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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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93098 49991580 2 N3O3C19H27 A3B3C19D27 -273.07 3.56 -8.85 -0.36 0
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93099 49991588 1 FO5N6C41H51 AB5C6D41E51 -249.96 3.6 -8.55 -0.49 0
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93100 49991600 1 ClO5N6C39H47 AB5C6D39E47 -192.36 9.47 -8.75 -0.64 0
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93101 49991601 1 ClO5N6C38H45 AB5C6D38E45 -188.55 7.82 -8.6 -0.6 0
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93102 49991610 1 O5N6C35H48 A5B6C35D48 -223.64 5.24 -8.91 -0.35 0
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93103 49991612 1 FO5N6C41H51 AB5C6D41E51 -246.15 7.24 -8.96 -0.32 0
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93104 49991614 1 F2O5N6C40H48 A2B5C6D40E48 -281.58 6.98 -8.93 -0.43 0
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93105 49991615 1 FO5N6C41H51 AB5C6D41E51 -247.99 11.42 -8.87 -0.75 0
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93106 49991622 1 O5N6C36H50 A5B6C36D50 -220.91 12.1 -8.68 -0.68 0
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93107 49991624 1 O5N6C40H56 A5B6C40D56 -236.44 9.87 -8.64 -0.74 0
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93108 49991629 1 O5N6C40H56 A5B6C40D56 -237.52 9.12 -8.8 -0.7 0
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93109 49991637 1 F2O5N6C40H48 A2B5C6D40E48 -283.66 6.04 -8.66 -0.25 0
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93110 49991696 2 N3O3C19H26 A3B3C19D26 -264.03 9.64 -8.95 -0.44 0
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93111 49991714 1 O5N6C39H48 A5B6C39D48 -189.61 7.46 -8.32 -0.37 0
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93112 49991715 1 O5N6C38H46 A5B6C38D46 -181.8 8.82 -8.42 -0.44 0
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93113 49991725 1 ClF3O4N5C33H41 AB3C4D5E33F41 -344.14 8.87 -9.06 -0.66 0
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93114 49991743 1 O5N6C40H50 A5B6C40D50 -198.14 9.07 -8.74 -0.53 0
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93115 49991744 1 FO5N6C40H49 AB5C6D40E49 -245.63 13.29 -8.83 -0.53 0
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93116 49991747 1 FO5N6C40H49 AB5C6D40E49 -245.68 4.52 -8.95 -0.62 0
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93117 49991749 1 BrO5N6C36H49 AB5C6D36E49 -230.75 12.39 -8.74 -0.66 0
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93119 49991755 1 ClO5N6C39H53 AB5C6D39E53 -236.06 7.04 -8.91 -0.75 0
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93120 49991760 1 FO5N6C39H47 AB5C6D39E47 -237.4 7.23 -8.49 -0.39 0
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93121 49991767 1 O5N6C40H50 A5B6C40D50 -202.66 1.95 -8.26 -0.28 0
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93122 49991772 1 O4N5C33H45 A4B5C33D45 -185.91 4.73 -8.54 -0.35 0
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93123 49991773 1 BrClO4N5C32H41 ABC4D5E32F41 -177.06 9.95 -9.04 -0.54 0