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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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188810 77769778 2 NO7C22H26 AB7C22D26 -445.31 7.32 -8.49 -0.8 0
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188811 77769779 1 O4N5C29H37 A4B5C29D37 -134.52 6.15 -9.24 -0.09 1
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188812 77769791 1 NPO5C18H27 ABC5D18E27 -228.49 6.58 0.0 0.0 0
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188813 77770022 1 ClN2O3C13H19 AB2C3D13E19 -159.07 4.69 -9.75 -0.08 0
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188814 77770023 1 N2O3C13H18 A2B3C13D18 -114.91 4.58 -9.72 -0.07 0
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188815 77770317 1 N4O7C31H42 A4B7C31D42 -285.85 6.74 -9.32 -0.35 0
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188816 77770451 1 SN3O7C25H43 AB3C7D25E43 -291.67 3.93 -9.3 -0.1 0
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188817 77770573 1 N2O5C30H42 A2B5C30D42 -233.64 6.26 -9.31 0.0 0
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188818 77770871 1 ClN3O4C23H26 AB3C4D23E26 -160.61 4.27 -9.6 -0.45 0
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188819 77770872 2 O2N3C12H12 A2B3C12D12 -82.66 8.18 -8.99 -0.71 0
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188820 77770873 1 O2N3C22H37 A2B3C22D37 -112.74 4.15 -8.93 0.42 0
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188821 77770874 1 N2O6C23H36 A2B6C23D36 -279.85 6.39 -9.68 0.06 0
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188822 77770875 1 N4O8C29H36 A4B8C29D36 -323.66 4.0 -9.51 -0.22 0
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188823 77770898 1 ClNO2C27H30 ABC2D27E30 -40.3 3.65 -8.58 -0.51 0
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188824 77771284 1 N4O4C31H32 A4B4C31D32 -70.81 3.61 -9.56 -0.97 0
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188825 77771307 1 ClSN6O7C25H35 ABC6D7E25F35 -269.06 7.53 -8.73 -1.12 0
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188826 77771308 1 SN4O5C34H52 AB4C5D34E52 -238.19 9.61 -9.33 -0.31 0
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188827 77771309 1 NO6C23H25 AB6C23D25 -240.67 1.42 -8.85 -0.46 0
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188828 77771310 1 FNO2C24H24 ABC2D24E24 -58.67 1.52 -8.18 -0.1 0
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188829 77772088 1 SO3N7C26H27 AB3C7D26E27 6.56 11.65 -8.93 -0.81 0
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188830 77772314 1 N3O4C32H33 A3B4C32D33 -72.79 5.14 -9.06 -0.82 0
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188831 77772481 1 O2N8C19H20 A2B8C19D20 62.06 11.66 -9.12 -1.09 0
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188832 77772482 2 ClN2O2C14H15 AB2C2D14E15 -115.34 7.67 -9.13 -0.38 0
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188833 77772483 1 N2O3C15H22 A2B3C15D22 -105.35 1.0 -9.48 -0.39 0
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188834 77772643 1 O4N7C37H45 A4B7C37D45 -87.7 3.73 -8.88 -0.44 0
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188835 77772644 1 N2O3C10H18 A2B3C10D18 -141.34 6.45 -10.18 0.41 0
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188836 77772862 1 N3O5C39H39 A3B5C39D39 -131.03 6.39 -9.51 -0.25 0
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188837 77772903 1 SCl2N3O4C36H37 AB2C3D4E36F37 -110.28 2.84 -8.82 -0.39 0
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188838 77772904 1 N4O5C23H28 A4B5C23D28 -163.4 7.37 -8.78 -0.39 0
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188839 77772905 1 O2N3C27H37 A2B3C27D37 -66.55 3.82 -8.25 -0.28 0
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188840 77772906 1 S2N3O5C26H35 A2B3C5D26E35 -177.36 3.14 -8.98 -1.43 0
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188841 77772907 1 Br2N2O5H22C24 A2B2C5D22E24 -128.24 3.92 -9.3 -1.76 0
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188842 77772908 1 SN2O4C24H26 AB2C4D24E26 -110.09 5.09 -8.6 -0.85 0
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188843 77773169 1 ON2C12H18 AB2C12D18 -16.8 4.89 -9.04 -0.05 0
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188844 77773365 2 N2O3C17H27 A2B3C17D27 -307.7 4.71 -9.3 0.22 0
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188845 77773930 1 SN3O5C15H21 AB3C5D15E21 -188.8 4.41 -9.71 -0.59 0
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188846 77773958 1 O2N5C28H49 A2B5C28D49 -62.87 3.6 -8.56 0.74 0
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188847 77774056 1 NNaSC5H9 ABCD5E9 0.79 11.88 0.0 0.0 0
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188848 77774174 1 ClSF2N5O8C36H48 ABC2D5E8F36G48 -443.53 5.47 -9.95 -1.08 0
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188849 77774294 1 NPO7C12H20 ABC7D12E20 -409.02 3.15 -10.72 -0.15 0
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188850 77774488 1 SO2F3N3H6C12 AB2C3D3E6F12 -140.13 3.65 -9.6 -1.7 0
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188851 77774489 1 NO9C46H79 AB9C46D79 -359.68 5.9 -8.53 0.68 0
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188852 77774490 1 SN5O9C31H45 AB5C9D31E45 -347.41 8.32 -9.28 -0.59 0
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188853 77774491 1 SN7O7C27H33 AB7C7D27E33 -172.31 4.59 -9.22 -0.74 0
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188854 77774492 1 SF3N3O6C26H30 AB3C3D6E26F30 -316.55 3.89 -9.07 -1.03 0
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188855 77774612 1 N7O13C41H63 A7B13C41D63 -628.83 4.71 -9.21 -0.66 0
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188856 77775335 1 SN4O6C31H38 AB4C6D31E38 -162.56 6.27 -9.36 -0.77 0
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188857 77775336 1 O3N4C24H30 A3B4C24D30 -81.91 9.1 -8.59 -0.38 0
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188858 77775337 1 ClFO2N5C22H23 ABC2D5E22F23 -50.79 3.86 -9.34 -1.03 0
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188859 77775562 1 ClO2N3C19H20 AB2C3D19E20 -50.16 3.32 -8.96 -0.71 0