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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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90611 49970719 1 FO5N6C39H47 AB5C6D39E47 -225.9 6.94 -8.8 -0.5 0
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90612 49970722 1 F2O5N6C38H44 A2B5C6D38E44 -266.56 5.42 -8.84 -0.71 0
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90613 49970724 1 N5O5C33H45 A5B5C33D45 -201.81 10.67 -8.68 -0.28 0
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90614 49970726 1 O4N5C32H43 A4B5C32D43 -171.18 4.58 -8.83 -0.15 0
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90615 49970733 1 O5N6C37H52 A5B6C37D52 -224.51 4.44 -9.06 -0.46 0
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90616 49970735 1 O5N6C38H52 A5B6C38D52 -219.41 7.13 -8.97 -0.23 0
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90617 49970736 1 O5N6C39H54 A5B6C39D54 -222.82 12.2 -8.87 -0.54 0
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90618 49970737 1 N6O6C37H50 A6B6C37D50 -242.26 4.65 -8.94 -0.38 0
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90619 49970738 1 O5N6C38H52 A5B6C38D52 -225.06 5.69 -8.98 -0.23 0
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90620 49970742 1 O5N6C36H50 A5B6C36D50 -224.51 5.54 -8.83 -0.52 0
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90622 49970744 1 O5N6C36H50 A5B6C36D50 -219.28 5.69 -9.0 -0.62 0
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90623 49970745 1 O5N6C37H52 A5B6C37D52 -226.67 10.82 -8.78 -0.34 0
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90624 49970746 1 O5N6C37H50 A5B6C37D50 -211.24 7.25 -8.77 -0.54 0
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90625 49970747 1 O5N6C38H52 A5B6C38D52 -214.09 7.21 -9.05 -0.28 0
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90627 49970757 1 FO5N6C33H43 AB5C6D33E43 -261.31 5.01 -8.56 -0.21 0
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90628 49970771 1 F2O4N5C31H39 A2B4C5D31E39 -246.54 5.85 -8.6 -0.75 0
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90629 49970772 1 O5N6C34H46 A5B6C34D46 -200.19 14.19 -9.09 -0.13 0
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90631 49970783 1 O5N6C40H50 A5B6C40D50 -188.71 2.66 -8.55 -0.49 0
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90632 49970790 1 FO5N6C40H49 AB5C6D40E49 -233.99 2.95 -8.84 -0.72 0
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90633 49970791 1 F2O5N6C39H46 A2B5C6D39E46 -261.84 10.04 -8.76 -0.99 0
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90634 49970796 1 ClO5N6C34H45 AB5C6D34E45 -227.09 4.88 -8.84 -0.46 0
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90635 49970798 1 ClO5N6C36H49 AB5C6D36E49 -232.67 8.56 -9.01 -0.58 0
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90636 49970811 1 BrO4N5C33H44 AB4C5D33E44 -179.34 7.3 -8.73 -0.19 0
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90637 49970819 1 O5N6C35H48 A5B6C35D48 -208.68 8.59 -8.9 -0.25 0
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90638 49970823 1 O5N6C37H52 A5B6C37D52 -229.23 13.89 -8.78 -0.27 0