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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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385726 134979835 1 ClSeO3C17H19 ABC3D17E19 -112.54 4.53 -9.11 -1.07 0
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385727 134979839 2 O3C9H10 A3B9C10 -202.13 2.57 -8.83 -0.73 0
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385728 134979844 1 OC13H24 AB13C24 -80.39 2.41 -9.47 1.39 0
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385731 134979855 1 SN2O3C18H18 AB2C3D18E18 -70.45 7.12 -8.91 -0.37 0
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385732 134979858 1 O2H18C21 A2B18C21 -11.79 1.68 -8.84 -0.63 0
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385733 134979859 1 O5C14H14 A5B14C14 -166.99 4.28 -10.36 -1.41 0
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385734 134979863 1 O3C23H36 A3B23C36 -160.31 1.54 -9.32 0.77 0
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385735 134979864 1 O8C19H28 A8B19C28 -285.5 2.11 -7.96 -0.6 0
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385736 134979866 1 O2C13H16 A2B13C16 -37.27 2.81 -9.35 0.34 0
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385737 134979867 1 O4C19H26 A4B19C26 -158.58 2.17 -9.41 0.23 0
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385738 134979871 1 AlC20H43 AB20C43 -123.77 0.13 -8.84 2.37 0
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385739 134979872 1 NOH17C19 ABC17D19 31.5 1.85 -9.74 -0.72 0
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385741 134979875 1 O5C17H24 A5B17C24 -228.52 5.6 -9.4 0.51 0
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385742 134979876 1 AlC17H29 AB17C29 -59.82 1.07 -8.37 0.63 0
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385743 134979882 1 PPtSBr2H17C19 ABCD2E17F19 143.9 1.89 -8.72 -3.26 0
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385744 134979887 3 SiC12H16 AB12C16 39.61 0.91 -8.77 0.52 0
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385745 134979891 1 C13H24 A13B24 -42.38 0.51 -9.02 1.65 0
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385746 134979892 1 OSiC18H30 ABC18D30 -101.61 1.28 -8.73 0.17 0
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385747 134979894 1 OC16H24 AB16C24 -39.59 1.32 -8.52 0.38 0
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385748 134979895 1 ClC11H13 AB11C13 12.79 2.11 -9.55 0.0 0
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385752 134979902 1 OSiC22H40 ABC22D40 -104.57 1.42 -8.45 -0.25 0
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385753 134979903 1 O3C25H34 A3B25C34 -84.48 1.98 -8.55 -0.48 0
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385754 134979904 1 C25H32 A25B32 61.63 0.82 -8.39 -0.69 0
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385755 134979905 2 O2C24H35 A2B24C35 -118.64 1.83 -8.1 -0.97 0
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385756 134979907 1 O2C17H30 A2B17C30 -113.49 0.9 -8.79 0.56 0
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385757 134979908 1 O2C7H12 A2B7C12 -60.66 3.03 -7.85 0.73 0
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385758 134979913 1 NOC21H35 ABC21D35 -66.88 3.61 -8.9 1.04 0
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385759 134979915 1 O4C13H18 A4B13C18 -182.83 4.84 -9.91 0.43 0
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385760 134979916 1 SiO5C14H22 AB5C14D22 -272.19 5.97 -9.53 0.32 0
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385761 134979923 1 SiO5C16H28 AB5C16D28 -292.96 3.25 -9.12 0.43 0
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385762 134979924 2 OC8H10 AB8C10 -70.87 2.05 -9.56 0.02 0
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385763 134979929 1 ClSeO2H19C20 ABC2D19E20 -32.74 2.9 -8.4 -0.67 0
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385764 134979931 1 SiO5C17H30 AB5C17D30 -302.25 3.42 -9.09 0.48 0
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385765 134979934 1 SN2O8C18H26 AB2C8D18E26 -287.25 5.44 -9.32 -0.84 0
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385766 134979936 1 NO4C17H21 AB4C17D21 -154.37 3.88 -9.24 -0.43 0
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385767 134979941 1 NO4C15H17 AB4C15D17 -140.43 5.15 -9.26 0.15 0
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385768 134979942 1 SiO3C14H22 AB3C14D22 -158.33 6.07 -9.62 -0.17 0
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385769 134979946 1 ClOF7H8C11 ABC7D8E11 -377.67 3.87 -10.71 -0.59 0
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385770 134979947 1 SO2C15H16 AB2C15D16 -18.83 5.92 -10.14 -0.48 -1
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385772 134979952 1 NO4C23H25 AB4C23D25 -127.41 3.25 -9.5 0.14 0
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385773 134979953 1 NO4C23H25 AB4C23D25 -123.39 3.25 -9.52 0.01 0
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385774 134979955 2 NO3C17H17 AB3C17D17 -189.33 2.93 -9.28 -0.69 0
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385776 134979960 2 O2C8H11 A2B8C11 -150.44 0.4 -9.53 0.67 0
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385777 134979962 1 NC16H21 AB16C21 30.88 0.91 -8.82 0.43 0
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385778 134979963 1 OSiC27H30 ABC27D30 22.17 1.69 -8.6 0.18 0
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385779 134979969 1 C19H24 A19B24 76.52 0.97 -8.51 0.45 0
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385780 134979970 2 C8H13 A8B13 44.86 0.72 -6.12 -0.78 0
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385781 134979971 2 OC7H15 AB7C15 -148.12 2.6 -9.98 2.09 0
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385783 134979974 1 NI2O4C34H41 AB2C4D34E41 -91.58 4.68 -8.52 -0.92 0
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385784 134979977 1 NO7C25H37 AB7C25D37 -338.73 1.76 -9.52 0.16 0
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385785 134979978 2 O4C6H11 A4B6C11 -375.79 3.14 -10.27 0.02 0
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385786 134979979 2 SO3C7H11 AB3C7D11 -275.9 1.66 -9.14 -0.57 0
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385787 134979980 1 OC11H18 AB11C18 -71.27 3.28 -9.66 0.91 0
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385788 134979981 1 NSO3C16H29 ABC3D16E29 -171.75 2.95 -9.26 0.04 0
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385789 134979983 4 C4H7 A4B7 -28.38 0.94 -9.35 1.4 0
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385790 134979984 1 C15H28 A15B28 -38.45 0.83 -9.21 1.43 0
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385791 134979985 1 C19H28 A19B28 6.04 1.15 -8.94 0.16 0
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385793 134979989 1 O2C19H36 A2B19C36 -126.56 2.3 -9.47 1.25 0
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385794 134979990 4 OC4H7 AB4C7 -207.55 2.04 -10.07 0.52 0
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385796 134979992 3 C5H8 A5B8 -6.99 0.87 -8.91 1.36 0
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385797 134979994 1 OC14H26 AB14C26 -68.1 2.42 -9.8 0.92 0
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385798 134979998 1 C13H24 A13B24 -26.7 0.79 -9.2 1.5 0
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385799 134979999 5 OC4H4 AB4C4 -156.57 3.66 -8.46 -0.24 0
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385801 134980006 1 C11H14 A11B14 19.68 0.78 -8.82 0.48 0
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385802 134980016 1 O3C11H14 A3B11C14 -99.29 2.45 -9.63 -0.07 0
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385803 134980019 1 BrSN2O5C41H63 ABC2D5E41F63 -255.93 12.0 -8.07 -0.36 0
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385804 134980021 1 SiO5C14H22 AB5C14D22 -268.86 4.18 -9.83 0.14 0
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385805 134980023 1 O2C15H26 A2B15C26 -121.06 0.99 -8.66 1.73 0
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385806 134980027 1 O4C11H16 A4B11C16 -182.65 0.44 -9.95 0.69 0
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385807 134980030 1 OC15H24 AB15C24 -64.62 4.25 -9.26 0.86 0
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385808 134980032 2 O3C7H10 A3B7C10 -268.67 2.13 -10.06 0.52 0
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385809 134980042 2 OC8H8 AB8C8 -20.46 1.27 -9.83 -0.72 0
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385810 134980043 1 NO4C15H17 AB4C15D17 -139.97 2.62 -9.29 0.0 0
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385813 134980056 1 NOF7C12H12 ABC7D12E12 -374.71 5.59 -10.04 0.25 0
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385814 134980057 1 NOF7C12H12 ABC7D12E12 -377.1 4.92 -10.09 0.25 0
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385815 134980059 2 OC8H10 AB8C10 -62.6 2.28 -9.02 0.35 0
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385816 134980062 1 NO7C17H25 AB7C17D25 -272.3 5.78 -9.83 0.39 0
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385817 134980063 1 SiO4C18H32 AB4C18D32 -219.64 2.0 -8.98 0.57 0
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385818 134980064 1 O4C19H32 A4B19C32 -204.33 2.49 -9.82 0.42 0
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385819 134980065 2 O3C7H9 A3B7C9 -256.06 1.41 -9.65 0.02 0
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385821 134980071 1 NO10C36H57 AB10C36D57 -389.9 6.68 -8.93 0.1 0
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385823 134980075 1 AlC18H39 AB18C39 -114.02 0.22 -8.84 2.34 0
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385824 134980077 1 SC13H20 AB13C20 -6.35 2.33 -8.35 0.6 0
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385825 134980083 1 O4C11H18 A4B11C18 -128.91 1.57 -10.16 0.14 0
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385826 134980084 3 OC5H8 AB5C8 -145.77 2.68 -9.16 0.24 0
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385827 134980087 2 O2C9H13 A2B9C13 -166.99 6.01 -10.04 0.06 0
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385828 134980091 1 OC29H46 AB29C46 -68.21 2.06 -9.04 1.33 0
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385829 134980094 1 C25H32 A25B32 100.65 1.31 -8.87 0.07 0
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385830 134980097 1 SC11H22 AB11C22 -30.0 1.55 -8.48 0.85 0
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385831 134980103 2 OC6H9 AB6C9 -94.46 2.46 -9.73 0.86 0
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385832 134980104 2 O2C7H12 A2B7C12 -210.72 2.34 -9.89 1.06 0
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385833 134980107 6 H4C5 A4B5 113.82 0.61 -8.69 -0.42 0
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385838 134980123 1 O4C15H16 A4B15C16 -135.65 3.84 -9.82 -0.98 0
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385839 134980124 1 SiO3C14H24 AB3C14D24 -202.78 5.79 -9.7 0.66 0
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385840 134980126 1 SiO4C13H22 AB4C13D22 -230.36 4.57 -9.52 0.63 0
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385841 134980127 1 SiO6C15H24 AB6C15D24 -309.76 7.72 -9.77 0.18 0
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385843 134980132 1 CrO7C15H16 AB7C15D16 -4.83 1.27 -6.96 0.73 0
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385844 134980134 1 CrO7C15H16 AB7C15D16 -4.95 2.25 -7.26 0.68 0
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385845 134980135 1 CrO2C10H16 AB2C10D16 -18.05 2.7 -7.56 0.84 0
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385846 134980136 1 O7C16H18 A7B16C18 -234.51 4.59 -9.72 -0.79 0