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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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226098 87323458 1 O4C23H30 A4B23C30 -164.8 2.43 -9.53 -0.06 0
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226099 87323562 1 NH7C8O8 AB7C8D8 -295.7 2.57 -10.94 -2.06 0
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226100 87323981 1 FNOH12C17 ABCD12E17 -5.86 4.09 -9.39 -0.96 0
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226101 87324119 1 OSC11H14 ABC11D14 -24.4 3.44 -9.03 -0.43 0
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226102 87324215 1 FNOH16C19 ABCD16E19 -18.37 1.48 -9.11 -0.73 0
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226103 87324641 1 Cl2S2N5O8H39C46 A2B2C5D8E39F46 -159.54 10.58 -8.56 -0.85 0
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226104 87325727 1 ON3C10H13 AB3C10D13 32.35 3.09 -9.42 -0.97 0
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226105 87325728 2 ClON2C8H9 ABC2D8E9 -74.63 6.35 -8.95 -0.91 0
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226106 87325740 1 OS2C6H12 AB2C6D12 9.9 2.44 -9.05 -1.36 0
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226107 87325741 1 SO2N9H23C24 AB2C9D23E24 95.21 12.69 -8.73 -1.44 0
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226108 87325752 1 ClSN4O5C24H29 ABC4D5E24F29 -150.38 7.54 -9.38 -1.23 0
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226109 87325754 1 N4O7H22C28 A4B7C22D28 -77.95 9.45 -9.47 -1.96 0
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226110 87325756 1 SN3O3H15C16 AB3C3D15E16 -26.95 0.92 -7.34 -0.66 0
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226111 87325763 1 ClSF3O6H12C13 ABC3D6E12F13 -375.3 6.39 -9.72 -1.66 0
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226112 87325776 2 N2C3H4 A2B3C4 86.03 3.3 -8.3 -0.6 0
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226113 87325781 1 SiO2C6H11 AB2C6D11 -0.16 2.12 0.0 0.0 0
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226114 87325783 1 SO10C12H26 AB10C12D26 -426.19 1.6 -9.97 -1.13 0
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226115 87325787 2 NOH13C19 ABC13D19 197.76 3.65 -8.4 -0.99 0
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226116 87325792 1 ClON6C25H25 ABC6D25E25 83.31 8.29 -9.17 -0.88 0
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226117 87325814 1 NO3C12H17 AB3C12D17 -74.66 3.31 -9.28 -0.03 0
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226118 87325815 1 BNF3O6C14H15 ABC3D6E14F15 -440.85 9.28 -9.23 -0.73 0
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226119 87325818 1 PSN5O11C31H58 ABC5D11E31F58 -637.61 16.96 -9.2 -0.16 0
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226120 87325819 1 PSN4O11C25H43 ABC4D11E25F43 -605.39 10.85 -9.11 0.01 0
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226121 87325820 1 PSN5O11C31H58 ABC5D11E31F58 -591.92 12.2 -7.94 -0.32 0
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226122 87325821 1 PSN4O11C25H43 ABC4D11E25F43 -566.52 6.32 -9.28 -0.16 0
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226123 87325822 2 NC21H25 AB21C25 148.54 0.64 -8.68 -0.42 0
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226124 87325824 1 F2N2S2O3C19H20 A2B2C2D3E19F20 -166.5 4.82 -9.16 -1.16 0
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226125 87325848 1 O3C12H26 A3B12C26 -167.5 6.54 -10.62 0.68 0
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226126 87325851 1 BrSCl3N3O4H17C21 ABC3D3E4F17G21 -98.97 3.67 -9.16 -1.18 0
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226127 87325853 1 ClO4C5H5 AB4C5D5 -169.97 4.69 -11.42 -1.08 0
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226128 87325854 2 O2N3C6H12 A2B3C6D12 -179.64 8.35 -9.26 0.12 0
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226129 87325855 1 NPH20C22 ABC20D22 104.29 0.99 -8.44 0.1 0
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226130 87325857 2 NO2F3C7H12 AB2C3D7E12 -506.5 12.19 -9.92 -0.36 0
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226131 87325861 1 N3O5C25H25 A3B5C25D25 -106.59 8.96 -9.23 -1.68 0
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226132 87325862 1 SN2O3C8H16 AB2C3D8E16 -153.27 7.37 -9.26 -0.87 0
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226133 87325864 1 ClF3S3N5O6C49H57 AB3C3D5E6F49G57 -293.97 12.0 -8.62 -1.0 0
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226134 87325865 1 SO2N6C20H22 AB2C6D20E22 -2.2 7.82 -9.07 -1.71 0
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226135 87325875 1 NO2C8H17 AB2C8D17 -53.15 3.97 -9.9 -0.09 0
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226136 87325881 1 S2N3O3H13C15 A2B3C3D13E15 -48.22 1.86 -8.45 -1.45 0
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226137 87325882 1 ClS3N5O6C47H54 AB3C5D6E47F54 -175.27 4.84 -8.59 -0.41 0
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226138 87325887 1 SiO4C10H22 AB4C10D22 -246.46 5.23 -9.33 0.64 0
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226139 87325889 1 N2O5H40C46 A2B5C40D46 -34.53 6.93 -8.25 -0.51 0
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226140 87325890 1 N2O5H40C46 A2B5C40D46 -34.83 5.94 -8.23 -0.66 1
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226141 87325894 1 INSO2C9H23 ABCD2E9F23 -87.58 7.59 0.0 0.0 0
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226142 87325896 1 O3N7C17H17 A3B7C17D17 6.92 12.96 -8.37 -1.05 0
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226143 87325897 4 O2C15H30 A2B15C30 -628.04 8.94 -10.39 0.26 0
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226144 87325898 1 O7C18H34 A7B18C34 -318.84 6.03 -10.44 0.03 -1
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226148 87325904 1 ClF3S3N5O6C47H55 AB3C3D5E6F47G55 -334.46 11.96 -8.63 -0.75 0
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226149 87325905 1 SN2O5C8H8 AB2C5D8E8 -144.94 1.55 -9.88 -1.29 0
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226150 87325906 1 SH2N2O5C6 AB2C2D5E6 -66.15 4.56 -10.99 -2.98 0