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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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95863 50015970 1 FO5N6C36H43 AB5C6D36E43 -222.98 6.35 -8.64 -0.74 0
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95864 50015975 1 O5N6C36H48 A5B6C36D48 -213.11 11.11 -8.71 -0.26 0
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95865 50015979 1 O5N6C32H42 A5B6C32D42 -199.9 10.88 -8.9 -0.28 0
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95866 50015996 1 O5N6C40H50 A5B6C40D50 -186.7 8.18 -8.5 -0.19 0
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95867 50016016 1 F2O4N5C35H41 A2B4C5D35E41 -221.38 6.02 -9.17 -0.57 0
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95868 50016089 1 SO4N7C30H43 AB4C7D30E43 -136.78 5.47 -8.82 -0.81 0
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95869 50016091 1 ClO5N6C36H49 AB5C6D36E49 -225.94 3.91 -8.99 -0.5 0
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95870 50016184 1 FN6O6C37H45 AB6C6D37E45 -262.7 8.19 -8.41 -0.59 0
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95871 50016188 1 F3O4N5C32H40 A3B4C5D32E40 -316.75 13.09 -8.76 -0.94 0
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95872 50016192 1 N5O5C33H45 A5B5C33D45 -194.39 7.75 -8.65 -0.44 0
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95873 50016197 1 FO4N5C32H42 AB4C5D32E42 -207.36 5.86 -8.88 -0.14 0
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95874 50016204 1 ClO5N6C38H51 AB5C6D38E51 -222.16 4.7 -8.93 -0.7 0
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95875 50016205 1 ClO5N6C36H49 AB5C6D36E49 -227.11 10.27 -8.92 -0.55 0
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95876 50016207 1 ClO5N6C36H49 AB5C6D36E49 -198.96 6.06 -8.26 -0.46 0
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95877 50016234 1 FO4N5C36H44 AB4C5D36E44 -181.5 6.49 -9.16 -0.56 0
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95878 50016235 1 F2O4N5C35H41 A2B4C5D35E41 -228.04 7.31 -8.89 -0.73 0
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95879 50016236 1 O4N5C35H43 A4B5C35D43 -136.09 7.79 -8.79 -0.51 0
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95880 50016237 1 FO4N5C35H42 AB4C5D35E42 -182.66 6.92 -8.76 -0.98 0
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95881 50016244 1 ClO4N5C34H40 AB4C5D34E40 -133.61 9.17 -8.24 -0.68 0
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95882 50016252 1 ClO4N5C35H42 AB4C5D35E42 -146.38 3.46 -8.79 -0.73 0
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95883 50016255 1 ClO4N5C33H38 AB4C5D33E38 -132.92 9.94 -8.72 -0.76 0
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95884 50016259 1 N5O5C32H43 A5B5C32D43 -191.18 3.56 -8.91 -0.34 0
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95885 50016264 1 N5O5C34H47 A5B5C34D47 -207.91 7.44 -8.86 -0.69 0
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95886 50016284 1 O5N6C34H48 A5B6C34D48 -227.5 4.48 -9.02 -0.42 0
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95887 50016291 1 FO5N6C37H45 AB5C6D37E45 -230.04 5.0 -8.97 -0.77 0