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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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112064 50393503 1 ClO5N6C38H45 AB5C6D38E45 -194.95 9.27 -8.78 -0.53 0
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112065 50393518 1 N6O6C41H52 A6B6C41D52 -232.46 9.69 -8.34 -0.48 0
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112066 50393546 1 ClO5N6C36H49 AB5C6D36E49 -225.72 5.78 -8.84 -0.85 0
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112067 50393586 1 ClN6O6C39H53 AB6C6D39E53 -274.64 2.23 -8.57 -0.31 0
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112068 50393750 1 ClN6O6C36H49 AB6C6D36E49 -268.69 5.53 -8.98 -0.83 0
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112070 50393752 1 ClN6O6C37H49 AB6C6D37E49 -257.33 1.58 -8.84 -0.77 0
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112071 50393753 1 ClN6O6C38H51 AB6C6D38E51 -261.44 6.93 -8.92 -0.74 0
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112072 50393754 1 ClN6O6C39H53 AB6C6D39E53 -265.26 10.04 -8.88 -0.77 0
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112073 50393755 1 ClN6O7C37H49 AB6C7D37E49 -290.22 3.65 -9.09 -0.94 0
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112074 50393756 1 ClN6O6C38H51 AB6C6D38E51 -262.02 9.02 -9.06 -0.76 0
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112075 50393757 1 ClN6O6C39H53 AB6C6D39E53 -274.4 4.9 -9.02 -0.7 0
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112076 50393768 1 N5O5C34H45 A5B5C34D45 -200.91 3.76 -8.78 -0.24 0
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112077 50393769 1 SN5O5C33H43 AB5C5D33E43 -190.7 6.59 -8.26 -0.2 0
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112078 50393770 1 ClN5O5C32H40 AB5C5D32E40 -195.12 9.33 -8.81 -0.28 0
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112079 50393859 1 ClO5N6C37H49 AB5C6D37E49 -232.21 6.42 -8.72 -0.86 0
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112080 50393860 1 ClO5N6C34H45 AB5C6D34E45 -227.67 2.07 -8.85 -0.93 0
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112081 50393944 1 ClN6O6C39H53 AB6C6D39E53 -265.68 7.2 -8.84 -0.8 0
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112082 50393945 1 ClN6O7C37H49 AB6C7D37E49 -287.52 4.86 -8.98 -0.77 0
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112083 50393946 2 N3O3C17H22 A3B3C17D22 -232.85 7.82 -8.62 -0.38 0
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112084 50393947 1 N5O5C35H47 A5B5C35D47 -203.42 7.69 -8.83 -0.16 0
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112085 50393959 2 N3O3C19H26 A3B3C19D26 -254.5 4.82 -8.94 -0.25 0
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112086 50394035 1 O5N6C37H50 A5B6C37D50 -218.69 10.78 -8.83 -0.55 0
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112087 50394165 1 FO5N6C38H45 AB5C6D38E45 -230.11 2.77 -9.01 -0.76 0
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112088 50394218 1 FO5N6C39H47 AB5C6D39E47 -234.0 4.62 -8.82 -0.61 0
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112089 50394219 1 F2O5N6C38H44 A2B5C6D38E44 -276.63 4.28 -9.2 -0.34 0