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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
Show
427310 135156825 1 ClFO3N5C10H11 ABC3D5E10F11 -106.53 4.63 -9.54 -0.99 0
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427311 135156829 1 ClFN6O13C33H40 ABC6D13E33F40 -419.4 2.06 -9.34 -1.94 0
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427312 135156843 1 FO2N5C23H28 AB2C5D23E28 -20.09 4.73 -9.14 -0.76 0
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427313 135156913 1 ClF3O7N9H19C21 AB3C7D9E19F21 -289.41 5.19 -9.36 -1.17 0
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427314 135156936 1 ClOSN4C18H19 ABCD4E18F19 29.3 3.66 -8.46 -1.09 0
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427315 135156961 1 SN6O6C38H50 AB6C6D38E50 -195.15 3.05 -8.02 -0.87 0
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427316 135157003 1 O3C14H20 A3B14C20 -102.51 2.5 -9.31 0.38 0
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427317 135157006 1 SN2O4C7H10 AB2C4D7E10 -97.62 5.91 -10.39 -0.74 0
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427318 135157028 1 ClSO3N4C22H31 ABC3D4E22F31 -143.91 7.94 -9.41 -0.78 0
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427319 135157069 1 ClO7N8C43H45 AB7C8D43E45 -163.92 13.3 -8.34 -1.5 0
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427320 135157074 1 F2N3O9C36H37 A2B3C9D36E37 -352.32 6.26 -8.62 -0.95 0
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427321 135157120 1 ClFN5O6C30H37 ABC5D6E30F37 -237.9 1.64 -8.96 -1.07 0
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427322 135157137 1 ClFSN7O11C58H65 ABCD7E11F58G65 -356.67 6.15 -8.61 -1.12 0
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427323 135157159 1 SF2N7O11C58H65 AB2C7D11E58F65 -408.32 7.76 -8.72 -1.02 0
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427324 135157189 1 BrN2O3C18H27 AB2C3D18E27 -132.4 1.57 -8.07 -0.12 0
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427325 135157190 2 NC7H8 AB7C8 51.99 3.08 -8.05 -0.2 0
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427326 135157199 1 ClSN8O8C49H57 ABC8D8E49F57 -229.12 4.17 -8.42 -1.03 0
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427327 135157210 1 ClFN3O9C27H33 ABC3D9E27F33 -344.21 7.8 -8.93 -1.24 0
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427328 135157212 1 OSN2C13H16 ABC2D13E16 -15.9 3.26 -8.7 -0.41 0
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427329 135157213 1 FSN4O6C31H37 ABC4D6E31F37 -241.01 8.67 -8.37 -0.43 0
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427330 135157226 2 NO3C9H17 AB3C9D17 -284.28 7.0 -8.54 0.48 0
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427331 135157227 1 FSN6O10H37C41 ABC6D10E37F41 -287.84 5.96 -9.26 -1.48 0
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427332 135157243 1 PF2N4O7C26H29 AB2C4D7E26F29 -366.94 6.29 -8.39 -0.32 1
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427333 135157245 1 SN4O4C27H33 AB4C4D27E33 -72.33 1.7 0.0 0.0 0
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427334 135157246 1 NO4H19C23 AB4C19D23 -75.34 4.72 -8.51 -0.66 0