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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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82862 49856703 5 NC4H5 AB4C5 86.17 4.36 -8.16 0.07 0
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82863 49856708 1 N5O5C33H35 A5B5C33D35 -108.02 4.56 -8.85 -0.82 0
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82864 49856709 1 N5O5C32H33 A5B5C32D33 -107.61 8.54 -8.72 -0.82 0
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82865 49856715 1 O9H28C39 A9B28C39 -203.97 4.94 -8.88 -0.95 0
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82866 49856716 1 O7H24C35 A7B24C35 -120.09 4.9 -8.49 -0.89 0
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82867 49856718 1 BFN2O4C21H26 ABC2D4E21F26 -271.88 1.39 -9.68 -0.48 0
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82868 49856719 1 FN2O3H15C16 AB2C3D15E16 -122.64 6.15 -9.93 -0.71 0
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82869 49856720 1 FN2O3H15C16 AB2C3D15E16 -121.38 4.4 -9.88 -0.93 0
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82870 49856723 1 ClN2O3H15C16 AB2C3D15E16 -82.87 1.99 -9.85 -0.96 0
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82871 49856727 1 BF2N2O4C34H37 AB2C2D4E34F37 -276.21 2.08 -9.55 -0.43 0
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82872 49856728 1 BFN2O4C35H40 ABC2D4E35F40 -241.0 1.97 -9.23 -0.4 0
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82873 49856729 1 BF2N2O4C34H37 AB2C2D4E34F37 -279.37 2.01 -9.62 -0.44 0
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82874 49856731 1 O3C26H44 A3B26C44 -200.86 2.63 -8.72 0.54 0
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82875 49856732 1 O3C26H44 A3B26C44 -198.84 1.21 -8.72 0.48 0
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82876 49856733 1 IOPC22H24 ABCD22E24 -11.18 6.19 -7.72 -0.26 0
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82877 49856734 1 SSiO4C17H30 ABC4D17E30 -236.85 4.35 -9.09 -0.65 0
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82878 49856737 1 O2N4H22C23 A2B4C22D23 32.92 7.89 -9.32 -0.98 0
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82879 49856739 1 FO2N5H18C20 AB2C5D18E20 -13.17 7.16 -9.48 -1.17 0
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82880 49856741 1 O7C34H34 A7B34C34 -239.11 4.15 -9.41 -0.58 0
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82881 49856742 1 O7H30C34 A7B30C34 -188.0 6.58 -9.32 -1.02 0
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82882 49856743 1 O9H34C36 A9B34C36 -271.72 5.13 -9.0 -0.86 0
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82883 49856745 1 O7C30H38 A7B30C38 -319.19 5.36 -9.36 -0.51 0
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82884 49856747 2 N2O2H11C12 A2B2C11D12 -71.38 7.5 -8.52 -1.38 0
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82885 49856749 2 ClNOH6C9 ABCD6E9 4.76 3.84 -8.83 -1.57 0
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82886 49856750 2 NO2H9C10 AB2C9D10 -74.68 1.83 -8.46 -0.9 0