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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