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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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168815 75022458 1 NO2C25H37 AB2C25D37 -100.25 5.56 -8.27 -0.21 0
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168816 75022525 1 ClO4N6C19H23 AB4C6D19E23 -89.26 4.54 -8.91 -0.58 0
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168817 75022747 1 ClNO4C22H26 ABC4D22E26 -152.88 3.21 -8.4 -1.13 0
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168818 75022817 5 OC5H8 AB5C8 -202.48 5.6 -9.37 0.86 0
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168819 75022818 1 F3N3O3H30C35 A3B3C3D30E35 -192.37 4.73 -8.86 -0.83 1
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168820 75022887 1 SN3O4C27H36 AB3C4D27E36 -134.64 10.86 0.0 0.0 0
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168821 75023225 1 ClFO2N5C35H43 ABC2D5E35F43 -86.53 4.31 -8.6 -0.08 0
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168822 75023517 1 ClON4C23H27 ABC4D23E27 48.77 3.6 -8.71 -0.69 0
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168823 75023518 2 O2C17H33 A2B17C33 -321.73 3.1 -9.62 1.42 0
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168824 75023519 1 O4C21H40 A4B21C40 -257.46 4.75 -9.66 1.58 0
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168825 75023739 1 O15N17C68H101 A15B17C68D101 -672.4 14.86 -8.74 -0.24 0
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168826 75024195 1 SN8O8C29H42 AB8C8D29E42 -324.02 2.68 -9.26 -0.54 0
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168827 75024499 1 O2N3F4C27H35 A2B3C4D27E35 -274.17 1.87 -8.84 -0.74 0
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168828 75024500 1 ClON3C26H36 ABC3D26E36 -42.67 2.57 -8.72 -0.09 0
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168829 75024501 1 ClN3S3O4H18C20 AB3C3D4E18F20 -59.9 8.83 -8.92 -1.24 0
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168830 75024502 1 FNSO2H20C22 ABCD2E20F22 -68.41 5.21 -9.32 -0.82 0
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168831 75024555 1 N4O8C37H40 A4B8C37D40 -144.68 9.31 -6.6 -0.99 0
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168832 75024697 1 SO2N4C24H32 AB2C4D24E32 -48.03 5.14 -9.11 -0.68 0
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168833 75024698 1 BrSN2O4C20H21 ABC2D4E20F21 -136.68 3.67 -9.47 -0.44 0
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168834 75024830 1 O13N15C66H89 A13B15C66D89 -482.45 12.52 -8.69 -0.4 0
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168835 75024957 1 NSO4C21H25 ABC4D21E25 -122.46 6.22 -8.44 -1.35 0
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168836 75025669 1 NO4C27H33 AB4C27D33 -113.05 3.27 -8.73 -0.13 0
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168837 75025776 1 N2O7C32H32 A2B7C32D32 -152.97 9.56 -9.13 -1.57 0
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168838 75025779 1 BrN2O6H23C32 AB2C6D23E32 -52.86 9.74 -8.79 -1.59 0
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168839 75025926 1 SN4O5C26H30 AB4C5D26E30 -69.22 7.38 -9.13 -0.8 0
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168840 75025927 1 BrSN4O5C25H27 ABC4D5E25F27 -53.74 6.25 -8.63 -0.57 0
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168841 75026154 2 O2N3C25H36 A2B3C25D36 -65.88 7.52 -8.79 -0.78 0
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168842 75026537 1 N32O34C117H192 A32B34C117D192 -1711.63 17.14 -9.01 -0.04 0
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168843 75026711 1 O2N3C28H35 A2B3C28D35 -56.66 2.88 -9.38 -0.28 0
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168844 75026750 1 SN7O8C33H47 AB7C8D33E47 -332.83 7.15 -8.43 -0.11 0
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168845 75026789 1 F2N4O4C25H26 A2B4C4D25E26 -137.79 6.42 -8.13 -1.03 0
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168846 75027044 1 BrN2O2H19C20 AB2C2D19E20 -27.85 5.52 -9.4 -0.69 0
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168847 75027045 1 BrCl2N2O2H13C18 AB2C2D2E13F18 -26.93 7.31 -9.67 -0.86 0
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168848 75027046 1 BrClN2O2F3H13C19 ABC2D2E3F13G19 -179.04 7.36 -9.69 -1.21 0
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168849 75027190 2 NO8C25H27 AB8C25D27 -545.58 8.28 -9.87 -0.8 0
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168850 75027674 1 FS2Cl3O3N6H16C29 AB2C3D3E6F16G29 93.24 6.89 -8.83 -1.66 0
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168851 75027919 1 ClON2C19H19 ABC2D19E19 23.56 4.11 -8.58 -0.8 0
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168852 75027987 1 O11N12C38H64 A11B12C38D64 -458.11 10.61 -9.69 -1.21 0
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168853 75028263 1 SN2O6C26H30 AB2C6D26E30 -167.44 7.74 -9.69 -0.11 0
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168854 75028383 1 N2O5C20H22 A2B5C20D22 -96.84 3.77 -9.61 -1.57 0
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168855 75028384 1 O2N6C15H20 A2B6C15D20 -17.85 3.75 -9.48 0.05 0
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168856 75028709 1 N5O6C15H23 A5B6C15D23 -199.26 2.06 -9.38 -1.32 0
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168857 75028710 1 SN4O4C11H14 AB4C4D11E14 -106.49 3.04 -9.0 -1.14 0
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168858 75028711 1 S2O4N5H17C18 A2B4C5D17E18 -47.46 3.23 -8.7 -1.25 0
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168859 75028712 1 SO4N5C16H17 AB4C5D16E17 -69.02 3.16 -8.59 -1.1 0
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168860 75028713 1 N5O5C16H21 A5B5C16D21 -131.38 4.77 -9.41 -1.34 0
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168861 75028714 1 ClO3N4C22H23 AB3C4D22E23 -81.01 3.02 -9.06 -1.0 0
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168862 75028737 1 ISN4O4C17H17 ABC4D4E17F17 -57.88 2.61 -8.51 -1.14 0
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168863 75029114 1 N3O4C17H17 A3B4C17D17 -104.31 4.27 -9.36 -1.5 0
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168864 75029848 1 ClO2N3H28C31 AB2C3D28E31 0.99 5.32 -8.33 -0.46 0