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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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94001 49998028 1 FO4N5C33H38 AB4C5D33E38 -169.57 8.98 -8.92 -0.84 0
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94002 49998042 1 ClN5O5C29H38 AB5C5D29E38 -207.45 9.14 -8.78 -0.66 0
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94003 49998043 1 BrO4N5C28H36 AB4C5D28E36 -156.77 5.67 -8.95 -0.41 0
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94004 49998044 1 FO4N5C29H38 AB4C5D29E38 -212.84 8.41 -8.67 -0.13 0
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94005 49998046 1 O4N5C31H43 A4B5C31D43 -180.24 7.76 -9.09 -0.09 0
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94006 49998052 1 FO5N6C41H51 AB5C6D41E51 -251.61 8.4 -8.77 -0.52 0
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94008 49998065 1 FN6O6C41H51 AB6C6D41E51 -280.41 12.15 -8.22 -0.42 0
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94009 49998066 1 FN6O6C41H51 AB6C6D41E51 -279.91 7.75 -8.3 -0.63 0
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94010 49998070 1 O5N6C35H48 A5B6C35D48 -228.0 7.11 -8.39 -0.27 0
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94011 49998078 1 FO5N6C40H49 AB5C6D40E49 -246.02 11.06 -8.59 -0.45 0
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94012 49998090 1 O5N6C35H48 A5B6C35D48 -217.62 9.88 -8.9 -0.43 0
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94013 49998142 1 ClO5N6C38H53 AB5C6D38E53 -238.25 6.16 -8.76 -0.49 0
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94014 49998162 1 F2O5N6C39H46 A2B5C6D39E46 -277.18 6.87 -8.95 -0.91 0
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94015 49998190 1 FO5N6C41H51 AB5C6D41E51 -240.88 5.45 -8.75 -0.57 0
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94016 49998209 1 ClO5N6C36H49 AB5C6D36E49 -239.88 7.22 -8.63 -0.29 0
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94017 49998218 1 O5N6C39H56 A5B6C39D56 -251.43 3.76 -8.83 -0.4 0
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94018 49998231 1 FN6O6C41H51 AB6C6D41E51 -275.54 6.28 -8.93 -0.52 0
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94019 49998232 1 O5N6C35H48 A5B6C35D48 -221.22 10.91 -8.89 -0.77 0
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94020 49998233 1 O5N6C37H52 A5B6C37D52 -223.54 6.46 -8.99 -0.26 0
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94021 49998247 1 ClO5N6C40H49 AB5C6D40E49 -207.82 8.08 -8.76 -0.5 0
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94022 49998281 1 FO5N6C38H53 AB5C6D38E53 -286.61 9.28 -8.59 -0.3 0
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94023 49998285 1 F2O5N6C40H48 A2B5C6D40E48 -279.3 11.12 -8.86 -0.87 0
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94024 49998287 1 FO5N6C41H51 AB5C6D41E51 -247.94 2.6 -8.64 -0.35 0
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94025 49998288 1 FO5N6C41H51 AB5C6D41E51 -241.06 11.13 -8.76 -0.54 0
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94026 49998289 1 ClO5N6C40H49 AB5C6D40E49 -204.99 6.22 -8.59 -0.5 0