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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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36852 8013757 1 NO6C21H31 AB6C21D31 -255.26 4.94 -8.66 0.16 0
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36853 8013785 1 ClFNO6C19H19 ABCD6E19F19 -252.8 2.77 -8.9 -0.67 0
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36854 8013786 1 OSN5C20H21 ABC5D20E21 76.87 4.96 -9.02 -0.88 0
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36855 8013798 1 NO6C21H25 AB6C21D25 -215.01 5.65 -8.51 -0.18 0
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36856 8013800 1 OSN4C16H24 ABC4D16E24 2.42 5.09 -8.6 -0.38 0
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36857 8013820 1 N2O7C18H26 A2B7C18D26 -284.19 6.34 -8.46 0.1 0
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36858 8013836 1 ClNF3O3H15C18 ABC3D3E15F18 -262.27 5.54 -8.96 -0.87 0
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36859 8013846 1 O7C20H22 A7B20C22 -238.54 1.49 -8.62 -0.76 0
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36860 8013853 1 N3O4C24H25 A3B4C24D25 -85.72 5.88 -8.79 -0.21 0
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36861 8013855 1 N3O4C24H25 A3B4C24D25 -89.96 5.45 -8.82 -0.49 0
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36862 8013884 1 NSO4H19C22 ABC4D19E22 -88.35 4.14 -8.71 -0.45 0
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36863 8013895 1 NF3O3C21H22 AB3C3D21E22 -269.0 2.52 -9.04 -0.95 0
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36864 8013943 1 NO5H21C24 AB5C21D24 -135.55 4.34 -8.77 -0.48 0
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36866 8013976 1 NO4C23H25 AB4C23D25 -132.69 4.67 -8.65 -0.07 0
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36867 8014000 2 NO2H10C11 AB2C10D11 -95.35 3.01 -8.98 -0.41 0
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36868 8014021 1 BrN2O5C11H11 AB2C5D11E11 -145.86 4.15 -9.81 -1.34 0
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36869 8014039 1 ClN2O5C12H13 AB2C5D12E13 -213.22 2.77 -10.03 -1.43 0
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36870 8014067 1 ClSN2O4H15C18 ABC2D4E15F18 -94.14 11.48 -9.18 -1.17 0
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36871 8014075 1 SN2O4H18C19 AB2C4D18E19 -49.02 6.5 -8.91 -0.76 0
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36872 8014079 1 BrN2O4H11C15 AB2C4D11E15 -25.73 3.35 -9.47 -1.11 0
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36873 8014092 1 N2S2O4H18C19 A2B2C4D18E19 -81.68 10.58 -8.8 -1.03 0
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36874 8014110 1 BrNO5H14C16 ABC5D14E16 -136.75 4.94 -9.35 -0.85 0
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36875 8014129 1 SN2O6C16H16 AB2C6D16E16 -160.37 5.67 -9.0 -0.9 0
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36876 8014140 1 BrNO4C16H20 ABC4D16E20 -136.34 5.0 -9.26 -1.12 0
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36877 8014143 1 SO6C17H18 AB6C17D18 -203.21 6.32 -8.86 -0.71 0
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36878 8014146 1 ClSO5H17C20 ABC5D17E20 -158.68 6.71 -8.98 -1.26 0
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36879 8014208 1 NSO4C21H25 ABC4D21E25 -142.86 5.23 -8.44 -0.84 0
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36880 8014216 1 NSO4C22H27 ABC4D22E27 -145.8 7.53 -8.94 -0.7 0
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36881 8014225 1 NSO4C22H27 ABC4D22E27 -146.55 8.11 -8.69 -0.96 0
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36882 8014226 1 SN2O4H18C19 AB2C4D18E19 -93.93 9.99 -9.1 -1.03 0
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36883 8014233 1 FNSO4C20H22 ABCD4E20F22 -181.92 5.75 -8.95 -0.84 0
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36884 8014235 1 ClSN2O4C17H17 ABC2D4E17F17 -115.34 6.07 -8.94 -0.79 0
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36885 8014243 1 SN3O4H17C20 AB3C4D17E20 -58.1 6.48 -8.87 -0.93 0
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36886 8014248 1 SO5C18H18 AB5C18D18 -144.03 7.09 -8.72 -0.55 1
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36887 8014310 1 SN2O5C21H31 AB2C5D21E31 -223.63 6.75 0.0 0.0 0
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36888 8014328 1 SN3O5C18H23 AB3C5D18E23 -205.15 5.45 -9.04 -1.32 1
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36889 8014330 1 SN3O3C20H28 AB3C3D20E28 -117.85 8.11 0.0 0.0 0
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36890 8014331 1 SN3O3C20H27 AB3C3D20E27 -134.06 3.06 -8.58 -0.83 0
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36891 8014333 1 SN3O3C20H27 AB3C3D20E27 -132.66 3.55 -8.59 -0.84 0
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36892 8014366 1 ClFN2S2O3H14C15 ABC2D2E3F14G15 -129.06 5.24 -9.18 -1.09 0
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36893 8014369 1 S2N3O5C15H15 A2B3C5D15E15 -78.1 8.69 -9.07 -1.43 0
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36894 8014372 1 N2S2O5C17H18 A2B2C5D17E18 -164.3 4.09 -8.89 -0.88 0
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36895 8014373 1 N2S2O3C18H22 A2B2C3D18E22 -93.58 4.97 -8.72 -0.97 0
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36896 8014381 1 N2O3H12C15 A2B3C12D15 -39.87 1.99 -9.12 -1.25 0
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36897 8014403 1 ClN2O4C17H23 AB2C4D17E23 -170.12 7.06 -8.56 -0.23 0
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36898 8014409 1 F2N2O5C17H20 A2B2C5D17E20 -298.92 6.98 -9.06 -0.61 1
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36899 8014428 1 N3O5C18H26 A3B5C18D26 -135.42 5.06 0.0 0.0 0
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36900 8014441 1 N2F3O3C17H21 A2B3C3D17E21 -285.42 4.91 -9.26 -0.53 0
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36901 8014472 1 SN2O5C19H28 AB2C5D19E28 -227.5 3.87 -8.69 -0.3 0
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36902 8014493 1 NO7H21C22 AB7C21D22 -240.89 5.11 -9.3 -1.68 0