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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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178782 76382033 1 SN4O6C19H32 AB4C6D19E32 -230.61 4.34 -8.08 -0.67 0
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178783 76382034 1 S3N5O7C20H25 A3B5C7D20E25 -191.62 4.37 -8.85 -0.89 2
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178785 76382303 1 FO3C34H49 AB3C34D49 -216.65 1.88 -8.62 0.24 0
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178786 76382304 1 BrSN2O4C20H23 ABC2D4E20F23 -129.99 5.14 -9.45 -0.85 0
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178787 76382305 2 NSO2C8H13 ABC2D8E13 -207.44 7.68 -9.43 -0.58 0
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178788 76382309 1 SN2O6C15H24 AB2C6D15E24 -228.31 5.57 -8.13 -0.78 0
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178789 76382310 1 ClNS2O5H16C21 ABC2D5E16F21 -95.71 4.69 -9.18 -1.9 0
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178790 76382573 2 N2O2C18H23 A2B2C18D23 -110.47 1.87 -9.22 -1.0 0
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178791 76382909 1 S2O12N13C80H95 A2B12C13D80E95 -359.54 10.84 -7.98 -1.02 1
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178792 76382910 1 S2O12N13C80H96 A2B12C13D80E96 -358.53 3.0 0.0 0.0 0
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178793 76382911 1 O7N8C28H42 A7B8C28D42 -279.57 5.52 -9.32 -0.48 0
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178794 76383740 1 FNO3H18C19 ABC3D18E19 -119.68 3.98 -9.81 -0.37 0
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178795 76383741 1 NO3C20H21 AB3C20D21 -79.46 4.67 -9.41 0.03 0
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178796 76383742 1 N5O17C49H79 A5B17C49D79 -694.07 8.47 -8.87 -1.77 0
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178797 76383743 2 N2O8C26H43 A2B8C26D43 -743.58 7.45 -8.44 -0.2 0
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178798 76383744 1 BrNO5H22C24 ABC5D22E24 -146.32 6.61 -8.99 -1.48 0
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178799 76383745 1 NO5H21C24 AB5C21D24 -126.66 5.67 -8.54 -1.27 0
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178800 76383746 1 F3N4O7C24H29 A3B4C7D24E29 -423.29 4.95 -9.94 -0.57 0
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178801 76383747 1 N4O5C22H28 A4B5C22D28 -180.67 2.39 -9.37 -0.1 0
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178802 76383760 1 NSSi2O4C35H65 ABC2D4E35F65 -287.93 3.93 -8.85 -0.68 0
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178803 76383976 1 N5O7C41H55 A5B7C41D55 -324.64 7.37 -8.49 -0.04 0
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178804 76384196 1 SN3O3C20H31 AB3C3D20E31 -116.5 1.7 -8.55 -0.05 0
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178805 76384484 1 N4O11C49H64 A4B11C49D64 -482.46 5.34 -9.3 -0.42 0
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178806 76384576 1 SN2O4C24H30 AB2C4D24E30 -111.78 4.3 -9.22 -1.35 0
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178807 76384577 1 NSO5C27H39 ABC5D27E39 -214.14 2.94 -9.09 -1.22 0
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178808 76385075 1 N5O9C40H45 A5B9C40D45 -275.13 8.56 -7.97 -1.92 0
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178809 76385176 1 SO6C17H24 AB6C17D24 -255.98 5.72 -9.2 -0.15 0
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178810 76385533 1 O16N22C57H88 A16B22C57D88 -617.63 6.95 -8.86 -0.58 0
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178811 76385721 1 NO6C25H33 AB6C25D33 -242.9 3.61 -8.59 -0.13 0
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178812 76385739 1 N2O4C19H20 A2B4C19D20 -98.15 3.27 -9.27 -1.15 0
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178813 76385835 1 INO2C15H18 ABC2D15E18 -31.75 3.39 -8.99 -1.18 0
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178814 76385836 1 INOC17H22 ABCD17E22 -19.88 2.75 -8.87 -0.96 0
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178815 76385837 1 INO2C20H20 ABC2D20E20 -2.56 2.92 -9.02 -1.11 0
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178816 76385838 1 INOC20H20 ABCD20E20 30.35 3.59 -8.97 -0.96 0
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178817 76385839 1 INO2C16H20 ABC2D16E20 -43.97 2.08 -8.95 -1.11 0
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178818 76385840 1 FON2C22H29 ABC2D22E29 -91.06 4.96 -8.84 0.35 0
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178819 76385841 1 N3O3C22H29 A3B3C22D29 -34.72 8.14 -8.33 -0.45 0
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178820 76385842 1 FON2C22H29 ABC2D22E29 -90.49 4.76 -8.76 0.4 0
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178821 76385843 2 SO8C20H22 AB8C20D22 -628.8 6.98 -8.69 -0.74 0
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178822 76385844 1 SO12C31H34 AB12C31D34 -448.88 3.58 -8.7 -0.19 0
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178823 76385960 1 ClKO4C24H40 ABC4D24E40 -319.32 9.87 -8.99 -0.01 0
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178824 76385961 1 ClN4O4H19C21 AB4C4D19E21 -67.23 6.27 -8.83 -1.56 0
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178825 76385962 1 FN4O4H19C21 AB4C4D19E21 -105.57 6.35 -8.81 -1.53 0
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178826 76385963 1 N5O5H21C22 A5B5C21D22 -32.59 5.94 -8.86 -2.12 0
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178827 76386226 1 FN3O10C41H60 AB3C10D41E60 -329.81 7.02 -8.68 -0.23 0
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178828 76386247 2 O2N3C6H9 A2B3C6D9 -89.77 7.21 -9.74 -1.17 0
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178829 76386464 1 ClFSN2O3C42H44 ABCD2E3F42G44 -80.01 1.97 -9.3 -1.1 0
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178830 76386778 1 N3O9C26H31 A3B9C26D31 -347.3 7.0 -9.32 -1.19 0
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178831 76386779 1 SF3N3O6C32H48 AB3C3D6E32F48 -469.09 10.86 -9.57 -1.24 0
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178832 76386780 1 SF3N3O4C31H48 AB3C3D4E31F48 -378.63 4.75 -9.25 -1.23 0