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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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105232 50106701 1 O5N6C33H38 A5B6C33D38 -170.14 10.9 -8.57 -0.54 0
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105233 50106702 1 FO5N6C32H35 AB5C6D32E35 -202.42 5.64 -9.19 -0.62 0
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105234 50106703 1 F2O5N6C32H34 A2B5C6D32E34 -254.86 7.03 -8.9 -0.93 0
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105235 50106705 1 FO5N6C33H37 AB5C6D33E37 -216.98 12.64 -8.76 -0.64 0
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105236 50106707 1 FO5N6C33H37 AB5C6D33E37 -217.27 5.79 -8.96 -0.68 0
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105237 50106710 1 FO5N6C33H37 AB5C6D33E37 -219.02 9.21 -9.11 -1.03 0
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105238 50106712 1 FO5N6C33H37 AB5C6D33E37 -214.6 9.62 -8.88 -0.67 0
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105239 50106713 1 FO5N6C34H39 AB5C6D34E39 -224.17 6.09 -8.9 -0.72 0
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105240 50106715 1 O5N6C31H42 A5B6C31D42 -212.13 5.94 -9.07 -0.44 0
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105241 50106717 1 O5N6C32H42 A5B6C32D42 -205.62 7.43 -8.89 -0.52 0
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105242 50106718 1 ClO5N6C29H37 AB5C6D29E37 -204.27 5.4 -9.14 -0.62 0
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105243 50106723 1 FO5N6C32H35 AB5C6D32E35 -209.24 11.06 -8.87 -1.11 0
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105244 50106731 1 ClO5N6C30H39 AB5C6D30E39 -219.22 7.97 -9.01 -0.58 0
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105245 50106734 1 ClO5N6C32H41 AB5C6D32E41 -214.71 4.07 -8.99 -0.69 0
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105246 50106737 1 FN4O4C31H35 AB4C4D31E35 -173.28 6.56 -8.46 -0.49 0
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105247 50106740 1 FO4N5C35H40 AB4C5D35E40 -181.18 7.45 -8.65 -0.53 0
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105248 50106741 1 FO4N5C36H42 AB4C5D36E42 -189.93 11.57 -8.59 -0.5 0
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105249 50106742 1 FO4N5C37H44 AB4C5D37E44 -196.73 10.92 -8.64 -0.55 0
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105250 50106743 1 FO4N5C34H40 AB4C5D34E40 -188.25 9.98 -8.61 -0.48 0
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105251 50106751 1 ClO5N6C32H35 AB5C6D32E35 -167.04 6.67 -8.97 -0.94 0
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105252 50106754 1 FN6O6C33H37 AB6C6D33E37 -248.31 2.3 -8.21 -0.5 0
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105253 50106757 1 FO5N6C33H37 AB5C6D33E37 -214.99 11.05 -8.82 -0.53 0
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105254 50106760 1 F2O5N6C32H34 A2B5C6D32E34 -248.24 6.5 -8.95 -0.66 0
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105255 50106761 1 F2O5N6C32H34 A2B5C6D32E34 -255.17 5.65 -8.9 -0.9 0
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105256 50106765 1 F2O5N6C33H36 A2B5C6D33E36 -263.24 5.91 -8.93 -0.4 0