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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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170349 75219385 1 N2O3H18C22 A2B3C18D22 28.34 2.7 -9.1 -0.5 0
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170350 75219386 1 FN2O3H17C22 AB2C3D17E22 -14.91 2.69 -9.16 -0.58 0
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170351 75219979 1 SN3O6C29H29 AB3C6D29E29 -187.81 6.78 -8.72 -1.35 0
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170352 75219980 1 O17C45H58 A17B45C58 -683.68 5.16 -8.92 -1.2 0
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170353 75220298 1 CuS2N4O4C19H28 AB2C4D4E19F28 -71.01 12.33 0.0 0.0 0
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170354 75220299 1 BrClO2H12C18 ABC2D12E18 -1.4 4.69 -8.92 -1.26 0
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170355 75220300 1 CuO2N4H26C28 AB2C4D26E28 110.71 3.41 0.0 0.0 0
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170356 75220301 1 O3C44H76 A3B44C76 -247.58 3.82 -9.07 0.96 0
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170357 75220530 1 PN4O10C41H51 AB4C10D41E51 -385.91 8.9 -8.77 -0.76 0
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170358 75220969 1 O4C15H20 A4B15C20 -136.38 5.95 -9.49 -0.33 0
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170359 75221052 1 O3C20H30 A3B20C30 -155.3 7.03 -10.04 0.77 0
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170360 75221064 1 S2N3O6C39H41 A2B3C6D39E41 -129.13 11.67 -8.04 -0.82 0
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170361 75221198 2 N2H15C23 A2B15C23 263.83 11.28 -8.39 -0.87 0
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170362 75221350 1 ClSN2O5C19H19 ABC2D5E19F19 -68.1 4.2 -9.71 -1.96 0
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170363 75221351 1 NSO6C21H25 ABC6D21E25 -177.7 6.17 -8.78 -1.22 0
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170364 75221499 1 SN4O5C18H26 AB4C5D18E26 -107.41 8.63 -9.21 -1.19 0
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170365 75221652 1 O2Cl3N5C18H18 A2B3C5D18E18 -19.95 2.61 -8.91 -0.64 0
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170366 75221653 1 ON9H19C24 AB9C19D24 209.25 14.77 -9.37 -1.13 0
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170367 75221846 1 N3O6H19C21 A3B6C19D21 -93.82 0.93 -9.94 -1.7 0
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170368 75221946 1 N2O4C23H24 A2B4C23D24 -119.85 7.99 -8.93 -0.35 0
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170369 75221947 1 N3O6C23H23 A3B6C23D23 -176.06 5.68 -9.06 -0.6 1
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170370 75221948 1 O4N5C25H34 A4B5C25D34 -124.38 6.72 0.0 0.0 0
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170371 75222137 1 S2O3N4H22C23 A2B3C4D22E23 1.76 5.57 -8.63 -1.03 0
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170372 75222634 1 N2O4H20C21 A2B4C20D21 -63.85 2.71 -9.01 -0.8 0
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170373 75222768 1 O5N6C13H20 A5B6C13D20 -167.12 2.95 -8.76 -0.3 0