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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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97019 50026845 1 ClF2O5N6C35H39 AB2C5D6E35F39 -261.47 11.84 -8.88 -1.05 0
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97020 50026847 1 ClF2O5N6H37C38 AB2C5D6E37F38 -234.91 8.33 -8.98 -0.78 0
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97021 50026851 1 ClF2O5N6C37H41 AB2C5D6E37F41 -269.01 6.31 -8.85 -0.89 0
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97023 50026857 1 O5N6C38H48 A5B6C38D48 -193.75 5.9 -8.83 -0.41 0
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97024 50026859 1 O5N6C39H48 A5B6C39D48 -181.48 7.11 -8.6 -0.38 0
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97025 50026865 1 O5N6C42H54 A5B6C42D54 -204.61 11.25 -8.62 -0.4 0
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97026 50026867 1 N6O7C39H48 A6B7C39D48 -248.08 3.13 -8.87 -0.36 0
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97027 50026885 1 FO5N6C41H45 AB5C6D41E45 -201.46 8.65 -8.75 -0.45 0
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97028 50026888 2 FN3O3C20H21 AB3C3D20E21 -266.81 9.13 -8.3 -0.52 0
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97029 50026890 3 FN2O2C13H13 AB2C2D13E13 -300.54 8.56 -8.35 -0.73 0
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97030 50026892 2 FN3O3C18H21 AB3C3D18E21 -301.78 8.92 -8.47 -0.41 0
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97031 50026903 1 F4O5N6H38C39 A4B5C6D38E39 -320.18 10.1 -9.05 -0.76 0
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97032 50026960 1 ClFO5N6C43H48 ABC5D6E43F48 -222.12 11.67 -8.74 -1.09 0
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97033 50026962 1 ClFO5N6C38H46 ABC5D6E38F46 -240.5 8.58 -8.75 -0.87 0
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97034 50026976 1 ClFO5N6C42H46 ABC5D6E42F46 -213.7 7.85 -8.56 -0.59 0
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97035 50026981 1 ClF2O4N5H32C35 AB2C4D5E32F35 -183.08 9.47 -8.88 -0.8 0
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97036 50027063 1 F2N6O6C37H42 A2B6C6D37E42 -289.95 11.65 -8.8 -0.81 0
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97037 50027114 1 ClFO5N6C40H50 ABC5D6E40F50 -261.2 11.65 -8.69 -0.63 0
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97038 50027158 1 F2O5N6C35H40 A2B5C6D35E40 -262.37 8.1 -8.91 -0.69 0
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97039 50027159 1 F2O5N6C35H38 A2B5C6D35E38 -247.87 8.03 -8.87 -0.54 0
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97040 50027161 1 F2O5N6C37H42 A2B5C6D37E42 -268.01 9.04 -8.88 -0.68 0
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97041 50027162 1 F2N6O6C35H38 A2B6C6D35E38 -283.81 14.32 -8.81 -0.77 0
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97042 50027228 1 ClF2O5N6C37H43 AB2C5D6E37F43 -278.5 9.05 -8.97 -1.03 0
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97043 50027233 1 F3O5N6C43H45 A3B5C6D43E45 -288.68 19.99 -8.56 -0.77 0
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97044 50027251 1 ClFO5N6C41H48 ABC5D6E41F48 -242.17 12.9 -8.7 -0.57 0