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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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221745 85286100 1 SO5N6C32H44 AB5C6D32E44 -148.02 5.46 -8.57 -0.69 0
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221746 85286101 1 N2S2O6H32C33 A2B2C6D32E33 -149.68 9.44 -8.55 -0.72 0
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221747 85286102 1 O9C35H52 A9B35C52 -365.93 6.38 -9.77 -0.7 0
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221748 85286103 1 N4O7C33H52 A4B7C33D52 -355.21 5.15 -9.36 -0.03 0
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221749 85286104 1 SO7C35H52 AB7C35D52 -294.68 7.18 -9.28 -0.65 0
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221750 85286105 1 N2Si3O6C29H60 A2B3C6D29E60 -434.34 1.94 -8.85 0.56 0
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221751 85286106 1 Si3O6C31H64 A3B6C31D64 -444.22 1.11 -9.19 0.19 0
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221752 85286107 1 P2N5O15C18H29 A2B5C15D18E29 -727.46 9.64 -9.55 -1.02 0
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221753 85286108 1 N3O8C34H41 A3B8C34D41 -268.11 4.17 -8.72 -0.04 0
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221754 85286109 1 N7O8C29H43 A7B8C29D43 -302.14 13.93 -9.22 -1.0 0
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221756 85286111 1 ClS4O6N7C20H20 AB4C6D7E20F20 -76.51 4.21 -8.45 -1.08 0
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221757 85286112 1 ClS4O6N7C20H20 AB4C6D7E20F20 -68.25 11.03 -8.76 -1.28 0
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221758 85286113 2 INSO2C8H8 ABCD2E8F8 -50.51 1.89 -9.98 -1.38 0
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221759 85286114 1 CuN4C38H42 AB4C38D42 269.03 4.29 0.0 0.0 0
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221760 85286115 2 N2C19H22 A2B19C22 279.71 29.36 -5.91 -1.96 0
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221761 85286116 1 N2F3O11H21C28 A2B3C11D21E28 -527.38 1.53 -9.76 -1.58 0
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221762 85286117 1 SCl2O4N5C29H33 AB2C4D5E29F33 -136.07 5.84 -8.54 -0.56 0
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221763 85286118 1 N6O7C32H38 A6B7C32D38 -262.45 4.16 -8.26 -0.37 0
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221764 85286119 1 N2O7C36H46 A2B7C36D46 -264.34 4.18 -9.35 -0.24 0
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221765 85286120 1 SiN2O7C34H44 AB2C7D34E44 -263.8 6.2 -9.38 0.1 0
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221767 85286122 1 O5C40H58 A5B40C58 -238.96 6.74 -8.77 -0.74 0
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221768 85286123 1 O5C40H58 A5B40C58 -218.93 2.99 -9.03 0.39 0
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221769 85286125 1 F2N5O5C33H35 A2B5C5D33E35 -254.06 6.76 -8.96 -0.56 0
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221770 85286126 1 O8N9C27H41 A8B9C27D41 -341.32 5.53 -9.83 -0.5 0
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221771 85286127 1 N3O8C33H53 A3B8C33D53 -355.51 4.89 -8.53 0.74 0
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221772 85286128 1 NO5C40H45 AB5C40D45 -132.96 1.71 -9.21 -0.05 0
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221773 85286129 1 N3O5C37H53 A3B5C37D53 -194.37 8.18 -9.27 0.03 0
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221774 85286130 1 SiO8C34H54 AB8C34D54 -416.05 3.56 -8.99 -0.7 0
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221775 85286131 1 NO5C39H57 AB5C39D57 -199.21 4.36 -8.6 0.44 0
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221776 85286132 1 NO5C39H57 AB5C39D57 -198.12 5.15 -8.62 0.38 0
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221777 85286133 1 ClN3O6C34H38 AB3C6D34E38 -236.43 3.51 -8.49 -0.53 0
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221781 85286137 1 O11C33H48 A11B33C48 -545.13 3.09 -10.09 0.44 0
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221783 85286139 4 O2C9H15 A2B9C15 -421.55 1.85 -9.18 0.93 0
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221784 85286140 1 ClSO4N6C31H41 ABC4D6E31F41 -115.11 7.62 -8.54 -0.67 0
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221785 85286141 1 ION3S3C26H28 ABC3D3E26F28 47.41 10.25 -7.8 -1.2 0
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221786 85286142 1 InO12C24H30 AB12C24D30 -373.95 6.49 0.0 0.0 0
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221787 85286143 2 O8C14H15 A8B14C15 -624.46 6.66 -9.01 -1.13 0
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221788 85286144 2 O6C16H23 A6B16C23 -506.26 3.61 -9.44 0.52 0
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221789 85286145 1 N2O9C34H42 A2B9C34D42 -331.44 5.96 -8.57 -1.09 0
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221790 85286146 1 N2S2O5H30C35 A2B2C5D30E35 -67.69 5.65 -8.73 -0.67 0
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221791 85286147 2 O2N3C18H21 A2B3C18D21 -108.93 2.23 -8.9 -0.46 0
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221792 85286148 1 SiN2O8C33H44 AB2C8D33E44 -385.43 3.5 -9.08 -0.07 0
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221793 85286149 1 N2Br3O8H11C18 A2B3C8D11E18 -145.5 3.68 -10.0 -1.6 0
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221794 85286150 1 Br2N5O5C24H25 A2B5C5D24E25 -139.77 4.28 -8.95 -1.3 0
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221795 85286151 1 BrN4O6C29H43 AB4C6D29E43 -330.79 5.34 -8.26 -0.29 0
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221796 85286152 1 BrNO8H30C31 ABC8D30E31 -279.05 4.37 -8.31 -1.14 2
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221797 85286153 1 FeN2O4C36H44 AB2C4D36E44 -88.77 6.64 -6.89 -0.73 0
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221798 85286154 1 N2O4C31H39 A2B4C31D39 -121.7 3.12 0.0 0.0 0
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221799 85286155 1 SN2O10C31H32 AB2C10D31E32 -355.3 1.21 -8.95 -1.31 0
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221802 85286158 1 O7C39H44 A7B39C44 -160.79 5.28 -8.88 0.07 0
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221803 85286159 1 SSiO7C34H44 ABC7D34E44 -304.85 5.74 -8.91 -0.95 0
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221804 85286160 1 SiO9C33H56 AB9C33D56 -403.95 5.25 -8.74 0.01 0
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221805 85286161 1 NiO2N4C36H46 AB2C4D36E46 251.59 5.51 -7.64 -3.74 0
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221806 85286162 1 MnS2N4O4H28C30 AB2C4D4E28F30 85.98 5.08 0.0 0.0 0
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221807 85286163 1 N3O8C34H47 A3B8C34D47 -389.14 5.43 -9.49 0.07 0
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221808 85286164 1 SSiN3O4C35H39 ABC3D4E35F39 -106.54 7.83 -9.12 -0.71 0
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221809 85286165 1 NSiO7C34H63 ABC7D34E63 -443.26 3.93 -8.86 0.61 0
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221810 85286166 1 N2O16C25H42 A2B16C25D42 -715.62 7.66 -10.19 0.37 0
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221811 85286167 1 FN6O6H31C33 AB6C6D31E33 -161.75 2.62 -9.27 -1.29 0
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221812 85286168 1 N6O13C24H46 A6B13C24D46 -595.86 4.22 -9.65 0.44 0
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221813 85286169 1 SO13C29H38 AB13C29D38 -573.07 2.07 -9.01 -0.79 0
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221814 85286170 1 FSN2O7C33H39 ABC2D7E33F39 -259.03 3.54 -8.56 -0.07 0
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221815 85286171 1 N6O7C32H46 A6B7C32D46 -334.15 3.73 -9.16 -0.38 0
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221816 85286172 1 F3S4N5O6C21H24 A3B4C5D6E21F24 -288.88 6.67 -8.4 -1.49 0
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221817 85286173 1 O4S4N5C19H23 A4B4C5D19E23 -80.81 9.05 -9.03 -0.85 0
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221818 85286174 2 Br2O3C8H10 A2B3C8D10 -267.66 4.9 -10.26 -1.15 0
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221819 85286175 1 Br2O3C8H10 A2B3C8D10 -131.42 2.86 -10.63 -1.23 0
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221821 85286177 1 FSi3O4N5C28H54 AB3C4D5E28F54 -356.8 4.32 -8.91 -0.5 0
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221822 85286178 2 NO8C13H17 AB8C13D17 -724.04 5.98 -10.26 -0.15 0
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221823 85286179 2 NO8C13H16 AB8C13D16 -607.59 3.5 -9.98 -1.2 0
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221825 85286181 1 N2O2H33C34 A2B2C33D34 64.54 4.42 0.0 0.0 0
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221826 85286182 1 SN2O8H32C34 AB2C8D32E34 -178.98 6.2 -8.82 -0.58 0
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221827 85286183 2 N2O2C19H23 A2B2C19D23 -82.58 1.4 -9.08 0.18 0
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221828 85286184 2 O3C20H26 A3B20C26 -180.51 5.19 -8.63 -0.88 0
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221829 85286185 1 SiN2O4C38H52 AB2C4D38E52 -133.68 2.62 -9.02 -0.64 1