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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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93683 49996012 1 FO5N6C42H51 AB5C6D42E51 -238.82 5.66 -8.83 -0.38 0
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93684 49996032 1 ClO5N6C36H49 AB5C6D36E49 -238.35 9.68 -8.75 -0.94 0
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93685 49996034 1 ClO5N6C41H51 AB5C6D41E51 -206.72 8.21 -8.95 -1.07 0
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93686 49996036 1 ClO5N6C35H47 AB5C6D35E47 -232.36 8.26 -8.85 -1.13 0
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93687 49996039 1 ClO5N6C41H57 AB5C6D41E57 -257.28 5.26 -9.01 -0.55 0
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93688 49996040 1 ClO5N6C38H53 AB5C6D38E53 -251.31 7.51 -8.85 -0.92 0
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93689 49996046 1 O4N5C34H45 A4B5C34D45 -170.32 9.54 -8.57 -0.27 0
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93690 49996054 1 ClO4N5C35H46 AB4C5D35E46 -188.44 9.34 -8.92 -0.21 0
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93691 49996061 1 O5N6C40H56 A5B6C40D56 -241.6 10.81 -8.89 -0.3 0
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93692 49996094 1 Cl2O4N5C34H43 A2B4C5D34E43 -188.93 10.87 -8.84 -0.49 0
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93693 49996105 1 FO5N6C42H51 AB5C6D42E51 -240.39 6.56 -8.85 -0.63 0
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93694 49996107 1 O5N6C43H54 A5B6C43D54 -197.03 5.99 -8.64 -0.31 0
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93695 49996108 1 FO5N6C42H51 AB5C6D42E51 -246.61 8.6 -8.9 -0.62 0
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93696 49996113 1 BrO5N6C36H47 AB5C6D36E47 -210.25 14.12 -8.77 -0.78 0
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93697 49996115 1 ClO5N6C37H49 AB5C6D37E49 -218.86 8.73 -8.84 -0.71 0
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93698 49996117 1 ClO5N6C41H55 AB5C6D41E55 -237.8 11.32 -8.7 -0.7 0
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93699 49996123 1 O5N6C42H54 A5B6C42D54 -204.7 7.89 -8.48 -0.42 0
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93700 49996124 1 O5N6C42H54 A5B6C42D54 -206.02 8.76 -8.45 -0.42 0
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93701 49996127 1 O5N6C41H52 A5B6C41D52 -196.52 9.01 -8.3 -0.46 0
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93702 49996130 6 NOC7H9 ABC7D9 -236.34 3.98 -8.28 -0.38 0
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93703 49996161 1 ClO5N6C36H47 AB5C6D36E47 -225.28 12.56 -8.65 -0.96 0
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93704 49996225 1 BrFO4N5C34H43 ABC4D5E34F43 -211.75 8.15 -8.93 -0.44 0
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93706 49996228 1 SO4N7C33H47 AB4C7D33E47 -161.82 13.27 -8.8 -0.71 0
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93707 49996243 1 FO5N6C43H53 AB5C6D43E53 -251.69 1.96 -8.8 -0.37 0
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93708 49996270 1 FO5N6C42H53 AB5C6D42E53 -249.56 7.45 -8.88 -0.42 0