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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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167304 74807143 1 OSF2N3C25H26 ABC2D3E25F26 -42.66 4.54 0.0 0.0 1
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167305 74807205 1 SN5O5C21H34 AB5C5D21E34 -131.34 7.74 0.0 0.0 0
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167306 74807257 1 N3O5C29H31 A3B5C29D31 -120.21 5.28 -8.88 -0.59 0
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167307 74807451 1 FO4N5C27H30 AB4C5D27E30 -95.25 6.96 -8.88 -0.62 0
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167308 74807452 1 SO2N3C26H29 AB2C3D26E29 15.06 2.67 -8.91 -0.89 0
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167309 74807453 1 FSO2N4C19H23 ABC2D4E19F23 -62.19 6.09 -8.66 -1.1 1
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167310 74807454 1 N3O5C30H38 A3B5C30D38 -154.81 2.96 0.0 0.0 0
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167311 74807455 1 N3O5C30H37 A3B5C30D37 -173.81 5.11 -8.9 -0.27 1
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167312 74807456 1 FOSN5C22H27 ABCD5E22F27 27.1 2.79 0.0 0.0 0
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167313 74807457 3 NOC10H13 ABC10D13 -99.84 4.33 -9.22 -0.27 0
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167314 74807461 1 N2O4C27H34 A2B4C27D34 -125.67 0.69 -8.63 0.14 -1
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167315 74808649 1 N4O4H5C8 A4B4C5D8 -37.92 5.41 0.0 0.0 1
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167316 74809228 1 N3O3C19H22 A3B3C19D22 21.92 6.33 0.0 0.0 1
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167317 74809421 1 FON5C18H23 ABC5D18E23 32.08 5.68 0.0 0.0 3
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167318 74809423 1 O3N4C25H45 A3B4C25D45 -51.72 3.05 0.0 0.0 1
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167319 74809614 1 FN3C18H25 AB3C18D25 6.08 3.11 0.0 0.0 1
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167320 74809759 1 FN5C21H25 AB5C21D25 73.57 3.74 0.0 0.0 0
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167321 74809760 1 FN5C21H24 AB5C21D24 49.65 3.17 -8.8 -0.15 1
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167322 74809761 1 N2O3C22H33 A2B3C22D33 -87.28 2.49 0.0 0.0 1
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167323 74809762 1 O2F3N4C18H26 A2B3C4D18E26 -178.01 8.64 0.0 0.0 0
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167324 74809763 1 O2F3N4C18H25 A2B3C4D18E25 -203.95 4.22 -8.92 -0.55 1
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167325 74809933 1 ClO2N3C24H27 AB2C3D24E27 1.29 3.75 0.0 0.0 1
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167326 74810069 1 N2O2C16H31 A2B2C16D31 -110.57 3.95 0.0 0.0 1
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167327 74810070 1 N3O3C22H32 A3B3C22D32 -46.53 20.26 0.0 0.0 1
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167328 74810071 1 OSN3C20H28 ABC3D20E28 37.54 18.86 0.0 0.0 2
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167329 74810072 1 OSN5C24H33 ABC5D24E33 65.94 15.73 -6.2 -0.78 1
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167330 74810073 1 ClN2O3C24H32 AB2C3D24E32 -95.49 5.6 0.0 0.0 0
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167331 74810074 1 FON5C21H22 ABC5D21E22 26.71 2.41 -8.69 -0.18 1
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167332 74810075 1 SO3N4C21H29 AB3C4D21E29 -59.6 4.97 0.0 0.0 1
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167333 74810728 1 SN3O4C18H32 AB3C4D18E32 -161.77 2.63 0.0 0.0 1
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167334 74810729 1 S2O3N4C18H29 A2B3C4D18E29 -72.21 5.58 0.0 0.0 1
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167335 74811167 1 ON8C23H33 AB8C23D33 79.8 3.72 0.0 0.0 1
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167336 74811177 1 OSN4C21H27 ABC4D21E27 46.5 2.92 0.0 0.0 1
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167337 74811212 1 N3O3C24H34 A3B3C24D34 -53.26 4.03 0.0 0.0 1
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167338 74811339 1 SN4O4C22H33 AB4C4D22E33 -122.6 1.97 0.0 0.0 1
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167339 74811872 1 O2N4C19H23 A2B4C19D23 17.86 3.53 0.0 0.0 1
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167340 74811873 1 F2N2O3C19H27 A2B2C3D19E27 -190.31 7.06 0.0 0.0 1
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167341 74811874 1 FN5H23C26 AB5C23D26 111.59 3.54 0.0 0.0 1
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167342 74811999 1 SO2N5C24H28 AB2C5D24E28 33.3 8.91 0.0 0.0 1
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167343 74812054 1 SN3O3C22H34 AB3C3D22E34 -101.45 8.0 0.0 0.0 0
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167344 74812245 1 F2N2O3C24H26 A2B2C3D24E26 -186.48 6.89 -8.95 0.08 1
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167345 74812365 1 ON3C24H34 AB3C24D34 27.98 5.59 0.0 0.0 0
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167346 74812742 1 FON4C18H27 ABC4D18E27 -55.13 4.61 -8.76 0.02 1
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167347 74812743 1 ON3C17H28 AB3C17D28 -1.86 2.91 0.0 0.0 1
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167348 74812790 1 FO2N4C23H36 AB2C4D23E36 -91.11 9.78 0.0 0.0 0
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167349 74812791 1 FO2N4C23H35 AB2C4D23E35 -116.42 4.38 -8.58 0.14 1
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167350 74812792 1 SO2N4C22H27 AB2C4D22E27 29.62 4.61 0.0 0.0 1
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167351 74812934 1 FO2N3C24H25 AB2C3D24E25 -27.49 6.37 0.0 0.0 1
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167352 74813390 1 SO2N5H24C26 AB2C5D24E26 37.46 4.54 0.0 0.0 1
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167353 74813396 1 NSO6C23H24 ABC6D23E24 -144.4 4.19 0.0 0.0 1