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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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164839 74460952 1 N3O6C28H42 A3B6C28D42 -287.97 7.72 0.0 0.0 -1
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164840 74460953 1 N4O6C25H31 A4B6C25D31 -244.36 9.13 0.0 0.0 -2
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164842 74461253 1 SO2N6C23H31 AB2C6D23E31 25.58 6.13 0.0 0.0 1
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164844 74461564 1 SN2O6C21H24 AB2C6D21E24 -209.88 7.47 -8.35 -0.87 -1
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164845 74461576 1 N3O6H20C22 A3B6C20D22 -109.62 24.18 0.0 0.0 0
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164846 74461577 1 ClSN3O5C19H24 ABC3D5E19F24 -215.58 4.45 -9.4 -0.35 -1
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164847 74461578 1 NO6C22H24 AB6C22D24 -206.39 1.73 0.0 0.0 1
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164849 74461686 1 N3O5H16C21 A3B5C16D21 13.87 8.1 0.0 0.0 1
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164850 74461950 1 BrSO2N3C19H25 ABC2D3E19F25 -35.39 13.99 0.0 0.0 1
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164851 74462217 1 O4N5C20H22 A4B5C20D22 -27.33 2.99 0.0 0.0 1
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164853 74462219 1 ClNPO3H12C13 ABCD3E12F13 -124.44 4.44 0.0 0.0 1
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164854 74462220 1 SO4N6C16H21 AB4C6D16E21 -16.18 2.67 0.0 0.0 0
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164855 74462221 1 N3O4C19H23 A3B4C19D23 -132.57 6.21 -8.53 -0.17 1
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164856 74462222 1 FO2N3C21H25 AB2C3D21E25 -80.96 6.97 0.0 0.0 1
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164857 74462223 1 SN3O4C13H24 AB3C4D13E24 -165.33 6.68 0.0 0.0 1
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164858 74462224 1 O2N3C18H26 A2B3C18D26 -51.69 3.11 0.0 0.0 2
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164859 74462225 1 N4O4C21H24 A4B4C21D24 -39.79 4.57 -8.31 -0.5 1
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164860 74462226 1 N4O4C21H23 A4B4C21D23 -26.87 4.48 0.0 0.0 0
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164861 74462227 1 SO3N4C19H28 AB3C4D19E28 -123.72 4.72 -9.25 -0.29 1
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164862 74462228 1 O3N5C23H36 A3B5C23D36 -102.3 6.31 0.0 0.0 0
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164863 74462325 1 OCl2F3N4H19C21 AB2C3D4E19F21 -142.21 3.56 -9.12 -0.82 0
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164865 74462559 1 NO3C21H34 AB3C21D34 -117.77 4.25 0.0 0.0 -1
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164866 74462560 1 NF2O6H12C19 AB2C6D12E19 -193.33 5.64 0.0 0.0 1
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164868 74462562 1 NO6H18C21 AB6C18D21 -106.93 7.2 0.0 0.0 1
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164869 74462563 1 O2N3C22H36 A2B3C22D36 -94.02 2.06 0.0 0.0 1