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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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435815 135192495 1 O2N5C18H25 A2B5C18D25 -23.85 2.01 -9.28 -0.71 0
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435816 135192496 1 ClON6H13C14 ABC6D13E14 85.7 2.77 -8.61 -0.98 0
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435817 135192499 1 ClFO2N8H32C35 ABC2D8E32F35 35.16 5.36 -8.68 -0.93 0
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435818 135192500 1 ClO4N10H27C29 AB4C10D27E29 17.71 7.07 -8.92 -1.57 0
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435819 135192501 1 NC17H25 AB17C25 91.45 2.89 -8.41 0.05 0
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435820 135192502 1 ClF3O3N9C30H31 AB3C3D9E30F31 -142.56 4.03 -8.72 -1.25 0
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435821 135192503 1 ClF3O3N9H29C31 AB3C3D9E29F31 -123.73 8.86 -9.78 -1.33 0
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435822 135192504 1 ClO4N10C28H29 AB4C10D28E29 -3.66 5.71 -9.18 -1.11 0
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435823 135192505 1 ClO2F4N8C30H31 AB2C4D8E30F31 -167.97 3.71 -8.44 -1.05 0
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435824 135192507 2 ClON3H15C16 ABC3D15E16 19.65 8.74 -8.89 -0.57 0
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435825 135192509 1 ClF2O5N7C30H30 AB2C5D7E30F30 -214.95 2.58 -8.38 -1.28 0
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435826 135192517 1 Cl2F2O2N7H27C29 A2B2C2D7E27F29 -79.49 1.77 -8.48 -1.17 0
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435827 135192518 1 NC10H19 AB10C19 -8.05 2.13 -8.74 0.54 0
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435828 135192523 1 FCl2O2N9C28H28 AB2C2D9E28F28 6.13 4.88 -8.7 -1.01 0
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435829 135192524 1 ClFO2N10H28C30 ABC2D10E28F30 93.7 6.45 -8.22 -1.86 0
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435830 135192527 1 ClO2N9C31H36 AB2C9D31E36 61.04 2.41 -8.49 -0.87 0
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435831 135192528 1 ClFO3N9C30H33 ABC3D9E30F33 -33.25 7.05 -8.7 -0.48 0
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435832 135192530 1 ClF2O3N9C31H34 AB2C3D9E31F34 -91.37 3.66 -8.18 -1.18 0
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435833 135192532 1 ClO2N8H35C36 AB2C8D35E36 76.12 5.79 -8.54 -0.84 0
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435834 135192536 1 Cl2F2O2N9H27C28 A2B2C2D9E27F28 -33.65 6.53 -8.63 -0.85 0
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435835 135192541 1 Cl2O2N11H29C30 A2B2C11D29E30 110.58 2.01 -8.43 -1.04 0
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435836 135192542 1 Cl2O2N11H29C30 A2B2C11D29E30 107.29 5.15 -8.2 -1.08 0
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435837 135192543 1 ClO4N6H33C34 AB4C6D33E34 -50.57 2.08 -8.59 -1.0 0
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435838 135192552 1 N3C7H13 A3B7C13 24.22 4.59 -8.85 0.77 0
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435839 135192553 1 N7O9C30H43 A7B9C30D43 -401.47 5.78 -9.43 -0.09 0