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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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98350 50043015 1 F2O5N6C38H44 A2B5C6D38E44 -267.39 3.83 -9.1 -0.58 0
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98351 50043022 1 FO4N5C36H42 AB4C5D36E42 -178.49 11.41 -8.71 -0.53 0
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98352 50043026 1 FO4N5C35H40 AB4C5D35E40 -179.87 14.8 -8.52 -0.54 0
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98353 50043036 1 FN5O5C37H44 AB5C5D37E44 -223.42 5.63 -8.28 -0.39 0
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98354 50043051 1 ClF2O5N6C37H41 AB2C5D6E37F41 -281.31 8.59 -9.02 -0.97 0
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98355 50043052 1 ClF2O5N6C38H43 AB2C5D6E38F43 -287.11 10.96 -8.85 -0.99 0
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98356 50043054 1 ClF2O5N6C33H35 AB2C5D6E33F35 -261.36 8.91 -8.88 -1.04 0
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98357 50043069 1 F2O5N6C39H46 A2B5C6D39E46 -277.98 7.9 -9.08 -0.96 0
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98358 50043070 1 F2O5N6C36H42 A2B5C6D36E42 -276.55 9.49 -8.92 -0.63 0
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98359 50043080 1 BrF2O3N4C29H29 AB2C3D4E29F29 -162.45 4.68 -8.79 -0.76 0
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98360 50043086 1 F2O5N6C38H38 A2B5C6D38E38 -223.43 9.96 -8.55 -0.56 0
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98361 50043087 1 F3O5N6H37C38 A3B5C6D37E38 -274.06 9.51 -8.68 -0.64 0
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98362 50043090 1 F2N6O6C39H40 A2B6C6D39E40 -266.9 9.77 -8.72 -0.57 0
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98363 50043124 1 N6O6C39H46 A6B6C39D46 -200.73 12.55 -8.55 -0.4 0
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98364 50043125 1 ClO5N6C40H47 AB5C6D40E47 -188.11 13.63 -8.5 -0.57 0
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98365 50043136 1 ClO5N6C41H43 AB5C6D41E43 -151.23 6.94 -8.38 -0.37 0
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98366 50043162 1 F2O5N6C34H38 A2B5C6D34E38 -259.63 12.68 -9.08 -0.89 0
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98368 50043180 1 FO4N5C36H42 AB4C5D36E42 -186.1 12.68 -8.56 -0.43 0
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98369 50043189 1 F2O4N5H35C36 A2B4C5D35E36 -187.1 8.88 -8.73 -0.97 0
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98370 50043218 1 F2N5O5C33H37 A2B5C5D33E37 -256.99 5.31 -8.28 -0.79 0
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98371 50043232 1 F3O5N6C40H41 A3B5C6D40E41 -283.21 11.68 -8.93 -0.52 0
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98372 50043251 1 F3O5N6H37C38 A3B5C6D37E38 -273.69 6.36 -8.78 -0.69 0
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98373 50043274 1 O4N5C34H39 A4B5C34D39 -124.21 3.4 -8.49 -0.25 0
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98374 50043279 1 O5N6C39H48 A5B6C39D48 -190.83 11.36 -8.45 -0.56 0
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98375 50043295 1 ClO5N6C39H45 AB5C6D39E45 -178.92 10.86 -8.74 -0.88 0