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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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114350 50480184 1 O5N6C37H46 A5B6C37D46 -183.99 6.05 -8.78 -0.49 0
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114351 50480222 1 ClFO5N6C38H44 ABC5D6E38F44 -233.43 6.18 -8.95 -0.96 0
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114352 50480226 1 ClFO5N6C41H48 ABC5D6E41F48 -235.24 5.6 -8.57 -0.58 0
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114353 50480292 1 F2O5N6C41H44 A2B5C6D41E44 -246.32 10.17 -9.07 -0.67 0
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114354 50480293 1 F3O5N6C41H43 A3B5C6D41E43 -284.26 7.32 -9.16 -0.9 0
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114355 50480371 1 ClFO5N6C36H40 ABC5D6E36F40 -223.76 7.25 -8.5 -0.41 0
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114356 50480372 1 ClFO5N6C39H46 ABC5D6E39F46 -243.83 2.43 -8.36 -0.66 0
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114357 50480373 1 ClF2O3N4H27C28 AB2C3D4E27F28 -171.44 5.29 -8.89 -0.98 0
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114358 50480374 1 F2O3N4C31H34 A2B3C4D31E34 -178.87 9.72 -8.86 -0.6 0
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114359 50480375 1 F2N4O5C30H30 A2B4C5D30E30 -233.19 6.76 -8.54 -0.59 0
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114360 50480376 1 O3N4F5H25C28 A3B4C5D25E28 -292.2 4.28 -9.2 -0.79 0
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114361 50480377 1 F3O5N6H37C38 A3B5C6D37E38 -270.77 5.7 -8.97 -0.92 0
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114362 50480378 1 F2O5N6C37H42 A2B5C6D37E42 -265.55 12.43 -8.82 -0.51 0
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114363 50480379 2 FN3O3C19H19 AB3C3D19E19 -258.81 5.04 -8.9 -0.49 0
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114364 50480451 1 N6O6C41H46 A6B6C41D46 -179.56 9.45 -8.71 -0.35 0
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114365 50480487 1 FO5N6C41H45 AB5C6D41E45 -198.17 4.74 -8.78 -0.83 0
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114366 50480533 1 FO5N6C34H39 AB5C6D34E39 -229.85 6.4 -8.51 -0.48 0
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114367 50480534 1 FO5N6C37H45 AB5C6D37E45 -245.19 6.81 -8.23 -0.42 0
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114368 50480535 1 F2O5N6C40H42 A2B5C6D40E42 -249.43 7.56 -8.54 -0.47 0
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114369 50480610 1 FO5N6C38H45 AB5C6D38E45 -221.46 10.59 -8.91 -0.42 0
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114370 50480611 1 FO5N6C39H47 AB5C6D39E47 -237.06 8.27 -8.71 -0.55 0
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114371 50480720 1 ClF2O5N6H39C40 AB2C5D6E39F40 -229.73 8.94 -8.59 -0.84 0
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114372 50480753 1 F3O5N6C40H41 A3B5C6D40E41 -283.48 5.82 -8.96 -0.87 0
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114373 50480754 1 F2O5N6C41H44 A2B5C6D41E44 -240.8 3.21 -9.0 -0.64 0
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114374 50480755 1 F2O5N6C41H44 A2B5C6D41E44 -244.03 10.92 -8.84 -0.67 0