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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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448119 135288614 1 FO2N8H21C27 AB2C8D21E27 77.07 8.34 -8.88 -2.5 0
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448120 135288620 1 SN2O6C52H76 AB2C6D52E76 -307.48 14.11 -9.54 -0.61 0
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448121 135288628 1 SN2O2F3C19H21 AB2C2D3E19F21 -232.13 1.31 -8.83 -1.03 0
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448122 135288634 1 Cl2O4N6H20C25 A2B4C6D20E25 -35.12 3.83 -9.76 -1.61 0
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448123 135288638 1 S2N9O11C62H85 A2B9C11D62E85 -437.93 5.4 -8.29 -0.92 0
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448124 135288648 1 O2F3N3C16H16 A2B3C3D16E16 -213.09 4.82 -9.78 -1.12 0
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448125 135288650 1 N6O8C45H78 A6B8C45D78 -411.38 5.89 -9.12 0.44 0
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448126 135288653 1 SCl2O2N8H16C23 AB2C2D8E16F23 109.82 6.04 -9.93 -1.8 0
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448127 135288654 1 Cl2O2N9H19C27 A2B2C9D19E27 117.68 4.09 -9.34 -1.57 0
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448128 135288675 1 N3O6C25H33 A3B6C25D33 -275.56 9.23 -8.5 -0.14 0
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448129 135288677 1 OSN9H27C29 ABC9D27E29 171.96 13.5 -8.43 -2.15 0
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448130 135288681 1 N10C27H30 A10B27C30 201.53 6.58 -8.13 -2.09 0
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448131 135288685 1 ON10C22H24 AB10C22D24 167.18 10.56 -8.02 -1.98 0
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448132 135288688 1 O2N8H20C25 A2B8C20D25 141.27 5.29 -8.69 -2.35 0
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448133 135288690 2 N5C14H16 A5B14C16 194.07 5.35 -8.13 -2.09 0
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448134 135288700 1 ON9H23C27 AB9C23D27 180.98 5.21 -8.84 -2.49 0
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448135 135288705 1 F3O3N5C33H40 A3B3C5D33E40 -213.37 12.07 -8.91 -0.92 0
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448136 135288707 1 ClOSN8H19C25 ABCD8E19F25 175.11 5.67 -8.69 -2.42 0
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448137 135288711 1 Cl3O3N7H18C28 A3B3C7D18E28 88.76 6.55 -9.34 -1.7 0
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448138 135288748 1 Cl2O3N7H21C29 A2B3C7D21E29 58.86 6.87 -9.17 -1.61 0
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448139 135288752 1 Cl2O2N7C27H27 A2B2C7D27E27 37.74 7.92 -9.42 -1.08 0
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448140 135288755 1 O3N6C36H44 A3B6C36D44 -32.09 7.21 -8.08 0.03 0
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448141 135288758 1 Cl2O2N8H20C29 A2B2C8D20E29 112.4 2.79 -9.32 -1.5 0
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448142 135288762 1 BrCl2O3N7H18C28 AB2C3D7E18F28 97.79 5.05 -9.69 -1.56 0
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448143 135288765 1 Cl2O2N9H21C28 A2B2C9D21E28 109.67 2.3 -8.27 -1.38 0
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448144 135288770 1 ON9H21C28 AB9C21D28 228.66 5.28 -8.67 -2.54 0
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448145 135288791 10 NC3H3 AB3C3 234.44 5.98 -8.12 -2.08 0
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448146 135288794 1 Cl2O2N8H22C27 A2B2C8D22E27 87.52 5.48 -9.72 -1.46 0
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448147 135288805 2 ON2C10H14 AB2C10D14 -31.35 3.62 -9.23 -0.16 0
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448148 135288812 1 N4O5C25H34 A4B5C25D34 -235.14 6.18 -9.31 -0.96 0
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448149 135288845 1 F2N2O4H36C37 A2B2C4D36E37 -180.87 7.27 -8.63 -0.74 0
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448150 135288846 1 ClN2C16H23 AB2C16D23 -26.02 2.37 -8.47 -0.08 1
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448151 135288858 1 N5O6C35H36 A5B6C35D36 -129.09 7.44 0.0 0.0 0
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448152 135288863 1 ON7H13C21 AB7C13D21 200.73 6.21 -8.65 -2.29 0
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448153 135288872 1 N2O4C7H18 A2B4C7D18 -138.56 5.26 -9.7 0.24 0
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448154 135288877 1 N7H21C22 A7B21C22 170.86 8.53 -7.93 -1.63 0
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448155 135288879 1 SN6H28C30 AB6C28D30 178.92 9.82 -8.16 -1.79 0
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448156 135288889 1 FN6H25C33 AB6C25D33 175.95 8.82 -8.36 -1.82 0
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448157 135288892 1 OSN6H28C31 ABC6D28E31 134.32 11.49 -8.34 -1.86 0
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448158 135288894 1 FSO3N7H26C34 ABC3D7E26F34 52.4 14.86 -8.38 -1.85 0
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448159 135288895 1 FSO3N7H26C34 ABC3D7E26F34 46.2 13.15 -8.07 -1.53 0
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448160 135288899 1 FON6H27C31 ABC6D27E31 105.13 9.2 -8.36 -1.78 0
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448161 135288901 1 OF2N6H22C28 AB2C6D22E28 56.42 7.4 -8.38 -1.9 0
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448163 135288904 1 FO2N7H34C35 AB2C7D34E35 51.22 12.62 -8.36 -1.82 0
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448164 135288911 1 O2N5H25C29 A2B5C25D29 107.39 4.89 -8.42 -1.93 0
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448165 135288912 1 OF3N3C17H20 AB3C3D17E20 -186.71 6.64 -9.23 -0.51 0
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448166 135288927 1 O2N5H15C23 A2B5C15D23 124.94 8.92 -8.39 -1.92 0
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448167 135288934 1 OSN5H17C25 ABC5D17E25 160.22 7.66 -8.52 -2.07 0
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448168 135288945 1 SN6H24C28 AB6C24D28 199.98 10.27 -8.3 -1.81 0
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448169 135288949 1 SN2O6C52H76 AB2C6D52E76 -304.48 12.45 -9.41 -0.52 0
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448170 135288959 1 FON8H31C32 ABC8D31E32 92.14 8.71 -8.44 -1.95 0
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448171 135288976 2 ClON3H10C12 ABC3D10E12 59.29 3.43 -9.69 -1.32 0
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448172 135288984 1 OSN6H24C28 ABC6D24E28 158.17 10.63 -8.39 -1.99 0
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448173 135288991 1 O2N6H24C27 A2B6C24D27 127.8 6.64 -8.33 -1.84 0
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448174 135289006 1 FON7H26C30 ABC7D26E30 117.38 9.99 -8.58 -2.04 0
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448175 135289022 1 SN7O7C47H77 AB7C7D47E77 -324.12 11.98 -8.87 -0.64 0
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448176 135289024 1 SCl2O2N8H20C25 AB2C2D8E20F25 103.47 11.36 -9.57 -1.45 0
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448177 135289043 1 FON6H25C31 ABC6D25E31 93.66 13.06 -8.48 -1.93 0
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448178 135289044 1 ON7H23C29 AB7C23D29 169.02 12.67 -8.52 -1.99 0
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448179 135289046 1 SF2N6H22C28 AB2C6D22E28 94.13 7.05 -8.39 -1.91 0
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448180 135289073 1 FSO3N7H28C31 ABC3D7E28F31 -1.45 4.8 -8.42 -1.86 0
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448181 135289075 1 FSO3N7H28C31 ABC3D7E28F31 2.84 11.4 -8.23 -1.67 0
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448182 135289080 2 ClO2N4H12C15 AB2C4D12E15 4.25 9.6 -9.17 -1.45 0
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448183 135289081 1 ON6H24C25 AB6C24D25 125.94 4.44 -8.09 -1.77 0
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448184 135289082 2 ClO2N3H14C16 AB2C3D14E16 -18.86 4.45 -8.8 -1.36 0
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448185 135289083 1 FSN6H23C31 ABC6D23E31 183.71 6.26 -8.39 -1.91 0
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448186 135289087 2 ON3H12C14 AB3C12D14 101.52 11.6 -8.32 -1.86 0
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448187 135289089 1 FON7C38H40 ABC7D38E40 86.12 7.41 -8.38 -1.85 0
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448188 135289091 1 Cl2O2N7H21C30 A2B2C7D21E30 98.77 2.73 -8.99 -1.52 0
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448189 135289108 1 FON6H27C31 ABC6D27E31 107.42 6.8 -8.49 -1.97 0
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448190 135289129 1 FO2N6H27C31 AB2C6D27E31 32.35 6.17 -8.41 -1.87 0
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448191 135289134 1 FO2N7C37H38 AB2C7D37E38 59.09 11.47 -8.41 -1.87 0
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448192 135289140 1 FON6H25C29 ABC6D25E29 108.8 10.59 -8.52 -1.99 0
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448193 135289145 1 FSO3N7H28C35 ABC3D7E28F35 41.09 6.03 -8.35 -1.82 0
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448194 135289147 1 FON6H27C34 ABC6D27E34 133.03 6.95 -8.5 -1.97 0