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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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424001 135121011 1 ClFO4N6C23H28 ABC4D6E23F28 -139.71 9.18 -8.82 -0.58 0
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424002 135121013 1 ClFN5O5C24H29 ABC5D5E24F29 -206.87 2.99 -8.64 -0.6 0
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424003 135121024 1 FO5N6H21C23 AB5C6D21E23 -144.07 3.66 -9.23 -1.6 0
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424004 135121025 1 ClF3O3N6H10C20 AB3C3D6E10F20 -75.35 4.86 -9.96 -2.43 0
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424005 135121026 1 ClF3O3N5H9C17 AB3C3D5E9F17 -120.5 2.5 -9.99 -2.06 0
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424006 135121027 1 ClF3O3N5H9C17 AB3C3D5E9F17 -112.89 2.81 -10.14 -2.28 0
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424007 135121028 1 ClO3N5F6H8C18 AB3C5D6E8F18 -272.26 3.92 -10.11 -2.53 0
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424008 135121030 1 ClO3F5N5H11C21 AB3C5D5E11F21 -203.11 4.3 -10.06 -2.4 0
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424009 135121031 1 ClF3O3N5H13C20 AB3C3D5E13F20 -125.25 5.76 -9.69 -2.01 0
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424010 135121032 1 ClF3O4N5H15C20 AB3C4D5E15F20 -183.88 3.66 -10.01 -2.02 0
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424011 135121035 1 ClO3F4N5H10C18 AB3C4D5E10F18 -165.98 3.99 -10.05 -2.13 0
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424012 135121036 1 ClF3O4N5H13C21 AB3C4D5E13F21 -158.89 4.74 -10.05 -2.1 0
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424013 135121038 1 O3F4N5H9C17 A3B4C5D9E17 -150.28 7.05 -10.1 -2.14 0
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424014 135121039 1 O3N5F6H9C18 A3B5C6D9E18 -264.09 4.61 -10.21 -2.21 0
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424015 135121040 1 ClO3N4F6H9C17 AB3C4D6E9F17 -306.97 5.16 -10.06 -2.12 0
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424016 135121041 1 ClF3O3N5H17C23 AB3C3D5E17F23 -142.48 5.47 -9.52 -2.25 0
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424017 135121042 1 ClO4N5F6H16C24 AB4C5D6E16F24 -347.25 8.65 -9.72 -2.13 0
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424018 135121043 1 ClO3F4N5H16C23 AB3C4D5E16F23 -188.13 4.75 -9.54 -2.19 0
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424019 135121044 1 ClO3F4N5H16C23 AB3C4D5E16F23 -191.02 4.13 -9.61 -2.3 0
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424020 135121046 1 Cl2F3O3N5H16C23 A2B3C3D5E16F23 -152.37 5.23 -9.6 -2.33 0
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424021 135121047 1 ClO3F5N5H15C23 AB3C5D5E15F23 -234.34 4.41 -9.7 -2.36 0
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424022 135121048 1 ClO4F5N5H17C24 AB4C5D5E17F24 -288.09 8.92 -9.52 -2.07 0
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424023 135121051 1 ClO3F5N5H15C23 AB3C5D5E15F23 -239.76 1.48 -10.08 -2.3 0
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424024 135121054 1 Cl2F3O3N5H16C23 A2B3C3D5E16F23 -153.04 4.02 -9.65 -2.3 0
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424025 135121056 1 ClO3F4N5H18C24 AB3C4D5E18F24 -200.37 6.0 -9.88 -1.92 0
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424026 135121057 1 ClO3F4N5H18C24 AB3C4D5E18F24 -199.7 3.56 -9.56 -2.14 0
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424027 135121061 1 Cl2O3F4N5H15C23 A2B3C4D5E15F23 -197.92 6.91 -9.65 -2.24 0
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424028 135121065 1 Cl2O3F4N5H15C23 A2B3C4D5E15F23 -199.36 4.86 -9.85 -2.19 0
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424029 135121066 1 ClO3F5N5H15C23 AB3C5D5E15F23 -236.71 3.7 -9.62 -2.27 0
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424030 135121068 1 ClO3F4N5H18C24 AB3C4D5E18F24 -197.87 5.52 -9.45 -2.07 0
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424031 135121070 1 ClF4O4N5H18C24 AB4C4D5E18F24 -224.59 10.14 -9.29 -2.04 0
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424032 135121071 1 ClF3O3N5H25C27 AB3C3D5E25F27 -167.62 7.47 -9.56 -1.94 0
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424033 135121072 1 ClF3O3N6H16C24 AB3C3D6E16F24 -111.66 3.79 -10.11 -2.32 0
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424034 135121077 1 ClF4O4N5H18C24 AB4C4D5E18F24 -229.52 3.73 -9.26 -1.96 0
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424035 135121078 1 ClO3F4N5H18C24 AB3C4D5E18F24 -202.46 3.2 -9.84 -2.1 0
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424036 135121086 1 ClO3F4N6H15C24 AB3C4D6E15F24 -155.81 8.44 -10.01 -2.13 0
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424037 135121087 1 ClO4F5N5H19C25 AB4C5D5E19F25 -296.39 7.17 -9.82 -2.04 0
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424038 135121088 1 ClSF3N5O5H19C24 ABC3D5E5F19G24 -226.75 5.97 -9.8 -2.21 0
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424039 135121090 1 ClF3O3N7H13C21 AB3C3D7E13F21 -71.98 6.14 -9.74 -2.06 0
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424040 135121095 1 ClO3F4N5H16C23 AB3C4D5E16F23 -190.24 5.19 -9.62 -2.32 0
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424041 135121105 1 ClO3F4N6H15C22 AB3C4D6E15F22 -175.58 3.86 -10.1 -2.29 0
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424042 135121112 1 ClF3O3N8H14C19 AB3C3D8E14F19 -100.79 1.69 -9.96 -2.32 0
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424043 135121113 1 ClF3O3N6H8C18 AB3C3D6E8F18 -75.81 3.95 -10.12 -2.52 0
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424044 135121116 1 ClO3F4N6H15C22 AB3C4D6E15F22 -181.91 3.19 -9.96 -1.98 0
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424045 135121126 1 ClF4O4N5H16C23 AB4C4D5E16F23 -221.05 7.35 -9.55 -2.11 0
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424046 135121128 1 ClF3O3N5H17C23 AB3C3D5E17F23 -146.92 6.1 -9.88 -1.92 0
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424047 135121129 1 ClF3O3N7H13C21 AB3C3D7E13F21 -72.17 7.59 -9.87 -2.01 0
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424048 135121135 1 ClF3O3N5H11C20 AB3C3D5E11F20 -78.91 5.97 -9.92 -2.28 0
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424049 135121138 1 ClO3F5N5H15C23 AB3C5D5E15F23 -237.36 5.81 -9.93 -1.96 0
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424050 135121139 1 ClO3F5N5H15C23 AB3C5D5E15F23 -238.36 4.82 -9.97 -2.0 0