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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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53801 14717997 1 O2N5C8H13 A2B5C8D13 -1.56 12.06 -8.95 -0.93 0
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53802 14717998 2 N2C9H9 A2B9C9 110.89 6.75 -8.44 -0.81 0
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53803 14718001 1 SO2N4C18H18 AB2C4D18E18 26.57 6.17 -8.41 -1.36 0
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53804 14718002 1 ON3H11C13 AB3C11D13 49.3 3.96 -7.75 -0.92 0
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53805 14718003 1 O2N3H13C14 A2B3C13D14 7.99 3.04 -7.74 -0.89 0
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53806 14718004 2 NO2H14C16 AB2C14D16 -78.38 3.49 -9.05 -0.25 0
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53807 14718007 1 ClON4C19H19 ABC4D19E19 42.75 4.19 -8.58 -1.68 -9
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53809 14718014 1 NO2C7H19 AB2C7D19 -94.79 7.78 -8.3 0.75 1
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53810 14718015 1 NOC7H18 ABC7D18 -32.81 1.66 0.0 0.0 0
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53811 14718016 1 ClNO2C9H22 ABC2D9E22 -113.92 14.5 -7.86 -0.48 0
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53812 14718020 1 SN2O3C8H8 AB2C3D8E8 -70.45 5.4 -9.49 -0.95 0
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53813 14718021 1 SN2O3C8H8 AB2C3D8E8 -69.22 7.78 -9.61 -0.96 -3
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53814 14718029 1 N2O8C11H13 A2B8C11D13 -245.92 2.93 0.0 0.0 0
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53815 14718039 1 NOC15H15 ABC15D15 32.37 3.13 -9.22 -0.37 0
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53816 14718041 1 C13H14 A13B14 19.37 1.02 -8.54 -0.22 0
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53817 14718044 1 OSN2C7H14 ABC2D7E14 -55.34 4.59 -8.68 -0.33 0
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53818 14718046 1 OSN2C9H18 ABC2D9E18 -58.06 7.94 -7.93 0.15 0
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53819 14718048 1 OSN2C11H22 ABC2D11E22 -75.24 4.73 -8.67 -0.31 0
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53820 14718049 1 OSN2C16H18 ABC2D16E18 -0.39 3.91 -8.56 -0.95 0
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53821 14718050 1 OSN2C16H18 ABC2D16E18 2.91 8.42 -8.05 -0.91 0
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53823 14718057 1 IrO3S3N6C21H39 AB3C3D6E21F39 -103.51 36.99 -9.54 -3.64 0
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53824 14718058 1 PtO2S2N4C14H26 AB2C2D4E14F26 15.94 4.66 -8.91 -1.44 0
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53825 14718060 1 AgOSN2C7H13 ABCD2E7F13 -84.66 15.35 -9.14 -3.36 0
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53827 14718063 1 CdO2S2N4C14H26 AB2C2D4E14F26 -53.64 3.29 -7.46 -0.49 0
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53828 14718064 1 HgO2S2N4C14H26 AB2C2D4E14F26 -30.9 5.6 -8.84 -0.96 0
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53838 14718101 1 PdS2N4O4C16H30 AB2C4D4E16F30 -113.59 5.85 -7.02 -1.58 0
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53840 14718104 1 CuS2N4O4C16H30 AB2C4D4E16F30 -178.2 3.2 0.0 0.0 0
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53841 14718105 1 AgSN2O2C8H15 ABC2D2E8F15 -148.8 13.82 -9.37 -3.74 0
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53842 14718108 1 CdS2N4O4C16H30 AB2C4D4E16F30 -139.34 10.07 -7.73 -0.71 0
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53843 14718110 1 PbS2N4O4C16H30 AB2C4D4E16F30 -182.16 7.33 -8.8 -1.52 0
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53844 14718111 1 CoO2S2N4C22H42 AB2C2D4E22F42 -82.37 8.57 0.0 0.0 0
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53846 14718120 1 AgOSN2C11H21 ABCD2E11F21 35.0 25.86 -7.97 -3.94 0
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53847 14718123 1 CdO2S2N4C22H42 AB2C2D4E22F42 40.0 29.35 -6.22 -4.4 0
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53848 14718124 1 HgO2S2N4C22H42 AB2C2D4E22F42 -105.08 6.92 -8.68 -0.92 0
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53849 14718138 1 CdO2S2N4H26C30 AB2C2D4E26F30 181.87 0.29 -7.73 -0.73 0
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53850 14718139 1 HgO2S2N4H26C30 AB2C2D4E26F30 330.53 6.47 -7.81 -1.34 0
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53851 14718146 1 RhO3S3N6C36H45 AB3C3D6E36F45 108.17 14.7 -8.32 -2.83 0
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53852 14718147 1 PdO2S2N4C24H30 AB2C2D4E24F30 6.43 9.55 -7.7 -0.7 0
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53853 14718151 1 CuO2S2N4C24H30 AB2C2D4E24F30 96.1 0.64 0.0 0.0 0
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53854 14718152 1 AgOSN2C12H15 ABCD2E12F15 -6.17 13.18 -9.2 -3.72 0
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53857 14718167 1 PtO2S2N4C32H34 AB2C2D4E32F34 229.09 12.3 -8.32 -1.34 0
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53858 14718168 1 CuO2S2N4C32H34 AB2C2D4E32F34 179.02 9.99 0.0 0.0 0
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53860 14718171 1 ZnO2S2N4C32H34 AB2C2D4E32F34 -34.03 1.8 -8.75 -0.7 0
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53861 14718177 1 CoO2S2N4C32H34 AB2C2D4E32F34 68.53 45.57 0.0 0.0 0
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53862 14718178 1 NiO2S2N4C32H34 AB2C2D4E32F34 130.54 9.77 -8.2 -0.99 0
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53863 14718181 1 PdO2S2N4C32H34 AB2C2D4E32F34 105.91 6.55 -7.31 -1.0 0
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53864 14718185 1 CuO2S2N4C32H34 AB2C2D4E32F34 184.13 2.57 0.0 0.0 0
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53865 14718186 1 AgOSN2C16H17 ABCD2E16F17 -30.68 14.21 -9.41 -4.22 0
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53868 14718198 1 ZrPb5F14 AB5C14 -1428.1 7.69 -7.77 -3.06 0
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53869 14718199 1 N2O5C13H14 A2B5C13D14 -169.6 8.16 -8.9 -1.46 0
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53870 14718200 1 N2O5C15H18 A2B5C15D18 -167.43 5.75 -8.44 -0.92 0
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53871 14718209 1 N4O5C30H48 A4B5C30D48 -217.21 4.67 -8.55 -1.05 0
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53872 14718214 1 N4O7C34H48 A4B7C34D48 -230.18 8.89 -8.58 -1.1 0
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53873 14718218 1 NO3C8H9 AB3C8D9 -102.35 3.41 -9.61 -0.69 0
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53874 14718220 1 NO4C24H51 AB4C24D51 -291.46 2.71 -9.5 1.57 0
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53875 14718221 1 AlCrC2N2O10H15 ABC2D2E10F15 -579.09 6.98 -7.52 0.87 -1
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53876 14718225 1 Si2Fe3H5O9 A2B3C5D9 -576.39 11.09 0.0 0.0 0
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53877 14718227 2 C7H10 A7B10 -23.14 0.19 -8.54 0.71 0
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53878 14718230 1 N2C3H8 A2B3C8 9.19 1.85 -8.71 1.31 0
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53879 14718246 1 HgN2S4O10C30H44 AB2C4D10E30F44 -378.49 5.6 -8.53 -1.54 12
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53882 14718257 1 PbO4C5H12 AB4C5D12 -134.22 4.78 -5.05 -0.72 -10
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53885 14718270 1 NSi5O6C21H53 AB5C6D21E53 -508.72 1.61 -9.47 0.5 0
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53886 14718271 1 NSi4O5C18H45 AB4C5D18E45 -425.96 1.13 -9.73 0.77 0
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53887 14718272 1 NSi4O5C18H45 AB4C5D18E45 -418.18 2.92 -9.68 0.58 0
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53888 14718274 1 ClNO4C23H42 ABC4D23E42 -59.9 15.87 -10.03 -2.47 0
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53889 14718275 1 BHMgO3 ABCD3 -169.44 7.98 -9.79 -2.18 0
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53890 14718282 1 SO3N5C9H11 AB3C5D9E11 26.48 8.48 -9.16 -1.88 0
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53891 14718287 1 SO3N5C16H17 AB3C5D16E17 39.73 9.34 -9.01 -1.82 0
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53892 14718307 2 O4C6H9 A4B6C9 -357.93 3.59 -10.85 0.21 0
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53893 14718310 1 F7O8C16H19 A7B8C16D19 -716.08 1.97 -11.07 -0.82 0
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53894 14718319 1 O6F7C16H21 A6B7C16D21 -633.84 1.13 -11.13 -0.9 0
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53895 14718320 1 N2C13H24 A2B13C24 -15.91 2.37 -8.15 2.56 0
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53896 14718322 1 NaSO3C16H25 ABC3D16E25 -183.96 5.77 -9.24 0.19 0
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53897 14718335 1 NO15C32H55 AB15C32D55 -758.84 6.66 -9.73 -0.46 0
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53898 14718337 2 N2C7H8 A2B7C8 96.76 2.96 -8.3 -0.58 0