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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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158839 56479543 1 BrSN3O3C19H24 ABC3D3E19F24 -98.93 6.88 -8.65 -0.7 0
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158840 56479546 1 S2N3O6C22H33 A2B3C6D22E33 -242.8 10.36 -8.62 -0.69 0
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158841 56479554 1 ClN4O4C23H27 AB4C4D23E27 -124.8 9.35 -8.95 -0.57 0
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158842 56479557 1 SO4N5C19H25 AB4C5D19E25 -119.48 12.18 -9.2 -0.73 0
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158843 56479561 1 ClS2N4O4C16H19 AB2C4D4E16F19 -105.58 4.99 -9.41 -1.14 0
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158844 57244064 1 Cl2N2O2H16C19 A2B2C2D16E19 15.34 2.8 -9.36 -0.83 0
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158845 57244068 1 SN2O5C12H16 AB2C5D12E16 -133.38 3.28 -9.11 -1.14 0
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158846 57244071 1 ClNO2C14H18 ABC2D14E18 -33.94 3.27 -8.6 0.28 0
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158847 57244074 1 N3O4C25H39 A3B4C25D39 -183.73 4.37 -9.25 0.16 0
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158848 57244075 2 ClC3H5 AB3C5 -27.94 1.13 -9.68 0.12 0
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158849 57244076 1 O2N3C14H31 A2B3C14D31 -133.68 1.75 -8.71 1.81 0
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158850 57244079 1 N3O3C16H17 A3B3C16D17 -39.6 3.45 -8.81 -1.29 0
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158851 57244083 1 S3O4C23H38 A3B4C23D38 -228.7 1.75 -8.82 -0.47 0
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158852 57244087 1 ClO5C23H35 AB5C23D35 -261.06 1.83 -8.92 0.62 0
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158853 57244088 1 NSO4C9H11 ABC4D9E11 -126.96 4.72 -9.22 -0.96 0
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158854 57244089 1 NSSiO11C29H49 ABCD11E29F49 -556.87 2.7 -8.95 -1.14 0
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158855 57244092 1 SN4O4C19H24 AB4C4D19E24 -82.59 6.2 -8.89 -0.86 0
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158856 57244094 1 OF2N4C18H20 AB2C4D18E20 -64.83 2.71 -8.82 -0.47 1
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158857 57244097 1 O3N5C22H44 A3B5C22D44 -87.39 18.21 0.0 0.0 0
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158858 57244099 1 N3O8C35H37 A3B8C35D37 -278.42 5.32 -8.78 -0.82 0
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158859 57244100 1 N2O2C43H76 A2B2C43D76 -164.15 4.94 -7.88 -0.19 0
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158860 57244101 1 SN4O4H16C19 AB4C4D16E19 -56.66 7.76 -9.22 -1.27 0
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158861 57244102 1 O2N6H28C29 A2B6C28D29 99.42 6.79 -8.31 -0.61 0
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158862 57244105 1 NO3C8H11 AB3C8D11 -123.11 3.67 -10.59 -1.35 1
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158863 57244110 1 NPF3O6C14H16 ABC3D6E14F16 -426.91 6.42 0.0 0.0 0