c7c89f14f9a676c74c114e1861e90 [0,0,0,1,0,1|2,0,0]=4 6210 B12R1.255 CC(C)CCOCC1CCCC1 fee412ea9039bb5cf6ec5ae77fbc33a8 [0,0,0,1,0,1|1,0,1]=4 6211 B12R1.255 CC(C)CCOCC1CCCO1 8446406c7f31c46b14132d0b1721ab73 [0,0,0,1,0,1|0,0,2]=4 6212 B12R1.255 CC(C)CCOCC1CCCS1 d6799e93876dd177caa42887b3d0bf20 [0,0,0,1,0,1|0,1,1]=4 6213 B12R1.255 CC(C)CCOCN1CCCC1 0fde17e337870cf53dac83b6c57aa5a4 [0,0,0,1,0,1|2,0,0]=4 6214 B12R1.255 CC(C)CCOC[C@@H]1CCCO1 8818d8561826537de09e9f2abaeb32af [0,0,0,1,0,1|0,0,2]=4 6215 B12R1.255 CC(C)CCOC[C@H]1CCCO1 ab8f5513359190ba90c88b99e92ee725 [0,0,0,1,0,1|0,0,2]=4 6216 B12R1.255 CC(C)COCC=C1CCCC1 c33ab1c2585eed486c23bee71b413b91 [0,0,0,1,0,1|2,0,0]=4 6217 B12R1.255 CC(C)NCCOC1CCCC1 bfa104d441ddd37999eba81e2f2d6317 [0,0,0,1,0,1|1,0,1]=4 6218 B12R1.255 CC(C)OCCOC1CCCC1 dbd68ecd0262f3e4af5099d45e5cd9d0 [0,0,0,1,0,1|1,0,1]=4 6219 B12R1.255 CC(C)OCCOC1CCCO1 22c2f53171999d2a1b094af3f1668126 [0,0,0,1,0,1|0,0,2]=4 6220 B12R1.255 CC(C)SCCOC1CCCC1 0e169c6cca3bdd29066e76366b9a98ec [0,0,0,1,0,1|1,0,1]=4 6221 B12R1.255 CC(C)SCCOC1CCCO1 e9f928a620a56f58ba23893f03e07c46 [0,0,0,1,0,1|0,0,2]=4 6222 B12R1.310 CCCC(=O)CNCCC1CC1 b8dac4d3972853401f1f9626ab0f926b [0,0,0,1,0,1|1,0,0]=3 6223 B12R1.310 CCCC(=O)CNCCN1CC1 d41f874c88bdfc4c1e71113647250be1 [0,0,0,1,0,1|2,0,0]=4 6224 B12R1.310 CCCC(=O)COCCC1CC1 b402d66c3a5794f8e89c82fe4622ea35 [0,0,0,1,0,1|0,0,0]=2 6225 B12R1.310 CCCC(=O)COCCN1CC1 8c6bfffa396c0206ba26b78a44405ca9 [0,0,0,1,0,1|1,0,0]=3 6226 B12R1.310 CCCC(=O)NCCOC1CC1 5eef59f7cdc291e46b19d99b5f39e8f3 [0,0,0,1,0,1|1,0,0]=3 6227 B12R1.310 CCCC(=O)OCCOC1CC1 c6355cd2c488ee5c8251c82f789bd58c [0,0,0,1,0,1|0,0,0]=2 6228 B12R1.310 CCCC(=O)OCNCC1CC1 5054915f96cb1a18ad842b1948acbcc8 [0,0,0,1,0,1|0,0,0]=2 6229 B12R1.310 CCCC(=O)OCOCC1CC1 827ee871609f5dfa9d7df47c0a9a3eef [0,0,0,1,0,1|0,0,0]=2 6230 B12R1.310 CCCC(=S)OCCOC1CC1 ed2b16a5dde6b35df010eab9e0bf1589 [0,0,0,1,0,1|0,1,0]=3 6231 B12R1.310 CCCC(C)COCCC1CC1 37278c7da780aad024b4c064a4c84757 [0,0,0,1,0,1|1,0,1]=4 6232 B12R1.310 CCCC(C)OCCCC1CC1 1ea5b09d6e8dcb94d0f8acbc09921d35 [0,0,0,1,0,1|1,0,1]=4 6233 B12R1.310 CCCC(C)OCCOC1CC1 cf04836d2bb4d35701252a0e12834c4a [0,0,0,1,0,1|1,0,1]=4 6234 B12R1.310 CCC[C@@H](C)OCCOC1CC1 f814fe667a85066061607ad4ee8a0cf8 [0,0,0,1,0,1|1,0,1]=4 6235 B12R1.310 CCC[C@H](C)OCCOC1CC1 fa07b01a3ba603b89f0f927fb74e9fcb [0,0,0,1,0,1|1,0,1]=4 6236 B12R1.310 CCNC(=O)CCNCC1CC1 3c1a832a86a7dc9d6c3f06dbc393f017 [0,0,0,1,0,1|2,0,0]=4 6237 B12R1.310 CCNC(=O)CCOCC1CC1 61e8f3bf495d8d92ee17b6c5e62c46ba [0,0,0,1,0,1|2,0,0]=4 6238 B12R1.310 CCNC(=O)CNCCC1CC1 8ad3b04a6e9f0c816c521baa85f43402 [0,0,0,1,0,1|2,0,0]=4 6239 B12R1.310 CCNC(=O)COCCC1CC1 e276248ced3940d7460cf97579f1b9ea [0,0,0,1,0,1|1,0,0]=3 6240 B12R1.310 CCNC(=O)COCCN1CC1 84dcfba3fe6c156842a9d72ed7657714 [0,0,0,1,0,1|2,0,0]=4 6241 B12R1.310 CCOC(=O)CCCNC1CC1 77dd52c73571f9442c46d8beeccc943a [0,0,0,1,0,1|2,0,0]=4 6242 B12R1.310 CCOC(=O)CCCOC1CC1 3d3a83f15beb306bdfdc95ab152c9887 [0,0,0,1,0,1|2,0,0]=4 6243 B12R1.310 CCOC(=O)CCNCC1CC1 52eaa40e8b3df50cf94f23c6de2d80a9 [0,0,0,1,0,1|2,0,0]=4 6244 B12R1.310 CCOC(=O)CCOCC1CC1 ed8f7a42b3ca6d8edcf5098fa9e659bf [0,0,0,1,0,1|2,0,0]=4 6245 B12R1.310 CCOC(=O)CNCCC1CC1 1df18f0b9f18a254c9bb8ce694c97667 [0,0,0,1,0,1|2,0,0]=4 6246 B12R1.310 CCOC(=O)COCCC1CC1 c9b01d3508f16c18b499953bc74106e7 [0,0,0,1,0,1|1,0,0]=3 6247 B12R1.310 CCOC(=O)COCCN1CC1 b74cdd2ef8c0ca24dea0ea8b927d0f77 [0,0,0,1,0,1|2,0,0]=4 6248 B12R1.310 CCOC(=O)OCNCC1CC1 7a5cf76961e7131344f26a098bc0980d [0,0,0,1,0,1|1,0,0]=3 6249 B12R1.310 CCOC(=O)OCOCC1CC1 a097b92a353b9bf41b083438dd24597d [0,0,0,1,0,1|1,0,0]=3 6250 B12R1.310 CCSC(=O)OCNCC1CC1 23e81ead4463d8f0e76d28a529d515f4 [0,0,0,1,0,1|1,0,0]=3 6251 B12R1.310 CCSC(=O)OCOCC1CC1 560e9933bfb68f8f9bb0b33a5f0edce8 [0,0,0,1,0,1|1,0,0]=3 6252 B12R1.310 COCC(=O)CNCCC1CC1 6c409632f587966f7fe92bca5ccfae1c [0,0,0,1,0,1|2,0,0]=4 6253 B12R1.310 COCC(=O)COCCC1CC1 907f497e3915512c906c876d32ae387c [0,0,0,1,0,1|1,0,0]=3 6254 B12R1.310 COCC(=O)COCCN1CC1 f4479a8a2f6a33d5600954936f69d30f [0,0,0,1,0,1|2,0,0]=4 6255 B12R1.310 COCC(=O)NCCOC1CC1 9bdb5f875d8c95cf5d39ce377a97e8d1 [0,0,0,1,0,1|2,0,0]=4 6256 B12R1.310 CSCC(=O)NCCOC1CC1 f2cf50719134c6cc6c31e4577722f852 [0,0,0,1,0,1|2,0,0]=4 6257 B12R1.310 O=C(CCF)NCCOC1CC1 5ce60401884f9faeb32546ba96dab900 [0,0,0,1,0,1|2,0,0]=4 6258 B12R1.310 O=C(CCO)NCCOC1CC1 493b053d378ddae46fc8e0eeaa985c4a [0,0,0,1,0,1|2,0,0]=4 6259 B12R1.310 O=C(CCS)NCCOC1CC1 1b7c30a60b88793d2787efbafb3d53a7 [0,0,0,1,0,1|2,0,0]=4 6260 B12R1.317 CC1(CCCN1C(=O)CCF)C 934bcf482557c2d8fc1c2ce674a31d95 [0,0,0,1,0,1|2,0,0]=4 6261 B12R1.317 CC1(CCCN1C(=O)CCO)C 8bc889b7f70993f2b57940a7646c1f04 [0,0,0,1,0,1|2,0,0]=4 6262 B12R1.317 CC1(CCCN1C(=O)CCS)C 29435085423504691864be5c2772c5cf [0,0,0,1,0,1|2,0,0]=4 6263 B12R1.317 CCCC(=O)N1CCCC1(C)C 788279873d02db464cc371e9e237e978 [0,0,0,1,0,1|1,0,0]=3 6264 B12R1.317 COCC(=O)N1CCCC1(C)C e1abfe231cd9b04ae51600569a23741d [0,0,0,1,0,1|2,0,0]=4 6265 B12R1.317 COCC(=O)N1CCOC1(C)C 7b3319c0f4f02763275b2c418cc43da8 [0,0,0,1,0,1|2,0,0]=4 6266 B12R1.317 CSCC(=O)N1CCCC1(C)C 721e29f30024c18df078072f0cde12e4 [0,0,0,1,0,1|2,0,0]=4 6267 B12R1.317 CSCC(=O)N1CCOC1(C)C 3ec805d5b33d1ba20a9bd4d20cd5f541 [0,0,0,1,0,1|2,0,0]=4 6268 B12R1.467 CCCC(=O)CNC1CC(C1)F e3029ec00771eb40f09c4232b4132248 [0,0,0,1,0,1|2,0,0]=4 6269 B12R1.467 CCCC(=O)CNC1CC(C1)O 2bb62a2d0e8b6015b1c2c404771f67b7 [0,0,0,1,0,1|2,0,0]=4 6270 B12R1.467 CCCC(=O)CNC1CN(C1)C 28f305311abb55e8e826346d7674410b [0,0,0,1,0,1|2,0,0]=4 6271 B12R1.467 CCCC(=O)CN[C@H]1C[C@@H](C1)F 467656087f991a84e36ccae0a21cb016 [0,0,0,1,0,1|2,0,0]=4 6272 B12R1.467 CCCC(=O)CN[C@H]1C[C@@H](C1)O 0c975abd89be768ba004778127eb9b27 [0,0,0,1,0,1|2,0,0]=4 6273 B12R1.467 CCCC(=O)CN[C@H]1C[C@H](C1)F 8c05536e2cfd4f02369d8a98147b991d [0,0,0,1,0,1|2,0,0]=4 6274 B12R1.467 CCCC(=O)CN[C@H]1C[C@H](C1)O 50ab3480bd3ba6662a57a2381e376a5e [0,0,0,1,0,1|2,0,0]=4 6275 B12R1.467 CCCC(=O)COC1CC(=O)C1 244d8c960d5a08ff89414088d67cf241 [0,0,0,1,0,1|1,0,1]=4 6276 B12R1.467 CCCC(=O)COC1CC(C1)C af35c1916ac31bdd3b7c4039812dc80d [0,0,0,1,0,1|0,0,0]=2 6277 B12R1.467 CCCC(=O)COC1CC(C1)F 0f062c1a5e7c2e017ebaf9b13a28ab4f [0,0,0,1,0,1|1,0,0]=3 6278 B12R1.467 CCCC(=O)COC1CN(C1)C 1eb0c977abe76c581162dd387553ee3e [0,0,0,1,0,1|1,0,0]=3 6279 B12R1.467 CCCC(=O)CO[C@H]1C[C@@H](C1)F 9b1dbc55361e1e801849cadfe7099c65 [0,0,0,1,0,1|1,0,0]=3 6280 B12R1.467 CCCC(=O)CO[C@H]1C[C@H](C1)F 21d07924c79e761ebb86fdb2fab04f67 [0,0,0,1,0,1|1,0,0]=3 6281 B12R1.467 CCCC(=O)NCC1CC(C1)O a304cf28195d7ffc5e421874cb0512ea [0,0,0,1,0,1|2,0,0]=4 6282 B12R1.467 CCCC(=O)NCC1CN(C1)C c9e3bb27d8d23bad2364c9a482ae3790 [0,0,0,1,0,1|2,0,0]=4 6283 B12R1.467 CCCC(=O)NC[C@H]1C[C@@H](C1)O e89d4635351c621d140cd70b6459c599 [0,0,0,1,0,1|2,0,0]=4 6284 B12R1.467 CCCC(=O)NC[C@H]1C[C@H](C1)O 2629e1b00e8cdedc0378d95615aa5bfa [0,0,0,1,0,1|2,0,0]=4 6285 B12R1.467 CCCC(=O)OCN1CC(C1)O 142e629e37e890983fe5ecd81607cb3b [0,0,0,1,0,1|1,0,0]=3 6286 B12R1.467 CCCC(=S)OCC1CC(C1)C 5301c7922cf33270ed5f9f78b04c849d [0,0,0,1,0,1|0,1,0]=3 6287 B12R1.467 CCCC(=S)OC[C@H]1C[C@H](C1)F 06d5b26c7b6ccecd5f4891765ebfd3e4 [0,0,0,1,0,1|1,1,0]=4 6288 B12R1.467 CCCC(C)COC1CC(C1)C 0453c065ed511a330f6061e9df628daa [0,0,0,1,0,1|1,0,1]=4 6289 B12R1.467 CCCC(C)OCC1CC(C1)C 295c9d85f70e46c4a94b9ba010abb866 [0,0,0,1,0,1|1,0,1]=4 6290 B12R1.467 CCCC(C)OC[C@H]1C[C@@H](C1)C bbb058f6d5a2a1ac3ac209ef81bd3201 [0,0,0,1,0,1|1,0,1]=4 6291 B12R1.467 CCC[C@@H](C)OCC1CC(C1)C 0369e9c294f051fb327da37e8ba93772 [0,0,0,1,0,1|1,0,1]=4 6292 B12R1.467 CCC[C@H](C)OCC1CC(C1)C dad4c410cec204a7e852a800e69b2282 [0,0,0,1,0,1|1,0,1]=4 6293 B12R1.467 CCNC(=O)COC1CC(C1)C 10cc220df23677cb4389976ae9468858 [0,0,0,1,0,1|1,0,0]=3 6294 B12R1.467 CCNC(=O)COC1CC(C1)F 58db68adf1458cf8b7b89da194d79b5b [0,0,0,1,0,1|2,0,0]=4 6295 B12R1.467 CCNC(=O)COC1CN(C1)C a615315d2a5a2d94785e7f74a3bea64a [0,0,0,1,0,1|2,0,0]=4 6296 B12R1.467 CCNC(=O)CO[C@H]1C[C@@H](C1)F 87dcd490afc2a2fde24e4cf84565ef55 [0,0,0,1,0,1|2,0,0]=4 6297 B12R1.467 CCNC(=O)CO[C@H]1C[C@H](C1)F f3793e438a03358e89564b4f0bfd8bd0 [0,0,0,1,0,1|2,0,0]=4 6298 B12R1.467 CCOC(=O)COC1CC(C1)C 16af37a795406422d3241a818a0c38f5 [0,0,0,1,0,1|1,0,0]=3 6299 B12R1.467 CCOC(=O)COC1CC(C1)F 569991cf606d8d25b1d285c243f3af24 [0,0,0,1,0,1|2,0,0]=4 6300 B12R1.467 CCOC(=O)COC1CN(C1)C 253eb0db5647e966ea61e35b84bf8eba [0,0,0,1,0,1|2,0,0]=4 6301 B12R1.467 CCOC(=O)CO[C@H]1C[C@@H](C1)F 30eb4acdd07d0ef0191f2700f4be3553 [0,0,0,1,0,1|2,0,0]=4 6302 B12R1.467 CCOC(=O)CO[C@H]1C[C@H](C1)F 0873c04e6f0affdc6c1f3234e4155ce8 [0,0,0,1,0,1|2,0,0]=4 6303 B12R1.467 CCOC(=O)OCN1CC(C1)F e0b521c11d991258edf03f12b9162cf4 [0,0,0,1,0,1|2,0,0]=4 6304 B12R1.467 CCOC(=O)OCN1CC(C1)O 2e49a5efb1b6b401f6cbfb359857eb31 [0,0,0,1,0,1|2,0,0]=4 6305 B12R1.467 CCSC(=O)OCN1CC(C1)F 79264711c58cc6dea0e5370f832ec315 [0,0,0,1,0,1|2,0,0]=4 6306 B12R1.467 CCSC(=O)OCN1CC(C1)O 4832af04c5bd739f26dfd325066d4798 [0,0,0,1,0,1|2,0,0]=4 6307 B12R1.467 COCC(=O)COC1CC(C1)C a15020cd172983d9b65f26be189885b0 [0,0,0,1,0,1|1,0,0]=3 6308 B12R1.861 C=C(C)COC1OC(=O)CC1C c5925d268643205270fbaf42bac32d0a [0,0,0,1,0,1|0,0,2]=4 6309 B12R1.861 CC(C)COC1CC(=O)NC1C 7f15ed5acff882a94bca77e6bc03fb94 [0,0,0,1,0,1|2,0,0]=4 6310 B12R1.861 CC(C)COC1OC(=O)CC1C f2f9852cea3830e663b4e30635d8f8f6 [0,0,0,1,0,1|0,0,0]=2 6311 B12R1.861 CC(C)CO[C@H]1CC(=O)N[C@H]1C e19a4c41d43f628d1eb0e58469ac8661 [0,0,0,1,0,1|2,0,0]=4 6312 B12R1.861 CC1=CC(=O)OC1OCC(C)C 71be5b135c79413cf7a7d890779da225 [0,0,0,1,0,1|0,0,2]=4 6313 B12R1.861 CC1CC(=O)OC1OCC(F)F d34e994a52af9d2fc5db1e3627cd5067 [0,0,0,1,0,1|2,0,0]=4 6314 B12R1.861 CC1CC(=O)OC1OCN(C)C e1eec7a06cbfa25498013dee5e650b3a [0,0,0,1,0,1|1,0,0]=3 6315 B12R1.878 CC(C)N1CCNC(=O)CC1C 59c629275e5a210ea3f78228e387c887 [0,0,0,1,0,1|1,0,0]=3 6316 B12R1.1020 CC(C)CN1CCCC(=O)CC1 8953ab876e11f55965977f34609677a3 [0,0,0,1,0,1|1,0,0]=3 6317 B12R1.1020 CC(C)CN1CCNC(=O)CC1 21115c3ee673ade29dd8e5bbbbc7af4e [0,0,0,1,0,1|2,0,0]=4 6318 B12R1.1020 CC(C)OC1CCCC(=O)NC1 79080301903acbb98511a326fcb42ca1 [0,0,0,1,0,1|1,0,0]=3 6319 B12R1.1020 CC(O)CN1CCCC(=O)CC1 2c47d410ec5bf0605c7a4ab6b061e42e [0,0,0,1,0,1|2,0,0]=4 6320 B12R1.1020 CN(C)CN1CCCC(=O)CC1 d15075f53f6486b41ddd92050a4331f0 [0,0,0,1,0,1|2,0,0]=4 6321 B12R1.1020 C[C@H](O)CN1CCCC(=O)CC1 b146f8d6fcb2fd046371774580f24917 [0,0,0,1,0,1|2,0,0]=4 6322 B12R1.1356 C=C(C)CCOCC(=O)C1CC1 8053b1ceb62ededfc309335477130d59 [0,0,0,1,0,1|0,0,2]=4 6323 B12R1.1356 C=C(C)CNCOC(=O)C1CC1 a677111cc84e6a2071cd3f64eca04ad2 [0,0,0,1,0,1|0,0,2]=4 6324 B12R1.1356 C=C(C)COCOC(=O)C1CC1 5848f632e27499ece31e85c675a8dbec [0,0,0,1,0,1|0,0,2]=4 6325 B12R1.1356 CC(=CCOCC(=O)C1CC1)C f354f9f57baba86af0ff3bc8103428db [0,0,0,1,0,1|0,0,2]=4 6326 B12R1.1356 CC(=O)CCOCC(=O)C1CC1 6811d2dcde9ff9ffe439d1fabb30b38f [0,0,0,1,0,1|1,0,1]=4 6327 B12R1.1356 CC(=O)CNCOC(=O)C1CC1 699b2bb36d343db64412d1fcbaff21f8 [0,0,0,1,0,1|1,0,1]=4 6328 B12R1.1356 CC(=O)COCOC(=O)C1CC1 a8a72c484798e7e0c0e0d2c6851f2f60 [0,0,0,1,0,1|1,0,1]=4 6329 B12R1.1356 CC(C)CCCOC(C)C1CC1 4dd04c70e06bff0ad31678de2a2a549c [0,0,0,1,0,1|1,0,1]=4 6330 B12R1.1356 CC(C)CCCO[C@@H](C)C1CC1 54a6f3daf9ab57dec3a767bc76ad0b97 [0,0,0,1,0,1|1,0,1]=4 6331 B12R1.1356 CC(C)CCCO[C@H](C)C1CC1 72f7851fa578d6aceb458334d22ed2dd [0,0,0,1,0,1|1,0,1]=4 6332 B12R1.1356 CC(C)CCNCC(=O)C1CC1 5a1108c8a1d8f1fb4386f92c1b20e020 [0,0,0,1,0,1|1,0,0]=3 6333 B12R1.1356 CC(C)CCOCC(=O)C1CC1 9af0b581ae5efc9f4b14c744f7808d96 [0,0,0,1,0,1|0,0,0]=2 6334 B12R1.1356 CC(C)CCOCC(C)C1CC1 44124477fdfd7a1a9e450dbc0d1c0ac9 [0,0,0,1,0,1|1,0,1]=4 6335 B12R1.1356 CC(C)CNCOC(=O)C1CC1 a4eb2e1ef64e2c41f542fdb505e8b60f [0,0,0,1,0,1|0,0,0]=2 6336 B12R1.1356 CC(C)COCOC(=O)C1CC1 da76e826229dcdc03f7b5655fcd071ea [0,0,0,1,0,1|0,0,0]=2 6337 B12R1.1356 CC(C)OCCOC(C)C1CC1 d9bb08b6222f7192be4a3d132703938c [0,0,0,1,0,1|1,0,1]=4 6338 B12R1.1356 CC(C)OCCO[C@@H](C)C1CC1 2bf7501a2b54213d9b69bd127d3e5eed [0,0,0,1,0,1|1,0,1]=4 6339 B12R1.1356 CC(C)OCCO[C@H](C)C1CC1 7683e94a1274da7d4806ec881aef9534 [0,0,0,1,0,1|1,0,1]=4 6340 B12R1.1356 CC(C)OCOCC(=O)C1CC1 194afe7648c4032c1f830f636cfdf448 [0,0,0,1,0,1|1,0,0]=3 6341 B12R1.1356 CC(C)SCCOC(C)C1CC1 5215ec5cebf73443cb80332cd16c0339 [0,0,0,1,0,1|1,0,1]=4 6342 B12R1.1356 CC(C)SCCO[C@@H](C)C1CC1 ecec42bdc84a52802b8560f956de2140 [0,0,0,1,0,1|1,0,1]=4 6343 B12R1.1356 CC(C)SCCO[C@H](C)C1CC1 89287c7fdfd0963eab59b58ec078e9f0 [0,0,0,1,0,1|1,0,1]=4 6344 B12R1.1356 CC(F)COCOC(=O)C1CC1 20c824fce63aa5b3f0eeb6d2c762d324 [0,0,0,1,0,1|1,0,0]=3 6345 B12R1.1356 CC(O)CCNCC(=O)C1CC1 2b322219f4a9d0468f0d6bfb32061c02 [0,0,0,1,0,1|2,0,0]=4 6346 B12R1.1356 CC(O)CNCOC(=O)C1CC1 d207835b34d31b58b232c45882ae8382 [0,0,0,1,0,1|1,0,0]=3 6347 B12R1.1356 CC(S)COCOC(=O)C1CC1 95c2586639553e6e0a4a20eece2cec68 [0,0,0,1,0,1|1,0,0]=3 6348 B12R1.1356 CN(C)CCNCC(=O)C1CC1 9f563789e1c61978940624fa374e3b09 [0,0,0,1,0,1|2,0,0]=4 6349 B12R1.1356 CN(C)CCOCC(=O)C1CC1 d9726f055758c4bcc58eb955725e3b90 [0,0,0,1,0,1|1,0,0]=3 6350 B12R1.1356 CS(=O)CCOCC(=O)C1CC1 e02a78b45b2cd58bc9d9c0dbc3d0a841 [0,0,0,1,0,1|2,0,0]=4 6351 B12R1.1356 C[C@@H](F)COCOC(=O)C1CC1 b32fe5c266f6069178c55f3e250e37ce [0,0,0,1,0,1|1,0,0]=3 6352 B12R1.1356 C[C@@H](O)CCNCC(=O)C1CC1 443672fc934dbdbd9431a8bb6646dda1 [0,0,0,1,0,1|2,0,0]=4 6353 B12R1.1356 C[C@@H](O)CNCOC(=O)C1CC1 0b92c5ac15927d1c0a5415e06ed60ddf [0,0,0,1,0,1|1,0,0]=3 6354 B12R1.1356 C[C@H](F)COCOC(=O)C1CC1 c78d893930866e7d5e0d024370a0cde9 [0,0,0,1,0,1|1,0,0]=3 6355 B12R1.1356 C[C@H](O)CCNCC(=O)C1CC1 f381e6fe23ba31e6e5ef371f7371c5f5 [0,0,0,1,0,1|2,0,0]=4 6356 B12R1.1356 C[C@H](O)CNCOC(=O)C1CC1 7bda22b9c0d1dc45af1b7dc822726d21 [0,0,0,1,0,1|1,0,0]=3 6357 B12R1.1356 O=C(COCCC(F)F)C1CC1 be0c91320bcb1c8608171fa4aec3d5b6 [0,0,0,1,0,1|2,0,0]=4 6358 B12R1.1356 O=C(OCNCC(F)F)C1CC1 661f79a7b64a704f942577df26230784 [0,0,0,1,0,1|2,0,0]=4 6359 B12R1.1356 O=C(OCOCC(F)F)C1CC1 2dbbb8af007280f828c05d36c4a6d7a4 [0,0,0,1,0,1|2,0,0]=4 6360 B12R1.1505 C=C1CC1COCC(=O)CCC 794d0a3e60901a3f027105a3cb966def [0,0,0,1,0,1|0,0,2]=4 6361 B12R1.1505 CCCC(=O)COCC1CC1C 87b0661d1c476daa3406f2544cbbacd0 [0,0,0,1,0,1|0,0,0]=2 6362 B12R1.1505 CCCC(=O)COC[C@@H]1C[C@@H]1C e1ffb29a07fa389093428fe7852bf468 [0,0,0,1,0,1|0,0,0]=2 6363 B12R1.1505 CCCC(=O)COC[C@@H]1C[C@@H]1F c791a8e23158cf377a06b5eb8bba55a1 [0,0,0,1,0,1|1,0,0]=3 6364 B12R1.1505 CCCC(=O)COC[C@@H]1C[C@H]1C 445c14981404e0db549a48344c3ac3db [0,0,0,1,0,1|0,0,0]=2 6365 B12R1.1505 CCCC(=O)COC[C@@H]1C[C@H]1F 4d7eb324a7a25aed0aaacfcbc43a38bc [0,0,0,1,0,1|1,0,0]=3 6366 B12R1.1505 CCCC(=O)COC[C@H]1C[C@@H]1C e900aebf247a018cb48e71aada8454ed [0,0,0,1,0,1|0,0,0]=2 6367 B12R1.1505 CCCC(=O)COC[C@H]1C[C@@H]1F fa28a4a8ead86093f31956435f63b1f6 [0,0,0,1,0,1|1,0,0]=3 6368 B12R1.1505 CCCC(=O)COC[C@H]1C[C@H]1F 2429f23fabc62d79d6ea8ec59cb99a95 [0,0,0,1,0,1|1,0,0]=3 6369 B12R1.1505 CCCC(=O)OCNC1CC1C 249756bddf6a566dc759a2421eaf6da2 [0,0,0,1,0,1|0,0,0]=2 6370 B12R1.1505 CCCC(=O)OCN[C@@H]1C[C@H]1F 63480396b74d02c998b081c7e18100f4 [0,0,0,1,0,1|1,0,0]=3 6371 B12R1.1505 CCCC(=O)OCN[C@H]1C[C@@H]1F 9dfbb70540b09a0b869c128d0d148727 [0,0,0,1,0,1|1,0,0]=3 6372 B12R1.1505 CCCC(=O)OCN[C@H]1C[C@H]1F 434755bcca1330f7bc80768061e12975 [0,0,0,1,0,1|1,0,0]=3 6373 B12R1.1505 CCCC(C)COCC1CC1C 20de894f72c7bb04e20506f202698e7d [0,0,0,1,0,1|1,0,1]=4 6374 B12R1.1505 CCCC(C)COC[C@@H]1C[C@@H]1C 56802ca7c310fd949e4850d3c6bce472 [0,0,0,1,0,1|1,0,1]=4 6375 B12R1.1505 CCCC(C)COC[C@@H]1C[C@H]1C a7afa90c8bd70a9072f393f5ac785bb9 [0,0,0,1,0,1|1,0,1]=4 6376 B12R1.1505 CCCC(C)COC[C@H]1C[C@@H]1C 4e097d54a3f86eb8983704fa429181a3 [0,0,0,1,0,1|1,0,1]=4 6377 B12R1.1505 CCNC(=O)CCNC1CC1C f592671b5f5c46fef9e8c1249effb6bc [0,0,0,1,0,1|2,0,0]=4 6378 B12R1.1505 CCNC(=O)COCC1CC1C 6004bc5e4bed422d27af7d5d2d3bb773 [0,0,0,1,0,1|1,0,0]=3 6379 B12R1.1505 CCNC(=O)COC[C@@H]1C[C@@H]1C 324d0222e50049d3b71d2eef98b3fff9 [0,0,0,1,0,1|1,0,0]=3 6380 B12R1.1505 CCNC(=O)COC[C@@H]1C[C@@H]1F 81fbd4f56b307209a5e941c3e61f331d [0,0,0,1,0,1|2,0,0]=4 6381 B12R1.1505 CCNC(=O)COC[C@@H]1C[C@H]1C bd7a3b685c5361977099e9a011720efc [0,0,0,1,0,1|1,0,0]=3 6382 B12R1.1505 CCNC(=O)COC[C@@H]1C[C@H]1F 602a175249a6ea661d9655a8f7b3be2d [0,0,0,1,0,1|2,0,0]=4 6383 B12R1.1505 CCNC(=O)COC[C@H]1C[C@@H]1C 25c61b63f50ad1d6434271e2c008fde7 [0,0,0,1,0,1|1,0,0]=3 6384 B12R1.1505 CCNC(=O)COC[C@H]1C[C@@H]1F e60c541892ad72b125150a2622e3e169 [0,0,0,1,0,1|2,0,0]=4 6385 B12R1.1505 CCNC(=O)COC[C@H]1C[C@H]1F 94124b7d9ee2851f23c182a3246842eb [0,0,0,1,0,1|2,0,0]=4 6386 B12R1.1505 CCOC(=O)CCNC1CC1C c518c9f1a022b08c9fba7a6b6ec8f8f5 [0,0,0,1,0,1|2,0,0]=4 6387 B12R1.1505 CCOC(=O)COCC1CC1C 11ae855b17a737290305f3ff5d686b29 [0,0,0,1,0,1|1,0,0]=3 6388 B12R1.1505 CCOC(=O)COC[C@@H]1C[C@@H]1C a79a2d3572b589643b59f450e44f649d [0,0,0,1,0,1|1,0,0]=3 6389 B12R1.1505 CCOC(=O)COC[C@@H]1C[C@@H]1F c90f1170e220a45669ae156c22ec318e [0,0,0,1,0,1|2,0,0]=4 6390 B12R1.1505 CCOC(=O)COC[C@@H]1C[C@H]1C 413e12c5899235a079c35504efbc6f37 [0,0,0,1,0,1|1,0,0]=3 6391 B12R1.1505 CCOC(=O)COC[C@@H]1C[C@H]1F 965dea2656dcc8ce709046b54ffd7120 [0,0,0,1,0,1|2,0,0]=4 6392 B12R1.1505 CCOC(=O)COC[C@H]1C[C@@H]1C e0764586ec52e3eb914fd34972a948ab [0,0,0,1,0,1|1,0,0]=3 6393 B12R1.1505 CCOC(=O)COC[C@H]1C[C@@H]1F feff9c1628d28624a9940b93747f1164 [0,0,0,1,0,1|2,0,0]=4 6394 B12R1.1505 CCOC(=O)COC[C@H]1C[C@H]1F 6401a6af05cd1a3fcb175f1519c1ce18 [0,0,0,1,0,1|2,0,0]=4 6395 B12R1.1505 CCOC(=O)OCNC1CC1C 38b8c6608624ad66c4a3da0394792ef7 [0,0,0,1,0,1|1,0,0]=3 6396 B12R1.1505 CCOC(=O)OCN[C@@H]1C[C@H]1F 39f6e8c830b8efed8e963dfee1af1a27 [0,0,0,1,0,1|2,0,0]=4 6397 B12R1.1505 CCOC(=O)OCN[C@H]1C[C@@H]1F 91d88e538f26b628d05828aa555975d6 [0,0,0,1,0,1|2,0,0]=4 6398 B12R1.1505 CCOC(=O)OCN[C@H]1C[C@H]1F 3c15d2b851bf62eb4307732d96b1e805 [0,0,0,1,0,1|2,0,0]=4 6399 B12R1.1505 CCSC(=O)OCNC1CC1C 626fc4a4363b6de6a61676b884732cc7 [0,0,0,1,0,1|1,0,0]=3 6400 B12R1.1505 CCSC(=O)OCN[C@@H]1C[C@H]1F 514736db515037679dc1b996344721b6 [0,0,0,1,0,1|2,0,0]=4 6401 B12R1.1505 CCSC(=O)OCN[C@H]1C[C@@H]1F d10bf47d5308043505fa101208ac45c7 [0,0,0,1,0,1|2,0,0]=4 6402 B12R1.1505 CCSC(=O)OCN[C@H]1C[C@H]1F fb45a4be6b0b3d989b260fd59db9e64b [0,0,0,1,0,1|2,0,0]=4 6403 B12R1.1505 COCC(=O)COCC1CC1C bfdea1262b84d5426a3338d5ad947244 [0,0,0,1,0,1|1,0,0]=3 6404 B12R1.1505 COCC(=O)COC[C@@H]1C[C@@H]1C 6d38e081dabf0909bf1374374f9e034f [0,0,0,1,0,1|1,0,0]=3 6405 B12R1.1505 COCC(=O)COC[C@@H]1C[C@@H]1F c6187527042a12cda06a7b6497e12ee0 [0,0,0,1,0,1|2,0,0]=4 6406 B12R1.1505 COCC(=O)COC[C@@H]1C[C@H]1C 964dcc175a6c0c6b78f007ea30648c84 [0,0,0,1,0,1|1,0,0]=3 6407 B12R1.1505 COCC(=O)COC[C@@H]1C[C@H]1F a9b2ffc954cca9e6fa55423d87e0ac0f [0,0,0,1,0,1|2,0,0]=4 6408 B12R1.1505 COCC(=O)COC[C@H]1C[C@@H]1C cabb258a2e4493a95dde3074b38f88df [0,0,0,1,0,1|1,0,0]=3 6409 B12R1.1505 COCC(=O)COC[C@H]1C[C@@H]1F 99ab101c5973f8782346f6af05f2907b [0,0,0,1,0,1|2,0,0]=4 6410 B12R1.1505 COCC(=O)COC[C@H]1C[C@H]1F 174391fa8f0cf64bcb3ac975cf8aa717 [0,0,0,1,0,1|2,0,0]=4 6411 B12R1.1560 CCOC(=O)[C@@H]1C[C@@H]1OC(C)C c883ab25def01666c78d53e20f3b0e67 [0,0,0,1,0,1|2,0,0]=4 6412 B12R1.1560 CCOC(=O)[C@H]1C[C@H]1OC(C)C ba82d42367d1e5b3879cbf0dcb09ec28 [0,0,0,1,0,1|2,0,0]=4 6413 B12R1.1571 CC1(OCC1NC(=O)CCF)C 73bcfa43caa9bc60bc3be17e0a5bf2b7 [0,0,0,1,0,1|2,0,0]=4 6414 B12R1.1571 CC1(OCC1NC(=O)CCO)C 9d62a3ebb21b83b07f9095b4efb84c44 [0,0,0,1,0,1|2,0,0]=4 6415 B12R1.1571 CC1(OCC1NC(=O)CCS)C e5c999299aaba3c94e39933cdf1a0aa4 [0,0,0,1,0,1|2,0,0]=4 6416 B12R1.1571 CCCC(=O)NC1COC1(C)C 214e57001b30c0f7f75b885c177b4df0 [0,0,0,1,0,1|1,0,0]=3 6417 B12R1.1571 CCCC(C)OC1COC1(C)C d20371c5e2f1339e302ec053a67d403c [0,0,0,1,0,1|1,0,1]=4 6418 B12R1.1571 COCC(=O)NC1COC1(C)C 50916d38bfb5cfcf1805e397375da181 [0,0,0,1,0,1|2,0,0]=4 6419 B12R1.1571 CSCC(=O)NC1COC1(C)C 7a5b085ab141055698523bbcf4306539 [0,0,0,1,0,1|2,0,0]=4 6420 B12R1.1572 CC1(C[C@@H]1CNC(=O)CCF)C c6d11779149906109596d1dc22ca00b8 [0,0,0,1,0,1|2,0,0]=4 6421 B12R1.1572 CC1(C[C@@H]1CNC(=O)CCO)C 0f6ae5e44f99a34a9a5e193ecd477530 [0,0,0,1,0,1|2,0,0]=4 6422 B12R1.1572 CC1(C[C@@H]1CNC(=O)CCS)C 4bf6a3c94ca74ef648cba2f7f6ce1ff7 [0,0,0,1,0,1|2,0,0]=4 6423 B12R1.1572 CC1(C[C@H]1CNC(=O)CCF)C f99db44668fc72075616299a2479ae73 [0,0,0,1,0,1|2,0,0]=4 6424 B12R1.1572 CC1(C[C@H]1CNC(=O)CCO)C 7e8f63120f2916dec440bbed65663d37 [0,0,0,1,0,1|2,0,0]=4 6425 B12R1.1572 CC1(C[C@H]1CNC(=O)CCS)C 8788c9c9ce1a281f133d8f890e3e5176 [0,0,0,1,0,1|2,0,0]=4 6426 B12R1.1572 CCCC(=O)CNC1CC1(C)C b4175c03606aba4e31e0c6c1c5f5eb4a [0,0,0,1,0,1|1,0,0]=3 6427 B12R1.1572 CCCC(=O)CN[C@@H]1CC1(C)C 4a5813e13ca8c2dfc71d02ad210499f2 [0,0,0,1,0,1|1,0,0]=3 6428 B12R1.1572 CCCC(=O)CN[C@H]1CC1(C)C 742aecead0102d8f0ab5ab31dd6ed735 [0,0,0,1,0,1|1,0,0]=3 6429 B12R1.1572 CCCC(=O)COC1CC1(F)F 0a2599a79ef1c46bce73f62695235925 [0,0,0,1,0,1|2,0,0]=4 6430 B12R1.1572 CCCC(=O)NC[C@@H]1CC1(C)C 7fe70289c63c8520c49d9d1336f79bdd [0,0,0,1,0,1|1,0,0]=3 6431 B12R1.1572 CCCC(=O)NC[C@H]1CC1(C)C 55aeb8efbd4db4e89a525464b51b66a0 [0,0,0,1,0,1|1,0,0]=3 6432 B12R1.1572 CCCC(=O)OCN1CC1(C)C d86c7179094bac94ab92672711cc4117 [0,0,0,1,0,1|0,0,0]=2 6433 B12R1.1572 CCCC(C)COC1CC1(C)C 5257d5a4fa451dde7061b1a2765b7550 [0,0,0,1,0,1|1,0,1]=4 6434 B12R1.1572 CCCC(C)OCC1CC1(C)C 9c408a808807f897e09bd8f190587bb3 [0,0,0,1,0,1|1,0,1]=4 6435 B12R1.1572 CCCC(C)OC[C@@H]1CC1(C)C c1f8ec3243698e92ef8958d14aac48a9 [0,0,0,1,0,1|1,0,1]=4 6436 B12R1.1572 CCCC(C)OC[C@H]1CC1(C)C af53a7256426080227e91b416ce5c5fc [0,0,0,1,0,1|1,0,1]=4 6437 B12R1.1572 CCNC(=O)CCN1CC1(C)C a77ed4450b2659d927ad95675f2c9467 [0,0,0,1,0,1|2,0,0]=4 6438 B12R1.1572 CCNC(=O)CNC1CC1(C)C 72d3617b202f082a017bb758f686a9d0 [0,0,0,1,0,1|2,0,0]=4 6439 B12R1.1572 CCNC(=O)CN[C@@H]1CC1(C)C 4b4a95b39522b67ea8ce9a7c2a2050b3 [0,0,0,1,0,1|2,0,0]=4 6440 B12R1.1572 CCNC(=O)CN[C@H]1CC1(C)C d2193f3d59e725dcecb9145aa48ab5f3 [0,0,0,1,0,1|2,0,0]=4 6441 B12R1.1572 CCNC(=O)COC1CC1(C)C a814657f8fd696e80464035e4391e2d9 [0,0,0,1,0,1|1,0,0]=3 6442 B12R1.1572 CCOC(=O)CCN1CC1(C)C ce8c81038380f0063e0d3ff42d65a54e [0,0,0,1,0,1|2,0,0]=4 6443 B12R1.1572 CCOC(=O)CNC1CC1(C)C fe5ffcfcce718048ac4eff725692296d [0,0,0,1,0,1|2,0,0]=4 6444 B12R1.1572 CCOC(=O)CN[C@@H]1CC1(C)C 5f96cc5043ed4d7285ae1ba78f724c61 [0,0,0,1,0,1|2,0,0]=4 6445 B12R1.1572 CCOC(=O)CN[C@H]1CC1(C)C a85b0ce1c48cead05a8cbd63539cbdf3 [0,0,0,1,0,1|2,0,0]=4 6446 B12R1.1572 CCOC(=O)COC1CC1(C)C d981d603eee060940b7f713bceeb6894 [0,0,0,1,0,1|1,0,0]=3 6447 B12R1.1572 CCOC(=O)OCN1CC1(C)C 02b53ec37c5a6764ea8adb4dcc1d3f9b [0,0,0,1,0,1|1,0,0]=3 6448 B12R1.1572 CCSC(=O)OCN1CC1(C)C 373f448e720264010a22a4b79fd6363b [0,0,0,1,0,1|1,0,0]=3 6449 B12R1.1572 COCC(=O)CNC1CC1(C)C 9ed88f1e328c4d2f06695c27e85d6931 [0,0,0,1,0,1|2,0,0]=4 6450 B12R1.1572 COCC(=O)CN[C@@H]1CC1(C)C 2cfb48e02482c7d3ff6bf43389261dfa [0,0,0,1,0,1|2,0,0]=4 6451 B12R1.1572 COCC(=O)CN[C@H]1CC1(C)C e9e6c178158f3abc7b9dd6579c868989 [0,0,0,1,0,1|2,0,0]=4 6452 B12R1.1572 COCC(=O)NC[C@@H]1CC1(C)C 8075f4847b291015ba82e68e404e6e57 [0,0,0,1,0,1|2,0,0]=4 6453 B12R1.1572 COCC(=O)NC[C@H]1CC1(C)C 6f6168d9126822a0a151aa81c803dbac [0,0,0,1,0,1|2,0,0]=4 6454 B12R1.1572 CSCC(=O)NC[C@@H]1CC1(C)C ec9bb2872210750ee8b56bb6ea6965c9 [0,0,0,1,0,1|2,0,0]=4 6455 B12R1.1572 CSCC(=O)NC[C@H]1CC1(C)C 750a59e2d823f02693825456383ae8e3 [0,0,0,1,0,1|2,0,0]=4 6456 B12R1.2795 CC(C)CCOCC1(CCC1)C 3194001394c376d68441c42eac7115af [0,0,0,1,0,1|1,0,1]=4 6457 B12R1.2795 CC(C)CCOCC1(CCC1)F 0c5110d7fb0fca6b9ed36afe2d922078 [0,0,0,1,0,1|1,0,1]=4 6458 B12R1.260 CC(C)CC(C)OC1CCCC1 7a611feb39a21277fc32e0d1cce784b4 [0,1,0,1,0,0|1,0,1]=4 6459 B12R1.260 CC(C)CC(C)OC1CCCO1 a54078b749be1f4e981fb05847e966c3 [0,1,0,1,0,0|0,0,2]=4 6460 B12R1.260 CC(C)C[C@@H](C)OC1CCCC1 b751c31fef955350835d54fe3fd5280d [0,1,0,1,0,0|1,0,1]=4 6461 B12R1.260 CC(C)C[C@H](C)OC1CCCC1 7d6a96e2baea11a56b8df482ea041ae2 [0,1,0,1,0,0|1,0,1]=4 6462 B12R1.313 CCCC(=O)N1C[C@@H](C[C@@H]1C)F 9dab2ba374710889694da199f10e3862 [0,1,0,1,0,0|2,0,0]=4 6463 B12R1.313 CCCC(=O)N1C[C@@H](C[C@@H]1C)O 9b07f26701ed6cf6f49afe6ebc1d6ccf [0,1,0,1,0,0|2,0,0]=4 6464 B12R1.313 CCCC(=O)N1C[C@@H](C[C@H]1C)F 4d8b84566afee1e99bb786ad231f270f [0,1,0,1,0,0|2,0,0]=4 6465 B12R1.313 CCCC(=O)N1C[C@@H](C[C@H]1C)O 509654ca0fcf97e9303f03b5659ef99c [0,1,0,1,0,0|2,0,0]=4 6466 B12R1.313 CCCC(=O)N1C[C@H](C[C@@H]1C)F 18415e2a3b20519f05d6e03cde5b61e2 [0,1,0,1,0,0|2,0,0]=4 6467 B12R1.313 CCCC(=O)N1C[C@H](C[C@@H]1C)O 736111c9972b3402d33b65d0959167fe [0,1,0,1,0,0|2,0,0]=4 6468 B12R1.313 CCCC(=O)N1C[C@H](C[C@H]1C)F 8145988c05f6cce982bd5b9bcee269cf [0,1,0,1,0,0|2,0,0]=4 6469 B12R1.313 CCCC(=O)N1C[C@H](C[C@H]1C)O e9b52183c0c2ea60b99cb133dae29df1 [0,1,0,1,0,0|2,0,0]=4 6470 B12R1.521 CCCC(=O)CN(C)CC1CC1 9d56226af4dd2a2a22312a72e33d8084 [0,1,0,1,0,0|2,0,0]=4 6471 B12R1.521 CCCC(C)OC(C)CC1CC1 88b2a47de368d2a1c8a89f88dfac6d8a [0,1,0,1,0,0|1,0,1]=4 6472 B12R1.521 CCOC(=O)OC(C)OC1CC1 bad1486bd65fbc28274cf2b97abd807a [0,1,0,1,0,0|2,0,0]=4 6473 B12R1.874 CC(C)CN1CCCNC(=O)C1 a75c2be9367463aac2ff4cab108bbd51 [0,1,0,1,0,0|2,0,0]=4 6474 B12R1.874 CC(C)OC1CCCNC(=O)C1 029010b05abf9975a9af31e8896960d6 [0,1,0,1,0,0|2,0,0]=4 6475 B12R1.1000 CC(C)N1[C@@H](CC(=O)C[C@@H]1C)C 1b9578f56b46880489c022afcbdb8d04 [0,1,0,1,0,0|2,0,0]=4 6476 B12R1.1061 CC(C)CC(=O)NC1CC(C1)O ec6fb8c11b737970ba064b7b45ca6fe7 [0,1,0,1,0,0|2,0,0]=4 6477 B12R1.1061 CC(C)CC(=O)NC1CN(C1)C 955ba8338e85bdedd8b5c7eb7726ce19 [0,1,0,1,0,0|2,0,0]=4 6478 B12R1.1061 CC(C)CC(=O)N[C@H]1C[C@@H](C1)O f3c4b20eef398bb866d8b08a3a449dff [0,1,0,1,0,0|2,0,0]=4 6479 B12R1.1061 CC(C)CC(=O)N[C@H]1C[C@H](C1)O 5fa9c9ebee9e7487d93e2ad096c84455 [0,1,0,1,0,0|2,0,0]=4 6480 B12R1.1061 CC(C)CC(C)OC1CC(C1)C 3a6f8f32c193e60f238b1e7fb2895eb9 [0,1,0,1,0,0|1,0,1]=4 6481 B12R1.1061 CC(O)CC(=O)NC1CC(C1)O 0d218f1eb18c9a555b453540eb4384b2 [0,1,0,1,0,0|2,0,0]=4 6482 B12R1.1061 CC(O)CC(=O)NC1CN(C1)C 699af5da80ef8f933f7b98bb7cf0e351 [0,1,0,1,0,0|2,0,0]=4 6483 B12R1.1061 CC(O)CC(=O)N[C@H]1C[C@@H](C1)O 2617cdf263b45abb5ba833defe3de2f0 [0,1,0,1,0,0|2,0,0]=4 6484 B12R1.1061 CC(O)CC(=O)N[C@H]1C[C@H](C1)O 3b3fcf1aa5ecc4fe7875bdff8d44226c [0,1,0,1,0,0|2,0,0]=4 6485 B12R1.1061 C[C@@H](O)CC(=O)NC1CC(C1)O 08682eab60f73dacf2402173045c962e [0,1,0,1,0,0|2,0,0]=4 6486 B12R1.1061 C[C@@H](O)CC(=O)NC1CN(C1)C 16323483a55684a6a27f18a09d3ba5f0 [0,1,0,1,0,0|2,0,0]=4 6487 B12R1.1061 C[C@@H](O)CC(=O)N[C@H]1C[C@@H](C1)O 776182d69dd7cc65cb9e1e567734e6ce [0,1,0,1,0,0|2,0,0]=4 6488 B12R1.1061 C[C@@H](O)CC(=O)N[C@H]1C[C@H](C1)O 0fe04b3f1306d1525ddee3cf7f7af115 [0,1,0,1,0,0|2,0,0]=4 6489 B12R1.1061 C[C@H](O)CC(=O)NC1CC(C1)O 079aa70551afb5c842c89dac6f96da8f [0,1,0,1,0,0|2,0,0]=4 6490 B12R1.1061 C[C@H](O)CC(=O)NC1CN(C1)C a46e7dff307cac484f1ff282c08329df [0,1,0,1,0,0|2,0,0]=4 6491 B12R1.1061 C[C@H](O)CC(=O)N[C@H]1C[C@@H](C1)O b074c4789afba4209ce857d1fd813ac7 [0,1,0,1,0,0|2,0,0]=4 6492 B12R1.1061 C[C@H](O)CC(=O)N[C@H]1C[C@H](C1)O f993997862cebba69199999196fdd16a [0,1,0,1,0,0|2,0,0]=4 6493 B12R1.1620 CC1(CC(C1)NC(=O)CCF)O 9b7d346c97030f75aaeacf5bb2f2220d [0,1,0,1,0,0|2,0,0]=4 6494 B12R1.1620 CCCC(=O)CN1CC(C1)(C)C 05835cd000e8bd04b2ddc2125a05bf56 [0,1,0,1,0,0|2,0,0]=4 6495 B12R1.1620 CCCC(=O)CN1CC(C1)(C)O 0d1b95364f3b6202dafe9add41191e43 [0,1,0,1,0,0|2,0,0]=4 6496 B12R1.1620 CCCC(=O)NC1CC(C1)(C)O 53c13f8c2f5ab910ca58941243c4a40b [0,1,0,1,0,0|1,0,0]=3 6497 B12R1.1620 CCCC(=O)NC1CC(C1)(F)F 06ebd5e46788f57a65d94dc2021896df [0,1,0,1,0,0|2,0,0]=4 6498 B12R1.1620 CCCC(=O)N[C@H]1C[C@@](C1)(C)O 6904d6cbd8653fb13d2c205c96cba5c6 [0,1,0,1,0,0|1,0,0]=3 6499 B12R1.1620 CCCC(=S)OC1CC(C1)(C)C b70554d7f0642d1f6b4babfd5de84fee [0,1,0,1,0,0|0,1,0]=3 6500 B12R1.1620 CCCC(=S)OC1CC(C1)(F)F e5ea5a411153a29894c5ef355620efdf [0,1,0,1,0,0|1,1,0]=4 6501 B12R1.1620 CCCC(C)OC1CC(C1)(C)C 60a601b0ac2c78722f5c9e00e96ef9a7 [0,1,0,1,0,0|1,0,1]=4 6502 B12R1.1620 CCC[C@@H](C)OC1CC(C1)(C)C 23674d0f7690509b226998de51a33885 [0,1,0,1,0,0|1,0,1]=4 6503 B12R1.1620 CCC[C@H](C)OC1CC(C1)(C)C b317d943de0755535103b2333fbd3220 [0,1,0,1,0,0|1,0,1]=4 6504 B12R1.1620 COCC(=O)NC1CC(C1)(C)O cf290fb769ad16e1d4cb3b0656f3660b [0,1,0,1,0,0|2,0,0]=4 6505 B12R1.1620 COCC(=O)N[C@H]1C[C@@](C1)(C)O 11e6138331f951279297f53a414842f2 [0,1,0,1,0,0|2,0,0]=4 6506 B12R1.1620 CSCC(=O)NC1CC(C1)(C)O a7be57d1e126f7261559512dbb9a6287 [0,1,0,1,0,0|2,0,0]=4 6507 B12R1.1620 CSCC(=O)N[C@H]1C[C@@](C1)(C)O 2dc32269b7371ac8bb82638a4dbc7e96 [0,1,0,1,0,0|2,0,0]=4 6508 B12R1.1620 C[C@@]1(C[C@H](C1)NC(=O)CCF)O 251d458ee86b15245c4ecb879ee8ba34 [0,1,0,1,0,0|2,0,0]=4 6509 B12R1.1811 CC(C)CC(C)OC(C)C1CC1 455348bdea850f3b069f6e4066ee7d55 [0,1,0,1,0,0|1,0,1]=4 6510 B12R1.1811 CC(C)CC(C)O[C@@H](C)C1CC1 122c2b1a9ec539d4c1771cf9fb1ff324 [0,1,0,1,0,0|1,0,1]=4 6511 B12R1.1811 CC(C)CC(C)O[C@H](C)C1CC1 c207b6f964a7c84f083e8742c5afe855 [0,1,0,1,0,0|1,0,1]=4 6512 B12R1.1811 CC(C)CN(C)CC(=O)C1CC1 681ac7e5e0d4a252b5d74aa216dab316 [0,1,0,1,0,0|2,0,0]=4 6513 B12R1.1811 CC(C)C[C@@H](C)OC(C)C1CC1 b03647587da38d269c07e3aa5a5cef36 [0,1,0,1,0,0|1,0,1]=4 6514 B12R1.1811 CC(C)C[C@H](C)OC(C)C1CC1 9e0f9be2643e2dbdc7d26d4b57f53f3e [0,1,0,1,0,0|1,0,1]=4 6515 B12R1.2055 CCCC(=O)NC1(CN(C1)C)C 49ef24ac6705f9a970a5e1eff785e1ae [0,1,0,1,0,0|2,0,0]=4 6516 B12R1.2055 CCCC(=O)N[C@@]1(C[C@H](C1)O)C 3eaec5d7d6bbb1d9e8b979a3786065db [0,1,0,1,0,0|2,0,0]=4 6517 B12R1.103 C=C(C)CC(=O)N1CCC(C1)C 543db3432a8c74baebe9714dd142aa04 [0,1,0,1,0,0|1,0,1]=4 6518 B12R1.103 CC(=O)CC(=O)N1CCC(C1)C 3b64b1ad76a77e9f3955c1250e7ca283 [0,1,0,1,0,0|1,0,1]=4 6519 B12R1.103 CC(C)CC(=O)N1CCC(C1)C d50df6ebc6cbcf1d3837ab489f9ebe18 [0,1,0,1,0,0|1,0,0]=3 6520 B12R1.103 CC(C)CC(=O)N1CCC(C1)F c9cc22ce3514559f0aa2ce79ffcc65f4 [0,1,0,1,0,0|2,0,0]=4 6521 B12R1.103 CC(C)CC(=O)N1CCC(C1)O 7bee685fe2f5b802b4ac679d9cad7dda [0,1,0,1,0,0|2,0,0]=4 6522 B12R1.103 CC(C)CC(=O)N1CCN(C1)C 4a6c11244507df7bed80cce95630c8f7 [0,1,0,1,0,0|2,0,0]=4 6523 B12R1.103 CC(C)CC(=O)N1CC[C@@H](C1)F 43a2acda7a6bf059a8bec937a3ebd39b [0,1,0,1,0,0|2,0,0]=4 6524 B12R1.103 CC(C)CC(=O)N1CC[C@@H](C1)O a5de66f40ec1f80c967dae130c4e13d5 [0,1,0,1,0,0|2,0,0]=4 6525 B12R1.103 CC(C)CC(=O)N1CC[C@H](C1)F cbeeb320f7cdb0e2b88fe99b028fe3d8 [0,1,0,1,0,0|2,0,0]=4 6526 B12R1.103 CC(C)CC(=O)N1CC[C@H](C1)O 1b5d56e2c8b9c90946ab7c76d60279c7 [0,1,0,1,0,0|2,0,0]=4 6527 B12R1.103 CC(O)CC(=O)N1CCC(C1)C 6f6bed2085d109fb7fe8803bd4ebdbed [0,1,0,1,0,0|1,0,0]=3 6528 B12R1.103 CC(O)CC(=O)N1CCC(C1)F 948278dcd24f19bd9c44f4c52f813367 [0,1,0,1,0,0|2,0,0]=4 6529 B12R1.103 CC(O)CC(=O)N1CCC(C1)O dcbe14de4b511b850f0bbf0107447648 [0,1,0,1,0,0|2,0,0]=4 6530 B12R1.103 CC(O)CC(=O)N1CCN(C1)C 8cf37c758226d51faa51876f8d603846 [0,1,0,1,0,0|2,0,0]=4 6531 B12R1.103 CC(O)CC(=O)N1CC[C@@H](C1)F 82d5c42b6d2db3a72c08c92fd2d6f68e [0,1,0,1,0,0|2,0,0]=4 6532 B12R1.103 CC(O)CC(=O)N1CC[C@@H](C1)O 92ccfa3845f3afd1da76b145aa5b5b7e [0,1,0,1,0,0|2,0,0]=4 6533 B12R1.103 CC(O)CC(=O)N1CC[C@H](C1)F 25e0932ad7d6ed81ce2d6a30570e04a3 [0,1,0,1,0,0|2,0,0]=4 6534 B12R1.103 CC(O)CC(=O)N1CC[C@H](C1)O ffc3d495f84f5a545026a1325b092f1c [0,1,0,1,0,0|2,0,0]=4 6535 B12R1.103 CC1CCN(C1)C(=O)CC(F)F 534b9787b50b7b4050ca01e8caf23add [0,1,0,1,0,0|2,0,0]=4 6536 B12R1.103 CC1CCN(C1)C(=O)CN(C)C d030ea96619687c8f287b5b4cb1eace1 [0,1,0,1,0,0|2,0,0]=4 6537 B12R1.103 CC1CCN(C1)C(=O)C[C@@H](C)O c241d835562716a2942189ce18118cc1 [0,1,0,1,0,0|1,0,0]=3 6538 B12R1.103 CC1CCN(C1)C(=O)C[C@H](C)O 8e06e9ab2ed0656e5d4df3941d3574d9 [0,1,0,1,0,0|1,0,0]=3 6539 B12R1.103 C[C@@H](O)CC(=O)N1CCC(C1)F 3110c2ae1a739e6258dcb27b93440c28 [0,1,0,1,0,0|2,0,0]=4 6540 B12R1.103 C[C@@H](O)CC(=O)N1CCC(C1)O 19d603d90b752a1f714d3eef0c64bd60 [0,1,0,1,0,0|2,0,0]=4 6541 B12R1.103 C[C@@H](O)CC(=O)N1CCN(C1)C 825ba7d344b85e7c7599979c94f7a5b6 [0,1,0,1,0,0|2,0,0]=4 6542 B12R1.103 C[C@@H](O)CC(=O)N1CC[C@@H](C1)F 45ef9a66fdaea688844337c594ef899c [0,1,0,1,0,0|2,0,0]=4 6543 B12R1.103 C[C@@H](O)CC(=O)N1CC[C@@H](C1)O 43c532b2af31257e8bfee177cfd5615e [0,1,0,1,0,0|2,0,0]=4 6544 B12R1.103 C[C@@H](O)CC(=O)N1CC[C@H](C1)F b120bb6a573f19055ee118cdcb4c4ee9 [0,1,0,1,0,0|2,0,0]=4 6545 B12R1.103 C[C@@H](O)CC(=O)N1CC[C@H](C1)O e25fe3e88584836125a2f13a2c52b108 [0,1,0,1,0,0|2,0,0]=4 6546 B12R1.103 C[C@H](O)CC(=O)N1CCC(C1)F d386bbb9b0480d871ae6cba442f56163 [0,1,0,1,0,0|2,0,0]=4 6547 B12R1.103 C[C@H](O)CC(=O)N1CCC(C1)O 8a1e39ec1b1d2e8e03b8bf88aa680fd8 [0,1,0,1,0,0|2,0,0]=4 6548 B12R1.103 C[C@H](O)CC(=O)N1CCN(C1)C e21900c83a22a2727bb118c03a440a73 [0,1,0,1,0,0|2,0,0]=4 6549 B12R1.103 C[C@H](O)CC(=O)N1CC[C@@H](C1)F ec91268e39587c0e4497fa11d9568deb [0,1,0,1,0,0|2,0,0]=4 6550 B12R1.103 C[C@H](O)CC(=O)N1CC[C@@H](C1)O 13c32c22976dab5082e7004dc1b87d0a [0,1,0,1,0,0|2,0,0]=4 6551 B12R1.103 C[C@H](O)CC(=O)N1CC[C@H](C1)F c5647fa18418b7d53d0d47ff4a8ad12b [0,1,0,1,0,0|2,0,0]=4 6552 B12R1.103 C[C@H](O)CC(=O)N1CC[C@H](C1)O f6794d23f4c65a4043295f53046da6ef [0,1,0,1,0,0|2,0,0]=4 6553 B12R1.105 CC(C)CCOC1=CC(=O)CC1 3d4b5bcaee537f0dbb7c44af33e16bf7 [0,1,0,1,0,0|1,0,1]=4 6554 B12R1.105 CC(C)CCOC1CCC(C1)C fbd44d6c1ad802f1ef3831860544083d [0,1,0,1,0,0|1,0,1]=4 6555 B12R1.105 CC(C)CCOC1CCC(C1)F ceb645636399fccad4ce8ef41714810a [0,1,0,1,0,0|1,0,1]=4 6556 B12R1.105 CC(C)CCOC1CCN(C1)C bbb15240e6dabe8268ebc38a7af250ef [0,1,0,1,0,0|1,0,1]=4 6557 B12R1.105 CC(C)CCOC1COC(C1)C 4bdf128f752159210660b11f7336cc57 [0,1,0,1,0,0|0,0,2]=4 6558 B12R1.105 CC(C)CCO[C@@H]1CCN(C1)C 68b06bd6e5d5d2f3195593baf9378a8b [0,1,0,1,0,0|1,0,1]=4 6559 B12R1.105 CC(C)CCO[C@H]1CCN(C1)C a750bf15f19cbd337b0dbeb98f3045ff [0,1,0,1,0,0|1,0,1]=4 6560 B12R1.142 CC(C)CC(=O)CNC1CC1C 10d33f3fdc0865ccd8402fd3d6ee6b52 [0,1,0,1,0,0|2,0,0]=4 6561 B12R1.142 CC(C)CC(C)OCC1CC1C 75d12ada0c148f5fa0cfc832b76babbd [0,1,0,1,0,0|1,0,1]=4 6562 B12R1.142 CC(C)CC(C)OC[C@@H]1C[C@@H]1C 4083733be262f170be77a1b63a405973 [0,1,0,1,0,0|1,0,1]=4 6563 B12R1.142 CC(C)CC(C)OC[C@@H]1C[C@H]1C 8e76f3306b409234e806e6d740a2dc5d [0,1,0,1,0,0|1,0,1]=4 6564 B12R1.142 CC(C)CC(C)OC[C@H]1C[C@@H]1C 62fa75544c026a32a12f41645828e344 [0,1,0,1,0,0|1,0,1]=4 6565 B12R1.1359 CC(C)C/C=C/C(=O)NC1CC1 3892da87017ee9945b50983847a733e9 [0,1,0,1,0,0|1,0,1]=4 6566 B12R1.1359 CC(C)CCCC(=O)NC1CC1 24bf673946a1d4adbb41a7abc647a778 [0,1,0,1,0,0|1,0,0]=3 6567 B12R1.1359 CC(C)CCNC(=O)CC1CC1 9231a98431852ce765aaeb590855e534 [0,1,0,1,0,0|1,0,0]=3 6568 B12R1.1359 CC(C)CCNC(=O)NC1CC1 2d2185649d40d4688761228a472576c2 [0,1,0,1,0,0|1,0,0]=3 6569 B12R1.1359 CC(C)CCNC(=S)NC1CC1 8e54968ad0e54867df2e0548ca4d5197 [0,1,0,1,0,0|1,1,0]=4 6570 B12R1.1359 CC(C)CCOC(C)CC1CC1 fdf29cef693db453d642d00be42085cd [0,1,0,1,0,0|1,0,1]=4 6571 B12R1.1359 CC(C)CNCC(=O)NC1CC1 9cc7cc91d463af01b4459cc9b2c8a7c8 [0,1,0,1,0,0|2,0,0]=4 6572 B12R1.1359 CC(C)COCC(=O)NC1CC1 2a7825b5714bce3c1e2968a2cf68805e [0,1,0,1,0,0|2,0,0]=4 6573 B12R1.1359 CC(C)OCCC(=O)NC1CC1 8354b82e6a3cc908992839828bd43b83 [0,1,0,1,0,0|2,0,0]=4 6574 B12R1.1359 CC(O)CCNC(=O)CC1CC1 b8d8e0950c6859c1a8e9b183e67d6f53 [0,1,0,1,0,0|2,0,0]=4 6575 B12R1.1359 CC(O)CCNC(=O)NC1CC1 4080808321e70ee1e3281802c205a0c1 [0,1,0,1,0,0|2,0,0]=4 6576 B12R1.1359 CN(C)CCCC(=O)NC1CC1 18a4893be62a90f5b29504536493595b [0,1,0,1,0,0|2,0,0]=4 6577 B12R1.1359 CN(C)CCNC(=O)CC1CC1 54f3f46b954d6cafc535eae103f1b21f [0,1,0,1,0,0|2,0,0]=4 6578 B12R1.1359 CN(C)CCNC(=O)NC1CC1 3c949b2692a73b35f8537c3ae02bcb4e [0,1,0,1,0,0|2,0,0]=4 6579 B12R1.1359 C[C@@H](O)CCNC(=O)CC1CC1 220f3925b7e4b74b02a7f85e6a2e6803 [0,1,0,1,0,0|2,0,0]=4 6580 B12R1.1359 C[C@@H](O)CCNC(=O)NC1CC1 f92790b6371a7a29695b2e4d84219f5f [0,1,0,1,0,0|2,0,0]=4 6581 B12R1.1359 C[C@H](O)CCNC(=O)CC1CC1 3943faecf4c210140c1fbc61d0b64473 [0,1,0,1,0,0|2,0,0]=4 6582 B12R1.1359 C[C@H](O)CCNC(=O)NC1CC1 dc8312df09f34c8fcb13f7da02837d74 [0,1,0,1,0,0|2,0,0]=4 6583 B12R1.1377 C=C(C)CC(=O)NCCC1CC1 64a28e06c0b9b656c38959299939c1ed [0,1,0,1,0,0|1,0,1]=4 6584 B12R1.1377 CC(=O)CC(=O)NCCC1CC1 190d22f3a8f615ba05e42a44f66fca8b [0,1,0,1,0,0|1,0,1]=4 6585 B12R1.1377 CC(C)CC(=O)CNCC1CC1 43b9014b58e52ab940a3bdde54efc46a [0,1,0,1,0,0|2,0,0]=4 6586 B12R1.1377 CC(C)CC(=O)COCC1CC1 b41aa3d3c2eed73110d80d7b516f3c72 [0,1,0,1,0,0|2,0,0]=4 6587 B12R1.1377 CC(C)CC(=O)NCCC1CC1 9202f44cbb4f71946e2cf19700f94765 [0,1,0,1,0,0|1,0,0]=3 6588 B12R1.1377 CC(C)CC(=O)NCCN1CC1 a23afe77674f49efabf897877c9e64f3 [0,1,0,1,0,0|2,0,0]=4 6589 B12R1.1377 CC(C)CC(=O)OCNC1CC1 4578511b6d4452d8a7905074688356ff [0,1,0,1,0,0|1,0,0]=3 6590 B12R1.1377 CC(C)CC(=O)OCOC1CC1 ab51832c39df0798694cf8e1b392228e [0,1,0,1,0,0|1,0,0]=3 6591 B12R1.1377 CC(C)CC(C)OCCC1CC1 3819c33d9545ee3f1ba53b4a2b748b5f [0,1,0,1,0,0|1,0,1]=4 6592 B12R1.1377 CC(C)C[C@@H](C)OCCC1CC1 2f49019a33ea5dba58dec77412a48a60 [0,1,0,1,0,0|1,0,1]=4 6593 B12R1.1377 CC(C)C[C@H](C)OCCC1CC1 eceaf51557e20d2b45160652c90bc9e6 [0,1,0,1,0,0|1,0,1]=4 6594 B12R1.1377 CC(C)OC(=O)OCNC1CC1 6baf15efcb7e6ba58f54361934cd86a6 [0,1,0,1,0,0|2,0,0]=4 6595 B12R1.1377 CC(C)OC(=O)OCOC1CC1 fb75a8198a2240890bf2679a82cff330 [0,1,0,1,0,0|2,0,0]=4 6596 B12R1.1377 CC(O)CC(=O)NCCC1CC1 c8657838084935423e152491e9082312 [0,1,0,1,0,0|1,0,0]=3 6597 B12R1.1377 CC(O)CC(=O)NCCN1CC1 0d9de2bc1a1c418f2fbeae8b026457d8 [0,1,0,1,0,0|2,0,0]=4 6598 B12R1.1377 CN(C)CC(=O)NCCC1CC1 f78f0bf1ba41745b0b7508dd2de1cfec [0,1,0,1,0,0|2,0,0]=4 6599 B12R1.1377 C[C@@H](O)CC(=O)NCCC1CC1 c04b3ce1eadeaca9c5726e732bf8632f [0,1,0,1,0,0|1,0,0]=3 6600 B12R1.1377 C[C@@H](O)CC(=O)NCCN1CC1 aaff34ec5e0b941ab9af552b30f0432b [0,1,0,1,0,0|2,0,0]=4 6601 B12R1.1377 C[C@H](O)CC(=O)NCCC1CC1 d33de53f866341d31f89bff9d4c26562 [0,1,0,1,0,0|1,0,0]=3 6602 B12R1.1377 C[C@H](O)CC(=O)NCCN1CC1 9b0fe22e277fe00bab3f3879017e941f [0,1,0,1,0,0|2,0,0]=4 6603 B12R1.1377 O=C(CC(F)F)NCCC1CC1 4cafc2c7aa526d500fd4a3bfbe36c746 [0,1,0,1,0,0|2,0,0]=4 6604 B12R1.1810 CC(C)CCOC1CC(C1)(C)C b21e2d9cc631b8d3a5a7f834cf4e35ad [0,1,0,1,0,0|1,0,1]=4 6605 B12R1.2685 C=C(C)CC(=O)NC1CC1(C)C f7a8ee7b6ee9af55795fa401ff200379 [0,1,0,1,0,0|1,0,1]=4 6606 B12R1.2685 C=C(C)CC(=O)N[C@@H]1CC1(C)C 483a97b8ce490c64861abc82ab7edf94 [0,1,0,1,0,0|1,0,1]=4 6607 B12R1.2685 C=C(C)CC(=O)N[C@H]1CC1(C)C 012c9bc0d50960f1987c85d361735e54 [0,1,0,1,0,0|1,0,1]=4 6608 B12R1.2685 CC(=O)CC(=O)NC1CC1(C)C adbad9870556bc429500b5e0e8e47eda [0,1,0,1,0,0|1,0,1]=4 6609 B12R1.2685 CC(=O)CC(=O)N[C@@H]1CC1(C)C e819b970c815ddbed0d23b3e2d6d3922 [0,1,0,1,0,0|1,0,1]=4 6610 B12R1.2685 CC(=O)CC(=O)N[C@H]1CC1(C)C a7780779df26a5ebf30c7fa34f611682 [0,1,0,1,0,0|1,0,1]=4 6611 B12R1.2685 CC(C)CC(=O)CN1CC1(C)C 5eee75b9d754e6216cfc88ff091ca769 [0,1,0,1,0,0|2,0,0]=4 6612 B12R1.2685 CC(C)CC(=O)NC1CC1(C)C 64c326efe8fb7a3b2c9a6748d64cc7b4 [0,1,0,1,0,0|1,0,0]=3 6613 B12R1.2685 CC(C)CC(=O)N[C@@H]1CC1(C)C ef297756accbe2b1c84f13ca8f62d8ad [0,1,0,1,0,0|1,0,0]=3 6614 B12R1.2685 CC(C)CC(=O)N[C@H]1CC1(C)C ccd11de44fe6d01e425b718ad67fa6ed [0,1,0,1,0,0|1,0,0]=3 6615 B12R1.2685 CC(C)CC(C)OC1CC1(C)C 46dfba4d87e82381bf633964b658ef8d [0,1,0,1,0,0|1,0,1]=4 6616 B12R1.2685 CC(C)C[C@@H](C)OC1CC1(C)C 9b953007a08369a26ebce0e5183b000c [0,1,0,1,0,0|1,0,1]=4 6617 B12R1.2685 CC(C)C[C@H](C)OC1CC1(C)C 27e76dd973988d8e2daec5325748b0da [0,1,0,1,0,0|1,0,1]=4 6618 B12R1.2685 CC(O)CC(=O)NC1CC1(C)C 642340ff00da94093d1cb0edc216b1ca [0,1,0,1,0,0|1,0,0]=3 6619 B12R1.2685 CC(O)CC(=O)N[C@@H]1CC1(C)C 31bce3643afb07bb84b3392baf2f1885 [0,1,0,1,0,0|1,0,0]=3 6620 B12R1.2685 CC(O)CC(=O)N[C@H]1CC1(C)C 12a7e07127e215931fb521e0465330c2 [0,1,0,1,0,0|1,0,0]=3 6621 B12R1.2685 CC1(CC1NC(=O)CC(F)F)C 68101da2f66b31b5bb943effa4a0fe89 [0,1,0,1,0,0|2,0,0]=4 6622 B12R1.2685 CC1(C[C@@H]1NC(=O)CC(F)F)C 7daeca2e7a155831b0f4d5e616263c80 [0,1,0,1,0,0|2,0,0]=4 6623 B12R1.2685 CC1(C[C@H]1NC(=O)CC(F)F)C cbf10a33d6b908fbdc945eda4bed4512 [0,1,0,1,0,0|2,0,0]=4 6624 B12R1.2685 CN(C)CC(=O)NC1CC1(C)C 180f4ec55efa1ba161bc4a4719f7a48e [0,1,0,1,0,0|2,0,0]=4 6625 B12R1.2685 CN(C)CC(=O)N[C@@H]1CC1(C)C 67ca9a4e709340e0cdee45a416d5ea67 [0,1,0,1,0,0|2,0,0]=4 6626 B12R1.2685 CN(C)CC(=O)N[C@H]1CC1(C)C 8fb0cbcd72cb46a8fe8a90262aba3718 [0,1,0,1,0,0|2,0,0]=4 6627 B12R1.2685 C[C@@H](O)CC(=O)NC1CC1(C)C 302283598f06a96ae4d159181379ec4e [0,1,0,1,0,0|1,0,0]=3 6628 B12R1.2685 C[C@@H](O)CC(=O)N[C@@H]1CC1(C)C 5d86f7eca26772f610bf1b157e3b9213 [0,1,0,1,0,0|1,0,0]=3 6629 B12R1.2685 C[C@@H](O)CC(=O)N[C@H]1CC1(C)C 8babeff102a0b2ceca7390631942fcb5 [0,1,0,1,0,0|1,0,0]=3 6630 B12R1.2685 C[C@H](O)CC(=O)NC1CC1(C)C 671187c25e0094b4d9bfd8dff31206c6 [0,1,0,1,0,0|1,0,0]=3 6631 B12R1.2685 C[C@H](O)CC(=O)N[C@@H]1CC1(C)C d5d9a6b9469ced01d83f10e925cd942e [0,1,0,1,0,0|1,0,0]=3 6632 B12R1.2685 C[C@H](O)CC(=O)N[C@H]1CC1(C)C 61ae8feb2e9c1659a88a0b9359bd5f2f [0,1,0,1,0,0|1,0,0]=3 6633 B12R1.136 CCCC(CC)OC1CC(C1)C a4d5b64d79662413a6d09768770107db [0,1,0,1,0,0|1,0,1]=4 6634 B12R1.138 C#CC(CCC)OCCC1CC1 f6b29fc63e51c3b1fba078cf11a71688 [0,1,0,1,0,0|1,0,1]=4 6635 B12R1.138 C=CC(CCC)OCCC1CC1 955da773115527ff4f76dffba6137baa [0,1,0,1,0,0|1,0,1]=4 6636 B12R1.138 CCCC(C#N)OCCC1CC1 7400b036398f8c9bcb742a0cf3956d5c [0,1,0,1,0,0|1,0,1]=4 6637 B12R1.138 CCCC(CC)OCCC1CC1 8bff325bf8f80eff11ae59fc2022f940 [0,1,0,1,0,0|1,0,1]=4 6638 B12R1.138 CCC[C@@H](CC)OCCC1CC1 7149b4abb32963075281921e7f60de44 [0,1,0,1,0,0|1,0,1]=4 6639 B12R1.252 CC(C)CCOC1C=CCCC1 df21520293dc71c93f06634c3d7af6a7 [0,1,0,1,0,0|1,0,1]=4 6640 B12R1.252 CC(C)CCOC1CCCCC1 7ace09065cf5c249b87b500a45dc4808 [0,1,0,1,0,0|1,0,1]=4 6641 B12R1.252 CC(C)CCOC1CCCCO1 b9341562c24dcf38b397bf3ce9263246 [0,1,0,1,0,0|0,0,2]=4 6642 B12R1.252 CC(C)CCOC1CCCOC1 bb9950fdee020af23a2eb06862fb47fe [0,1,0,1,0,0|0,0,2]=4 6643 B12R1.252 CC(C)CCOC1CCCSC1 1e86025f7ea5d9193f48ae160a366db4 [0,1,0,1,0,0|0,1,1]=4 6644 B12R1.252 CC(C)CCOC1CCOCC1 ff3a7c609e4520607e568fe261665c62 [0,1,0,1,0,0|1,0,1]=4 6645 B12R1.252 CC(C)CCOC1CCSCC1 8e04a55f73cfb33bd9ec9cf9ba3b3eaf [0,1,0,1,0,0|1,0,1]=4 6646 B12R1.252 CC(C)CCO[C@@H]1CCCOC1 2bd32438de5a2b88fd9b02c3b5bcd2a3 [0,1,0,1,0,0|0,0,2]=4 6647 B12R1.252 CC(C)CCO[C@H]1CCCOC1 75ffd4cf369989646db60cfacd8c16d1 [0,1,0,1,0,0|0,0,2]=4 6648 B12R1.610 CCCC(CC)OCC1CC1C 2d47dfeee8e092898fe6ef254f1fb353 [0,1,0,1,0,0|1,0,1]=4 6649 B12R1.610 CCCC(CC)OC[C@@H]1C[C@@H]1C 225212f081ef9d65eff330d75ffdb8b8 [0,1,0,1,0,0|1,0,1]=4 6650 B12R1.610 CCCC(CC)OC[C@@H]1C[C@H]1C 2ab200e06545cd95a72e10c7e579366a [0,1,0,1,0,0|1,0,1]=4 6651 B12R1.610 CCCC(CC)OC[C@H]1C[C@@H]1C 3378770c50743fa034d1fe5997bcce6f [0,1,0,1,0,0|1,0,1]=4 6652 B12R1.960 C#CC(CCC)OC1CC1(C)C 4808a28acf9cf5fade9765c0020364cb [0,1,0,1,0,0|1,0,1]=4 6653 B12R1.960 C=CC(CCC)OC1CC1(C)C e3a1506f70eadc690973087b7cf8ff20 [0,1,0,1,0,0|1,0,1]=4 6654 B12R1.960 CCCC(C#N)OC1CC1(C)C 10f0e66d67de040bf1beee2877c1dcc0 [0,1,0,1,0,0|1,0,1]=4 6655 B12R1.960 CCCC(CC)OC1CC1(C)C 9b3b4510bbff4646ead5b5abdb814f99 [0,1,0,1,0,0|1,0,1]=4 6656 B12R1.960 CCC[C@@H](CC)OC1CC1(C)C ba6cb5fc9d1fe73a553d2f7ed77641db [0,1,0,1,0,0|1,0,1]=4 6657 B12R1.3756 CC(C)CCOC(C#N)C1CC1 5a9bcae57755938b1e6c73288aa72984 [0,1,0,1,0,0|1,0,1]=4 6658 B12R1.3756 CCC(OCCC(C)C)C1CC1 b6d65176bd136fd1a97beb0c8386e71c [0,1,0,1,0,0|1,0,1]=4 6659 B12R1.16 CC1CCN(CC1)C(=O)CCF 17e26a40d40bd1a74c4b48270bc9e143 [0,1,0,1,0,0|2,0,0]=4 6660 B12R1.16 CC1CCN(CC1)C(=O)CCO c8f1748164c80d52812c349d3809b12d [0,1,0,1,0,0|2,0,0]=4 6661 B12R1.16 CC1CCN(CC1)C(=O)CCS e6b3577333ceb086f3acae7dfcd77698 [0,1,0,1,0,0|2,0,0]=4 6662 B12R1.16 CCCC(=O)N1CCC(CC1)C 23c13642fbb293b1ecce1385e683f866 [0,1,0,1,0,0|1,0,0]=3 6663 B12R1.16 CCCC(=O)N1CCC(CC1)Cl 51f2d25419fc2497a9235127b7d16a04 [0,1,0,1,0,0|2,0,0]=4 6664 B12R1.16 CCCC(=O)N1CCC(CC1)F 1ce748132d23ea85b667f84b5ff4fb1d [0,1,0,1,0,0|2,0,0]=4 6665 B12R1.16 CCCC(=O)N1CCC(CC1)I 53f96568adaaa76b1cf02c498a33e122 [0,1,0,1,0,0|2,0,0]=4 6666 B12R1.16 CCCC(=O)N1CCC(CC1)O dff86cd76f333260b5737374b7da3c84 [0,1,0,1,0,0|2,0,0]=4 6667 B12R1.16 CCCC(=O)N1CCN(CC1)C 20bbeff5b6042cd07396b427898b8e7f [0,1,0,1,0,0|2,0,0]=4 6668 B12R1.16 COCC(=O)N1CCC(CC1)C 5d393433f52b81ecaad68fd6a57b667e [0,1,0,1,0,0|2,0,0]=4 6669 B12R1.16 CSCC(=O)N1CCC(CC1)C 4fea61568fd8224756bf48cffe7036a9 [0,1,0,1,0,0|2,0,0]=4 6670 B12R1.125 CC(C)CNC1CCCCC1=O 469ceb216d7f04ab13f9b3df2fbe43f7 [0,1,0,1,0,0|2,0,0]=4 6671 B12R1.125 CC(C)CNC1CCCNC1=O cbd6b417e9df25e6eb26680e1ee6a820 [0,1,0,1,0,0|2,0,0]=4 6672 B12R1.125 CC(C)CNC1COCCC1=O 46fb9daed86446d93b739aec60df4655 [0,1,0,1,0,0|2,0,0]=4 6673 B12R1.125 CC(C)CNC1SCCCC1=O 4944e126483c2567a541eeaa86aa0bc1 [0,1,0,1,0,0|2,0,0]=4 6674 B12R1.125 CC(C)CN[C@@H]1CCCNC1=O 7d7788c3d5155227b9123ac6a6aeb707 [0,1,0,1,0,0|2,0,0]=4 6675 B12R1.125 CC(C)CN[C@H]1CCCNC1=O 0c7641e05072e90890734a76529ba5bd [0,1,0,1,0,0|2,0,0]=4 6676 B12R1.125 CC(C)COC1CCCCC1=O a0f2c77d8948585b5610f98c5345691d [0,1,0,1,0,0|2,0,0]=4 6677 B12R1.125 CC(C)COC1CCCNC1=O c2541c088ec71858265f7064497111fd [0,1,0,1,0,0|2,0,0]=4 6678 B12R1.125 CC(C)COC1CCCOC1=O b33dfde8212ee6d757617789edd54c30 [0,1,0,1,0,0|2,0,0]=4 6679 B12R1.125 CC(C)COC1SCCCC1=O 3fa095c65cef11e3210e73e4f3cc13f0 [0,1,0,1,0,0|2,0,0]=4 6680 B12R1.125 CC(C)CO[C@@H]1CCCNC1=O 9b2927d27f76dff3dbd03a3b4c4cc431 [0,1,0,1,0,0|2,0,0]=4 6681 B12R1.125 CC(C)CO[C@H]1CCCNC1=O 977e0b3e14f02b01351c69f5381a86b1 [0,1,0,1,0,0|2,0,0]=4 6682 B12R1.125 CC(C)OCC1=CCCCC1=O 9410f19b8ab985719721ce671c554783 [0,1,0,1,0,0|2,0,0]=4 6683 B12R1.125 CC(C)OCC1CCCCC1=O 6c1fb32da731ed54a462ce45e88dc7bf [0,1,0,1,0,0|2,0,0]=4 6684 B12R1.125 CC(C)OCC1CCCNC1=O bc27e95e0133e0fba23214e6a846c234 [0,1,0,1,0,0|2,0,0]=4 6685 B12R1.131 CC(C)OCC1(CCCC1=O)C 4b7720131b129be51aae255b1a188aee [0,1,0,1,0,0|2,0,0]=4 6686 B12R1.554 CCCC(=O)C(=O)NC1CC1C 38dcad951078372e0db70d3f391bc6c6 [0,1,0,1,0,0|2,0,0]=4 6687 B12R1.556 CCCC(=O)C(=O)NCC1CC1 07a2c91387343019a946d3b7d393c2ee [0,1,0,1,0,0|2,0,0]=4 6688 B12R1.558 CCCC(=O)N(C)C1CC(C1)F 40a5faaa1e33d09e788384aa4aba249e [0,1,0,1,0,0|2,0,0]=4 6689 B12R1.558 CCCC(=O)N(C)C1CC(C1)O 6f5d6eec5b467c672652d0f0a033fcad [0,1,0,1,0,0|2,0,0]=4 6690 B12R1.558 CCCC(=O)N(C)C1CN(C1)C 122ad5e8d67b0c3853a8e0b1c1776b76 [0,1,0,1,0,0|2,0,0]=4 6691 B12R1.558 CCCC(=O)N(C)[C@H]1C[C@@H](C1)F b123ce1ec1b3b5d2103beb53fa58edab [0,1,0,1,0,0|2,0,0]=4 6692 B12R1.558 CCCC(=O)N(C)[C@H]1C[C@@H](C1)O 5d734341afe482343b5923b36740ae34 [0,1,0,1,0,0|2,0,0]=4 6693 B12R1.558 CCCC(=O)N(C)[C@H]1C[C@H](C1)F f04d6a08b98b182adb45a69140406230 [0,1,0,1,0,0|2,0,0]=4 6694 B12R1.1566 CCCC(=O)N1CC(C1)C(C)O 8eb3b371e0748b070fdf4771321314ba [0,1,0,1,0,0|2,0,0]=4 6695 B12R1.1566 CCCC(=O)N1CC(C1)N(C)C d75b7f372d5c12d4b4f0959ef4b0cc96 [0,1,0,1,0,0|2,0,0]=4 6696 B12R1.1580 CC1(CCN(C1)C(=O)CCF)C 29a7ac4d6246d2a7fa0013b0f15adf2f [0,1,0,1,0,0|2,0,0]=4 6697 B12R1.1580 CC1(CCN(C1)C(=O)CCF)F e204328d53bcb224400fe750e84fa37a [0,1,0,1,0,0|2,0,0]=4 6698 B12R1.1580 CC1(CCN(C1)C(=O)CCF)O feda067fb8569296a9729a82c6dd077a [0,1,0,1,0,0|2,0,0]=4 6699 B12R1.1580 CC1(CCN(C1)C(=O)CCO)C 4cb3cea95b49057c2dd6c45839234abb [0,1,0,1,0,0|2,0,0]=4 6700 B12R1.1580 CC1(CCN(C1)C(=O)CCO)F b7b2b5d54f1d5b9df407c763496c34d4 [0,1,0,1,0,0|2,0,0]=4 6701 B12R1.1580 CC1(CCN(C1)C(=O)CCO)O 6557e7ebaa4767cbc35b642df5cacb9d [0,1,0,1,0,0|2,0,0]=4 6702 B12R1.1580 CC1(CCN(C1)C(=O)CCS)C e4be2aa9cdd723974baa5046577294f1 [0,1,0,1,0,0|2,0,0]=4 6703 B12R1.1580 CC1(CCN(C1)C(=O)CCS)F 559adc0442a67b7c720021c343c051e1 [0,1,0,1,0,0|2,0,0]=4 6704 B12R1.1580 CC1(CCN(C1)C(=O)CCS)O 63f89b2d0e7aba5729bbba8b640e5759 [0,1,0,1,0,0|2,0,0]=4 6705 B12R1.1580 CCCC(=O)N1CCC(C1)(C)C 18d4344256dbd983d6844045dd75d7db [0,1,0,1,0,0|1,0,0]=3 6706 B12R1.1580 CCCC(=O)N1CCC(C1)(C)F 8ab115210e07e048983580f9772a9a33 [0,1,0,1,0,0|1,0,0]=3 6707 B12R1.1580 CCCC(=O)N1CCC(C1)(C)O b39ec605b8e5a31d18556813108d72bd [0,1,0,1,0,0|1,0,0]=3 6708 B12R1.1580 CCCC(=O)N1CCC(C1)(F)F 6a8513ae07f19523c1542c5f5cf26ec4 [0,1,0,1,0,0|2,0,0]=4 6709 B12R1.1580 CCCC(=O)N1CC[C@@](C1)(C)O 8296fd32e5d476b2781b54f8adcfebe8 [0,1,0,1,0,0|1,0,0]=3 6710 B12R1.1580 CCCC(=O)N1CC[C@](C1)(C)O 262a450f369a028a00e9485973761bca [0,1,0,1,0,0|1,0,0]=3 6711 B12R1.1580 COCC(=O)N1CCC(C1)(C)C 55ba1b9f7206c989f42d01002e8fc298 [0,1,0,1,0,0|2,0,0]=4 6712 B12R1.1580 COCC(=O)N1CCC(C1)(C)F a0e7f16f095c44288f8022eb00620b86 [0,1,0,1,0,0|2,0,0]=4 6713 B12R1.1580 COCC(=O)N1CCC(C1)(C)O ce079256baca8084dd3d60120ebe12c6 [0,1,0,1,0,0|2,0,0]=4 6714 B12R1.1580 COCC(=O)N1CC[C@@](C1)(C)O 4ead9633412d020b6b762bd689b0b0aa [0,1,0,1,0,0|2,0,0]=4 6715 B12R1.1580 COCC(=O)N1CC[C@](C1)(C)O 4ac49a58e1d5fa0a31749dab5f3c509f [0,1,0,1,0,0|2,0,0]=4 6716 B12R1.1580 CSCC(=O)N1CCC(C1)(C)C 2a44d37f0b2536d21b3f27f4339d545c [0,1,0,1,0,0|2,0,0]=4 6717 B12R1.1580 CSCC(=O)N1CCC(C1)(C)F d63c55b94ece7f9f0489ea12d95379fe [0,1,0,1,0,0|2,0,0]=4 6718 B12R1.1580 CSCC(=O)N1CCC(C1)(C)O 7ed6517ab402dcc37779617914bb2490 [0,1,0,1,0,0|2,0,0]=4 6719 B12R1.1580 CSCC(=O)N1CC[C@@](C1)(C)O 7c7d979e3a68d161595888d1f734df3b [0,1,0,1,0,0|2,0,0]=4 6720 B12R1.1580 CSCC(=O)N1CC[C@](C1)(C)O c1f845a8f5e4d94e0298a0b199735050 [0,1,0,1,0,0|2,0,0]=4 6721 B12R1.1580 C[C@@]1(CCN(C1)C(=O)CCF)O 601777835449e725442a8969ac1ab3c6 [0,1,0,1,0,0|2,0,0]=4 6722 B12R1.1580 C[C@@]1(CCN(C1)C(=O)CCO)O 228e102322ac8795a69d0187301c0c15 [0,1,0,1,0,0|2,0,0]=4 6723 B12R1.1580 C[C@@]1(CCN(C1)C(=O)CCS)O cafc6fafed5733dc395f07558c52df90 [0,1,0,1,0,0|2,0,0]=4 6724 B12R1.1580 C[C@]1(CCN(C1)C(=O)CCF)O f81aa46757aba21a118c45354b80cdb6 [0,1,0,1,0,0|2,0,0]=4 6725 B12R1.1580 C[C@]1(CCN(C1)C(=O)CCO)O 1f8a755ae24fb9f928cea09aadb839ed [0,1,0,1,0,0|2,0,0]=4 6726 B12R1.1580 C[C@]1(CCN(C1)C(=O)CCS)O 963bd4f0e88fd81ec35965ae5d421137 [0,1,0,1,0,0|2,0,0]=4 6727 B12R1.1812 CC(C)CNC(=O)C(=O)C1CC1 9cea6a686b3338278b51d3f36e666ca3 [0,1,0,1,0,0|2,0,0]=4 6728 B12R1.1812 CC(C)CNC(C)C(=O)C1CC1 92914488851d3e437a60a92ee3d5d029 [0,1,0,1,0,0|2,0,0]=4 6729 B12R1.1812 CC(C)COC(C)C(=O)C1CC1 f442fedf676424102eeff26b4ea9b7a9 [0,1,0,1,0,0|2,0,0]=4 6730 B12R1.2245 CCCC(=O)C(=O)N1CC1(C)C b6df1cf0f2f4db60ebd8cd2bfe112c79 [0,1,0,1,0,0|2,0,0]=4 6731 B12R1.145 CC(C)C(C)NC1CCCC1=O 8a432591010a6db4921351e0cf035feb [0,1,0,1,0,0|2,0,0]=4 6732 B12R1.145 CC(C)[C@@H](C)NC1CCCC1=O 1f076cd7738eafd64c3c539437c097ac [0,1,0,1,0,0|2,0,0]=4 6733 B12R1.145 CC(C)[C@H](C)NC1CCCC1=O 9770e6f4125a129f1f47ce793cbab5d8 [0,1,0,1,0,0|2,0,0]=4 6734 B12R1.225 CC(C)C(C)N1CCCC(=O)C1 045ce88afe12a8f3731d4ff88c95431d [0,1,0,1,0,0|2,0,0]=4 6735 B12R1.264 CC(C)C(C)COC1CCCC1 80208e2487a9916ba45c783a34ff8905 [0,1,0,1,0,0|1,0,1]=4 6736 B12R1.264 CC(C)C(C)COC1CCCO1 cb5a9b0c8ff9f27e5ba4a21b83fe5344 [0,1,0,1,0,0|0,0,2]=4 6737 B12R1.311 CCCC(=O)CNC1COC1C 07d5edbe6759eb58cab5882fc20be769 [0,1,0,1,0,0|2,0,0]=4 6738 B12R1.311 CCCC(=O)CN[C@@H]1CC[C@H]1C c2cdfe9e8750f1b09ad2a0ee2b6588ff [0,1,0,1,0,0|2,0,0]=4 6739 B12R1.311 CCCC(=O)CN[C@H]1CC[C@H]1C 7c4d1bc2825bf7f971b7446c3fc9d711 [0,1,0,1,0,0|2,0,0]=4 6740 B12R1.311 CCCC(=O)COC1COC1C 05a7e6ed66c2fb2eeceadc1db6a45c78 [0,1,0,1,0,0|2,0,0]=4 6741 B12R1.311 CCCC(=O)NCC1CCN1C e409ec19eaf7af1b38ef61b39eb80521 [0,1,0,1,0,0|2,0,0]=4 6742 B12R1.314 CC1CN(CC1O)C(=O)CCF 5da99c930f00f85d3c6b712a847056a7 [0,1,0,1,0,0|2,0,0]=4 6743 B12R1.314 CC1CN(CC1O)C(=O)CCO 7f63952d3420814bfcf3352b2116e24c [0,1,0,1,0,0|2,0,0]=4 6744 B12R1.314 CC1CN(CC1O)C(=O)CCS 6bb8e7ee8fba43cf4d03f21bf388a9ae [0,1,0,1,0,0|2,0,0]=4 6745 B12R1.314 CCCC(=O)N1CC(C(C1)Br)O e84d8718a6166594a3cb5daa40a75569 [0,1,0,1,0,0|2,0,0]=4 6746 B12R1.314 CCCC(=O)N1CC(C(C1)O)C 8a0f42ef0c975e88b88108dc62aff227 [0,1,0,1,0,0|1,0,0]=3 6747 B12R1.314 CCCC(=O)N1C[C@@H]([C@H](C1)O)O eec621a5ec15bdd7b431896333564b8c [0,1,0,1,0,0|2,0,0]=4 6748 B12R1.314 CCCC(=O)N1C[C@H]([C@@H](C1)F)O 5873b75c2b0533bfc256b00553d684c6 [0,1,0,1,0,0|2,0,0]=4 6749 B12R1.314 CCCC(=O)N1C[C@H]([C@@H](C1)O)O 4f68ed2f1790f744af01544b6942ec76 [0,1,0,1,0,0|2,0,0]=4 6750 B12R1.314 CCCC(=O)N1C[C@H]([C@H](C1)O)C f886d249e64f8caae445d327fd0a9ce4 [0,1,0,1,0,0|1,0,0]=3 6751 B12R1.314 CCCC(=O)N1C[C@H]([C@H](C1)O)O 8b88006087e03cbfbb9ff7147b9c3af6 [0,1,0,1,0,0|2,0,0]=4 6752 B12R1.314 COCC(=O)N1CC(C(C1)O)C 76a24d9713110b4fbe54a66b885ceb46 [0,1,0,1,0,0|2,0,0]=4 6753 B12R1.314 COCC(=O)N1C[C@H]([C@H](C1)O)C eef32bc692aef6d7010a32b4bf00fe45 [0,1,0,1,0,0|2,0,0]=4 6754 B12R1.314 CSCC(=O)N1CC(C(C1)O)C 30b799ed397421f3be03ce9582b2a2c8 [0,1,0,1,0,0|2,0,0]=4 6755 B12R1.314 CSCC(=O)N1C[C@H]([C@H](C1)O)C eb36001a7db8422ca9d158bc74a2953e [0,1,0,1,0,0|2,0,0]=4 6756 B12R1.314 C[C@@H]1CN(C[C@@H]1O)C(=O)CCF a7c9b9133dd0d5a36989e8b6308f3ccf [0,1,0,1,0,0|2,0,0]=4 6757 B12R1.314 C[C@@H]1CN(C[C@@H]1O)C(=O)CCO 94ed6b4bb0a5e5e7d9997bf4a9c00878 [0,1,0,1,0,0|2,0,0]=4 6758 B12R1.314 C[C@@H]1CN(C[C@@H]1O)C(=O)CCS 4cb3c1510b827fd4587c043253ba43ef [0,1,0,1,0,0|2,0,0]=4 6759 B12R1.686 CCCC(=O)CN[C@@H](C)C1CC1 1ff2f6f1da2d039de05a69a27c00012f [0,1,0,1,0,0|2,0,0]=4 6760 B12R1.686 CCCC(=O)CN[C@H](C)C1CC1 9740cd81990ec863bde4b5a36d3fe4b5 [0,1,0,1,0,0|2,0,0]=4 6761 B12R1.686 CCCC(=O)COC(C)C1CC1 216a24f75afe022f3345ba439537603f [0,1,0,1,0,0|2,0,0]=4 6762 B12R1.686 CCCC(=O)CO[C@@H](C)C1CC1 8fbf481b1de23e32851d020f6fca5cf5 [0,1,0,1,0,0|2,0,0]=4 6763 B12R1.686 CCCC(=O)CO[C@H](C)C1CC1 6153e992cf59dfba79eda58ffda344ad [0,1,0,1,0,0|2,0,0]=4 6764 B12R1.686 CCCC(=O)NCC(O)C1CC1 3873831869571026515302d2cd6242c3 [0,1,0,1,0,0|1,0,0]=3 6765 B12R1.686 CCCC(=O)OCN(C)C1CC1 67a485f47cb6905cf9dcca82dcb1c49b [0,1,0,1,0,0|1,0,0]=3 6766 B12R1.686 CCCC(=S)OCC(=O)C1CC1 4f21e2d6ec4f3dd2a11b56576d1191d9 [0,1,0,1,0,0|0,1,1]=4 6767 B12R1.686 CCCC(C)OCC(C)C1CC1 1a8de0e06fb33cf5ddfb9581f6640eac [0,1,0,1,0,0|1,0,1]=4 6768 B12R1.686 CCOC(=O)OCN(C)C1CC1 0df5c232d7182618661b00789ea04f30 [0,1,0,1,0,0|2,0,0]=4 6769 B12R1.686 CCSC(=O)OCN(C)C1CC1 5fd86c65b8b63be45903c6da21b20ee5 [0,1,0,1,0,0|2,0,0]=4 6770 B12R1.686 COCC(=O)NCC(O)C1CC1 bc8638081b05dd85f4ca809b1f3d4073 [0,1,0,1,0,0|2,0,0]=4 6771 B12R1.686 CSCC(=O)NCC(O)C1CC1 cc19e39f854dc0e055d1fdf0bf69004a [0,1,0,1,0,0|2,0,0]=4 6772 B12R1.686 O=C(CCF)NCC(O)C1CC1 595407c8c3f6a2a443d86b7b35bb8757 [0,1,0,1,0,0|2,0,0]=4 6773 B12R1.686 O=C(CCO)NCC(O)C1CC1 7a3fa7c9c1e2483c178f467f515c89ad [0,1,0,1,0,0|2,0,0]=4 6774 B12R1.686 O=C(CCS)NCC(O)C1CC1 2cc382029e701d119f87f2013410c42a [0,1,0,1,0,0|2,0,0]=4 6775 B12R1.1039 CC1CC(C1)OCC(C)C(C)C a96a613edee08275431da60804b0b4c8 [0,1,0,1,0,0|1,0,1]=4 6776 B12R1.1360 CC(C)C(C)COC(C)C1CC1 a05ed177df13b8723e5384f9a088c138 [0,1,0,1,0,0|1,0,1]=4 6777 B12R1.1360 CC(C)C(C)CO[C@@H](C)C1CC1 686bbcaf8b71c985f9c5472893a7cb4a [0,1,0,1,0,0|1,0,1]=4 6778 B12R1.1360 CC(C)C(C)CO[C@H](C)C1CC1 b17466e140225c85763a6041bc2f0d05 [0,1,0,1,0,0|1,0,1]=4 6779 B12R1.1360 CC(C)C(C)NCC(=O)C1CC1 b2c84fb272a467f9edf8d64664bb0dcc [0,1,0,1,0,0|2,0,0]=4 6780 B12R1.1360 CC(C)C(C)OCC(=O)C1CC1 80134e13fe99631b4b1417e3bb4db5c0 [0,1,0,1,0,0|2,0,0]=4 6781 B12R1.1360 CC(C)[C@@H](C)NCC(=O)C1CC1 c899b1ec37ca8998d1a4a54770fa89b8 [0,1,0,1,0,0|2,0,0]=4 6782 B12R1.1360 CC(C)[C@@H](C)OCC(=O)C1CC1 db982e0d7f844ecbe5580fa5e3103d04 [0,1,0,1,0,0|2,0,0]=4 6783 B12R1.1360 CC(C)[C@H](C)NCC(=O)C1CC1 02bf1eb6aa2ca07a65f557ac07b94d5e [0,1,0,1,0,0|2,0,0]=4 6784 B12R1.1360 CC(C)[C@H](C)OCC(=O)C1CC1 55f909ff4bd187dc6b993793445ca42e [0,1,0,1,0,0|2,0,0]=4 6785 B12R1.33 C=C(CC)C(=O)N1CCC(C1)C 6ff2168b19717e3b9a387cd805f14c2c [0,1,0,1,0,0|1,0,1]=4 6786 B12R1.33 CC1CCN(C1)C(=O)C(O)CO 6444d2ca9133e2a2d759c2806e64f9b5 [0,1,0,1,0,0|2,0,0]=4 6787 B12R1.33 CC1CCN(C1)C(=O)[C@@H](O)CO b59ab1460348b42a92d509abae6bf6bc [0,1,0,1,0,0|2,0,0]=4 6788 B12R1.33 CC1CCN(C1)C(=O)[C@H](O)CF 0bd59b10ce244d3a30b7075af8c6c9cb [0,1,0,1,0,0|2,0,0]=4 6789 B12R1.33 CCC(=O)C(=O)N1CCC(C1)C 93467e8c037ac87f1b68fc8ca9e259c1 [0,1,0,1,0,0|1,0,1]=4 6790 B12R1.33 CCC(O)C(=O)N1CCC(C1)C be1b12993bb7ba39ec027629b9e3db8a [0,1,0,1,0,0|1,0,0]=3 6791 B12R1.33 CCC(O)C(=O)N1CCC(C1)F f52adc998b423ea1eaa2bb7b181697c7 [0,1,0,1,0,0|2,0,0]=4 6792 B12R1.33 CCC(O)C(=O)N1CCC(C1)O 16fad8989f960412f3d07a42f418d62b [0,1,0,1,0,0|2,0,0]=4 6793 B12R1.33 CCC(O)C(=O)N1CCN(C1)C 77d7e6d754d2e61dea8c178b8b9f5d74 [0,1,0,1,0,0|2,0,0]=4 6794 B12R1.33 CCC(O)C(=O)N1CC[C@@H](C1)F da55141917e84cf31792c893f5b737be [0,1,0,1,0,0|2,0,0]=4 6795 B12R1.33 CCC(O)C(=O)N1CC[C@@H](C1)O 5cc9bef8539b22249cc3c53e5ae8511a [0,1,0,1,0,0|2,0,0]=4 6796 B12R1.33 CCC(O)C(=O)N1CC[C@H](C1)F 3794970a8e0dc2d65e204d236321729d [0,1,0,1,0,0|2,0,0]=4 6797 B12R1.33 CCC(O)C(=O)N1CC[C@H](C1)O 8daec5f20a01536a8325489e3a134474 [0,1,0,1,0,0|2,0,0]=4 6798 B12R1.33 CC[C@@H](O)C(=O)N1CCC(C1)C 43467ece3fecf43d3cf1a3df019128be [0,1,0,1,0,0|1,0,0]=3 6799 B12R1.33 CC[C@@H](O)C(=O)N1CCC(C1)F d80880a9b24009aec94a67bb296483a5 [0,1,0,1,0,0|2,0,0]=4 6800 B12R1.33 CC[C@@H](O)C(=O)N1CCC(C1)O a4c71c5718644d327f112416d1bfc592 [0,1,0,1,0,0|2,0,0]=4 6801 B12R1.33 CC[C@@H](O)C(=O)N1CCN(C1)C 55df2c720beabc2c023d4e59c5661d42 [0,1,0,1,0,0|2,0,0]=4 6802 B12R1.33 CC[C@@H](O)C(=O)N1CC[C@@H](C1)F f59c394218b5fd1e223a4c0b4e2b750b [0,1,0,1,0,0|2,0,0]=4 6803 B12R1.33 CC[C@@H](O)C(=O)N1CC[C@@H](C1)O 8b16e038596e1894e68ceaa823fb2e30 [0,1,0,1,0,0|2,0,0]=4 6804 B12R1.33 CC[C@@H](O)C(=O)N1CC[C@H](C1)F 08e6dc908f9b6db15bd0c5686586141e [0,1,0,1,0,0|2,0,0]=4 6805 B12R1.33 CC[C@@H](O)C(=O)N1CC[C@H](C1)O 90837baf5a0bbc3703a5b95200aa222b [0,1,0,1,0,0|2,0,0]=4 6806 B12R1.33 CC[C@H](O)C(=O)N1CCC(C1)C c4deb7b19afcd1cc6f9e287b2a843ba7 [0,1,0,1,0,0|1,0,0]=3 6807 B12R1.33 CC[C@H](O)C(=O)N1CCC(C1)F 9c245912417f1f5250e70a5c4ef6574b [0,1,0,1,0,0|2,0,0]=4 6808 B12R1.33 CC[C@H](O)C(=O)N1CCC(C1)O 1ae63a193e6fa07eb1cc14cf39d81741 [0,1,0,1,0,0|2,0,0]=4 6809 B12R1.33 CC[C@H](O)C(=O)N1CCN(C1)C d8e447a940610baba99659b1a9118310 [0,1,0,1,0,0|2,0,0]=4 6810 B12R1.33 CC[C@H](O)C(=O)N1CC[C@@H](C1)F 854859524d633c578a556b8b9ef3483d [0,1,0,1,0,0|2,0,0]=4 6811 B12R1.33 CC[C@H](O)C(=O)N1CC[C@@H](C1)O 11a7a55c5348cbb51cc9dbd8fe9d6ec6 [0,1,0,1,0,0|2,0,0]=4 6812 B12R1.33 CC[C@H](O)C(=O)N1CC[C@H](C1)F 67752887a16a2096b0133f4d66fceae9 [0,1,0,1,0,0|2,0,0]=4 6813 B12R1.33 CC[C@H](O)C(=O)N1CC[C@H](C1)O 98ed0c0507042e0e380fbda1feaad9ce [0,1,0,1,0,0|2,0,0]=4 6814 B12R1.33 CC[C@H](S)C(=O)N1CCC(C1)C 1a97cc2940d91c78328282e5f90a1d53 [0,1,0,1,0,0|1,0,0]=3 6815 B12R1.33 CC[C@H](S)C(=O)N1CCC(C1)F 31c60df29d9c6a6822cd4ec1ce9eb9ff [0,1,0,1,0,0|2,0,0]=4 6816 B12R1.33 CC[C@H](S)C(=O)N1CCC(C1)O adb3c2417ab7780ded1596b0fc8919fb [0,1,0,1,0,0|2,0,0]=4 6817 B12R1.33 CC[C@H](S)C(=O)N1CCN(C1)C 8f62f87b72c2f71bba00b2c689dbc0cf [0,1,0,1,0,0|2,0,0]=4 6818 B12R1.33 CC[C@H](S)C(=O)N1CC[C@@H](C1)F 1760881664d119166426eb8c509b1ce9 [0,1,0,1,0,0|2,0,0]=4 6819 B12R1.33 CC[C@H](S)C(=O)N1CC[C@@H](C1)O 33d700fee1e66857013a97a4e79aae4e [0,1,0,1,0,0|2,0,0]=4 6820 B12R1.33 CC[C@H](S)C(=O)N1CC[C@H](C1)F 0767b75c275da468999b91eb3f53a58e [0,1,0,1,0,0|2,0,0]=4 6821 B12R1.33 CC[C@H](S)C(=O)N1CC[C@H](C1)O 8e303cdb21807ddde413985fb20c1e47 [0,1,0,1,0,0|2,0,0]=4 6822 B12R1.33 COC(C)C(=O)N1CCC(C1)C 69b7f7e451cc0683f452192651e335ef [0,1,0,1,0,0|2,0,0]=4 6823 B12R1.33 CO[C@@H](C)C(=O)N1CCC(C1)C 7210c07b05e62f6cfb03d9611e03e436 [0,1,0,1,0,0|2,0,0]=4 6824 B12R1.33 CO[C@H](C)C(=O)N1CCC(C1)C 81f54c8fe92f86a5d610253edbf9e030 [0,1,0,1,0,0|2,0,0]=4 6825 B12R1.33 CSC(C)C(=O)N1CCC(C1)C 0859b0b422137e14e00727d557237a26 [0,1,0,1,0,0|2,0,0]=4 6826 B12R1.469 CCC(O)C(=O)NC1CC(C1)F 89bfbbcf7cae506bee5667b474333b0c [0,1,0,1,0,0|2,0,0]=4 6827 B12R1.469 CCC(O)C(=O)NC1CC(C1)O a67c59244e1422fe1b3971258e796314 [0,1,0,1,0,0|2,0,0]=4 6828 B12R1.469 CCC(O)C(=O)NC1CN(C1)C 34d41ae2bd7b24d928209883687f7858 [0,1,0,1,0,0|2,0,0]=4 6829 B12R1.469 CCC(O)C(=O)N[C@H]1C[C@@H](C1)F 8f09c80442c8a04cce17cc3358c395e4 [0,1,0,1,0,0|2,0,0]=4 6830 B12R1.469 CCC(O)C(=O)N[C@H]1C[C@@H](C1)O 56d05fa8f8f37218f28ac17177ca443f [0,1,0,1,0,0|2,0,0]=4 6831 B12R1.469 CCC(O)C(=O)N[C@H]1C[C@H](C1)F 0d5e409bf16308339acabf485c8b455b [0,1,0,1,0,0|2,0,0]=4 6832 B12R1.469 CCC(O)C(=O)N[C@H]1C[C@H](C1)O c5c3071950ca2c8faef9eb5a374253f2 [0,1,0,1,0,0|2,0,0]=4 6833 B12R1.469 CCN(C)C(=O)CC1CC(C1)C 400ef11f0220f64a22c55d7afd6ecd88 [0,1,0,1,0,0|2,0,0]=4 6834 B12R1.469 CC[C@@H](O)C(=O)NC1CC(C1)F 8086ec0927a2351ba21cc4eea6a7e7d3 [0,1,0,1,0,0|2,0,0]=4 6835 B12R1.469 CC[C@@H](O)C(=O)NC1CC(C1)O f844da58f5e26bbc5e9b310650ceb516 [0,1,0,1,0,0|2,0,0]=4 6836 B12R1.469 CC[C@@H](O)C(=O)NC1CN(C1)C 081b72ccb8b0f268ba6a83aedb333a83 [0,1,0,1,0,0|2,0,0]=4 6837 B12R1.469 CC[C@@H](O)C(=O)N[C@H]1C[C@@H](C1)F b2ee79d8b98cdeb12d8fd9bf9d90b8e2 [0,1,0,1,0,0|2,0,0]=4 6838 B12R1.469 CC[C@@H](O)C(=O)N[C@H]1C[C@@H](C1)O bf68272e2b4a70d56b839b966e30a956 [0,1,0,1,0,0|2,0,0]=4 6839 B12R1.469 CC[C@@H](O)C(=O)N[C@H]1C[C@H](C1)F 1929598180b287de9e0b81afbf2db2b5 [0,1,0,1,0,0|2,0,0]=4 6840 B12R1.469 CC[C@@H](O)C(=O)N[C@H]1C[C@H](C1)O a8c59129b22614fdf65522bff1816a47 [0,1,0,1,0,0|2,0,0]=4 6841 B12R1.469 CC[C@H](O)C(=O)NC1CC(C1)F 72f85cf64b35bd9a948120c19145b107 [0,1,0,1,0,0|2,0,0]=4 6842 B12R1.469 CC[C@H](O)C(=O)NC1CC(C1)O 5176bdec0040e6dfbf8686d6f5e3b4a1 [0,1,0,1,0,0|2,0,0]=4 6843 B12R1.469 CC[C@H](O)C(=O)NC1CN(C1)C 4743ccb719ec71a574bec853600de093 [0,1,0,1,0,0|2,0,0]=4 6844 B12R1.469 CC[C@H](O)C(=O)N[C@H]1C[C@@H](C1)F 630af15ccb3ba081793b32013fd06612 [0,1,0,1,0,0|2,0,0]=4 6845 B12R1.469 CC[C@H](O)C(=O)N[C@H]1C[C@@H](C1)O 2d63c82ee9c9d9a2b364670b73b5f300 [0,1,0,1,0,0|2,0,0]=4 6846 B12R1.469 CC[C@H](O)C(=O)N[C@H]1C[C@H](C1)F 2fda4bd1a37995ed685da12793b317ed [0,1,0,1,0,0|2,0,0]=4 6847 B12R1.469 CC[C@H](O)C(=O)N[C@H]1C[C@H](C1)O 6f5b13d697d274d324e47f0801d5eedf [0,1,0,1,0,0|2,0,0]=4 6848 B12R1.469 CC[C@H](S)C(=O)NC1CC(C1)F b1ebb1dc261ab3b1333df10bf67af393 [0,1,0,1,0,0|2,0,0]=4 6849 B12R1.469 CC[C@H](S)C(=O)NC1CC(C1)O 85081b01488afef6384bddfb243a5e9f [0,1,0,1,0,0|2,0,0]=4 6850 B12R1.469 CC[C@H](S)C(=O)NC1CN(C1)C ae3509a7d257891a6db90ce06622088c [0,1,0,1,0,0|2,0,0]=4 6851 B12R1.469 CC[C@H](S)C(=O)N[C@H]1C[C@@H](C1)F a98f5169dda9f500b9e3fcd7cf33a6ba [0,1,0,1,0,0|2,0,0]=4 6852 B12R1.469 CC[C@H](S)C(=O)N[C@H]1C[C@@H](C1)O 0a79b96cd89b87957de887151ca140c2 [0,1,0,1,0,0|2,0,0]=4 6853 B12R1.469 CC[C@H](S)C(=O)N[C@H]1C[C@H](C1)F bd78bb6ba1258bd0b5360880f7d54ad2 [0,1,0,1,0,0|2,0,0]=4 6854 B12R1.469 CC[C@H](S)C(=O)N[C@H]1C[C@H](C1)O 18ff1aa36dc0e3193dac8f9060a1f45b [0,1,0,1,0,0|2,0,0]=4 6855 B12R1.471 C=C(CC)C(=O)NCCC1CC1 4a8697fd851efe234b2b813b90e30d6e [0,1,0,1,0,0|1,0,1]=4 6856 B12R1.471 CCC(=O)C(=O)NCCC1CC1 0875eae04a8ffd3cd42791ce7ccabc57 [0,1,0,1,0,0|1,0,1]=4 6857 B12R1.471 CCC(C)C(=O)CNCC1CC1 af5e35fbf657fe06a383f7f6e914081b [0,1,0,1,0,0|2,0,0]=4 6858 B12R1.471 CCC(C)C(=O)COCC1CC1 3458bf19ddee088350a82bbc72bd4079 [0,1,0,1,0,0|2,0,0]=4 6859 B12R1.471 CCC(C)C(C)OCCC1CC1 83e8287b456e2c406eb509c5345935b1 [0,1,0,1,0,0|1,0,1]=4 6860 B12R1.471 CCC(O)C(=O)NCCC1CC1 3d1970795b3b7de76affbde015409f41 [0,1,0,1,0,0|1,0,0]=3 6861 B12R1.471 CCC(O)C(=O)NCCN1CC1 c74ef2fc9a71c56e018b79ee9fd229f2 [0,1,0,1,0,0|2,0,0]=4 6862 B12R1.471 CCN(C)C(=O)CCCC1CC1 bb1413553afddf42015140fad7634262 [0,1,0,1,0,0|2,0,0]=4 6863 B12R1.471 CCN(C)C(=O)NCCC1CC1 f4e55290091d82d4cca4af50fa81027c [0,1,0,1,0,0|2,0,0]=4 6864 B12R1.471 CC[C@@H](O)C(=O)NCCC1CC1 1bf57232cfc2d568c21e02e774c584ab [0,1,0,1,0,0|1,0,0]=3 6865 B12R1.471 CC[C@@H](O)C(=O)NCCN1CC1 3da9f289641c4e809974a5fdb4c3541d [0,1,0,1,0,0|2,0,0]=4 6866 B12R1.471 CC[C@H](O)C(=O)NCCC1CC1 20a8ade90a6858adf75f779864495443 [0,1,0,1,0,0|1,0,0]=3 6867 B12R1.471 CC[C@H](O)C(=O)NCCN1CC1 ca655002c6fa359aa35aa32d4ad71e52 [0,1,0,1,0,0|2,0,0]=4 6868 B12R1.471 CC[C@H](S)C(=O)NCCC1CC1 a8b8c483a7592d20256250a5dff99eeb [0,1,0,1,0,0|1,0,0]=3 6869 B12R1.471 CC[C@H](S)C(=O)NCCN1CC1 05c1a8ecbd2d1cc08e24f26a95ba56ca [0,1,0,1,0,0|2,0,0]=4 6870 B12R1.471 COC(C)C(=O)NCCC1CC1 d6f91a5ed15e5b19bcf87bc0dabf94d4 [0,1,0,1,0,0|2,0,0]=4 6871 B12R1.471 CO[C@@H](C)C(=O)NCCC1CC1 063f70bcb0fec88e1975a5dd2022e89a [0,1,0,1,0,0|2,0,0]=4 6872 B12R1.471 CO[C@H](C)C(=O)NCCC1CC1 f2e596c8e0974ec8d4049d1d07c88984 [0,1,0,1,0,0|2,0,0]=4 6873 B12R1.471 CSC(C)C(=O)NCCC1CC1 6b2ab64e886a52a839b915001dca71b0 [0,1,0,1,0,0|2,0,0]=4 6874 B12R1.471 O=C(NCCC1CC1)C(O)CO 58c4f53c10d54b3078b3ec4752013f79 [0,1,0,1,0,0|2,0,0]=4 6875 B12R1.471 O=C(NCCC1CC1)[C@@H](O)CO faa838ee67d4f9f756cdc88b659d53f4 [0,1,0,1,0,0|2,0,0]=4 6876 B12R1.471 O=C(NCCC1CC1)[C@H](O)CF b09888074da9dc77c9216c243d9f19b4 [0,1,0,1,0,0|2,0,0]=4 6877 B12R1.839 CCC(C)C(=O)CNC1CC1C c5353054f0656d0a9ec05dd526098c80 [0,1,0,1,0,0|2,0,0]=4 6878 B12R1.1357 CC(C)C/C=C/C(=O)N1CCC1 80ad3f4d89b4db58dfae2d058f156b7c [0,1,0,1,0,0|1,0,1]=4 6879 B12R1.1357 CC(C)CCCC(=O)N1CCC1 8e998420472ee46a1b275b06863533e4 [0,1,0,1,0,0|1,0,0]=3 6880 B12R1.1357 CC(C)CCNC(=O)C1=CCC1 4e26aed7a44521d152b394e287c4e8ec [0,1,0,1,0,0|1,0,1]=4 6881 B12R1.1357 CC(C)CCNC(=O)C1CCO1 34932be4ef15803c2cafc7c8d99dc22f [0,1,0,1,0,0|1,0,0]=3 6882 B12R1.1357 CC(C)CCNC(=O)N1CCC1 b04f8888e397472f5f3ceca91cd2104f [0,1,0,1,0,0|1,0,0]=3 6883 B12R1.1357 CC(C)CCNC(=O)[C@@H]1CCO1 274dc67fcd6250664dfc607a88d310b9 [0,1,0,1,0,0|1,0,0]=3 6884 B12R1.1357 CC(C)CCNC(=O)[C@H]1CCO1 2a251869dc75986a1e613320f34d9d46 [0,1,0,1,0,0|1,0,0]=3 6885 B12R1.1357 CC(C)CCNC(=S)N1CCC1 2bac2d5f9216895d15a39c8a95ff0bb7 [0,1,0,1,0,0|1,1,0]=4 6886 B12R1.1357 CC(C)CCOC(C)C1CCC1 1fe640bd410d84b77af2ce4158ccb01c [0,1,0,1,0,0|1,0,1]=4 6887 B12R1.1357 CC(C)CCOC(C)C1COC1 486b5d2b1fd17bb8e17d8d7b851f0fce [0,1,0,1,0,0|1,0,1]=4 6888 B12R1.1357 CC(C)CCO[C@@H](C)C1CCC1 824e531feb980a9a462a92f79558a504 [0,1,0,1,0,0|1,0,1]=4 6889 B12R1.1357 CC(C)CCO[C@@H](C)C1COC1 9e06ef18fea6309446ce821cc9d33c31 [0,1,0,1,0,0|1,0,1]=4 6890 B12R1.1357 CC(C)CCO[C@H](C)C1COC1 f0546c968a42e398b22e958de5fe53b1 [0,1,0,1,0,0|1,0,1]=4 6891 B12R1.1357 CC(C)CNCC(=O)C1CCC1 f492d3ef279a08d667eecd216aeee8cf [0,1,0,1,0,0|2,0,0]=4 6892 B12R1.1357 CC(C)CNCC(=O)N1CCC1 17ffe248f579b25d286f70ddae05aa8b [0,1,0,1,0,0|2,0,0]=4 6893 B12R1.1357 CC(C)COCC(=O)C1CCC1 6422a795ba63cbb4498eaa845a54c1d1 [0,1,0,1,0,0|2,0,0]=4 6894 B12R1.1357 CC(C)COCC(=O)N1CCC1 99428bde27c5f3effdaa0c54253c2b34 [0,1,0,1,0,0|2,0,0]=4 6895 B12R1.1357 CC(C)OCCC(=O)N1CCC1 641039b7d89a667f28e92f355df790dd [0,1,0,1,0,0|2,0,0]=4 6896 B12R1.1357 CC(C)SCCC(=O)N1CCC1 05e1852d9625e36f4b9d83fc99e73a42 [0,1,0,1,0,0|2,0,0]=4 6897 B12R1.1357 CC(O)CCNC(=O)C1CCO1 7cc1b269c78670157b7216f9316e6ca7 [0,1,0,1,0,0|2,0,0]=4 6898 B12R1.1357 CC(O)CCNC(=O)N1CCC1 046f4219c31e2d49d7d08d788434aaa4 [0,1,0,1,0,0|2,0,0]=4 6899 B12R1.1357 CC(O)CCNC(=O)[C@@H]1CCO1 f07cd871bc893a029209fc2f05973d5e [0,1,0,1,0,0|2,0,0]=4 6900 B12R1.1357 CC(O)CCNC(=O)[C@H]1CCO1 20c94a2279a34b2351d9aa74b0e1ac34 [0,1,0,1,0,0|2,0,0]=4 6901 B12R1.1357 CN(C)CCCC(=O)N1CCC1 78fcb97abac1ac22b6832103246feed3 [0,1,0,1,0,0|2,0,0]=4 6902 B12R1.1357 CN(C)CCNC(=O)C1CCO1 77720c861c158d87461d6a11a45fe94a [0,1,0,1,0,0|2,0,0]=4 6903 B12R1.1357 CN(C)CCNC(=O)N1CCC1 f90772d6d952882cf667b2f7c6565379 [0,1,0,1,0,0|2,0,0]=4 6904 B12R1.1357 CN(C)CCNC(=O)[C@@H]1CCO1 685e458f9680134de8a96852de885924 [0,1,0,1,0,0|2,0,0]=4 6905 B12R1.1357 CN(C)CCNC(=O)[C@H]1CCO1 0dbfff8322d819cabccb7630e8da853e [0,1,0,1,0,0|2,0,0]=4 6906 B12R1.1357 C[C@@H](O)CCNC(=O)C1CCO1 f3627b9729122f6e4f80f71df15633d5 [0,1,0,1,0,0|2,0,0]=4 6907 B12R1.1357 C[C@@H](O)CCNC(=O)N1CCC1 c5aaf46c481c1ffdcf8e64aa37374fe5 [0,1,0,1,0,0|2,0,0]=4 6908 B12R1.1357 C[C@@H](O)CCNC(=O)[C@@H]1CCO1 bd9c6fd8fbebaa6f3460f27aeeffa4ec [0,1,0,1,0,0|2,0,0]=4 6909 B12R1.1357 C[C@@H](O)CCNC(=O)[C@H]1CCO1 244dc947eade79f4225face3797bb8b1 [0,1,0,1,0,0|2,0,0]=4 6910 B12R1.1357 C[C@H](O)CCNC(=O)C1CCO1 1610ca111e5d604b9ed2792aea35db73 [0,1,0,1,0,0|2,0,0]=4 6911 B12R1.1357 C[C@H](O)CCNC(=O)N1CCC1 4e2b119e69d454b77700df9fb3a41e60 [0,1,0,1,0,0|2,0,0]=4 6912 B12R1.1357 C[C@H](O)CCNC(=O)[C@@H]1CCO1 35e152c14052cd501981b41f67c5e76b [0,1,0,1,0,0|2,0,0]=4 6913 B12R1.1357 C[C@H](O)CCNC(=O)[C@H]1CCO1 4031bc543b242b767e2d0045f301de5a [0,1,0,1,0,0|2,0,0]=4 6914 B12R1.1358 CC(C)CCOC(C)C1(CC1)C a30c99c767aeee285ea36e01f98da53f [0,1,0,1,0,0|1,0,1]=4 6915 B12R1.1358 CC(C)CNCC(=O)C1(CC1)C e74a178fe3472163076dbb29f986ea71 [0,1,0,1,0,0|2,0,0]=4 6916 B12R1.1358 CC(C)CNCC(=O)C1(CC1)F 9c57e98ad7d72a92f01ffbb58a957e6c [0,1,0,1,0,0|2,0,0]=4 6917 B12R1.1358 CC(C)COCC(=O)C1(CC1)C 4751fac84d6d91587916e974bb983d1d [0,1,0,1,0,0|2,0,0]=4 6918 B12R1.1358 CC(C)COCC(=O)C1(CC1)F eeb8ef0ddedd3179ca4afede3b530c9b [0,1,0,1,0,0|2,0,0]=4 6919 B12R1.1658 CCC(C)N1CCCC(=O)CC1 edeec1574846ac8d9e0bfa40bc304cbd [0,1,0,1,0,0|2,0,0]=4 6920 B12R1.2091 C=C(CC)C(=O)NC1CC1(C)C f6a25c682d2902e4da767e0dd9ba0952 [0,1,0,1,0,0|1,0,1]=4 6921 B12R1.2091 C=C(CC)C(=O)N[C@@H]1CC1(C)C 6466b075755331a89da1a8de89ba303e [0,1,0,1,0,0|1,0,1]=4 6922 B12R1.2091 C=C(CC)C(=O)N[C@H]1CC1(C)C 687c84e6c8514dbb9599f0c3c4fb8ea6 [0,1,0,1,0,0|1,0,1]=4 6923 B12R1.2091 CC1(CC1NC(=O)C(O)CO)C 7603fa672ddccad7f4ebd1a55b5848b7 [0,1,0,1,0,0|2,0,0]=4 6924 B12R1.2091 CC1(CC1NC(=O)[C@@H](O)CO)C 0158c96bbc73b9f68b139552b7141147 [0,1,0,1,0,0|2,0,0]=4 6925 B12R1.2091 CC1(CC1NC(=O)[C@H](O)CF)C 34ce69e30d1243672184d8cf8b51fe03 [0,1,0,1,0,0|2,0,0]=4 6926 B12R1.2091 CC1(C[C@@H]1NC(=O)C(O)CO)C 078c785ea808f898b900799603539b6f [0,1,0,1,0,0|2,0,0]=4 6927 B12R1.2091 CC1(C[C@@H]1NC(=O)[C@@H](O)CO)C 31cb7d1cab04bd2025d7591a4d207c99 [0,1,0,1,0,0|2,0,0]=4 6928 B12R1.2091 CC1(C[C@@H]1NC(=O)[C@H](O)CF)C 41a7772bc7c14443f203ee463b876087 [0,1,0,1,0,0|2,0,0]=4 6929 B12R1.2091 CC1(C[C@H]1NC(=O)C(O)CO)C 9a04be2bfb29193dfbed31f78dd27963 [0,1,0,1,0,0|2,0,0]=4 6930 B12R1.2091 CC1(C[C@H]1NC(=O)[C@@H](O)CO)C c4d85e3f47fee0f1dca0cfc4ffa5e285 [0,1,0,1,0,0|2,0,0]=4 6931 B12R1.2091 CC1(C[C@H]1NC(=O)[C@H](O)CF)C 9aa5b720e4674b94561ad68682cd5471 [0,1,0,1,0,0|2,0,0]=4 6932 B12R1.2091 CCC(=O)C(=O)NC1CC1(C)C c165c200515362bf2b9f40445326c9ea [0,1,0,1,0,0|1,0,1]=4 6933 B12R1.2091 CCC(=O)C(=O)N[C@@H]1CC1(C)C 6d3c52177081b1a2caba3b237d8e23b1 [0,1,0,1,0,0|1,0,1]=4 6934 B12R1.2091 CCC(=O)C(=O)N[C@H]1CC1(C)C 79ce4f97093d2913952e3d105003f851 [0,1,0,1,0,0|1,0,1]=4 6935 B12R1.2091 CCC(C)C(=O)CN1CC1(C)C 10c6c6cefdf1ddf7230c60989fd3b348 [0,1,0,1,0,0|2,0,0]=4 6936 B12R1.2091 CCC(C)C(C)OC1CC1(C)C ee5e968131699aaf101c8f0c99ba2efd [0,1,0,1,0,0|1,0,1]=4 6937 B12R1.2091 CCC(O)C(=O)NC1CC1(C)C a6fc400b400b7c30cdee93e1a656a79d [0,1,0,1,0,0|1,0,0]=3 6938 B12R1.2091 CCC(O)C(=O)N[C@@H]1CC1(C)C aa640307fa3f69a919f1b35777ca2052 [0,1,0,1,0,0|1,0,0]=3 6939 B12R1.2091 CCC(O)C(=O)N[C@H]1CC1(C)C e652454139c5b268e3daec8b15c87fa0 [0,1,0,1,0,0|1,0,0]=3 6940 B12R1.2091 CCN(C)C(=O)NC1CC1(C)C 13ecf32d21d6c12c00f0e2bcf851a67a [0,1,0,1,0,0|2,0,0]=4 6941 B12R1.2091 CCN(C)C(=O)N[C@@H]1CC1(C)C 11f2e1535efa2b1e8970d2dc424209e4 [0,1,0,1,0,0|2,0,0]=4 6942 B12R1.2091 CCN(C)C(=O)N[C@H]1CC1(C)C ae823b54112c94a750176ceb7406026c [0,1,0,1,0,0|2,0,0]=4 6943 B12R1.2091 CC[C@@H](O)C(=O)NC1CC1(C)C 3a0b10b6d9aefaccf88745c47162f9bd [0,1,0,1,0,0|1,0,0]=3 6944 B12R1.2091 CC[C@@H](O)C(=O)N[C@@H]1CC1(C)C ce5d47d13a79d11c64788ea191a11d59 [0,1,0,1,0,0|1,0,0]=3 6945 B12R1.2091 CC[C@@H](O)C(=O)N[C@H]1CC1(C)C a17f10b7e3271a7408b6cb32ff10fdc9 [0,1,0,1,0,0|1,0,0]=3 6946 B12R1.2091 CC[C@H](O)C(=O)NC1CC1(C)C 12aff1ed6546aedffeec4bb875716e3a [0,1,0,1,0,0|1,0,0]=3 6947 B12R1.2091 CC[C@H](O)C(=O)N[C@@H]1CC1(C)C 81254002af0167e7acf15e3cb89d20c4 [0,1,0,1,0,0|1,0,0]=3 6948 B12R1.2091 CC[C@H](O)C(=O)N[C@H]1CC1(C)C b8f39520399323fc327196f111eabd7f [0,1,0,1,0,0|1,0,0]=3 6949 B12R1.2091 CC[C@H](S)C(=O)NC1CC1(C)C e09f842ee6b89e7345b0d3d2c41d256e [0,1,0,1,0,0|1,0,0]=3 6950 B12R1.2091 CC[C@H](S)C(=O)N[C@@H]1CC1(C)C 010613b3613b7e4ec7685dbe35be0997 [0,1,0,1,0,0|1,0,0]=3 6951 B12R1.2091 CC[C@H](S)C(=O)N[C@H]1CC1(C)C f5468627ae22d658f9a8dde09d6694b2 [0,1,0,1,0,0|1,0,0]=3 6952 B12R1.2091 CSC(C)C(=O)NC1CC1(C)C 570b98b36ad9b10355356a1f7785f534 [0,1,0,1,0,0|2,0,0]=4 6953 B12R1.2091 CSC(C)C(=O)N[C@@H]1CC1(C)C 628dad5b420ded834c9d87da65b57477 [0,1,0,1,0,0|2,0,0]=4 6954 B12R1.2091 CSC(C)C(=O)N[C@H]1CC1(C)C 3ae5b817118b98d1355d597679885870 [0,1,0,1,0,0|2,0,0]=4 6955 B12R1.29 C#CCCC(=O)N1CCC(C1)C 512cf0af4b64e3fcd57549b31a2fde85 [0,1,0,1,0,0|1,0,1]=4 6956 B12R1.29 C/C=C/CC(=O)N1CCC(C1)C efba234ec1173ae0c3ec974c3395b67c [0,1,0,1,0,0|1,0,1]=4 6957 B12R1.29 C=CCCC(=O)N1CCC(C1)C e79502410804d736102e0ed53b1ea5b7 [0,1,0,1,0,0|1,0,1]=4 6958 B12R1.29 CC#CCC(=O)N1CCC(C1)C 6a2615bb045230f064c01062d7ee4684 [0,1,0,1,0,0|1,0,1]=4 6959 B12R1.29 CC/C=C/C(=O)N1CCC(C1)C e98edcdf553fa77632465192d94a45e8 [0,1,0,1,0,0|1,0,1]=4 6960 B12R1.29 CC/C=C\C(=O)N1CCC(C1)C 4bff776994b8f6afe6727a818b372073 [0,1,0,1,0,0|1,0,1]=4 6961 B12R1.29 CC1CCN(C1)C(=O)CCC#N 75a1b3979b93ce8d905c43bf464751b5 [0,1,0,1,0,0|1,0,1]=4 6962 B12R1.29 CC1CCN(C1)C(=O)CCC=O 78e47f9b31dcd3d928251583e717001d [0,1,0,1,0,0|1,0,1]=4 6963 B12R1.29 CC1CCN(C1)C(=O)CCCF c447fae49fcfb09279db081586363b60 [0,1,0,1,0,0|1,0,0]=3 6964 B12R1.29 CC1CCN(C1)C(=O)CCCS e3cceaeb7ef818fb68ade597a6f19a6a [0,1,0,1,0,0|1,0,0]=3 6965 B12R1.29 CC1CCN(C1)C(=O)NCCF 129bbb19946c9f0b5a28bafa51d76656 [0,1,0,1,0,0|2,0,0]=4 6966 B12R1.29 CC1CCN(C1)C(=O)NCCN fd8db54f14d1f09e6b189ba39a656b1e [0,1,0,1,0,0|2,0,0]=4 6967 B12R1.29 CC1CCN(C1)C(=O)NCCO 54be02227f9d882ebcd1313884278768 [0,1,0,1,0,0|2,0,0]=4 6968 B12R1.29 CC1CCN(C1)C(=O)NCCS 5282c3cb14dcc985959d6cfb0ca93ad5 [0,1,0,1,0,0|2,0,0]=4 6969 B12R1.29 CCC#CC(=O)N1CCC(C1)C 2dda5da58f3ff1690686793fb9b0cf86 [0,1,0,1,0,0|1,0,1]=4 6970 B12R1.29 CCC=CC(=O)N1CCC(C1)C 5fe8079103b43c3f31c83ab2497fd9aa [0,1,0,1,0,0|1,0,1]=4 6971 B12R1.29 CCCCC(=O)N1CCC(C1)C c257c3330cf49e7452fa3de4e949faa6 [0,1,0,1,0,0|1,0,0]=3 6972 B12R1.29 CCCCC(=O)N1CCC(C1)F 7dc04bd7ef9264880f80a7f2072b2ca8 [0,1,0,1,0,0|2,0,0]=4 6973 B12R1.29 CCCCC(=O)N1CCC(C1)O 32663d4db24ce25a8ed0f7ec14c007e0 [0,1,0,1,0,0|2,0,0]=4 6974 B12R1.29 CCCCC(=O)N1CCN(C1)C b735150e455fb2404961b4fbf6c9e2fd [0,1,0,1,0,0|2,0,0]=4 6975 B12R1.29 CCCCC(=O)N1CC[C@@H](C1)F e03324ea5e32ac34f32c44c5f75d2048 [0,1,0,1,0,0|2,0,0]=4 6976 B12R1.29 CCCCC(=O)N1CC[C@@H](C1)O b235a48636cfa4c032bdef66197bdff8 [0,1,0,1,0,0|2,0,0]=4 6977 B12R1.29 CCCCC(=O)N1CC[C@H](C1)F d04688083f80cec1da5c17ab5ea6edf0 [0,1,0,1,0,0|2,0,0]=4 6978 B12R1.29 CCCCC(=O)N1CC[C@H](C1)O f221194f3ffe64864eed3fb81fc45c05 [0,1,0,1,0,0|2,0,0]=4 6979 B12R1.29 CCCNC(=O)C1CCC(O1)C 90ec765d72a726007bc179abb84be4fe [0,1,0,1,0,0|2,0,0]=4 6980 B12R1.29 CCCNC(=O)N1CCC(C1)C c7fa1f33e5ee3a291d104b0d6ed8f0cc [0,1,0,1,0,0|1,0,0]=3 6981 B12R1.29 CCCNC(=O)N1CCC(C1)F 72eb28e7659bd0272c337f3c9338e902 [0,1,0,1,0,0|2,0,0]=4 6982 B12R1.29 CCCNC(=O)N1CCC(C1)O 9d1b3613e83561f2ae8dbc1f4a2e85be [0,1,0,1,0,0|2,0,0]=4 6983 B12R1.29 CCCNC(=O)N1CCN(C1)C 4a3a7cadb6ca875810a7f5914ec6d59b [0,1,0,1,0,0|2,0,0]=4 6984 B12R1.29 CCCNC(=O)N1CC[C@@H](C1)F 5202a1ea240651974e5423b1dfc33bb6 [0,1,0,1,0,0|2,0,0]=4 6985 B12R1.29 CCCNC(=O)N1CC[C@@H](C1)O 849e11b7f584f4da7e9d61ae702803e2 [0,1,0,1,0,0|2,0,0]=4 6986 B12R1.29 CCCNC(=O)N1CC[C@H](C1)F 577ca18afce34a46a975bf95520ad5a6 [0,1,0,1,0,0|2,0,0]=4 6987 B12R1.29 CCCNC(=O)N1CC[C@H](C1)O d65e7c1657f711b8ba9bc03cea016fbd [0,1,0,1,0,0|2,0,0]=4 6988 B12R1.29 CCCNC(=O)[C@H]1CC[C@H](O1)C 47266b8d96ca902d9ae519cf91837304 [0,1,0,1,0,0|2,0,0]=4 6989 B12R1.29 CCCNC(=S)N1CCC(C1)C 374c4dcfad142d0a245570a54985ea73 [0,1,0,1,0,0|1,1,0]=4 6990 B12R1.29 CCOCC(=O)N1CCC(C1)C dde54bef707a344604f7d4576fb37706 [0,1,0,1,0,0|1,0,0]=3 6991 B12R1.29 CCOCC(=O)N1CCC(C1)F c874f10dfc3475f02116c63cfd26742e [0,1,0,1,0,0|2,0,0]=4 6992 B12R1.29 CCOCC(=O)N1CCC(C1)O 3f9c6ad553d18b34c45651ba2c62c5a3 [0,1,0,1,0,0|2,0,0]=4 6993 B12R1.29 CCOCC(=O)N1CCN(C1)C 9976ff1d099648721dbd3694e9b6fbe5 [0,1,0,1,0,0|2,0,0]=4 6994 B12R1.29 CCOCC(=O)N1CC[C@@H](C1)F 5b369ed637479fa323a6f0cdc50843f2 [0,1,0,1,0,0|2,0,0]=4 6995 B12R1.29 CCOCC(=O)N1CC[C@@H](C1)O 0ead53b1e97aec9c22eda5d05b18a332 [0,1,0,1,0,0|2,0,0]=4 6996 B12R1.29 CCOCC(=O)N1CC[C@H](C1)F 34a99abfebcbcf29ee240f7049a6895b [0,1,0,1,0,0|2,0,0]=4 6997 B12R1.29 CCOCC(=O)N1CC[C@H](C1)O a687854c3b2d71ad388ca0d66ad11376 [0,1,0,1,0,0|2,0,0]=4 6998 B12R1.29 CCSCC(=O)N1CCC(C1)C fd4e04d3211bfd22cf9ce535d09776e6 [0,1,0,1,0,0|1,0,0]=3 6999 B12R1.29 CCSCC(=O)N1CCC(C1)F a7b0b13ef8f530c7560b6e9603f64403 [0,1,0,1,0,0|2,0,0]=4 7000 B12R1.29 CCSCC(=O)N1CCC(C1)O c293c35551b487602124c916cba1d1f2 [0,1,0,1,0,0|2,0,0]=4 7001 B12R1.29 CCSCC(=O)N1CCN(C1)C b5cb1caaddfc93e99eb3f353d437fa7e [0,1,0,1,0,0|2,0,0]=4 7002 B12R1.29 CCSCC(=O)N1CC[C@@H](C1)F e25c984f94c89396acc637f50ac236c1 [0,1,0,1,0,0|2,0,0]=4 7003 B12R1.29 CCSCC(=O)N1CC[C@@H](C1)O 92a536b273c6b27b9f1ea6e87f0ff445 [0,1,0,1,0,0|2,0,0]=4 7004 B12R1.29 CCSCC(=O)N1CC[C@H](C1)F 4136004d19bb54a7e865051b2f071450 [0,1,0,1,0,0|2,0,0]=4 7005 B12R1.29 CCSCC(=O)N1CC[C@H](C1)O ccff12e1b3da7be1d31017198b591779 [0,1,0,1,0,0|2,0,0]=4 7006 B12R1.29 CN1CCN(C1)C(=O)CCCF 798c1d36b5d1ed204bd9b296754240bd [0,1,0,1,0,0|2,0,0]=4 7007 B12R1.29 CN1CCN(C1)C(=O)CCCS 9cf2765eefb4e1d04361716a85d9dff4 [0,1,0,1,0,0|2,0,0]=4 7008 B12R1.29 COCCC(=O)N1CCC(C1)C 99d832a8a2035997f305994ed2251195 [0,1,0,1,0,0|1,0,0]=3 7009 B12R1.29 COCCC(=O)N1CCC(C1)F c0c789cdaf09b3e47ff8f1a031927e99 [0,1,0,1,0,0|2,0,0]=4 7010 B12R1.29 COCCC(=O)N1CCC(C1)O 1f23d91ad855d4fb8bb797f1497aae92 [0,1,0,1,0,0|2,0,0]=4 7011 B12R1.29 COCCC(=O)N1CCN(C1)C 490a80725c275c73688c4715fbc1cce5 [0,1,0,1,0,0|2,0,0]=4 7012 B12R1.29 COCCC(=O)N1CC[C@@H](C1)F d9d4eddc828503480530425f972e7ed1 [0,1,0,1,0,0|2,0,0]=4 7013 B12R1.29 COCCC(=O)N1CC[C@@H](C1)O 034050403038d478cd3c8606c1cc900f [0,1,0,1,0,0|2,0,0]=4 7014 B12R1.29 COCCC(=O)N1CC[C@H](C1)F 03666c28916a189735722544ada055b8 [0,1,0,1,0,0|2,0,0]=4 7015 B12R1.29 COCCC(=O)N1CC[C@H](C1)O c79cac0960f9d94e23f88e2c6307e0a2 [0,1,0,1,0,0|2,0,0]=4 7016 B12R1.29 CSCCC(=O)N1CCC(C1)C 290bed56ee6f7804bd381a552ac7dc54 [0,1,0,1,0,0|1,0,0]=3 7017 B12R1.29 CSCCC(=O)N1CCC(C1)F ae8d860304764620e7ccd18a2d6096bc [0,1,0,1,0,0|2,0,0]=4 7018 B12R1.29 CSCCC(=O)N1CCC(C1)O 3370dbd36d491bcf2aa555a8b2cef00a [0,1,0,1,0,0|2,0,0]=4 7019 B12R1.29 CSCCC(=O)N1CCN(C1)C e07c40115ccf949082ddb4998def93ba [0,1,0,1,0,0|2,0,0]=4 7020 B12R1.29 CSCCC(=O)N1CC[C@@H](C1)F b79cfbbfdc760622db2f13927b01abd8 [0,1,0,1,0,0|2,0,0]=4 7021 B12R1.29 CSCCC(=O)N1CC[C@@H](C1)O 9a6434b6c43a79632a501ca74ff14997 [0,1,0,1,0,0|2,0,0]=4 7022 B12R1.29 CSCCC(=O)N1CC[C@H](C1)F 27ecfed43e6e7e8af88ff9e161b3eab6 [0,1,0,1,0,0|2,0,0]=4 7023 B12R1.29 CSCCC(=O)N1CC[C@H](C1)O 7fa73ec84ed96a7895bdf08b389abb59 [0,1,0,1,0,0|2,0,0]=4 7024 B12R1.29 CSSCC(=O)N1CCC(C1)C 7f1827cab46907a9c170f8d795fc4fc3 [0,1,0,1,0,0|2,0,0]=4 7025 B12R1.29 O=C(CCCF)N1CCC(C1)F a55fa7b9bb6448800f8cd2a7be9a74b7 [0,1,0,1,0,0|2,0,0]=4 7026 B12R1.29 O=C(CCCF)N1CCC(C1)O d6037a9a93488b293392a57b70e2ed4d [0,1,0,1,0,0|2,0,0]=4 7027 B12R1.29 O=C(CCCF)N1CC[C@@H](C1)F d2ecf6db12647c9cb42d8445d84514e0 [0,1,0,1,0,0|2,0,0]=4 7028 B12R1.29 O=C(CCCF)N1CC[C@@H](C1)O fefe5c3d05c418c53594129640d3db2a [0,1,0,1,0,0|2,0,0]=4 7029 B12R1.29 O=C(CCCF)N1CC[C@H](C1)F c3b075d6074b4c5cb7fe4112a97c3b0e [0,1,0,1,0,0|2,0,0]=4 7030 B12R1.29 O=C(CCCF)N1CC[C@H](C1)O 6d2472ce78128a9ea5ff6dab686da427 [0,1,0,1,0,0|2,0,0]=4 7031 B12R1.29 O=C(CCCS)N1CCC(C1)F 993bd5528a34e98dfd3ace1d251c1438 [0,1,0,1,0,0|2,0,0]=4 7032 B12R1.29 O=C(CCCS)N1CCC(C1)O 62d9d97cefce12d5074606c261c215db [0,1,0,1,0,0|2,0,0]=4 7033 B12R1.29 O=C(CCCS)N1CC[C@@H](C1)F 673d1a9fc10f69054bc70784a894befb [0,1,0,1,0,0|2,0,0]=4 7034 B12R1.29 O=C(CCCS)N1CC[C@@H](C1)O 32bf4ad9c5e139bb83997a43087602e8 [0,1,0,1,0,0|2,0,0]=4 7035 B12R1.29 O=C(CCCS)N1CC[C@H](C1)F 39b9fa1ca867fff70d333d615dd1e031 [0,1,0,1,0,0|2,0,0]=4 7036 B12R1.29 O=C(CCCS)N1CC[C@H](C1)O 3f032ebf3c72b5bb7dd8c8fffb684519 [0,1,0,1,0,0|2,0,0]=4 7037 B12R1.57 CC(C)N1CNC(=O)CC1CO 203da9c666e2342c3c2365fc248e4935 [0,1,0,1,0,0|2,0,0]=4 7038 B12R1.127 CC(C)CN1CC(=O)NCC1C 9b9061a30d7d94dfcd3e31c7e339cb64 [0,1,0,1,0,0|2,0,0]=4 7039 B12R1.127 CC(C)CN1CC(=O)NC[C@@H]1C 945c849f62ea3024bd54b065c8c69fad [0,1,0,1,0,0|2,0,0]=4 7040 B12R1.127 CC(C)CN1CC(=O)NC[C@H]1C c458e7a0101930e5bc85d916c6ba2c00 [0,1,0,1,0,0|2,0,0]=4 7041 B12R1.430 CC(C)CCO[C@H]1C[C@H](C1)CF ef7f3dc2710de121e68c81cadefb8db6 [0,1,0,1,0,0|1,0,1]=4 7042 B12R1.430 CCN1CC(C1)OCCC(C)C 075b5aefd77946e58fd44254be11c416 [0,1,0,1,0,0|1,0,1]=4 7043 B12R1.430 COC1CC(C1)OCCC(C)C e20fb6891bd07bbe018876d949e3cbf2 [0,1,0,1,0,0|1,0,1]=4 7044 B12R1.430 CO[C@H]1C[C@@H](C1)OCCC(C)C b8262b6d882783c6330949c2fbdcc1bb [0,1,0,1,0,0|1,0,1]=4 7045 B12R1.430 CO[C@H]1C[C@H](C1)OCCC(C)C c10ce2745164a794f03ac9c260727418 [0,1,0,1,0,0|1,0,1]=4 7046 B12R1.462 CC1CC(C1)CC(=O)NCCBr dc5ef97d720b21461755faf68ed9053c [0,1,0,1,0,0|2,0,0]=4 7047 B12R1.462 CC1CC(C1)CC(=O)NCCF f53b0a45035a3ffde689034879b58fd1 [0,1,0,1,0,0|2,0,0]=4 7048 B12R1.462 CC1CC(C1)CC(=O)NCCI 6bf9f8a2175bc2cbe297617286bf54b9 [0,1,0,1,0,0|2,0,0]=4 7049 B12R1.462 CC1CC(C1)CC(=O)NCCO ee566ebab8ddc4b5e2589daf7521f9b6 [0,1,0,1,0,0|2,0,0]=4 7050 B12R1.462 CC1CC(C1)CC(=O)NCCS 6dae1d945b7302c108c914741546b244 [0,1,0,1,0,0|2,0,0]=4 7051 B12R1.462 CCCCC(=O)NC1CC(C1)F f25cb3543497587550e1dbf1254326b9 [0,1,0,1,0,0|2,0,0]=4 7052 B12R1.462 CCCCC(=O)NC1CC(C1)O c2ff1aca4c31c37f7097bf1189d3b589 [0,1,0,1,0,0|2,0,0]=4 7053 B12R1.462 CCCCC(=O)NC1CN(C1)C da2b012506086897b7f147a87e05a28b [0,1,0,1,0,0|2,0,0]=4 7054 B12R1.462 CCCCC(=O)N[C@H]1C[C@@H](C1)F 4b53cab308e68ef040be8035c3d8f6b8 [0,1,0,1,0,0|2,0,0]=4 7055 B12R1.462 CCCCC(=O)N[C@H]1C[C@@H](C1)O 9bd700fd7cc248d32caff96653767ad3 [0,1,0,1,0,0|2,0,0]=4 7056 B12R1.462 CCCCC(=O)N[C@H]1C[C@H](C1)F 730a3e66f7ef64d6466983269e9e1d51 [0,1,0,1,0,0|2,0,0]=4 7057 B12R1.462 CCCCC(=O)N[C@H]1C[C@H](C1)O ed8f10c82e1ae520bc716c7f16681854 [0,1,0,1,0,0|2,0,0]=4 7058 B12R1.462 CCCCC(C)OC1CC(C1)C 1fe30c77d9bb407993d7eb0de1c29031 [0,1,0,1,0,0|1,0,1]=4 7059 B12R1.462 CCCNC(=O)CC1CC(C1)C 605afeabdb9e07adacabbf27b66f325a [0,1,0,1,0,0|1,0,0]=3 7060 B12R1.462 CCCNC(=O)C[C@H]1C[C@@H](C1)F 1cefea136fe35aa86ed69e70405fc813 [0,1,0,1,0,0|2,0,0]=4 7061 B12R1.462 CCCNC(=O)C[C@H]1C[C@@H](C1)O 38920259f365d12e32d1415322f9194d [0,1,0,1,0,0|2,0,0]=4 7062 B12R1.462 CCCNC(=O)C[C@H]1C[C@H](C1)O b0381dceb3f056ec8083a4aa306b9774 [0,1,0,1,0,0|2,0,0]=4 7063 B12R1.462 CCCNC(=O)NC1CC(C1)F 4dd9780548bde5b7c5bf9c67036168a8 [0,1,0,1,0,0|2,0,0]=4 7064 B12R1.462 CCCNC(=O)NC1CC(C1)N bd1e651c4339b709acbd915557fbfc23 [0,1,0,1,0,0|2,0,0]=4 7065 B12R1.462 CCCNC(=O)NC1CC(C1)O 8e7f28c41f1dce9122dda2f3d56545c0 [0,1,0,1,0,0|2,0,0]=4 7066 B12R1.462 CCCNC(=O)NC1CN(C1)C 46671361440caf3e37071acb998472e1 [0,1,0,1,0,0|2,0,0]=4 7067 B12R1.462 CCCNC(=O)N[C@H]1C[C@@H](C1)F d002b608813f477760aeaa47f8b242af [0,1,0,1,0,0|2,0,0]=4 7068 B12R1.462 CCCNC(=O)N[C@H]1C[C@@H](C1)N bbda223051f6df8362b68e8e65a11ad8 [0,1,0,1,0,0|2,0,0]=4 7069 B12R1.462 CCCNC(=O)N[C@H]1C[C@@H](C1)O 679d47cf45ef744bed892fef4a5a5356 [0,1,0,1,0,0|2,0,0]=4 7070 B12R1.462 CCCNC(=O)N[C@H]1C[C@H](C1)F 7df4f0ac943e322a2c9d037c91dcc560 [0,1,0,1,0,0|2,0,0]=4 7071 B12R1.462 CCCNC(=O)N[C@H]1C[C@H](C1)O f915e3c4224c9f3aa6321a0df2cadcb1 [0,1,0,1,0,0|2,0,0]=4 7072 B12R1.462 CCOCC(=O)NC1CC(C1)F d4de22f206bf4d528e761f16c3dda7ab [0,1,0,1,0,0|2,0,0]=4 7073 B12R1.462 CCOCC(=O)NC1CC(C1)O 181e6c1df4b708ef52e50851aca0be68 [0,1,0,1,0,0|2,0,0]=4 7074 B12R1.462 CCOCC(=O)NC1CN(C1)C c5984c0e56d15c7af4e8a302379fcc6a [0,1,0,1,0,0|2,0,0]=4 7075 B12R1.462 CCOCC(=O)N[C@H]1C[C@@H](C1)F f6bb604cc6bdbc283d7da689508917c8 [0,1,0,1,0,0|2,0,0]=4 7076 B12R1.462 CCOCC(=O)N[C@H]1C[C@@H](C1)O 7fab95a534a1dc2dc467d69dd33b1f18 [0,1,0,1,0,0|2,0,0]=4 7077 B12R1.462 CCOCC(=O)N[C@H]1C[C@H](C1)F 9e1e4f9a24bf62d3064617fb46b7a554 [0,1,0,1,0,0|2,0,0]=4 7078 B12R1.462 CCOCC(=O)N[C@H]1C[C@H](C1)O 369e4f0385ee40ec755459794def0ecf [0,1,0,1,0,0|2,0,0]=4 7079 B12R1.462 CCSCC(=O)NC1CC(C1)F 0da39054a0d7f5d12ed2ab3fb4864fd2 [0,1,0,1,0,0|2,0,0]=4 7080 B12R1.462 CCSCC(=O)NC1CC(C1)O 59e6fea3b46f47f5f4c11c27c8a92125 [0,1,0,1,0,0|2,0,0]=4 7081 B12R1.462 CCSCC(=O)NC1CN(C1)C c9af112f9dc8e374945e474155b01497 [0,1,0,1,0,0|2,0,0]=4 7082 B12R1.462 CCSCC(=O)N[C@H]1C[C@@H](C1)F 57f27857528eeb0e98437294885fdac5 [0,1,0,1,0,0|2,0,0]=4 7083 B12R1.462 CCSCC(=O)N[C@H]1C[C@@H](C1)O 6c86a9fa443be393cc0d018a1f16a5e8 [0,1,0,1,0,0|2,0,0]=4 7084 B12R1.462 CCSCC(=O)N[C@H]1C[C@H](C1)F 7191f5a6ebe9f3e1976da865f66a11f7 [0,1,0,1,0,0|2,0,0]=4 7085 B12R1.462 CCSCC(=O)N[C@H]1C[C@H](C1)O 4d324e912be72ceb35c0f3d2dc6f7165 [0,1,0,1,0,0|2,0,0]=4 7086 B12R1.462 CN1CC(C1)NC(=O)CCCF aed61c1eed5a32e04436e93da7c736eb [0,1,0,1,0,0|2,0,0]=4 7087 B12R1.462 CN1CC(C1)NC(=O)CCCS 91ab86331456e195a9cb3efe734fdd6d [0,1,0,1,0,0|2,0,0]=4 7088 B12R1.462 COCCC(=O)NC1CC(C1)F 8af4fd662eff48b7f150d37d47f68107 [0,1,0,1,0,0|2,0,0]=4 7089 B12R1.462 COCCC(=O)NC1CC(C1)O 149049758fdb1171a27c77395bb4e29d [0,1,0,1,0,0|2,0,0]=4 7090 B12R1.462 COCCC(=O)NC1CN(C1)C 88cb64dcf28e2656428a4782ccd96454 [0,1,0,1,0,0|2,0,0]=4 7091 B12R1.462 COCCC(=O)N[C@H]1C[C@@H](C1)F 183dd9f23e1e566d151160c4a13c264c [0,1,0,1,0,0|2,0,0]=4 7092 B12R1.462 COCCC(=O)N[C@H]1C[C@@H](C1)O d4f6710208c9ba46b09799cdc2747487 [0,1,0,1,0,0|2,0,0]=4 7093 B12R1.462 COCCC(=O)N[C@H]1C[C@H](C1)F 11d88d759c76f9b433ece58425f3038d [0,1,0,1,0,0|2,0,0]=4 7094 B12R1.462 COCCC(=O)N[C@H]1C[C@H](C1)O fb334335fecb7aabe1dfc316f1e00385 [0,1,0,1,0,0|2,0,0]=4 7095 B12R1.462 CSCCC(=O)NC1CC(C1)O dab3a89fbc4f4b00d3967ad2994a1c31 [0,1,0,1,0,0|2,0,0]=4 7096 B12R1.462 CSCCC(=O)NC1CN(C1)C 363612a123f4912f1214a5fd767e06ba [0,1,0,1,0,0|2,0,0]=4 7097 B12R1.462 CSCCC(=O)N[C@H]1C[C@@H](C1)O 95cba4021c062cc25444ce78d4998893 [0,1,0,1,0,0|2,0,0]=4 7098 B12R1.462 CSCCC(=O)N[C@H]1C[C@H](C1)O a65c3bf392bc4413f7d44f362e5848ac [0,1,0,1,0,0|2,0,0]=4 7099 B12R1.462 O=C(CCCF)NC1CC(C1)F d53d58002d67c338511705bc96b4825a [0,1,0,1,0,0|2,0,0]=4 7100 B12R1.462 O=C(CCCF)NC1CC(C1)O 091037b1170010286a775b98d3a8c56e [0,1,0,1,0,0|2,0,0]=4 7101 B12R1.462 O=C(CCCF)N[C@H]1C[C@@H](C1)F e09ca3acb1723cb0bfe66f37f6cb97a4 [0,1,0,1,0,0|2,0,0]=4 7102 B12R1.462 O=C(CCCF)N[C@H]1C[C@@H](C1)O d7d7f68e048bb45ac345af1c548642dd [0,1,0,1,0,0|2,0,0]=4 7103 B12R1.462 O=C(CCCF)N[C@H]1C[C@H](C1)F 21c2418e2a66787b594a53d6e6052862 [0,1,0,1,0,0|2,0,0]=4 7104 B12R1.462 O=C(CCCF)N[C@H]1C[C@H](C1)O 943ea4c09ebcdab72a59c3be6c9d8aae [0,1,0,1,0,0|2,0,0]=4 7105 B12R1.462 O=C(CCCS)NC1CC(C1)F 6e189f1762472ae883d1c96bea73bcf1 [0,1,0,1,0,0|2,0,0]=4 7106 B12R1.462 O=C(CCCS)NC1CC(C1)O f7eb1f0be5b0a05399dbe84319065ecf [0,1,0,1,0,0|2,0,0]=4 7107 B12R1.462 O=C(CCCS)N[C@H]1C[C@@H](C1)F 147ee6d3a95b88c369c29c852e0ecf9c [0,1,0,1,0,0|2,0,0]=4 7108 B12R1.462 O=C(CCCS)N[C@H]1C[C@@H](C1)O c77a0462b8d58bcd2a8aadc2ad62d05a [0,1,0,1,0,0|2,0,0]=4 7109 B12R1.462 O=C(CCCS)N[C@H]1C[C@H](C1)F 25e471205906a1c3708e0e180dc975cf [0,1,0,1,0,0|2,0,0]=4 7110 B12R1.462 O=C(CCCS)N[C@H]1C[C@H](C1)O f8c76c7f0925985d988a13495c5ca5b7 [0,1,0,1,0,0|2,0,0]=4 7111 B12R1.464 C#CCCC(=O)NCCC1CC1 99db551e9be3b2707ca91464628c0268 [0,1,0,1,0,0|1,0,1]=4 7112 B12R1.464 C/C=C/CC(=O)NCCC1CC1 2f27924e4753526a444b178b64d6cb1d [0,1,0,1,0,0|1,0,1]=4 7113 B12R1.464 C=CCCC(=O)NCCC1CC1 cd7975ee013236d483af014dc7037121 [0,1,0,1,0,0|1,0,1]=4 7114 B12R1.464 CC#CCC(=O)NCCC1CC1 6271f215ec902b7d51594abbfdef8857 [0,1,0,1,0,0|1,0,1]=4 7115 B12R1.464 CC/C=C/C(=O)NCCC1CC1 0a01a6cb7d73f0172de7529d40696d94 [0,1,0,1,0,0|1,0,1]=4 7116 B12R1.464 CC/C=C\C(=O)NCCC1CC1 950560d23f81ce4c4bd6fa6e19ff8090 [0,1,0,1,0,0|1,0,1]=4 7117 B12R1.464 CCC#CC(=O)NCCC1CC1 3aaec3d70063dc068f66e2e59a5e0db2 [0,1,0,1,0,0|1,0,1]=4 7118 B12R1.464 CCC=CC(=O)NCCC1CC1 678f54cf44374fefe0de456fcd600ba1 [0,1,0,1,0,0|1,0,1]=4 7119 B12R1.464 CCCCC(=O)NCCC1CC1 ad968fdec4d052e5613d4ba300f20332 [0,1,0,1,0,0|1,0,0]=3 7120 B12R1.464 CCCCC(=O)NCCN1CC1 6d3dd88b5beb6dbcfd5a75043af0dcc0 [0,1,0,1,0,0|2,0,0]=4 7121 B12R1.464 CCCCC(=O)OCNC1CC1 32936cde5d52dbf687757e2724987d2d [0,1,0,1,0,0|1,0,0]=3 7122 B12R1.464 CCCCC(=O)OCOC1CC1 62f57097065184062c6371adddfab550 [0,1,0,1,0,0|1,0,0]=3 7123 B12R1.464 CCCCC(C)OCCC1CC1 8390dbee1e747e1390a6336d7ce7d58c [0,1,0,1,0,0|1,0,1]=4 7124 B12R1.464 CCCC[C@@H](C)OCCC1CC1 167b40672e09b0cca7ffa217f13f3522 [0,1,0,1,0,0|1,0,1]=4 7125 B12R1.464 CCCC[C@H](C)OCCC1CC1 5031e862154f1d61e3ea1dfe3087a0e6 [0,1,0,1,0,0|1,0,1]=4 7126 B12R1.464 CCCNC(=O)CCCC1CC1 8632f5c4f2587a22796c49da1d1e8ad6 [0,1,0,1,0,0|1,0,0]=3 7127 B12R1.464 CCCNC(=O)CNCC1CC1 70c72426ee6673bba1a1ae4abe6325c3 [0,1,0,1,0,0|2,0,0]=4 7128 B12R1.464 CCCNC(=O)COCC1CC1 84047463bb0568e00124dd25005eb738 [0,1,0,1,0,0|2,0,0]=4 7129 B12R1.464 CCCNC(=O)CSCC1CC1 3b4bc72992c5700e31f5116538eb61ba [0,1,0,1,0,0|2,0,0]=4 7130 B12R1.464 CCCNC(=O)NCCC1CC1 1113f430506a1b577bbcc4ccdf8958ae [0,1,0,1,0,0|1,0,0]=3 7131 B12R1.464 CCCNC(=O)NCCN1CC1 552d46747516cbe3809f8fac04113a29 [0,1,0,1,0,0|2,0,0]=4 7132 B12R1.464 CCCNC(=S)NCCC1CC1 50d8a77c5e6a6b6ac4ffdade4621f95c [0,1,0,1,0,0|1,1,0]=4 7133 B12R1.464 CCCOC(=O)CCOC1CC1 dde870784c6580b27b49e36c42b4c02e [0,1,0,1,0,0|2,0,0]=4 7134 B12R1.464 CCCOC(=O)CNCC1CC1 dd0d6fb12c5ae2ba7aab15279765034a [0,1,0,1,0,0|2,0,0]=4 7135 B12R1.464 CCCOC(=O)COCC1CC1 79caba3dd96d33bd35e1d71408bcbc2b [0,1,0,1,0,0|2,0,0]=4 7136 B12R1.464 CCCOC(=O)OCNC1CC1 0c0d200df95cae8f991366d3339beb39 [0,1,0,1,0,0|1,0,0]=3 7137 B12R1.464 CCCOC(=O)OCOC1CC1 3514334f763ce30a34dbe30741258431 [0,1,0,1,0,0|1,0,0]=3 7138 B12R1.464 CCOCC(=O)NCCC1CC1 790bf9d4906cce0435c16db067677b43 [0,1,0,1,0,0|1,0,0]=3 7139 B12R1.464 CCOCC(=O)NCCN1CC1 4a577a892c102d6e58fb48f791b285ff [0,1,0,1,0,0|2,0,0]=4 7140 B12R1.464 CCOCC(C)OCCC1CC1 b7a47359f76e5255430fedb2e6203911 [0,1,0,1,0,0|1,0,1]=4 7141 B12R1.464 CCSCC(=O)NCCC1CC1 496c03dbac218b11791df43d00bf3c61 [0,1,0,1,0,0|1,0,0]=3 7142 B12R1.464 CCSCC(=O)NCCN1CC1 3f5a1e4839e92db11c93e149472000ea [0,1,0,1,0,0|2,0,0]=4 7143 B12R1.464 COCCC(=O)NCCC1CC1 fb75db8a03d609761ea122e54b27e9f7 [0,1,0,1,0,0|1,0,0]=3 7144 B12R1.464 COCCC(=O)NCCN1CC1 b4f9e37df670abffff06e0fae98b50f0 [0,1,0,1,0,0|2,0,0]=4 7145 B12R1.464 COCCC(C)OCCC1CC1 80eba9ddd4a29161df601a1c8b222302 [0,1,0,1,0,0|1,0,1]=4 7146 B12R1.464 CSCCC(=O)CNCC1CC1 e0ba44d7a2adcd376e884e3d91116036 [0,1,0,1,0,0|2,0,0]=4 7147 B12R1.464 CSCCC(=O)COCC1CC1 b74faea54a6dbaa35706b79b62fc35b0 [0,1,0,1,0,0|2,0,0]=4 7148 B12R1.464 CSCCC(=O)NCCC1CC1 8f8e6b6de542e277e39c335c256cd0ce [0,1,0,1,0,0|1,0,0]=3 7149 B12R1.464 CSCCC(=O)NCCN1CC1 d11bf1ce6c3c8eb9fd3924a143e2a8e5 [0,1,0,1,0,0|2,0,0]=4 7150 B12R1.464 CSCCC(C)OCCC1CC1 674c1ca2774aec62817c1a8e4d9638df [0,1,0,1,0,0|1,0,1]=4 7151 B12R1.464 CSSCC(=O)NCCC1CC1 083465feb284c8137462667188c58929 [0,1,0,1,0,0|2,0,0]=4 7152 B12R1.464 N#CCCC(=O)NCCC1CC1 826d387f95e004985aa43eab526894df [0,1,0,1,0,0|1,0,1]=4 7153 B12R1.464 NCCNC(=O)NCCC1CC1 34e4e0c150c1139c9030ecb6b038c784 [0,1,0,1,0,0|2,0,0]=4 7154 B12R1.464 O=C(CCCC1CC1)NCCBr b9ec8f71f807df83cf2e4eb77ee19366 [0,1,0,1,0,0|2,0,0]=4 7155 B12R1.464 O=C(CCCC1CC1)NCCF 7b92784507f3ad87bdf7625602defae7 [0,1,0,1,0,0|2,0,0]=4 7156 B12R1.464 O=C(CCCC1CC1)NCCI 2ec40641acd63bd8bbd3a8a54bb852a1 [0,1,0,1,0,0|2,0,0]=4 7157 B12R1.464 O=C(CCCC1CC1)NCCO c85e8ab7a2a7575d98185cb827a323a5 [0,1,0,1,0,0|2,0,0]=4 7158 B12R1.464 O=C(CCCC1CC1)NCCS d7c7d560765bec0f458d791e14f98bf9 [0,1,0,1,0,0|2,0,0]=4 7159 B12R1.464 O=C(CCCF)NCCC1CC1 f19fb4c8e476d45adebc772af87ebc2d [0,1,0,1,0,0|1,0,0]=3 7160 B12R1.464 O=C(CCCF)NCCN1CC1 4ba09d2f946a61afe96165943573702d [0,1,0,1,0,0|2,0,0]=4 7161 B12R1.464 O=C(CCCS)NCCC1CC1 58ceaf1d8b33300e374d34ad0ad09f0e [0,1,0,1,0,0|1,0,0]=3 7162 B12R1.464 O=C(CCCS)NCCN1CC1 e9fc750b88ff021293a0b6dc5691c92e [0,1,0,1,0,0|2,0,0]=4 7163 B12R1.464 O=C(NCCF)NCCC1CC1 8a4e9fc1504361323a21ae106dcd0570 [0,1,0,1,0,0|2,0,0]=4 7164 B12R1.464 O=C(NCCO)NCCC1CC1 21115f0f495f05539d1d0e38c1582ec4 [0,1,0,1,0,0|2,0,0]=4 7165 B12R1.464 O=C(NCCS)NCCC1CC1 3df66a1da41d401727de47e040c928b3 [0,1,0,1,0,0|2,0,0]=4 7166 B12R1.464 O=CCCC(=O)NCCC1CC1 7f5b5986be8d21bd6418827542b6cdf7 [0,1,0,1,0,0|1,0,1]=4 7167 B12R1.549 CCCCC(C)OCC1CC1C a0e1b538f556ba8c611a2524c5b18adf [0,1,0,1,0,0|1,0,1]=4 7168 B12R1.549 CCCCC(C)OC[C@@H]1C[C@@H]1C 792df62751f8c9891f9e6aad6d7b5658 [0,1,0,1,0,0|1,0,1]=4 7169 B12R1.549 CCCCC(C)OC[C@@H]1C[C@H]1C 76680b461502eedc7e46294aed1865fc [0,1,0,1,0,0|1,0,1]=4 7170 B12R1.549 CCCCC(C)OC[C@H]1C[C@@H]1C d0ea1cd804c8932f1c0d2193bb70be25 [0,1,0,1,0,0|1,0,1]=4 7171 B12R1.549 CCCNC(=O)CNC1CC1C b27568d99189466fd627a86076628613 [0,1,0,1,0,0|2,0,0]=4 7172 B12R1.549 CCCOC(=O)CNC1CC1C e6686344ca051c7b1f0ddd710a94338c [0,1,0,1,0,0|2,0,0]=4 7173 B12R1.549 CSCCC(=O)CNC1CC1C 9c3983de61406433b774164e54096ca3 [0,1,0,1,0,0|2,0,0]=4 7174 B12R1.895 CC1=C(C(=O)CC1)OCC(C)C 400a964f417e70a1228d2dc22700b2dc [0,1,0,1,0,0|2,0,0]=4 7175 B12R1.2043 C#CCCC(=O)NC1CC1(C)C beea041a0035cefe85acb69f52fef1d0 [0,1,0,1,0,0|1,0,1]=4 7176 B12R1.2043 C#CCCC(=O)N[C@@H]1CC1(C)C 13403c03d51b5c5146c81739d09f8a82 [0,1,0,1,0,0|1,0,1]=4 7177 B12R1.2043 C#CCCC(=O)N[C@H]1CC1(C)C 5ddcc63d979c835a572995d6119e18b3 [0,1,0,1,0,0|1,0,1]=4 7178 B12R1.2043 C/C=C/CC(=O)NC1CC1(C)C 6a033a5ac21f58e31ec8cb4ffbd29e97 [0,1,0,1,0,0|1,0,1]=4 7179 B12R1.2043 C/C=C/CC(=O)N[C@@H]1CC1(C)C 8650e4836cb1343526b0d731657e75e8 [0,1,0,1,0,0|1,0,1]=4 7180 B12R1.2043 C/C=C/CC(=O)N[C@H]1CC1(C)C 95727b7c6926bde9a429c5c7dec48a96 [0,1,0,1,0,0|1,0,1]=4 7181 B12R1.2043 C=CCCC(=O)NC1CC1(C)C c7b81cc56fca93fe61c4d7edc2aafa83 [0,1,0,1,0,0|1,0,1]=4 7182 B12R1.2043 C=CCCC(=O)N[C@@H]1CC1(C)C 82d9349bc420dc2e8c07c814d99455f5 [0,1,0,1,0,0|1,0,1]=4 7183 B12R1.2043 C=CCCC(=O)N[C@H]1CC1(C)C bcae215f97bd077cb77faa30216405d6 [0,1,0,1,0,0|1,0,1]=4 7184 B12R1.2043 CC#CCC(=O)NC1CC1(C)C 763997b3ca8243b1bce133bbf64a4f84 [0,1,0,1,0,0|1,0,1]=4 7185 B12R1.2043 CC#CCC(=O)N[C@@H]1CC1(C)C 0ce1cb1585bf89654fe9a417f6360d7b [0,1,0,1,0,0|1,0,1]=4 7186 B12R1.2043 CC#CCC(=O)N[C@H]1CC1(C)C 46c23aab0c2f9e2f31a1ffe8c43fad23 [0,1,0,1,0,0|1,0,1]=4 7187 B12R1.2043 CC/C=C/C(=O)NC1CC1(C)C ed779dea6fa20ad2802718c15b10b5cd [0,1,0,1,0,0|1,0,1]=4 7188 B12R1.2043 CC/C=C/C(=O)N[C@@H]1CC1(C)C 7163d30689e0f523ffc02ff1a5388d4f [0,1,0,1,0,0|1,0,1]=4 7189 B12R1.2043 CC/C=C/C(=O)N[C@H]1CC1(C)C 1e46be5911305665069d63643bc370eb [0,1,0,1,0,0|1,0,1]=4 7190 B12R1.2043 CC/C=C\C(=O)NC1CC1(C)C 5d3abc982116877e9728af89c2238cce [0,1,0,1,0,0|1,0,1]=4 7191 B12R1.2043 CC/C=C\C(=O)N[C@@H]1CC1(C)C 81a58d80c14258fe89a394581736d500 [0,1,0,1,0,0|1,0,1]=4 7192 B12R1.2043 CC/C=C\C(=O)N[C@H]1CC1(C)C 674bbdbbe1eb5e7d2825e75ac0c02b9b [0,1,0,1,0,0|1,0,1]=4 7193 B12R1.2043 CC1(CC1NC(=O)CCC#N)C f0cf6e77395c033fe4bbabb6064568e9 [0,1,0,1,0,0|1,0,1]=4 7194 B12R1.2043 CC1(CC1NC(=O)CCC=O)C 7f82443fc566f9a6b088afde7ae5426f [0,1,0,1,0,0|1,0,1]=4 7195 B12R1.2043 CC1(CC1NC(=O)CCCF)C 773def34bc285f5f6443aafd2c6c3077 [0,1,0,1,0,0|1,0,0]=3 7196 B12R1.2043 CC1(CC1NC(=O)CCCS)C 48d8b372ebcd3e24ddcd4491abaff437 [0,1,0,1,0,0|1,0,0]=3 7197 B12R1.2043 CC1(CC1NC(=O)NCCF)C b1d8f1bba0d51a8f42dea12b3f8c48c1 [0,1,0,1,0,0|2,0,0]=4 7198 B12R1.2043 CC1(CC1NC(=O)NCCN)C 25ca981b3a80eb4c1f7437d5b954b98a [0,1,0,1,0,0|2,0,0]=4 7199 B12R1.2043 CC1(CC1NC(=O)NCCO)C 9a175686b4e82118450a6fc7d59f8af6 [0,1,0,1,0,0|2,0,0]=4 7200 B12R1.2043 CC1(CC1NC(=O)NCCS)C 06b985c7856059211645867333149630 [0,1,0,1,0,0|2,0,0]=4 7201 B12R1.2043 CC1(C[C@@H]1NC(=O)CCC#N)C 6f4538d1fa27e365d83f1a3d96bb897d [0,1,0,1,0,0|1,0,1]=4 7202 B12R1.2043 CC1(C[C@@H]1NC(=O)CCC=O)C 32ecd9b091075432d704db8f221e1cac [0,1,0,1,0,0|1,0,1]=4 7203 B12R1.2043 CC1(C[C@@H]1NC(=O)CCCF)C 26073bd54da735d10415197d194fdc02 [0,1,0,1,0,0|1,0,0]=3 7204 B12R1.2043 CC1(C[C@@H]1NC(=O)CCCS)C 85eafd36480961419e25dbf2dc7b9a71 [0,1,0,1,0,0|1,0,0]=3 7205 B12R1.2043 CC1(C[C@@H]1NC(=O)NCCF)C 56ce69b7f49906f884d21334b62ecb61 [0,1,0,1,0,0|2,0,0]=4 7206 B12R1.2043 CC1(C[C@@H]1NC(=O)NCCN)C e0e2e46c376243e786b18b7a0dd4fc29 [0,1,0,1,0,0|2,0,0]=4 7207 B12R1.2043 CC1(C[C@@H]1NC(=O)NCCO)C baa753bf82af91f6c5b6110720a45034 [0,1,0,1,0,0|2,0,0]=4 7208 B12R1.2043 CC1(C[C@@H]1NC(=O)NCCS)C 330f24d7c42b2442afff3e0901346a90 [0,1,0,1,0,0|2,0,0]=4 7209 B12R1.2043 CC1(C[C@H]1NC(=O)CCC#N)C e954a1f009aca68de468629022591656 [0,1,0,1,0,0|1,0,1]=4 7210 B12R1.2043 CC1(C[C@H]1NC(=O)CCC=O)C 30831f9701cb766b5b912e76741af471 [0,1,0,1,0,0|1,0,1]=4 7211 B12R1.2043 CC1(C[C@H]1NC(=O)CCCF)C 8a9e1531514ddd140730c73eb97f6e8a [0,1,0,1,0,0|1,0,0]=3 7212 B12R1.2043 CC1(C[C@H]1NC(=O)CCCS)C 563d568bdf93d32501b6928e175e369e [0,1,0,1,0,0|1,0,0]=3 7213 B12R1.2043 CC1(C[C@H]1NC(=O)NCCF)C 116b5597140eea82fd5b0115d6b7d7c0 [0,1,0,1,0,0|2,0,0]=4 7214 B12R1.2043 CC1(C[C@H]1NC(=O)NCCN)C b16d4e9fb193856de3c94b27ac13a4a9 [0,1,0,1,0,0|2,0,0]=4 7215 B12R1.2043 CC1(C[C@H]1NC(=O)NCCO)C eae6a6bbbd0a0fe4b6eb155c3a408a33 [0,1,0,1,0,0|2,0,0]=4 7216 B12R1.2043 CC1(C[C@H]1NC(=O)NCCS)C d72d1f5c523260c3203f078837137f26 [0,1,0,1,0,0|2,0,0]=4 7217 B12R1.2043 CCC#CC(=O)NC1CC1(C)C 5a633e7415afc6077843b3a2d62bff41 [0,1,0,1,0,0|1,0,1]=4 7218 B12R1.2043 CCC#CC(=O)N[C@@H]1CC1(C)C 54f1ac994ea8e8a679cbf9ef57cb3cd0 [0,1,0,1,0,0|1,0,1]=4 7219 B12R1.2043 CCC#CC(=O)N[C@H]1CC1(C)C fbe2b4e8273dccb23aa5861e36085072 [0,1,0,1,0,0|1,0,1]=4 7220 B12R1.2043 CCC=CC(=O)NC1CC1(C)C a566298f574647d1a902fbcdd580486e [0,1,0,1,0,0|1,0,1]=4 7221 B12R1.2043 CCC=CC(=O)N[C@@H]1CC1(C)C 191b642d89d02d4790e2c758a863673f [0,1,0,1,0,0|1,0,1]=4 7222 B12R1.2043 CCC=CC(=O)N[C@H]1CC1(C)C 59c546c092fdecedb7acf74635408b2b [0,1,0,1,0,0|1,0,1]=4 7223 B12R1.2043 CCCCC(=O)NC1CC1(C)C 173ee0bd104dcbd8ffb00fa195597bb9 [0,1,0,1,0,0|1,0,0]=3 7224 B12R1.2043 CCCCC(=O)N[C@@H]1CC1(C)C 61c8fbd50149bbafe5fb5ce074579422 [0,1,0,1,0,0|1,0,0]=3 7225 B12R1.2043 CCCCC(=O)N[C@H]1CC1(C)C 3c43d045782e455e020d1e48338a9958 [0,1,0,1,0,0|1,0,0]=3 7226 B12R1.2043 CCCCC(C)OC1CC1(C)C 980a2ea8481cda7be479a00460d96521 [0,1,0,1,0,0|1,0,1]=4 7227 B12R1.2043 CCCC[C@@H](C)OC1CC1(C)C c839e654dee59c48645bb054a6a61988 [0,1,0,1,0,0|1,0,1]=4 7228 B12R1.2043 CCCC[C@H](C)OC1CC1(C)C f14d99098d92a1b048fe67d4a92aad56 [0,1,0,1,0,0|1,0,1]=4 7229 B12R1.2043 CCCNC(=O)CN1CC1(C)C b2bdeee4dac7e3a441b71410c301ebae [0,1,0,1,0,0|2,0,0]=4 7230 B12R1.2043 CCCNC(=O)NC1CC1(C)C 38586d7ad92b969b1893d53b2bf72d89 [0,1,0,1,0,0|1,0,0]=3 7231 B12R1.2043 CCCNC(=O)N[C@@H]1CC1(C)C cfead6820aaff525faebde630d402269 [0,1,0,1,0,0|1,0,0]=3 7232 B12R1.2043 CCCNC(=O)N[C@H]1CC1(C)C fe4271c73774de8af306761a6a627b9b [0,1,0,1,0,0|1,0,0]=3 7233 B12R1.2043 CCCNC(=S)NC1CC1(C)C 9ef3b0cff2e862e2c39b93d5a3ea4fe0 [0,1,0,1,0,0|1,1,0]=4 7234 B12R1.2043 CCCNC(=S)N[C@@H]1CC1(C)C 57066b6210e8e92956365658d5b388ee [0,1,0,1,0,0|1,1,0]=4 7235 B12R1.2043 CCCNC(=S)N[C@H]1CC1(C)C befe333f13c75a11e3ed6ec9a00ed91a [0,1,0,1,0,0|1,1,0]=4 7236 B12R1.2043 CCCOC(=O)CN1CC1(C)C 0c0534b7f49c91f08616aa02dbf8f7c0 [0,1,0,1,0,0|2,0,0]=4 7237 B12R1.2043 CCOCC(=O)NC1CC1(C)C 2db86e2dbc6020c83f29e493c3af9690 [0,1,0,1,0,0|1,0,0]=3 7238 B12R1.2043 CCOCC(=O)N[C@@H]1CC1(C)C 4586a7a97bd440b9381164b41bdd23b9 [0,1,0,1,0,0|1,0,0]=3 7239 B12R1.2043 CCOCC(=O)N[C@H]1CC1(C)C 6899b96b4e0217bcc151b8ecd47d6a31 [0,1,0,1,0,0|1,0,0]=3 7240 B12R1.2043 CCOCC(C)OC1CC1(C)C 81dcbbd5e5d4f6344add576c2f91b427 [0,1,0,1,0,0|1,0,1]=4 7241 B12R1.2043 CCSCC(=O)NC1CC1(C)C bf9a3a8462b96d0c471dbef5905897e9 [0,1,0,1,0,0|1,0,0]=3 7242 B12R1.2043 CCSCC(=O)N[C@@H]1CC1(C)C a83dd25dc7b65ef00f8cbc760bca6e30 [0,1,0,1,0,0|1,0,0]=3 7243 B12R1.2043 CCSCC(=O)N[C@H]1CC1(C)C c1b1e354b177ccac6aceb19f485bcc55 [0,1,0,1,0,0|1,0,0]=3 7244 B12R1.2043 COCCC(=O)NC1CC1(C)C 49ce1577de4c17391863debe2847dc4e [0,1,0,1,0,0|1,0,0]=3 7245 B12R1.2043 COCCC(=O)N[C@@H]1CC1(C)C 5899a204fc3041f3965f0341112f67f9 [0,1,0,1,0,0|1,0,0]=3 7246 B12R1.2043 COCCC(=O)N[C@H]1CC1(C)C 9aa6f47416e0df050ed267063498d273 [0,1,0,1,0,0|1,0,0]=3 7247 B12R1.2043 COCCC(C)OC1CC1(C)C ebd91e826595b75cd31767633092aa87 [0,1,0,1,0,0|1,0,1]=4 7248 B12R1.2043 CSCCC(=O)CN1CC1(C)C 07f83cdfbee2a635ac7be66ff380201c [0,1,0,1,0,0|2,0,0]=4 7249 B12R1.2043 CSCCC(=O)NC1CC1(C)C d1b4d4e69590e59581ae53c549a2234e [0,1,0,1,0,0|1,0,0]=3 7250 B12R1.2043 CSCCC(=O)N[C@@H]1CC1(C)C ee61fce3eb26125ee046b15ecb0b5491 [0,1,0,1,0,0|1,0,0]=3 7251 B12R1.2043 CSCCC(=O)N[C@H]1CC1(C)C 7bb6f9a35d8c09c99c7b9e4920953d27 [0,1,0,1,0,0|1,0,0]=3 7252 B12R1.2043 CSSCC(=O)NC1CC1(C)C ced8b12a5ffdac5f760f0116ca9de6fe [0,1,0,1,0,0|2,0,0]=4 7253 B12R1.2043 CSSCC(=O)N[C@@H]1CC1(C)C 39e245cc5a4a9443c3da6f7faca03d88 [0,1,0,1,0,0|2,0,0]=4 7254 B12R1.2043 CSSCC(=O)N[C@H]1CC1(C)C 00e29fb56bdcb929490b502bd35e485f [0,1,0,1,0,0|2,0,0]=4 7255 B12R1.50 CC(CO)CN1CCCC(=O)C1 f733cec19cf52de9f6679a873f35b439 [0,1,0,1,0,0|2,0,0]=4 7256 B12R1.50 CC(CO)NC1CCCC(=O)C1 da566c1bcb06eccb8d10701387a24680 [0,1,0,1,0,0|2,0,0]=4 7257 B12R1.50 CCC(C)CN1CCCC(=O)C1 0319f05b64bc028c178ed432530dec29 [0,1,0,1,0,0|2,0,0]=4 7258 B12R1.50 CCC(C)NC1CCCC(=O)C1 fabf32750d69f1324d59558471afc109 [0,1,0,1,0,0|2,0,0]=4 7259 B12R1.50 CC[C@@H](C)CN1CCCC(=O)C1 c531552e0a8ea267755761312c400a34 [0,1,0,1,0,0|2,0,0]=4 7260 B12R1.50 CC[C@@H](C)NC1CCCC(=O)C1 92df84eae4eb3a0550f63e1ea2bd7c23 [0,1,0,1,0,0|2,0,0]=4 7261 B12R1.50 CC[C@H](C)CN1CCCC(=O)C1 4ca7a8fd7d7dd37b5a4b2462215e770e [0,1,0,1,0,0|2,0,0]=4 7262 B12R1.50 CC[C@H](C)NC1CCCC(=O)C1 18278269ab933e5d568359509ed77f88 [0,1,0,1,0,0|2,0,0]=4 7263 B12R1.50 COC(C)CN1CCCC(=O)C1 0ecd79607e142ebef5f1d2c8e2a1ea3a [0,1,0,1,0,0|2,0,0]=4 7264 B12R1.50 CO[C@@H](C)CN1CCCC(=O)C1 bffa148dca1a49fe066a695b25eaf731 [0,1,0,1,0,0|2,0,0]=4 7265 B12R1.50 CO[C@H](C)CN1CCCC(=O)C1 35d425fd566725611f8a6a69cccdcfbb [0,1,0,1,0,0|2,0,0]=4 7266 B12R1.50 C[C@@H](CO)CN1CCCC(=O)C1 9dadd9c3d083bcca981809a86df622f8 [0,1,0,1,0,0|2,0,0]=4 7267 B12R1.50 C[C@@H](CO)NC1CCCC(=O)C1 b7ab08492a140cd95fa5863da882a9fd [0,1,0,1,0,0|2,0,0]=4 7268 B12R1.50 C[C@H](CO)CN1CCCC(=O)C1 717a0b0b1dc92d76f10e6c4394f92adb [0,1,0,1,0,0|2,0,0]=4 7269 B12R1.50 C[C@H](CO)NC1CCCC(=O)C1 c436d61280cfa545558a167adc9771f1 [0,1,0,1,0,0|2,0,0]=4 7270 B12R1.309 CCCC(=O)CN[C@@H]1C[C@@H]1OC 4717ca0a8840aa6426b46275deee30f6 [0,1,0,1,0,0|2,0,0]=4 7271 B12R1.309 CCCC(=O)CN[C@@H]1C[C@H]1CO c4c7292b261f768b7016f2d527c032b8 [0,1,0,1,0,0|2,0,0]=4 7272 B12R1.309 CCCC(=O)CN[C@H]1C[C@@H]1CO 68338b47114ef65cacdf7333c3ca25ef [0,1,0,1,0,0|2,0,0]=4 7273 B12R1.309 CCCC(=O)CN[C@H]1C[C@H]1CO 647806f5ef9ca28e8e5caac3cac50d47 [0,1,0,1,0,0|2,0,0]=4 7274 B12R1.309 CCCC(=O)NCC1CC1CO e21ac12da69a5aef29f121abc9b66377 [0,1,0,1,0,0|1,0,0]=3 7275 B12R1.309 COCC(=O)NCC1CC1CO 94001698b5339731c060185e3eaa6c2c [0,1,0,1,0,0|2,0,0]=4 7276 B12R1.309 CSCC(=O)NCC1CC1CO 899e7a1dfc58904640b87be302077e27 [0,1,0,1,0,0|2,0,0]=4 7277 B12R1.309 O=C(CCF)NCC1CC1CO 2b3a9fa9ec9b648a71f8f549165f73f6 [0,1,0,1,0,0|2,0,0]=4 7278 B12R1.309 O=C(CCO)NCC1CC1CO a6f2ee7ab7868e306b9963ff524f8000 [0,1,0,1,0,0|2,0,0]=4 7279 B12R1.309 O=C(CCS)NCC1CC1CO a8f84493ef7667769981fdd1daf93c50 [0,1,0,1,0,0|2,0,0]=4 7280 B12R1.312 C#CC1CCN(C1)C(=O)CCC e5feece79d9f27eea273d55f611f7e6d [0,1,0,1,0,0|1,0,1]=4 7281 B12R1.312 C=CC1CCN(C1)C(=O)CCC 9e0e4a4ba408ff1366304eb0b489f967 [0,1,0,1,0,0|1,0,1]=4 7282 B12R1.312 CCC1CCN(C1)C(=O)CCF 8cbbc3c906fc44c8234d52e1da002cac [0,1,0,1,0,0|2,0,0]=4 7283 B12R1.312 CCC1CCN(C1)C(=O)CCO 47faea54ab668b9544769a1680a779b6 [0,1,0,1,0,0|2,0,0]=4 7284 B12R1.312 CCC1CCN(C1)C(=O)CCS f8aef378c009fb7590b341aab8b6c5e1 [0,1,0,1,0,0|2,0,0]=4 7285 B12R1.312 CCC1CCN(C1)C(=O)COC 16d924bf0a877ae7cf945792e5c4cc7b [0,1,0,1,0,0|2,0,0]=4 7286 B12R1.312 CCC1CCN(C1)C(=O)CSC 5106447a899c68cae075923dbfd1d09b [0,1,0,1,0,0|2,0,0]=4 7287 B12R1.312 CCCC(=O)N1CCC(C1)C#N d40cc5c819e1741c84ce882afca63a71 [0,1,0,1,0,0|1,0,1]=4 7288 B12R1.312 CCCC(=O)N1CCC(C1)CC 523ef14985a1b1f4a940e3e5749e23c6 [0,1,0,1,0,0|1,0,0]=3 7289 B12R1.312 CCCC(=O)N1CCC(C1)CO 2a59f2aa7e047f8e613c435c25145cb2 [0,1,0,1,0,0|1,0,0]=3 7290 B12R1.312 CCCC(=O)N1CCC(C1)OC 1de80132e9e0a75cf199392b1d56e172 [0,1,0,1,0,0|1,0,0]=3 7291 B12R1.312 CCCC(=O)N1CC[C@@H](C1)C#N 2465aaeb3cfc21c09dca4f09e923cf64 [0,1,0,1,0,0|1,0,1]=4 7292 B12R1.312 CCCC(=O)N1CC[C@@H](C1)CO b5740ab6ff447e1b7e5280fc9ed0e7f8 [0,1,0,1,0,0|1,0,0]=3 7293 B12R1.312 CCCC(=O)N1CC[C@@H](C1)OC a2bd47e9fea6d24dd0936f1f197b9166 [0,1,0,1,0,0|1,0,0]=3 7294 B12R1.312 CCCC(=O)N1CC[C@H](C1)C#N 7f9b08261f1cd381006dbcaa35e22e77 [0,1,0,1,0,0|1,0,1]=4 7295 B12R1.312 CCCC(=O)N1CC[C@H](C1)CO b0208ea09607fc0a524395b32229c0b6 [0,1,0,1,0,0|1,0,0]=3 7296 B12R1.312 CCCC(=O)N1CC[C@H](C1)OC e0c35d5ec5791b8ea88a051665f55c28 [0,1,0,1,0,0|1,0,0]=3 7297 B12R1.312 COC1CCN(C1)C(=O)CCF 76ee409b3f16348668f74b01d592886e [0,1,0,1,0,0|2,0,0]=4 7298 B12R1.312 COC1CCN(C1)C(=O)CCO 9258521bfa9bbd095f877cc8a54e1b91 [0,1,0,1,0,0|2,0,0]=4 7299 B12R1.312 COC1CCN(C1)C(=O)CCS 86dd91ab8e0697d8626b44e996ea763a [0,1,0,1,0,0|2,0,0]=4 7300 B12R1.312 COC1CCN(C1)C(=O)CSC beeef14c8caf6f6a4a1d37012ce307d5 [0,1,0,1,0,0|2,0,0]=4 7301 B12R1.312 COCC(=O)N1CCC(C1)CO bfeab18022d7a444099243a46c2efbdf [0,1,0,1,0,0|2,0,0]=4 7302 B12R1.312 COCC(=O)N1CCC(C1)OC 2eeadc3e6197700e6567af5b89a3036e [0,1,0,1,0,0|2,0,0]=4 7303 B12R1.312 COCC(=O)N1CC[C@@H](C1)CO aad74f5c306ee4564e0b8a410453c639 [0,1,0,1,0,0|2,0,0]=4 7304 B12R1.312 COCC(=O)N1CC[C@@H](C1)OC 94550136dd989d96ff3d51231a17b1ce [0,1,0,1,0,0|2,0,0]=4 7305 B12R1.312 COCC(=O)N1CC[C@H](C1)CO b7bd7788bc9127ae8598e6c149f4edf4 [0,1,0,1,0,0|2,0,0]=4 7306 B12R1.312 COCC(=O)N1CC[C@H](C1)OC 5bb565389ef200446be2f6235a1a09fb [0,1,0,1,0,0|2,0,0]=4 7307 B12R1.312 CO[C@@H]1CCN(C1)C(=O)CCF fbba611aadb64e8c626409d4060ac83c [0,1,0,1,0,0|2,0,0]=4 7308 B12R1.312 CO[C@@H]1CCN(C1)C(=O)CCO 392ced8fa9911cddf4a1710cd8aabb14 [0,1,0,1,0,0|2,0,0]=4 7309 B12R1.312 CO[C@@H]1CCN(C1)C(=O)CCS 450e646ac1655af89ec245b0523d4ae4 [0,1,0,1,0,0|2,0,0]=4 7310 B12R1.312 CO[C@@H]1CCN(C1)C(=O)CSC 6482048abefb56569e813501a839aa94 [0,1,0,1,0,0|2,0,0]=4 7311 B12R1.312 CO[C@H]1CCN(C1)C(=O)CCF 132295b2f60f342f190b753fd64938bf [0,1,0,1,0,0|2,0,0]=4 7312 B12R1.312 CO[C@H]1CCN(C1)C(=O)CCO 314b42cf8445cbe1cb4c0444c7327be7 [0,1,0,1,0,0|2,0,0]=4 7313 B12R1.312 CO[C@H]1CCN(C1)C(=O)CCS d51ca84e397702b69cc918233acedb4f [0,1,0,1,0,0|2,0,0]=4 7314 B12R1.312 CO[C@H]1CCN(C1)C(=O)CSC eb2f38ce27f16f9e97365b13716c1f3b [0,1,0,1,0,0|2,0,0]=4 7315 B12R1.312 CSCC(=O)N1CCC(C1)CO 943fd394b75c18219de649ab987a8774 [0,1,0,1,0,0|2,0,0]=4 7316 B12R1.312 CSCC(=O)N1CC[C@@H](C1)CO fc623e427eded904782c1ea120df22b0 [0,1,0,1,0,0|2,0,0]=4 7317 B12R1.312 CSCC(=O)N1CC[C@H](C1)CO 6cabea44ab604d0ca53def3eaaf3740f [0,1,0,1,0,0|2,0,0]=4 7318 B12R1.312 O=C(CCF)N1CCC(C1)CO 9173a8d50a6f158eb7585c78ab5009ea [0,1,0,1,0,0|2,0,0]=4 7319 B12R1.312 O=C(CCF)N1CC[C@@H](C1)CO 4b1238e385d4f0c8f6d98feb1db36e30 [0,1,0,1,0,0|2,0,0]=4 7320 B12R1.312 O=C(CCF)N1CC[C@H](C1)CO b97fc30ea125586914c2b72373813eff [0,1,0,1,0,0|2,0,0]=4 7321 B12R1.312 O=C(CCO)N1CCC(C1)CO ec6c12aca95557a6917ee490a0864eee [0,1,0,1,0,0|2,0,0]=4 7322 B12R1.312 O=C(CCO)N1CC[C@@H](C1)CO d19e90d74e1a12c4d8b27693183a05dc [0,1,0,1,0,0|2,0,0]=4 7323 B12R1.312 O=C(CCO)N1CC[C@H](C1)CO 95d6178caf1a00695a6e5cb6920f9e76 [0,1,0,1,0,0|2,0,0]=4 7324 B12R1.312 O=C(CCS)N1CCC(C1)CO d98af297ca3e3f6717a35ccb7f1ace34 [0,1,0,1,0,0|2,0,0]=4 7325 B12R1.312 O=C(CCS)N1CC[C@@H](C1)CO c8cbab3d88ae86ef5086cba4d14e2ba2 [0,1,0,1,0,0|2,0,0]=4 7326 B12R1.312 O=C(CCS)N1CC[C@H](C1)CO 8e589f6e7d1c6db23903ebb673262f7f [0,1,0,1,0,0|2,0,0]=4 7327 B12R1.315 CCCC(=O)CNCC1CCC1 27281dff6f9946712929ef1a2d15c447 [0,1,0,1,0,0|2,0,0]=4 7328 B12R1.315 CCCC(=O)CNCC1CCO1 2c9aa811a844e459c0ae7420528d4837 [0,1,0,1,0,0|2,0,0]=4 7329 B12R1.315 CCCC(=O)CNCC1COC1 f8839bdff691874f8193beb0077aa6a0 [0,1,0,1,0,0|2,0,0]=4 7330 B12R1.315 CCCC(=O)CNC[C@@H]1CCO1 bd2e8f3d54e002ce80fa961b8b09f2d3 [0,1,0,1,0,0|2,0,0]=4 7331 B12R1.315 CCCC(=O)CNC[C@H]1CCO1 c8f4488c57631acb5f8776687ec16e14 [0,1,0,1,0,0|2,0,0]=4 7332 B12R1.315 CCCC(=O)COCC1CCC1 d60493aad543ba611ec030e93a681dc5 [0,1,0,1,0,0|2,0,0]=4 7333 B12R1.315 CCCC(=O)COCC1CCO1 664eb2a85c45aa7f61cf5d56e9e43135 [0,1,0,1,0,0|2,0,0]=4 7334 B12R1.315 CCCC(=O)COCC1COC1 1edf1d052541b4033842640ccfbea7e1 [0,1,0,1,0,0|2,0,0]=4 7335 B12R1.315 CCCC(=O)COCC1CSC1 08fe8e4f6505ff76d450d6a780bb59a6 [0,1,0,1,0,0|2,0,0]=4 7336 B12R1.315 CCCC(=O)COC[C@@H]1CCO1 42dd5cef036d9f056e1330bdd3d6f16f [0,1,0,1,0,0|2,0,0]=4 7337 B12R1.315 CCCC(=O)COC[C@H]1CCO1 eda1e02dc4a44dfc95d266ab643e0c85 [0,1,0,1,0,0|2,0,0]=4 7338 B12R1.315 CCCC(=O)NCCC1CCC1 549fc1b699f41761744f1a3c4fdf8ffc [0,1,0,1,0,0|1,0,0]=3 7339 B12R1.315 CCCC(=O)NCCC1CCO1 8189c68730c638b16c10ba9ef2bcb817 [0,1,0,1,0,0|1,0,0]=3 7340 B12R1.315 CCCC(=O)NCCC1COC1 b61e6382a2223efbe5d6db8257f6e1a1 [0,1,0,1,0,0|1,0,0]=3 7341 B12R1.315 CCCC(=O)NCCN1CCC1 a09804f8d584f0b958284f809b96b83d [0,1,0,1,0,0|2,0,0]=4 7342 B12R1.315 CCCC(=O)NCC[C@@H]1CCO1 3b823b36d7475cc335fe3267a11dd09f [0,1,0,1,0,0|1,0,0]=3 7343 B12R1.315 CCCC(=O)OCNC1CCC1 aedd0edf9c7670a18cdc341b4c3d779c [0,1,0,1,0,0|1,0,0]=3 7344 B12R1.315 CCCC(=O)OCNC1COC1 0e8fc202424c66123d8b7f4eea740ab8 [0,1,0,1,0,0|1,0,0]=3 7345 B12R1.315 CCCC(=O)OCOC1CCC1 868af7332a80d5c01a4aa342c0dc846a [0,1,0,1,0,0|1,0,0]=3 7346 B12R1.315 CCCC(=O)OCOC1COC1 37295a5e0cc34e2ab2692c5aa727badb [0,1,0,1,0,0|1,0,0]=3 7347 B12R1.315 CCCC(=O)OCOC1CSC1 3620f8675f4970ce29b5f4220459b075 [0,1,0,1,0,0|1,0,0]=3 7348 B12R1.315 CCCC(=S)OCCC1CCC1 20e8338f880556764713bf6a8e75c30f [0,1,0,1,0,0|0,1,0]=3 7349 B12R1.315 CCCC(=S)OCCC1CCO1 9417a236decd275228d42ffc3e3bea56 [0,1,0,1,0,0|0,1,0]=3 7350 B12R1.315 CCCC(=S)OCCC1COC1 2e6c6609fa0cbdda276ef6ff82fdca4d [0,1,0,1,0,0|0,1,0]=3 7351 B12R1.315 CCCC(C)OCCC1CCC1 d4ab96e7e34440fb49282cd210264e66 [0,1,0,1,0,0|1,0,1]=4 7352 B12R1.315 CCCC(C)OCCC1CCO1 4de64bba23336651148c3e125d8300d6 [0,1,0,1,0,0|1,0,1]=4 7353 B12R1.315 CCCC(C)OCCC1COC1 0f623a161fe937cb8a03aeb84c3b65db [0,1,0,1,0,0|1,0,1]=4 7354 B12R1.315 CCCC(C)OCC[C@@H]1CCO1 00bc9d907e32ff4cc002f18388232dac [0,1,0,1,0,0|1,0,1]=4 7355 B12R1.315 CCCC(C)OCC[C@H]1CCO1 d49a385d7d683086048947e2877c0bd6 [0,1,0,1,0,0|1,0,1]=4 7356 B12R1.315 CCC[C@@H](C)OCCC1CCC1 b4af0d82ec316fc929af8aa2a751d4f8 [0,1,0,1,0,0|1,0,1]=4 7357 B12R1.315 CCC[C@@H](C)OCCC1CCO1 cbabea64f4f2fc360ded6844de7a9ccb [0,1,0,1,0,0|1,0,1]=4 7358 B12R1.315 CCC[C@@H](C)OCCC1COC1 516514d16603a08cf3f36b33e4256e41 [0,1,0,1,0,0|1,0,1]=4 7359 B12R1.315 CCC[C@H](C)OCCC1CCC1 489b08bfae5bb114c343be76a4e42529 [0,1,0,1,0,0|1,0,1]=4 7360 B12R1.315 CCC[C@H](C)OCCC1CCO1 7827de1b941301925322a831a2443589 [0,1,0,1,0,0|1,0,1]=4 7361 B12R1.315 CCC[C@H](C)OCCC1COC1 b6c90e89426a37adb56b69dd2b149c7e [0,1,0,1,0,0|1,0,1]=4 7362 B12R1.315 CCOC(=O)OCNC1CCC1 e4db422c7defe383fe065e0634dda263 [0,1,0,1,0,0|2,0,0]=4 7363 B12R1.315 CCOC(=O)OCNC1COC1 0ee81f381f51ae4b5a23fd9a5b1bb854 [0,1,0,1,0,0|2,0,0]=4 7364 B12R1.315 CCOC(=O)OCOC1CCC1 99109b7a6320c08c1888ac48b72bcbe7 [0,1,0,1,0,0|2,0,0]=4 7365 B12R1.315 CCOC(=O)OCOC1COC1 01f97ddd8d8ae0acc0d8a2dadcbafa1c [0,1,0,1,0,0|2,0,0]=4 7366 B12R1.315 CCOC(=O)OCOC1CSC1 33a1242e846ac8b5ffcc47297b44816e [0,1,0,1,0,0|2,0,0]=4 7367 B12R1.315 CCSC(=O)OCNC1CCC1 56fcda8ae6089bdc04707d26555d2e8b [0,1,0,1,0,0|2,0,0]=4 7368 B12R1.315 CCSC(=O)OCNC1COC1 fea0705af4af3c620f2fa3b9083d38ae [0,1,0,1,0,0|2,0,0]=4 7369 B12R1.315 CCSC(=O)OCOC1CCC1 8970f28dbd65669aa9382a92ba0d5f9f [0,1,0,1,0,0|2,0,0]=4 7370 B12R1.315 CCSC(=O)OCOC1COC1 7a9feb7573a63e6a1a0e7edd094ff4e8 [0,1,0,1,0,0|2,0,0]=4 7371 B12R1.315 CCSC(=O)OCOC1CSC1 29223575ce467425c8240cb7c289443d [0,1,0,1,0,0|2,0,0]=4 7372 B12R1.315 COCC(=O)NCCC1CCC1 b8bc237ec306c19c55aa6164add3d0e7 [0,1,0,1,0,0|2,0,0]=4 7373 B12R1.315 COCC(=O)NCCC1CCO1 1daff80a04387d3fe757a693c2b84337 [0,1,0,1,0,0|2,0,0]=4 7374 B12R1.315 COCC(=O)NCCC1COC1 adc4827570e8e58088804a16ad3dee4a [0,1,0,1,0,0|2,0,0]=4 7375 B12R1.315 COCC(=O)NCC[C@@H]1CCO1 2f0af415d66cc4f5fb5977daedc375ed [0,1,0,1,0,0|2,0,0]=4 7376 B12R1.315 CSCC(=O)NCCC1CCC1 9e367dbdb259541050c75d6e2f8b9425 [0,1,0,1,0,0|2,0,0]=4 7377 B12R1.315 CSCC(=O)NCCC1CCO1 dec4c0a5b087f9855cac80070d31c0ee [0,1,0,1,0,0|2,0,0]=4 7378 B12R1.315 CSCC(=O)NCCC1COC1 796ade0619e5ddeca1e1e7c1f40cf7c4 [0,1,0,1,0,0|2,0,0]=4 7379 B12R1.315 CSCC(=O)NCC[C@@H]1CCO1 f1a4face902ceacb6ea9b0e8beef197b [0,1,0,1,0,0|2,0,0]=4 7380 B12R1.315 O=C(CCF)NCCC1CCC1 0a6f201b5c5ddda8e2ceb9326552b7dd [0,1,0,1,0,0|2,0,0]=4 7381 B12R1.315 O=C(CCF)NCCC1CCO1 559eb76e8002c4ecd0d9ffc72e34ea82 [0,1,0,1,0,0|2,0,0]=4 7382 B12R1.315 O=C(CCF)NCCC1COC1 3b82600ccfc6344b64d56595c1f7c5f6 [0,1,0,1,0,0|2,0,0]=4 7383 B12R1.315 O=C(CCF)NCC[C@@H]1CCO1 c3566bc492780c5c6cab71c72631f553 [0,1,0,1,0,0|2,0,0]=4 7384 B12R1.315 O=C(CCO)NCCC1CCC1 b6410d39f6d188b65b9e4a306ad2de50 [0,1,0,1,0,0|2,0,0]=4 7385 B12R1.315 O=C(CCO)NCCC1CCO1 e68994d8830aac9c9f558fc8b6cfee19 [0,1,0,1,0,0|2,0,0]=4 7386 B12R1.315 O=C(CCO)NCCC1COC1 7b381786b03f864697103b1a84b6a4f8 [0,1,0,1,0,0|2,0,0]=4 7387 B12R1.315 O=C(CCO)NCC[C@@H]1CCO1 44b44a79d8c5ac797c349d081a1c5d63 [0,1,0,1,0,0|2,0,0]=4 7388 B12R1.315 O=C(CCS)NCCC1CCC1 c22876a92837bef78ca3ac8781a9295b [0,1,0,1,0,0|2,0,0]=4 7389 B12R1.315 O=C(CCS)NCCC1CCO1 aa15755e17a745c9586cce9d594e90fb [0,1,0,1,0,0|2,0,0]=4 7390 B12R1.315 O=C(CCS)NCCC1COC1 53e728d5e20a5ea4fc5f406c5e8312b9 [0,1,0,1,0,0|2,0,0]=4 7391 B12R1.315 O=C(CCS)NCC[C@@H]1CCO1 b73793bbda06cc34dcd4698f17e05be2 [0,1,0,1,0,0|2,0,0]=4 7392 B12R1.353 CC(CF)OCN1CCCC1=O f9c610ebeda43b5651fc4943843bf805 [0,1,0,1,0,0|2,0,0]=4 7393 B12R1.353 CC(CO)CNC1CCCC1=O 6575949831914e5d20ed9a160902e6d5 [0,1,0,1,0,0|2,0,0]=4 7394 B12R1.353 CC(CO)NCN1CCCC1=O 375bced9a9a688420a63269e0c74b943 [0,1,0,1,0,0|2,0,0]=4 7395 B12R1.353 CCC(C)CNC1CCCC1=O 847ccccd669cc16036aa3683becb570f [0,1,0,1,0,0|2,0,0]=4 7396 B12R1.353 CCC(C)COC1CCCC1=O 0a0d0b2981db4721fb14b3b8892c5d8e [0,1,0,1,0,0|2,0,0]=4 7397 B12R1.353 CCC(C)NCN1CCCC1=O 9bb676a46ab356310e01e339d7e36084 [0,1,0,1,0,0|2,0,0]=4 7398 B12R1.353 CCC(C)OCC1CCCC1=O 37454923ba302bffb23791918d6b0833 [0,1,0,1,0,0|2,0,0]=4 7399 B12R1.353 CCC(C)OCN1CCCC1=O 00f316f66af474635943cac5930d3bcd [0,1,0,1,0,0|2,0,0]=4 7400 B12R1.353 CCN(C)CCN1CCCC1=O 7f542a9e61dfc3a75a749ea9f0f16193 [0,1,0,1,0,0|2,0,0]=4 7401 B12R1.353 CC[C@@H](C)COC1CCCC1=O 371e7aab76d875c526fba0ee4936de0f [0,1,0,1,0,0|2,0,0]=4 7402 B12R1.353 CC[C@@H](C)NCN1CCCC1=O 7298e4f3ebe203d6afec777ff18de6b6 [0,1,0,1,0,0|2,0,0]=4 7403 B12R1.353 CC[C@@H](C)OCN1CCCC1=O 58406c1f101b979ef699b05460cdb416 [0,1,0,1,0,0|2,0,0]=4 7404 B12R1.353 CC[C@H](C)CNC1CCCC1=O 7d51878d1f3e8043b49e1de06d847120 [0,1,0,1,0,0|2,0,0]=4 7405 B12R1.353 CC[C@H](C)COC1CCCC1=O 80aa56aa5f0675be923955aeb6d67edb [0,1,0,1,0,0|2,0,0]=4 7406 B12R1.353 CC[C@H](C)NCN1CCCC1=O afafbb399bd1a61e5e2783c007998290 [0,1,0,1,0,0|2,0,0]=4 7407 B12R1.353 CC[C@H](C)OCN1CCCC1=O d4798c61bdbfab392f872d8a2e0c9f11 [0,1,0,1,0,0|2,0,0]=4 7408 B12R1.353 COC(C)COC1CCCC1=O 97f2b771e957e357d87ee053c4191612 [0,1,0,1,0,0|2,0,0]=4 7409 B12R1.353 CO[C@@H](C)COC1CCCC1=O a596997992f8df826a396ede2c63cb84 [0,1,0,1,0,0|2,0,0]=4 7410 B12R1.353 CO[C@H](C)COC1CCCC1=O d96c7f77464e6320317fde69faa60650 [0,1,0,1,0,0|2,0,0]=4 7411 B12R1.353 C[C@@H](CO)NCN1CCCC1=O 8da823b0ec2761f47b2d48a91759643b [0,1,0,1,0,0|2,0,0]=4 7412 B12R1.353 C[C@H](CO)CNC1CCCC1=O 317159a9ece9b333d911c0e0c1c75a75 [0,1,0,1,0,0|2,0,0]=4 7413 B12R1.353 C[C@H](CO)NCN1CCCC1=O f7ce91c97ac45bbd690f3a724f2412cc [0,1,0,1,0,0|2,0,0]=4 7414 B12R1.394 CCC(C)CCOC1CC(C1)C ef3122f8368f0451f38c4b39fe3cda0c [0,1,0,1,0,0|1,0,1]=4 7415 B12R1.477 CCC(C)CCOC1CCCC1 b18e04e977403b76a199b7912a4082c3 [0,1,0,1,0,0|1,0,1]=4 7416 B12R1.477 CCC(C)CCOC1CCCO1 b05c375f9443d4f928bb805d6b55c59b [0,1,0,1,0,0|0,0,2]=4 7417 B12R1.477 CC[C@H](C)CCOC1CCCC1 9d9271cca5f239fe2504ac11df1970ca [0,1,0,1,0,0|1,0,1]=4 7418 B12R1.477 COC(C)CCOC1CCCC1 5e9d773e775bbcbd4b2dff29bc96ddc7 [0,1,0,1,0,0|1,0,1]=4 7419 B12R1.532 C=CC(C)OC1OC(=O)CC1C 06c2afdbc864c58eaa2a372407563fbf [0,1,0,1,0,0|1,0,1]=4 7420 B12R1.532 CC(C=O)OC1OC(=O)CC1C cd9102b4fd92ab9ec24ef89727f5a2bd [0,1,0,1,0,0|1,0,1]=4 7421 B12R1.532 CC1CC(=O)OC1O[C@H](C)C=O 6ccfea5c3d8d2613b98ec679d926c6bf [0,1,0,1,0,0|1,0,1]=4 7422 B12R1.532 CCC(C)OC1OC(=O)CC1C a7e2b0146e570b72f805469cb98414e9 [0,1,0,1,0,0|1,0,0]=3 7423 B12R1.1527 CCCC(=O)CNCC1(CC1)F c62d4d4827a8220c3a97bf658bbe1e62 [0,1,0,1,0,0|2,0,0]=4 7424 B12R1.1527 CCCC(=O)CNCC1(CC1)O 3a09ac0c1203813192c56aeb857205fe [0,1,0,1,0,0|2,0,0]=4 7425 B12R1.1527 CCCC(=O)COCC1(CC1)Br 595bccdd3187eb557d167db50db8a49e [0,1,0,1,0,0|2,0,0]=4 7426 B12R1.1527 CCCC(=O)COCC1(CC1)C 00b1c18049b7e4814fde4355cfe00db2 [0,1,0,1,0,0|2,0,0]=4 7427 B12R1.1527 CCCC(=O)COCC1(CC1)Cl c46b0dc37a76ba8569e5aca8d1539eba [0,1,0,1,0,0|2,0,0]=4 7428 B12R1.1527 CCCC(=O)COCC1(CC1)F 8003a5a8fd82b132ac913eec425b1b14 [0,1,0,1,0,0|2,0,0]=4 7429 B12R1.1527 CCCC(=O)NCCC1(CC1)O eabf22e0d3d70fd2db039db369bd1fd6 [0,1,0,1,0,0|1,0,0]=3 7430 B12R1.1527 CCCC(=O)OCNC1(CC1)C ef2852b775a0e46a78e3b6a63cb019a9 [0,1,0,1,0,0|1,0,0]=3 7431 B12R1.1527 CCOC(=O)OCNC1(CC1)C 03cc449ca4431b1401703d0143083939 [0,1,0,1,0,0|2,0,0]=4 7432 B12R1.1527 CCSC(=O)OCNC1(CC1)C d3068deb7b99f82098f32fd54c1b8b9f [0,1,0,1,0,0|2,0,0]=4 7433 B12R1.1527 COCC(=O)NCCC1(CC1)O aa43a1d743b029137cb243dc5626949f [0,1,0,1,0,0|2,0,0]=4 7434 B12R1.1527 CSCC(=O)NCCC1(CC1)O b345e3a86083f91770fc3e6b3438820e [0,1,0,1,0,0|2,0,0]=4 7435 B12R1.1527 O=C(CCF)NCCC1(CC1)O 2ecefb63c5288ad6113a13e0df124557 [0,1,0,1,0,0|2,0,0]=4 7436 B12R1.1527 O=C(CCO)NCCC1(CC1)O d8456053737d11104dbc3e0b28086859 [0,1,0,1,0,0|2,0,0]=4 7437 B12R1.1527 O=C(CCS)NCCC1(CC1)O 72b23660b15ac4652c737906ef6742fd [0,1,0,1,0,0|2,0,0]=4 7438 B12R1.1579 CCCC(=O)N1CCC(C1C)O 5e2ac15204006b04d3f39438b31542c1 [0,1,0,1,0,0|2,0,0]=4 7439 B12R1.1579 CCCC(=O)N1CC[C@@H]([C@@H]1C)O 3996ac3906ecd6f08b3c5c1ed57215bf [0,1,0,1,0,0|2,0,0]=4 7440 B12R1.1579 CCCC(=O)N1CC[C@H]([C@H]1C)O 6c0567ead425ddb5cfe7adb2860534ef [0,1,0,1,0,0|2,0,0]=4 7441 B12R1.1621 CCCC(=O)CN1CC(C1)CC 810a42d2cb1e7d930a8bd0231bd685ec [0,1,0,1,0,0|2,0,0]=4 7442 B12R1.1621 CCCC(=O)CN1CC(C1)CF de965d3424af429b094a8b162c17c49b [0,1,0,1,0,0|2,0,0]=4 7443 B12R1.1621 CCCC(=O)CN1CC(C1)CO 266c7509c0b17fac1a2988c314f9724a [0,1,0,1,0,0|2,0,0]=4 7444 B12R1.1621 CCCC(=O)CN1CC(C1)OC 877b2186c562e9c57a0524cfa8a60793 [0,1,0,1,0,0|2,0,0]=4 7445 B12R1.1621 CCCC(=O)CN1CC(C1)SC 4db1dfb136afea8d1ed5018ee45fe030 [0,1,0,1,0,0|2,0,0]=4 7446 B12R1.1621 CCCC(=O)NC1CC(C1)CO 7f993c29dbe2d66fd0fb92e66febb1e8 [0,1,0,1,0,0|1,0,0]=3 7447 B12R1.1621 CCCC(=O)NC1CC(C1)OC 941f22246c10baf1c8f95e398a7584ac [0,1,0,1,0,0|1,0,0]=3 7448 B12R1.1621 CCCC(=O)NC1CN(C1)CC 74e3d936608b9061ebccc7bfe4a74b9c [0,1,0,1,0,0|2,0,0]=4 7449 B12R1.1621 CCCC(=O)N[C@H]1C[C@@H](C1)CO 1ca23ccacd6a9f6b7ccc5b1cbef1e87b [0,1,0,1,0,0|1,0,0]=3 7450 B12R1.1621 CCCC(=O)N[C@H]1C[C@@H](C1)OC fa238680ea734ae313a4c102d6f7521f [0,1,0,1,0,0|1,0,0]=3 7451 B12R1.1621 CCCC(=O)N[C@H]1C[C@H](C1)CO ad37d566bc007af8453b05a1f683c65c [0,1,0,1,0,0|1,0,0]=3 7452 B12R1.1621 CCCC(=O)N[C@H]1C[C@H](C1)OC 0fa46a05a0241374cb75f8a716cfc08b [0,1,0,1,0,0|1,0,0]=3 7453 B12R1.1621 CCCC(=S)OC1CC(C1)C#N e64b414aed362822f4e177fad1e13e02 [0,1,0,1,0,0|0,1,1]=4 7454 B12R1.1621 CCCC(=S)OC1CC(C1)OC eb1054c94c6d3bab7486109a1ee108ea [0,1,0,1,0,0|0,1,0]=3 7455 B12R1.1621 CCCC(=S)O[C@H]1C[C@@H](C1)OC 1d13819486b8874e413771c220a6785e [0,1,0,1,0,0|0,1,0]=3 7456 B12R1.1621 CCCC(C)OC1CC(C1)OC 3b869c5bce5428cf35dc412a4bc33432 [0,1,0,1,0,0|1,0,1]=4 7457 B12R1.1621 CCCC(C)O[C@H]1C[C@@H](C1)OC 43ec6a4eb57f91d41f1303b1bf647641 [0,1,0,1,0,0|1,0,1]=4 7458 B12R1.1621 CCCC(C)O[C@H]1C[C@H](C1)CF 0fd4f8d8237a623e319b8daad9218841 [0,1,0,1,0,0|1,0,1]=4 7459 B12R1.1621 CCCC(C)O[C@H]1C[C@H](C1)OC f42d06e6f02b6762dbefacaf3642d691 [0,1,0,1,0,0|1,0,1]=4 7460 B12R1.1621 CCC[C@@H](C)OC1CC(C1)OC cf3055d1442c1b2ccd3826e15bcf9621 [0,1,0,1,0,0|1,0,1]=4 7461 B12R1.1621 CCC[C@@H](C)O[C@H]1C[C@@H](C1)OC d9a73505c71d8d7d656fe9d111a55303 [0,1,0,1,0,0|1,0,1]=4 7462 B12R1.1621 CCC[C@H](C)OC1CC(C1)OC d9f70dc4da6215b47e460e7162392167 [0,1,0,1,0,0|1,0,1]=4 7463 B12R1.1621 CCC[C@H](C)O[C@H]1C[C@@H](C1)OC 9e48392055400002a682317a0a34d57b [0,1,0,1,0,0|1,0,1]=4 7464 B12R1.1621 COC1CC(C1)NC(=O)CCF 61db5a5817af8739831a312ff8136891 [0,1,0,1,0,0|2,0,0]=4 7465 B12R1.1621 COC1CC(C1)NC(=O)CCO b77cd62f6010a0ad07363d4c843f860d [0,1,0,1,0,0|2,0,0]=4 7466 B12R1.1621 COC1CC(C1)NC(=O)CCS 79283d95ca490b465ac89c21ada04140 [0,1,0,1,0,0|2,0,0]=4 7467 B12R1.1621 COC1CC(C1)NC(=O)CSC 0f77c76ec9cd984b809649360ad1765c [0,1,0,1,0,0|2,0,0]=4 7468 B12R1.1621 COCC(=O)NC1CC(C1)CO 3daa87cc4d2c019e24245b0f57cfb5c8 [0,1,0,1,0,0|2,0,0]=4 7469 B12R1.1621 COCC(=O)NC1CC(C1)OC 0934ae96cf1e1ff641b55c96f923272b [0,1,0,1,0,0|2,0,0]=4 7470 B12R1.1621 COCC(=O)N[C@H]1C[C@@H](C1)CO 85025c9301fcc45221df928993e42aa3 [0,1,0,1,0,0|2,0,0]=4 7471 B12R1.1621 COCC(=O)N[C@H]1C[C@@H](C1)OC 1ae6c11f915f65372f6bb737d853d524 [0,1,0,1,0,0|2,0,0]=4 7472 B12R1.1621 COCC(=O)N[C@H]1C[C@H](C1)CO 73b1d6b3e335f0246c3a3681911733c6 [0,1,0,1,0,0|2,0,0]=4 7473 B12R1.1621 COCC(=O)N[C@H]1C[C@H](C1)OC d1317e43166b95414082d613fabd1e30 [0,1,0,1,0,0|2,0,0]=4 7474 B12R1.1621 CO[C@H]1C[C@@H](C1)NC(=O)CCF 5bd3cb1ff97873db6c7df34a80b18594 [0,1,0,1,0,0|2,0,0]=4 7475 B12R1.1621 CO[C@H]1C[C@@H](C1)NC(=O)CCO 4173b5799cc12219e2849077ff879a4f [0,1,0,1,0,0|2,0,0]=4 7476 B12R1.1621 CO[C@H]1C[C@@H](C1)NC(=O)CCS 3e3daeb58bde4f4bbc0d28d863c5f869 [0,1,0,1,0,0|2,0,0]=4 7477 B12R1.1621 CO[C@H]1C[C@@H](C1)NC(=O)CSC b65fc8f87377a1880663b2030b616126 [0,1,0,1,0,0|2,0,0]=4 7478 B12R1.1621 CO[C@H]1C[C@H](C1)NC(=O)CCF c5b4477a8aeff34e73bdce4b7c304d23 [0,1,0,1,0,0|2,0,0]=4 7479 B12R1.1621 CO[C@H]1C[C@H](C1)NC(=O)CCO abf86e0a03b59f80530d44175f0e5d3f [0,1,0,1,0,0|2,0,0]=4 7480 B12R1.1621 CO[C@H]1C[C@H](C1)NC(=O)CCS 60a07505ce0362f5b58fc5ce973d60aa [0,1,0,1,0,0|2,0,0]=4 7481 B12R1.1621 CO[C@H]1C[C@H](C1)NC(=O)CSC 7c3946d153c7461be80b52092d3bc78f [0,1,0,1,0,0|2,0,0]=4 7482 B12R1.1621 CSCC(=O)NC1CC(C1)CO d432f5c8a5bb11a76623679891d0ab74 [0,1,0,1,0,0|2,0,0]=4 7483 B12R1.1621 CSCC(=O)N[C@H]1C[C@@H](C1)CO a87bc4aabf66a4fd913ccebc28915515 [0,1,0,1,0,0|2,0,0]=4 7484 B12R1.1621 CSCC(=O)N[C@H]1C[C@H](C1)CO 6155e3bc10427468ffdccf7f8ded8d33 [0,1,0,1,0,0|2,0,0]=4 7485 B12R1.1621 O=C(CCF)NC1CC(C1)CO c599accd507e88c51dbb1d578062f96a [0,1,0,1,0,0|2,0,0]=4 7486 B12R1.1621 O=C(CCF)N[C@H]1C[C@@H](C1)CO f231eb668aca387027e93235f5fe6282 [0,1,0,1,0,0|2,0,0]=4 7487 B12R1.1621 O=C(CCF)N[C@H]1C[C@H](C1)CO 8ea6139fe6175eaebe2fcd20b28593e6 [0,1,0,1,0,0|2,0,0]=4 7488 B12R1.1621 O=C(CCO)NC1CC(C1)CO cfc02a64a6779ee62544fd8518f6e9df [0,1,0,1,0,0|2,0,0]=4 7489 B12R1.1621 O=C(CCO)N[C@H]1C[C@@H](C1)CO 5cd0d9c416fcccd1293bb78a3b217e52 [0,1,0,1,0,0|2,0,0]=4 7490 B12R1.1621 O=C(CCO)N[C@H]1C[C@H](C1)CO 0e393f8cc68a78ba25327e2899762bbc [0,1,0,1,0,0|2,0,0]=4 7491 B12R1.1621 O=C(CCS)NC1CC(C1)CO 32988baf3b2b510aaf7f395103a463b7 [0,1,0,1,0,0|2,0,0]=4 7492 B12R1.1621 O=C(CCS)N[C@H]1C[C@@H](C1)CO f341675c7b359ec69ddf990860adeba2 [0,1,0,1,0,0|2,0,0]=4 7493 B12R1.1621 O=C(CCS)N[C@H]1C[C@H](C1)CO ecf885e75ad0b03f15d0876cb241aefe [0,1,0,1,0,0|2,0,0]=4 7494 B12R1.1689 C#CC(C)NCOC(=O)C1CC1 a81c8783155e8bc30ab996610205ce0f [0,1,0,1,0,0|1,0,1]=4 7495 B12R1.1689 C#CC(C)OCOC(=O)C1CC1 4cafe3f17d9646352ac7a5bf70cd4455 [0,1,0,1,0,0|1,0,1]=4 7496 B12R1.1689 C#C[C@@H](C)NCOC(=O)C1CC1 dc12e1b10ab37a3d48dd79c166208104 [0,1,0,1,0,0|1,0,1]=4 7497 B12R1.1689 C#C[C@@H](C)OCOC(=O)C1CC1 48beafd8d6e2fbdd9a1dd849d94fb842 [0,1,0,1,0,0|1,0,1]=4 7498 B12R1.1689 C#C[C@H](C)NCOC(=O)C1CC1 5596bf7912a2496d85de7c04c9fa74f0 [0,1,0,1,0,0|1,0,1]=4 7499 B12R1.1689 C#C[C@H](C)OCOC(=O)C1CC1 bda54ff154c18ade8baf5c4a4c5f5aba [0,1,0,1,0,0|1,0,1]=4 7500 B12R1.1689 C=CC(C)NCOC(=O)C1CC1 a3eb1810f5a5085dfb738faa8735198e [0,1,0,1,0,0|1,0,1]=4 7501 B12R1.1689 C=CC(C)OCOC(=O)C1CC1 1a4505d10696cb283e9bab9b27eb0426 [0,1,0,1,0,0|1,0,1]=4 7502 B12R1.1689 C=C[C@H](C)OCOC(=O)C1CC1 98dd2f6aad0a0e644bb2eb62f09df6e0 [0,1,0,1,0,0|1,0,1]=4 7503 B12R1.1689 CC(C#N)NCOC(=O)C1CC1 d0a15aa15b4bba76808e566a61f58107 [0,1,0,1,0,0|1,0,1]=4 7504 B12R1.1689 CC(C=O)OCOC(=O)C1CC1 3d9ef11b7408d93dbdde20ecc8b39649 [0,1,0,1,0,0|1,0,1]=4 7505 B12R1.1689 CC(CO)CNCC(=O)C1CC1 fcfba4b29220e98ff979aba2c3df3204 [0,1,0,1,0,0|2,0,0]=4 7506 B12R1.1689 CC(CO)NCOC(=O)C1CC1 94793032b88830cae3d1922c8710d602 [0,1,0,1,0,0|1,0,0]=3 7507 B12R1.1689 CCC(C)CCOC(C)C1CC1 593fa48717a3735f2a073996199d9ef4 [0,1,0,1,0,0|1,0,1]=4 7508 B12R1.1689 CCC(C)CCO[C@@H](C)C1CC1 db1fd2b975b42eec17f45274b3c020c4 [0,1,0,1,0,0|1,0,1]=4 7509 B12R1.1689 CCC(C)CCO[C@H](C)C1CC1 e5e050495e69f7f99b935dd458ca9115 [0,1,0,1,0,0|1,0,1]=4 7510 B12R1.1689 CCC(C)CNCC(=O)C1CC1 7b921c7dec0a4a3000b08739356b6187 [0,1,0,1,0,0|2,0,0]=4 7511 B12R1.1689 CCC(C)COCC(=O)C1CC1 1ca2286e84e8ceb09a635c856b50ad90 [0,1,0,1,0,0|2,0,0]=4 7512 B12R1.1689 CC[C@@H](C)COCC(=O)C1CC1 644922c5261e2502ea1ccddb4c03f274 [0,1,0,1,0,0|2,0,0]=4 7513 B12R1.1689 CC[C@H](C)CCOC(C)C1CC1 c12e88013d1daa535c1b85078393276d [0,1,0,1,0,0|1,0,1]=4 7514 B12R1.1689 CC[C@H](C)CNCC(=O)C1CC1 5fa8eda1c3b0e6f7d6b533fc89df5269 [0,1,0,1,0,0|2,0,0]=4 7515 B12R1.1689 CC[C@H](C)COCC(=O)C1CC1 9adfc63d8ff92d9dbf65805952cfe3ef [0,1,0,1,0,0|2,0,0]=4 7516 B12R1.1689 COC(C)CCOC(C)C1CC1 5ff8caa3c6d9a97b0c0c018c4600983e [0,1,0,1,0,0|1,0,1]=4 7517 B12R1.1689 COC(C)COCC(=O)C1CC1 f007e1719be9d04b1aa4aaa44c41b557 [0,1,0,1,0,0|2,0,0]=4 7518 B12R1.1689 CO[C@@H](C)CNCC(=O)C1CC1 0c9b70213e843f13e9e08e31aae5e174 [0,1,0,1,0,0|2,0,0]=4 7519 B12R1.1689 CO[C@@H](C)COCC(=O)C1CC1 0a7d8cdfe482cc139a0d5790a7e0fee8 [0,1,0,1,0,0|2,0,0]=4 7520 B12R1.1689 CO[C@H](C)CNCC(=O)C1CC1 cd179e6be19ff0eb2b3976f0967001e3 [0,1,0,1,0,0|2,0,0]=4 7521 B12R1.1689 CO[C@H](C)COCC(=O)C1CC1 16451dedd4472949f78f887f793565eb [0,1,0,1,0,0|2,0,0]=4 7522 B12R1.1689 C[C@@H](CO)NCOC(=O)C1CC1 da2465c058b229af6f286f1e8560d9ce [0,1,0,1,0,0|1,0,0]=3 7523 B12R1.1689 C[C@H](CO)CNCC(=O)C1CC1 847931172d055b3928dd62085dc86546 [0,1,0,1,0,0|2,0,0]=4 7524 B12R1.1689 C[C@H](CO)NCOC(=O)C1CC1 558976cb4133f88a82b99fd1ed632443 [0,1,0,1,0,0|1,0,0]=3 7525 B12R1.119 CC(C)(C)CN1CCCC(=O)C1 74461e3f966e8163122388ae16fef486 [0,1,0,1,0,0|2,0,0]=4 7526 B12R1.119 CC(C)(F)CN1CCCC(=O)C1 f04c83f71c1e621329b35566265c2047 [0,1,0,1,0,0|2,0,0]=4 7527 B12R1.119 CC(C)(O)CN1CCCC(=O)C1 637e6c8cafbe051a62a937e0c21dea47 [0,1,0,1,0,0|2,0,0]=4 7528 B12R1.129 CC(C)(C)CNC1CCCC1=O 8186492b0a17b1351342616f61173876 [0,1,0,1,0,0|2,0,0]=4 7529 B12R1.129 CC(C)(C)COC1CCCC1=O acbb7394c091a49fa93b32f0b61ce4ce [0,1,0,1,0,0|2,0,0]=4 7530 B12R1.129 CC(C)(C)NCN1CCCC1=O 222353f74a5270ee1f2f253cb796093a [0,1,0,1,0,0|2,0,0]=4 7531 B12R1.129 CC(C)(F)COC1CCCC1=O c2a7e80fbbcb222bce21a7d9cac1fd68 [0,1,0,1,0,0|2,0,0]=4 7532 B12R1.129 CC(C)(O)CNC1CCCC1=O dfb394e2eb4bca42222045dca1ef4e39 [0,1,0,1,0,0|2,0,0]=4 7533 B12R1.129 CC(C)(O)COC1CCCC1=O 18152928efcd6879c60758cf8b5ea0fa [0,1,0,1,0,0|2,0,0]=4 7534 B12R1.219 CC1CC(C1)OCCC(C)(C)C 01626d9e9669c5b6445d79f6b5633edd [0,1,0,1,0,0|1,0,1]=4 7535 B12R1.219 CC1CC(C1)OCCC(C)(C)O 4ceab8dfe9575cc44c15a466736709f2 [0,1,0,1,0,0|1,0,1]=4 7536 B12R1.890 CC(C)(C)CCOC1CCCC1 a8f74aaa5565909985875568c401708a [0,1,0,1,0,0|1,0,1]=4 7537 B12R1.890 CC(C)(C)CCOC1CCCO1 3b45f22590b635de231796e74c4d9123 [0,1,0,1,0,0|0,0,2]=4 7538 B12R1.890 CC(C)(O)CCOC1CCCC1 e9f73ea139f2168c87f8a8392f4358af [0,1,0,1,0,0|1,0,1]=4 7539 B12R1.890 CC(C)(O)CCOC1CCCO1 c16287e96ae59ba129d074a46bd8eaf3 [0,1,0,1,0,0|0,0,2]=4 7540 B12R1.890 CC(C)(S)CCOC1CCCC1 221cb630812975cd7a45c6744c6e4161 [0,1,0,1,0,0|1,0,1]=4 7541 B12R1.3183 CC(C)(Br)COCC(=O)C1CC1 4a18763ac7f93324d3c1ede0c8be168e [0,1,0,1,0,0|2,0,0]=4 7542 B12R1.3183 CC(C)(C)CNCC(=O)C1CC1 2bb3f3d4918bf0851a0cab432747d0c4 [0,1,0,1,0,0|2,0,0]=4 7543 B12R1.3183 CC(C)(C)COCC(=O)C1CC1 d105af2021947b31a92a7df8ad5833c8 [0,1,0,1,0,0|2,0,0]=4 7544 B12R1.3183 CC(C)(C)NCOC(=O)C1CC1 d806bc120f47f9219ee8a408a2804ad7 [0,1,0,1,0,0|1,0,0]=3 7545 B12R1.3183 CC(C)(F)COCC(=O)C1CC1 803f596f8cb9d2f3903a8c615eee36d0 [0,1,0,1,0,0|2,0,0]=4 7546 B12R1.3183 CC(C)(O)CNCC(=O)C1CC1 b71f6f7ad8cce953b5667396336b468e [0,1,0,1,0,0|2,0,0]=4 7547 B12R1.3183 CC(C)(O)COCC(=O)C1CC1 fcb6d877ad5a5e0996adcfedbb281aa4 [0,1,0,1,0,0|2,0,0]=4 7548 B12R1.3183 CC(C)(S)COCC(=O)C1CC1 bff3ce8046a194c8b4a3e3b0ad256c76 [0,1,0,1,0,0|2,0,0]=4 7549 B12R1.3183 CC(OCCC(C)(C)C)C1CC1 84e15f00abb184021c30b834f3735a9d [0,1,0,1,0,0|1,0,1]=4 7550 B12R1.3183 CC(OCCC(C)(C)O)C1CC1 8d56780277c14e12f799593ee939c078 [0,1,0,1,0,0|1,0,1]=4 7551 B12R1.3183 CC(OCCC(C)(C)S)C1CC1 05a589c1c5e6be69b0a8dad5123cd5b7 [0,1,0,1,0,0|1,0,1]=4 7552 B12R1.3183 C[C@@H](OCCC(C)(C)C)C1CC1 61bb24f8ffe3280935ec0abc48d4ad0e [0,1,0,1,0,0|1,0,1]=4 7553 B12R1.3183 C[C@@H](OCCC(C)(C)O)C1CC1 27546062b70983ff4bc70ad4585f62e8 [0,1,0,1,0,0|1,0,1]=4 7554 B12R1.3183 C[C@H](OCCC(C)(C)C)C1CC1 b30d1ea938699803c139e23540488404 [0,1,0,1,0,0|1,0,1]=4 7555 B12R1.3183 C[C@H](OCCC(C)(C)O)C1CC1 b5aa1879fa04192d2315989c4e022b87 [0,1,0,1,0,0|1,0,1]=4 7556 B12R2.1472 CCCC(=O)N1CC2CC1C2 c4601d8248479f7dc787877850db8ff6 [0,0,0,2,0,0|1,0,0]=3 7557 B12R2.1472 COCC(=O)N1CC2CC1C2 4aed7f12a5759b0c108a3b1aa179c7fe [0,0,0,2,0,0|2,0,0]=4 7558 B12R2.1472 CSCC(=O)N1CC2CC1C2 765a0391365633b4586cd9e911262506 [0,0,0,2,0,0|2,0,0]=4 7559 B12R2.1472 O=C(CCF)N1CC2CC1C2 3eb40801a63960b7ebf11a624309f081 [0,0,0,2,0,0|2,0,0]=4 7560 B12R2.1472 O=C(CCO)N1CC2CC1C2 9755c6f69dc47e704501f13dda0afcaa [0,0,0,2,0,0|2,0,0]=4 7561 B12R2.1472 O=C(CCS)N1CC2CC1C2 b9376dab09a221ab707e09afcca51415 [0,0,0,2,0,0|2,0,0]=4 7562 B12R2.1485 CCCC(=O)N1CCC2C1C2 73cda9ec66ab6c8606494ecd8b72fb71 [0,0,0,2,0,0|1,0,0]=3 7563 B12R2.1485 COCC(=O)N1CCC2C1C2 c39bbf31723fe7615a6950b1f9fe582a [0,0,0,2,0,0|2,0,0]=4 7564 B12R2.1485 CSCC(=O)N1CCC2C1C2 75445086ae06917f91067df08221e3da [0,0,0,2,0,0|2,0,0]=4 7565 B12R2.1485 O=C(CCF)N1CCC2C1C2 8f4d2007b800c18ddca3ee7114585547 [0,0,0,2,0,0|2,0,0]=4 7566 B12R2.1485 O=C(CCO)N1CCC2C1C2 f87e1e6cc103ad1e387b63fa1a0a7260 [0,0,0,2,0,0|2,0,0]=4 7567 B12R2.1485 O=C(CCS)N1CCC2C1C2 ab3c4725a932b5d66436ff01fce22717 [0,0,0,2,0,0|2,0,0]=4 7568 B12R2.1488 CCCC(=O)N1CC2CC2C1 797669f3a0f6e3ec6174f20aeaf47191 [0,0,0,2,0,0|1,0,0]=3 7569 B12R2.1488 COCC(=O)N1CC2CC2C1 1a158de524b834e503c9079525a1882e [0,0,0,2,0,0|2,0,0]=4 7570 B12R2.1488 CSCC(=O)N1CC2CC2C1 0c2e140ce2c1af34662878647d3bc2e6 [0,0,0,2,0,0|2,0,0]=4 7571 B12R2.1488 O=C(CCF)N1CC2CC2C1 b0e5ffccad3e8caac12877add65356b6 [0,0,0,2,0,0|2,0,0]=4 7572 B12R2.1488 O=C(CCO)N1CC2CC2C1 f1a4403a15fc2f5373be997f6a37dd8c [0,0,0,2,0,0|2,0,0]=4 7573 B12R2.1488 O=C(CCS)N1CC2CC2C1 b66addaf6e061f211f12465041f13b71 [0,0,0,2,0,0|2,0,0]=4 7574 B12R2.211 CC1CC1NC2CCCC2=O b1718f56400c899a6bb903b7f48650eb [0,0,0,2,0,0|2,0,0]=4 7575 B12R2.439 CC1(CN1C2CCCC2=O)C 63541107fb04e078313b63b8cdc5eb7f [0,0,0,2,0,0|2,0,0]=4 7576 B12R2.466 O=C1CCCC1COC2CC2 26b53b3921d2fc61ed7231502e4e2b78 [0,0,0,2,0,0|2,0,0]=4 7577 B12R2.466 O=C1CCCC1NCC2CC2 af06d642c64f5a67e00da07a33cffe39 [0,0,0,2,0,0|2,0,0]=4 7578 B12R2.466 O=C1CCCC1OCC2CC2 4da69ee00cb161d0484b37b7dcf74339 [0,0,0,2,0,0|2,0,0]=4 7579 B12R2.466 O=C1CCCN1CNC2CC2 59f3e2a008634ba22d7db359596cc9fd [0,0,0,2,0,0|2,0,0]=4 7580 B12R2.466 O=C1CCCN1COC2CC2 8c5cdad291e074fab5adffd65abfb146 [0,0,0,2,0,0|2,0,0]=4 7581 B12R2.667 CC1CC(C1)OCCC2CC2 5f2e037a37d634b4452e3000a5cd2b35 [0,0,0,2,0,0|1,0,1]=4 7582 B12R2.1277 CC1CC(C1)OC2CC2(C)C 9c8bba762d16d26b20437624c974f082 [0,0,0,2,0,0|1,0,1]=4 7583 B12R2.1286 O=C1CCCN(C1)CC2CC2 b8f36898b01bbb0309f3949188953915 [0,0,0,2,0,0|2,0,0]=4 7584 B12R2.20 CC1CC1COC2CCCC2 f3ff212e59543dcc54074e11f9d7e0bf [0,0,0,2,0,0|1,0,1]=4 7585 B12R2.20 C[C@@H]1C[C@H]1COC2CCCC2 e001cae9aa4e40a32fbbe5e33657d396 [0,0,0,2,0,0|1,0,1]=4 7586 B12R2.20 C[C@H]1C[C@@H]1COC2CCCC2 af5cc183a0963d0c55fd2d2b10f627d7 [0,0,0,2,0,0|1,0,1]=4 7587 B12R2.20 C[C@H]1C[C@H]1COC2CCCC2 7346c8f3bb5985e5ee6f297c341c4a85 [0,0,0,2,0,0|1,0,1]=4 7588 B12R2.136 CC1CC(C1)OC2CCCC2 8aea66d4d39b7f2598aab1d744a58183 [0,0,0,2,0,0|1,0,1]=4 7589 B12R2.2383 C1CCC(C1)OCCC2CC2 ec61edd35bc53a38659fa4e0d7b2e4f4 [0,0,0,2,0,0|1,0,1]=4 7590 B12R2.2383 C1COC(C1)OCCC2CC2 82c69f73d05c7634fdf24da398d481c8 [0,0,0,2,0,0|0,0,2]=4 7591 B12R2.2401 CC1(CC1OC2CCCC2)C 0b7415e60b3ce6949f987dcc3924a30e [0,0,0,2,0,0|1,0,1]=4 7592 B12R2.2401 CC1(CC1OC2CCCO2)C 46f7593fbf6041863ff029abf1cbe876 [0,0,0,2,0,0|0,0,2]=4 7593 B12R2.665 CC1CC(C1)OC(C)C2CC2 df83a25fc0d4ffcf72992e1933139f1e [0,0,0,2,0,0|1,0,1]=4 7594 B12R2.419 CC(OC[C@@H]1C[C@@H]1C)C2CC2 c57a2f7fb5e2703e0f53f3d8ac770d60 [0,0,0,2,0,0|1,0,1]=4 7595 B12R2.419 CC(OC[C@@H]1C[C@H]1C)C2CC2 ad4d444c05f283cbd0cbd333502c01c5 [0,0,0,2,0,0|1,0,1]=4 7596 B12R2.419 CC(OC[C@H]1C[C@@H]1C)C2CC2 1b31a0b8fe610ae2024352fe62ce6d56 [0,0,0,2,0,0|1,0,1]=4 7597 B12R2.419 CC1CC1COC(C)C2CC2 2d1865363bb0dc3912dfe6ee372c84f0 [0,0,0,2,0,0|1,0,1]=4 7598 B12R2.419 CC1CC1NCC(=O)C2CC2 177de8185583c1b1cdf7a3c0c71833be [0,0,0,2,0,0|2,0,0]=4 7599 B12R2.4794 CC(OCCC1CC1)C2CC2 121a1977e3c3b6db47123ce72735279c [0,0,0,2,0,0|1,0,1]=4 7600 B12R2.4794 C[C@@H](OCCC1CC1)C2CC2 8890041a8f4511a41385c08bdf8b53ae [0,0,0,2,0,0|1,0,1]=4 7601 B12R2.4794 C[C@H](OCCC1CC1)C2CC2 ca1e99d0cd1bfff4b324af59f9b0230e [0,0,0,2,0,0|1,0,1]=4 7602 B12R2.4794 O=C(CNCC1CC1)C2CC2 b4097551357b3ca4affdf15a4acc97c5 [0,0,0,2,0,0|2,0,0]=4 7603 B12R2.4794 O=C(COCC1CC1)C2CC2 998865c74dfa563be143292d6a1387a8 [0,0,0,2,0,0|2,0,0]=4 7604 B12R2.4794 O=C(OCNC1CC1)C2CC2 3e017f124d097cc0174450a059e34fe4 [0,0,0,2,0,0|1,0,0]=3 7605 B12R2.4794 O=C(OCOC1CC1)C2CC2 ff28d81c0ef6d385341b1bb75e264ccd [0,0,0,2,0,0|1,0,0]=3 7606 B12R2.3278 CC(OC1CC1(C)C)C2CC2 feb0d40cfe531dd9d9f7938904f6fb86 [0,0,0,2,0,0|1,0,1]=4 7607 B12R2.3278 CC1(CN1CC(=O)C2CC2)C ecf0b66010a7f0e99ce1e19b0922d11c [0,0,0,2,0,0|2,0,0]=4 7608 B12R2.3278 C[C@@H](OC1CC1(C)C)C2CC2 6e4eb2d9c868e49ff2035c47495b4363 [0,0,0,2,0,0|1,0,1]=4 7609 B12R2.3278 C[C@H](OC1CC1(C)C)C2CC2 9c85a73db3ef2dca55e7da354e5c4533 [0,0,0,2,0,0|1,0,1]=4 7610 B8R0.9 C=C(CC)COC(C)C 158b3c8f8440057d90f95fd6ad44dfdf [1,0,0,0,1,0|2,0,0]=4 7611 B8R0.9 CC(C)CNC(=O)CF 9eb01591588fc3f21824d07c6994c4ce [1,0,0,0,1,0|2,0,0]=4 7612 B8R0.9 CC(C)CNC(=O)CO 748dd4a1556e9d036080c13c38338fdb [1,0,0,0,1,0|2,0,0]=4 7613 B8R0.9 CC(C)CNC(=O)CS 24a37322ef0bc9a4c645dfd16fd4ed0f [1,0,0,0,1,0|2,0,0]=4 7614 B8R0.9 CCC(=O)COC(C)C 5c8d297b0416149f24332452b8f0f1e3 [1,0,0,0,1,0|1,0,0]=3 7615 B8R0.9 CCC(=O)NCC(C)C 80d4e4c057e6f7b9eae8a2bfacaea014 [1,0,0,0,1,0|1,0,0]=3 7616 B8R0.9 CCC(=O)NCC(C)O a0cefa62fd20423cdc1bf66278a42129 [1,0,0,0,1,0|2,0,0]=4 7617 B8R0.9 CCC(=O)NC[C@@H](C)O a391cc3778995f10350211a29d249a09 [1,0,0,0,1,0|2,0,0]=4 7618 B8R0.9 CCC(=O)NC[C@H](C)O 700448fc71267e87914b635955ddeec8 [1,0,0,0,1,0|2,0,0]=4 7619 B8R0.9 CCC(C)OCC(C)C 94adce536ef43774d73b8b91df56b54a [1,0,0,0,1,0|1,0,1]=4 7620 B8R0.9 CCN(C)CCC(C)C cccf47d146781af2a5619f47aba63cf9 [1,0,0,0,1,0|2,0,0]=4 7621 B8R0.9 CC[C@@H](C)OCC(C)C 555334e47789bc366cc5b9b7c24f502e [1,0,0,0,1,0|1,0,1]=4 7622 B8R0.9 CC[C@H](C)OCC(C)C 5cf0f20f2e3b8b673a5127012ceee597 [1,0,0,0,1,0|1,0,1]=4 7623 B8R0.9 CNC(=O)CNC(C)C 566e2c52ea2eed119c48dda13ee7cd22 [1,0,0,0,1,0|2,0,0]=4 7624 B8R0.9 CNC(=O)COC(C)C ac98fb8d262335081328b24dd3b587d1 [1,0,0,0,1,0|2,0,0]=4 7625 B8R0.9 COC(=O)CNC(C)C c3733748a55be9c482138184ed5baa45 [1,0,0,0,1,0|2,0,0]=4 7626 B8R0.9 COC(=O)COC(C)C 532fce5a880346bf56d52549b85157a8 [1,0,0,0,1,0|2,0,0]=4 7627 B8R0.5 CCCC(=S)OC(C)C 79ff90d7e7d68c5664ea5acd6b8154a5 [0,0,0,0,2,0|0,1,0]=3 7628 B8R0.5 CCCC(C)OC(C)C af28c67907ad8e9b80a1443e1881a09f [0,0,0,0,2,0|1,0,1]=4 7629 B8R0.5 CCCN(C)CC(C)C 2b43726cfeef4d65e0d306fc15d81329 [0,0,0,0,2,0|2,0,0]=4 7630 B8R0.5 CCC[C@@H](C)OC(C)C 38af500727caf5ac56759d6ba34645ea [0,0,0,0,2,0|1,0,1]=4 7631 B8R0.5 CCC[C@H](C)OC(C)C 39fe789680e7206034f6b275f2ba377c [0,0,0,0,2,0|1,0,1]=4 7632 B12R0.277 C=C(C)CCCOCC(=O)CCC 15567e2063ef3c8dbad61b4f8844c85f [0,0,0,0,0,2|0,0,2]=4 7633 B12R0.277 C=C(C)CCNCOC(=O)CCC 718f135d0ef334333fd3d85719ddd1c0 [0,0,0,0,0,2|0,0,2]=4 7634 B12R0.277 C=C(C)CCOCOC(=O)CCC dc0907f83cbf3c0caf4cc1f7d4caf09e [0,0,0,0,0,2|0,0,2]=4 7635 B12R0.277 C=C(C)COCCOC(=O)CCC 58eca89829538ab29e3630ff0e963d23 [0,0,0,0,0,2|0,0,2]=4 7636 B12R0.277 CC(C)OCCCNC(=O)CCF 42b84f18bbb6ef8b89d9459a0f5371d2 [0,0,0,0,0,2|2,0,0]=4 7637 B12R0.277 CC(C)OCCCNC(=O)CCO c988fad3e900765b552697d4293b6170 [0,0,0,0,0,2|2,0,0]=4 7638 B12R0.277 CC(C)OCCCNC(=O)CCS 441c6fe6b5387b18b85b78e65e60b6cf [0,0,0,0,0,2|2,0,0]=4 7639 B12R0.277 CC(C)SCCCNC(=O)CCF 1be2f6432dc153fd16f2b10718f6d228 [0,0,0,0,0,2|2,0,0]=4 7640 B12R0.277 CC(C)SCCCNC(=O)CCO 273d0dd7673147aeaf3364b5159ff651 [0,0,0,0,0,2|2,0,0]=4 7641 B12R0.277 CC(C)SCCCNC(=O)CCS 8f71df9cfdbab70d6d0a66eae4bedfe5 [0,0,0,0,0,2|2,0,0]=4 7642 B12R0.277 CCCC(=O)CNCCCC(C)C 0cdf7a83896c98113f3d6ee9b4f8b347 [0,0,0,0,0,2|1,0,0]=3 7643 B12R0.277 CCCC(=O)CNCCCN(C)C d113a0693f7e2b10977ecaea43172d50 [0,0,0,0,0,2|2,0,0]=4 7644 B12R0.277 CCCC(=O)CNCCOC(C)C 8450825829bb687d6cf88f4d65d612c3 [0,0,0,0,0,2|1,0,0]=3 7645 B12R0.277 CCCC(=O)COCCCC(=O)C 3da7cdfec4b00cb21b32b8839e58b887 [0,0,0,0,0,2|1,0,1]=4 7646 B12R0.277 CCCC(=O)COCCCC(C)C 88358ad6a6c24db94213aaeac694703b [0,0,0,0,0,2|0,0,0]=2 7647 B12R0.277 CCCC(=O)COCCCN(C)C 112ba11ee26b51a3bdb59e382ee481f3 [0,0,0,0,0,2|1,0,0]=3 7648 B12R0.277 CCCC(=O)COCCNC(=O)C 51e75085f8521ff18992744c15314b2a [0,0,0,0,0,2|1,0,1]=4 7649 B12R0.277 CCCC(=O)COCCOC(=O)C b817b58f6bb7b450f9b74cd3788e0109 [0,0,0,0,0,2|1,0,1]=4 7650 B12R0.277 CCCC(=O)COCCOC(C)C c5c4b49f543d5c91a603dfc580536f3a [0,0,0,0,0,2|0,0,0]=2 7651 B12R0.277 CCCC(=O)COCCOC(F)F 9d34ba0a7eeff166d886fe1d0a41604f [0,0,0,0,0,2|2,0,0]=4 7652 B12R0.277 CCCC(=O)COCCSC(C)C 74eb5553f94685f9492cc589b608fe20 [0,0,0,0,0,2|0,0,0]=2 7653 B12R0.277 CCCC(=O)NCCCCN(C)C 4182b619231052c36819d74b2518b6d1 [0,0,0,0,0,2|2,0,0]=4 7654 B12R0.277 CCCC(=O)NCCCOC(C)C e987865254bd6cf15cecf0cd05fee4e5 [0,0,0,0,0,2|1,0,0]=3 7655 B12R0.277 CCCC(=O)NCCCSC(C)C 85f371fa37a3cc4b41a944250493f1d6 [0,0,0,0,0,2|1,0,0]=3 7656 B12R0.277 CCCC(=O)OCCOCC(C)C 0d6c23e4e2c081651a9e8ed36175fa54 [0,0,0,0,0,2|0,0,0]=2 7657 B12R0.277 CCCC(=O)OCCOCC(F)F 1caa82f8d0ed1abd173f33246a405d3f [0,0,0,0,0,2|2,0,0]=4 7658 B12R0.277 CCCC(=O)OCCOCN(C)C 027b2bfe613a9d2ec218fb7953e92d44 [0,0,0,0,0,2|1,0,0]=3 7659 B12R0.277 CCCC(=O)OCNCC=C(C)C b112877f73d041d55e57c042c580e903 [0,0,0,0,0,2|0,0,1]=3 7660 B12R0.277 CCCC(=O)OCNCCC(C)C 3965b5f710098be8254116ed16eb6bd2 [0,0,0,0,0,2|0,0,0]=2 7661 B12R0.277 CCCC(=O)OCNCCC(C)O 850e8804b12e9cd489ab622800f4ee35 [0,0,0,0,0,2|1,0,0]=3 7662 B12R0.277 CCCC(=O)OCNCCC(F)F ca2146e7818c5ca6da1d645c0422ed3c [0,0,0,0,0,2|2,0,0]=4 7663 B12R0.277 CCCC(=O)OCNCCN(C)C 080c392b40d7582f1077e90c935a8a25 [0,0,0,0,0,2|1,0,0]=3 7664 B12R0.277 CCCC(=O)OCNCCS(=O)C dc2a7a2c1ee143246bad16387828f477 [0,0,0,0,0,2|2,0,0]=4 7665 B12R0.277 CCCC(=O)OCNCC[C@@H](C)O cb4e9dadadc81a8e9356bc9ea2288ae0 [0,0,0,0,0,2|1,0,0]=3 7666 B12R0.277 CCCC(=O)OCNCC[C@H](C)O 23dd082ae5f991062ed03dac0cee15c4 [0,0,0,0,0,2|1,0,0]=3 7667 B12R0.277 CCCC(=O)OCOC/C=C(/C)\Cl 3ae90d4a983d00c6fd13f100686286bf [0,0,0,0,0,2|1,0,1]=4 7668 B12R0.277 CCCC(=O)OCOC/C=C(/C)\I 5e13c77e14d519b86a39064f2ebbe0dd [0,0,0,0,0,2|1,0,1]=4 7669 B12R0.277 CCCC(=O)OCOCC=C(C)C e1898a86800b705380c4ef0ee89e0c48 [0,0,0,0,0,2|0,0,1]=3 7670 B12R0.277 CCCC(=O)OCOCC=C(C)I b64d7b4966827a68d708110b6dc7f332 [0,0,0,0,0,2|1,0,1]=4 7671 B12R0.277 CCCC(=O)OCOCCC(=O)C bb4b9eb1eb38071e94a026175dfc08dd [0,0,0,0,0,2|1,0,1]=4 7672 B12R0.277 CCCC(=O)OCOCCC(C)C e62877fa3856a6a73a06deeca331957a [0,0,0,0,0,2|0,0,0]=2 7673 B12R0.277 CCCC(=O)OCOCCC(F)F a2041d77db6335b0700c39d642b79ca3 [0,0,0,0,0,2|2,0,0]=4 7674 B12R0.277 CCCC(=O)OCOCCN(C)C 0e2366aff4a3161a7f9834838f6be9a3 [0,0,0,0,0,2|1,0,0]=3 7675 B12R0.277 CCCC(=O)OCOCCS(=O)C 2672d65c32e91aa2e381b7e14655f9c1 [0,0,0,0,0,2|2,0,0]=4 7676 B12R0.277 CCCC(=O)OCOCNC(=O)C 9aa76d62919081d9433e291ec61d7e09 [0,0,0,0,0,2|1,0,1]=4 7677 B12R0.277 CCCC(=S)OCCCCC(C)C f4a18bc73988d6655c431a725b3b188c [0,0,0,0,0,2|0,1,0]=3 7678 B12R0.277 CCCC(=S)OCCCCN(C)C d2debb01878c9285baee020a60c892f1 [0,0,0,0,0,2|1,1,0]=4 7679 B12R0.277 CCCC(=S)OCCOCC(C)C 0b3dcec2de2387c3c681a7dff96718b9 [0,0,0,0,0,2|0,1,0]=3 7680 B12R0.277 CCCC(C)CCOCCC(C)C 645613536b1399784860682f3ec4f793 [0,0,0,0,0,2|1,0,1]=4 7681 B12R0.277 CCCC(C)COCCCC(C)C 0f0b1d43da07d56128e45b7efa4e1227 [0,0,0,0,0,2|1,0,1]=4 7682 B12R0.277 CCCC(C)COCCOC(C)C bddce8dc2e428b13ebf8d09476cfaa1a [0,0,0,0,0,2|1,0,1]=4 7683 B12R0.277 CCCC(C)COCCSC(C)C 78b8ab236697ea696a85038b7991ba17 [0,0,0,0,0,2|1,0,1]=4 7684 B12R0.277 CCCC(C)OCCCCC(C)C 78d3712ca26412aee34799bb98d1f532 [0,0,0,0,0,2|1,0,1]=4 7685 B12R0.277 CCCC(C)OCCCOC(C)C 3bce41277ad645dd6168acaaf2bf49bc [0,0,0,0,0,2|1,0,1]=4 7686 B12R0.277 CCCC(C)OCCCSC(C)C 1576a083c1e7ae9d52b6ffe0042f0108 [0,0,0,0,0,2|1,0,1]=4 7687 B12R0.277 CCCC(C)OCCOCC(C)C 710b673b99e4a963f4cb00348a264b6d [0,0,0,0,0,2|1,0,1]=4 7688 B12R0.277 CCCC(C)OCCSCC(C)C c60b57ab36ea118e35c55f6ba44bbfda [0,0,0,0,0,2|1,0,1]=4 7689 B12R0.277 CCCC(S)CCOCCC(C)C faf137d2385be68e990631c41a9262ca [0,0,0,0,0,2|0,1,1]=4 7690 B12R0.277 CCC[C@@H](C)OCCCCC(C)C ba703a8dbc150d293dd063086b33a27d [0,0,0,0,0,2|1,0,1]=4 7691 B12R0.277 CCC[C@@H](C)OCCOCC(C)C c298896749fae127bb9d62141dfbdcf9 [0,0,0,0,0,2|1,0,1]=4 7692 B12R0.277 CCC[C@H](C)OCCCCC(C)C ab1f946a7b6a9f6e01e7458e8b303e53 [0,0,0,0,0,2|1,0,1]=4 7693 B12R0.277 CCC[C@H](C)OCCOCC(C)C 2f0b7337b13ee9572ef847599ab8baab [0,0,0,0,0,2|1,0,1]=4 7694 B12R0.277 CCNC(=O)CCNCCC(C)C 0c1ff574b56eb1349559660fff5635da [0,0,0,0,0,2|2,0,0]=4 7695 B12R0.277 CCNC(=O)CCOCCC(C)C ad0d4297976c009ca2f0904c79866338 [0,0,0,0,0,2|1,0,0]=3 7696 B12R0.277 CCNC(=O)CCOCCN(C)C 5a53b414247f7233a225665d1016c0fb [0,0,0,0,0,2|2,0,0]=4 7697 B12R0.277 CCNC(=O)CNCCCC(C)C 796833fb5f98772806b7f56bfd91a86a [0,0,0,0,0,2|2,0,0]=4 7698 B12R0.277 CCNC(=O)CNCCOC(C)C 5856b379edc6a77d8ba792f8a6b38263 [0,0,0,0,0,2|2,0,0]=4 7699 B12R0.277 CCNC(=O)CNCCSC(C)C 8b390212e4245c1f8f239a97a55403d0 [0,0,0,0,0,2|2,0,0]=4 7700 B12R0.277 CCNC(=O)COC/C=C/C(C)C bc37556b1245e92f24d8893e30274c76 [0,0,0,0,0,2|1,0,1]=4 7701 B12R0.277 CCNC(=O)COCCC=C(C)C e437681b6960a87ec054fb977598fc4a [0,0,0,0,0,2|1,0,1]=4 7702 B12R0.277 CCNC(=O)COCCCC(C)C a86274b222a3444b55da3f452ef4a38a [0,0,0,0,0,2|1,0,0]=3 7703 B12R0.277 CCNC(=O)COCCCN(C)C 2645d1cd5b32ccc8b7e41caff68a39df [0,0,0,0,0,2|2,0,0]=4 7704 B12R0.277 CCNC(=O)COCCOC(C)C 348f9b97d2506d5fa72be86e7ecee36b [0,0,0,0,0,2|1,0,0]=3 7705 B12R0.277 CCNC(=O)COCCSC(C)C 89538df9ff8670985f2441a828c40e80 [0,0,0,0,0,2|1,0,0]=3 7706 B12R0.277 CCOC(=O)/C=C/CCOC(C)C 807a85daeccd2633a1531b8e38be289b [0,0,0,0,0,2|2,0,0]=4 7707 B12R0.277 CCOC(=O)/C=C/CNCC(C)C 2edae0ef125948f8f7677f0aa8cc7417 [0,0,0,0,0,2|2,0,0]=4 7708 B12R0.277 CCOC(=O)/C=C/COCC(C)C 49fbd82c26c47c231998965f70411593 [0,0,0,0,0,2|2,0,0]=4 7709 B12R0.277 CCOC(=O)C#CCOCC(C)C 1e7fc38c36d031e58beaceab89a70162 [0,0,0,0,0,2|2,0,0]=4 7710 B12R0.277 CCOC(=O)C=CCNCC(C)C c8ed271d8666b1bdc40e4d12b79aecd2 [0,0,0,0,0,2|2,0,0]=4 7711 B12R0.277 CCOC(=O)C=CCOCC(C)C 55ba2db1561f013c040e889d9b2eb0be [0,0,0,0,0,2|2,0,0]=4 7712 B12R0.277 CCOC(=O)CCCCOC(C)C f3f61d767de38b4c202188e052cd53f4 [0,0,0,0,0,2|2,0,0]=4 7713 B12R0.277 CCOC(=O)CCCNCC(C)C 37577ea8273c37fa0f024c5a801b3c8a [0,0,0,0,0,2|2,0,0]=4 7714 B12R0.277 CCOC(=O)CCCOCC(C)C 923f88dd2cb088ddfc5e4c57922038c7 [0,0,0,0,0,2|2,0,0]=4 7715 B12R0.277 CCOC(=O)CCNCCC(C)C b62b055ffc8a45dbac9b37d6fa24df83 [0,0,0,0,0,2|2,0,0]=4 7716 B12R0.277 CCOC(=O)CCNCOC(C)C 9fad5ae59b0bd3fb8b559a6affd56d21 [0,0,0,0,0,2|2,0,0]=4 7717 B12R0.277 CCOC(=O)CCOCCC(C)C afb058a10dc409ef9cc2cfb3331a0d25 [0,0,0,0,0,2|1,0,0]=3 7718 B12R0.277 CCOC(=O)CCOCCN(C)C 9b97c8909cd54cfcba347a40bb17ca83 [0,0,0,0,0,2|2,0,0]=4 7719 B12R0.277 CCOC(=O)CCOCOC(C)C 64b1df944ae295c7cbd1f2072d222818 [0,0,0,0,0,2|2,0,0]=4 7720 B12R0.277 CCOC(=O)CNCCCC(C)C 6966206b057a4188d55e7cd5454b5769 [0,0,0,0,0,2|2,0,0]=4 7721 B12R0.277 CCOC(=O)CNCCOC(C)C 743d1810b323a26a46a5971efa69b49d [0,0,0,0,0,2|2,0,0]=4 7722 B12R0.277 CCOC(=O)CNCCSC(C)C ea6e9bcafb078196a34477f166013df3 [0,0,0,0,0,2|2,0,0]=4 7723 B12R0.277 CCOC(=O)COC/C=C/C(C)C f3c073c120dd5dfacaf778bf43b56092 [0,0,0,0,0,2|1,0,1]=4 7724 B12R0.277 CCOC(=O)COCCC=C(C)C 37e12c582bb701837bcc51f23427d2fa [0,0,0,0,0,2|1,0,1]=4 7725 B12R0.277 CCOC(=O)COCCCC(C)C a952fed1079630c5887f4b737aece31a [0,0,0,0,0,2|1,0,0]=3 7726 B12R0.277 CCOC(=O)COCCCN(C)C a64935eafdd67acefab76f7120a89498 [0,0,0,0,0,2|2,0,0]=4 7727 B12R0.277 CCOC(=O)COCCOC(C)C f57416c66a94e8a0ea1935be4077c93a [0,0,0,0,0,2|1,0,0]=3 7728 B12R0.277 CCOC(=O)COCCSC(C)C db0b2a9ef6a32217b7975794ac4635d6 [0,0,0,0,0,2|1,0,0]=3 7729 B12R0.277 CCOC(=O)OCNCC=C(C)C a0ec65bf3b6a82829cd66df9e427990a [0,0,0,0,0,2|1,0,1]=4 7730 B12R0.277 CCOC(=O)OCNCCC(C)C 4408a20985ab60683a765288a1c912ba [0,0,0,0,0,2|1,0,0]=3 7731 B12R0.277 CCOC(=O)OCNCCC(C)O 005e84eaf1121e82bf0acfbb002425d8 [0,0,0,0,0,2|2,0,0]=4 7732 B12R0.277 CCOC(=O)OCNCCN(C)C 8535aa7807e39c969c153fecd85beb45 [0,0,0,0,0,2|2,0,0]=4 7733 B12R0.277 CCOC(=O)OCNCC[C@@H](C)O 00ad70a09f2676422485fefb42d4285a [0,0,0,0,0,2|2,0,0]=4 7734 B12R0.277 CCOC(=O)OCNCC[C@H](C)O 84eb2180f2db34e9785c07fad8219812 [0,0,0,0,0,2|2,0,0]=4 7735 B12R0.277 CCOC(=O)OCOCC=C(C)C 67a59c212ca25184a78ea1653614b042 [0,0,0,0,0,2|1,0,1]=4 7736 B12R0.277 CCOC(=O)OCOCCC(C)C c69b290c3812ad755d70a52f37fe512d [0,0,0,0,0,2|1,0,0]=3 7737 B12R0.277 CCOC(=O)OCOCCN(C)C cd68da3aec1baec9e267c17358c39180 [0,0,0,0,0,2|2,0,0]=4 7738 B12R0.277 CCSC(=O)OCNCC=C(C)C 11366158d881df9fa7ad2fdf2b711fa0 [0,0,0,0,0,2|1,0,1]=4 7739 B12R0.277 CCSC(=O)OCNCCC(C)C 36c4cb5ddf8ec5b567dd9b2ee668e81a [0,0,0,0,0,2|1,0,0]=3 7740 B12R0.277 CCSC(=O)OCNCCC(C)O ad531fb727a7cae866ec3c238dab803d [0,0,0,0,0,2|2,0,0]=4 7741 B12R0.277 CCSC(=O)OCNCCN(C)C 4fae9b313fbdd9f45a859dc17c084d7e [0,0,0,0,0,2|2,0,0]=4 7742 B12R0.277 CCSC(=O)OCNCC[C@@H](C)O 7e04741be40ae98c62bed7acbd68a3a1 [0,0,0,0,0,2|2,0,0]=4 7743 B12R0.277 CCSC(=O)OCNCC[C@H](C)O 62229ed0c9d5c607a62524a3f3b227e0 [0,0,0,0,0,2|2,0,0]=4 7744 B12R0.277 CCSC(=O)OCOCC=C(C)C 50d46df6fb579af7985595911be20f43 [0,0,0,0,0,2|1,0,1]=4 7745 B12R0.277 CCSC(=O)OCOCCC(C)C e5f92dfc7dc8e16e2fb5cdfc77cf47a1 [0,0,0,0,0,2|1,0,0]=3 7746 B12R0.277 CCSC(=O)OCOCCN(C)C 4dbf894587ed0616673c00f670a2965a [0,0,0,0,0,2|2,0,0]=4 7747 B12R0.277 COCC(=O)CNCCCC(C)C 4002959bd1fa17d486c729911f052eab [0,0,0,0,0,2|2,0,0]=4 7748 B12R0.277 COCC(=O)COCCCC(C)C e758f8db5e61f47d3d9ebd5e89557a0a [0,0,0,0,0,2|1,0,0]=3 7749 B12R0.277 COCC(=O)COCCCN(C)C d2ebf67bc70eb3abd69ce10fbf72cbaf [0,0,0,0,0,2|2,0,0]=4 7750 B12R0.277 COCC(=O)COCCOC(C)C 7baad87267dacf530b6f039155437fef [0,0,0,0,0,2|1,0,0]=3 7751 B12R0.277 COCC(=O)COCCSC(C)C f4bac410efff14b812e690079347fc8a [0,0,0,0,0,2|1,0,0]=3 7752 B12R0.277 COCC(=O)NCCCOC(C)C 2beafedcd31a9deb2531d991a299bd25 [0,0,0,0,0,2|2,0,0]=4 7753 B12R0.277 COCC(=O)NCCCSC(C)C b93b2e4e77f0b6e0730a6beff38bbc40 [0,0,0,0,0,2|2,0,0]=4 7754 B12R0.277 CSCC(=O)NCCCOC(C)C 343ab8e4ff88541d7390279ff6840e60 [0,0,0,0,0,2|2,0,0]=4 7755 B12R0.277 CSCC(=O)NCCCSC(C)C e9d937c34d77650646e1b70577ac628a [0,0,0,0,0,2|2,0,0]=4