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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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381857 134972709 1 CrO3C15H18 AB3C15D18 -0.41 2.24 -7.58 0.11 0
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381858 134972710 2 O2C8H9 A2B8C9 -126.12 7.54 -9.55 -0.5 0
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381859 134972711 2 O2C8H9 A2B8C9 -130.36 7.07 -9.45 -1.35 0
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381860 134972715 1 CrSiO9C34H40 ABC9D34E40 -338.09 3.89 -7.91 -0.26 0
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381861 134972716 1 CrSiO4C29H40 ABC4D29E40 -132.59 4.25 -7.86 -0.44 0
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381862 134972717 1 FN2O6C11H13 AB2C6D11E13 -281.51 6.28 -9.42 -0.92 0
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381863 134972718 1 SnN2O11C23H34 AB2C11D23E34 -463.92 7.37 -9.47 -0.65 0
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381864 134972719 1 Li2S2H4C5 A2B2C4D5 58.47 5.53 -7.77 0.82 0
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381865 134972720 1 SiO5C35H46 AB5C35D46 -230.03 3.54 -9.07 -0.06 0
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381866 134972722 1 O6C17H30 A6B17C30 -285.97 3.16 -9.98 1.51 0
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381868 134972724 2 OSiC9H11 ABC9D11 -111.02 2.27 -8.95 0.14 0
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381869 134972725 1 NCl2O2C11H13 AB2C2D11E13 -102.38 3.24 -8.87 -0.23 0
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381870 134972726 2 OC7H9 AB7C9 -59.71 2.26 -8.83 0.33 0
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381872 134972730 1 NOC20H21 ABC20D21 43.27 3.34 -8.82 -0.13 0
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381873 134972731 1 NOC15H19 ABC15D19 9.98 3.62 -8.73 -0.16 0
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381874 134972733 1 O3C15H20 A3B15C20 -123.74 2.77 -8.47 0.5 0
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381875 134972735 1 NOH5C6 ABC5D6 69.68 3.55 -8.3 -1.64 0
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381876 134972736 1 NC17H25 AB17C25 35.58 1.05 -8.62 0.46 0
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381877 134972737 1 O2N5C13H15 A2B5C13D15 4.81 5.92 -8.54 -0.7 0
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381878 134972738 1 O3C14H20 A3B14C20 -124.33 1.76 -9.5 0.22 0
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381879 134972739 1 NO2F3C17H22 AB2C3D17E22 -193.58 2.23 -8.44 0.04 0
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381880 134972740 1 NO2F3C15H18 AB2C3D15E18 -210.43 3.07 -8.63 -0.18 0
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381881 134972741 1 NO2F3C15H18 AB2C3D15E18 -207.41 4.29 -8.6 -0.05 0
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381882 134972742 1 NSiO3C21H27 ABC3D21E27 -129.78 3.33 -9.16 -0.07 0
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381883 134972743 1 O3C13H16 A3B13C16 -98.29 4.78 -9.82 -0.43 0
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381884 134972744 1 NO5C19H27 AB5C19D27 -206.3 2.53 -9.52 -0.13 0
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381885 134972745 1 ClON2C21H21 ABC2D21E21 48.77 6.58 -9.22 -0.25 0
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381886 134972746 2 OSiN2C9H15 ABC2D9E15 -135.48 5.77 -8.55 -0.09 0
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381887 134972747 1 NOH19C20 ABC19D20 22.85 5.63 -9.69 -0.91 0
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381888 134972748 2 OC10H11 AB10C11 -47.79 3.49 -8.66 -0.21 0
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381889 134972749 1 NO2C8H15 AB2C8D15 -92.08 1.47 -10.17 -0.38 0
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381890 134972751 1 S2H10C17 A2B10C17 133.59 1.39 -8.55 -0.98 0
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381891 134972752 2 SH5C9 AB5C9 132.78 1.32 -8.54 -1.15 0
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381892 134972754 1 ClN2O5C20H21 AB2C5D20E21 -176.21 3.58 -9.61 -0.75 0
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381893 134972755 2 NO3C13H15 AB3C13D15 -221.31 4.85 -9.34 -0.06 0
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381894 134972756 2 NO3C13H15 AB3C13D15 -223.14 6.26 -9.55 -0.26 0
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381895 134972757 2 NO3C13H15 AB3C13D15 -224.18 2.96 -9.66 -0.13 0
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381896 134972758 1 NO6C19H25 AB6C19D25 -211.23 3.73 -8.83 0.09 0
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381897 134972759 1 NO5C13H21 AB5C13D21 -203.79 2.03 -9.38 0.46 0
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381898 134972760 1 ClNO5C18H22 ABC5D18E22 -180.24 2.28 -9.5 -0.28 0
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381899 134972761 1 ClNO5C20H20 ABC5D20E20 -107.56 7.26 -10.04 -1.31 0
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381900 134972762 1 IO6H17C20 AB6C17D20 -137.61 5.64 -8.22 -1.4 0
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381901 134972763 1 OS2C18H26 AB2C18D26 -51.62 1.63 -8.69 0.25 0
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381902 134972764 1 O6H14C19 A6B14C19 -156.23 8.78 -9.01 -2.11 0
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381903 134972765 1 BrO12C33H33 AB12C33D33 -361.82 5.58 -7.83 -1.05 0
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381904 134972766 1 O4C13H18 A4B13C18 -157.45 1.89 -9.91 -0.2 0
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381905 134972767 1 N2O2C15H18 A2B2C15D18 -47.23 3.28 -8.39 0.38 0
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381906 134972768 3 OC3H4 AB3C4 -102.69 7.2 -10.16 -0.25 0
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381907 134972769 1 IN2O9C15H17 AB2C9D15E17 -374.16 6.39 -9.74 -1.58 0
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381908 134972770 1 IN2O11C20H25 AB2C11D20E25 -473.48 6.77 -9.69 -1.6 0
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381909 134972771 1 SnN2O11C23H34 AB2C11D23E34 -495.06 5.49 -9.76 -0.41 0
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381910 134972772 1 SnN2O9C18H26 AB2C9D18E26 -396.19 7.23 -9.71 -0.26 0
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381912 134972776 2 OSiC9H11 ABC9D11 -110.4 2.15 -8.76 0.25 0
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381913 134972777 2 NC7H7 AB7C7 102.54 2.21 -8.5 -0.55 0
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381914 134972778 1 NSSiO4C17H27 ABCD4E17F27 -189.05 6.29 -8.75 -0.86 0
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381915 134972779 1 NSiO4C23H33 ABC4D23E33 -163.84 4.74 -9.0 -0.67 0
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381916 134972780 1 NC18H19 AB18C19 85.58 1.58 -8.58 0.34 0
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381917 134972781 1 ClNO2H12C15 ABC2D12E15 -47.04 4.49 -9.2 -0.65 0
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381918 134972782 1 ClNO5C20H20 ABC5D20E20 -109.91 0.83 -9.89 -1.37 0
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381919 134972783 1 O4C19H28 A4B19C28 -197.26 1.67 -8.27 0.52 0
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381920 134972784 1 SiO7C15H28 AB7C15D28 -370.1 4.43 -9.12 0.04 0
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381921 134972785 1 OC14H18 AB14C18 -40.73 3.79 -9.66 -0.07 0
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381922 134972786 1 SF3O6H21C23 AB3C6D21E23 -296.97 4.44 -8.23 -1.55 0
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381923 134972787 1 NO7C22H31 AB7C22D31 -311.27 2.66 -8.81 0.11 0
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381924 134972788 1 ClNO2C7H12 ABC2D7E12 -70.81 2.11 -9.28 0.38 0
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381925 134972790 2 OC14H22 AB14C22 -145.85 1.98 -9.01 1.55 0
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381926 134972791 1 N2O3H16C22 A2B3C16D22 7.06 4.73 -9.05 -1.12 0
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381927 134972792 1 NO2C19H25 AB2C19D25 -93.68 2.11 -8.9 -0.11 0
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381928 134972793 1 ON2C26H36 AB2C26D36 -20.77 5.25 -8.14 -0.18 -2
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381932 134972797 1 ClPO12C22H30 ABC12D22E30 -553.28 4.76 -9.61 -0.53 0
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381933 134972798 1 ClPSiO12C28H44 ABCD12E28F44 -648.89 3.45 -8.84 -0.28 0
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381934 134972800 2 OC5H10 AB5C10 -124.43 2.27 -9.8 1.98 1
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381935 134972801 1 BOPC33H37 ABCD33E37 119.47 5.34 0.0 0.0 0
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381936 134972802 1 O3C7H12 A3B7C12 -135.07 6.02 -10.72 0.72 0
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381937 134972803 1 NSiO7C35H37 ABC7D35E37 -216.93 5.23 -8.76 -0.6 0