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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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219742 85164730 1 BO6C36H39 AB6C36D39 -174.7 2.97 -9.15 0.01 0
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219743 85164731 2 N2O4C15H17 A2B4C15D17 -289.88 0.92 -9.5 -0.94 0
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219744 85164732 1 SN2O8C30H32 AB2C8D30E32 -262.77 2.28 -9.23 -0.51 0
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219745 85164752 1 SiO6C33H60 AB6C33D60 -406.34 6.11 -8.85 0.75 0
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219746 85164755 1 F3O3N7C16H18 A3B3C7D16E18 -142.59 1.93 -9.41 -1.79 0
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219747 85164767 1 NO5C36H55 AB5C36D55 -244.16 9.57 -9.48 -0.65 1
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219748 85164773 1 S3N4O6H23C26 A3B4C6D23E26 18.76 9.66 0.0 0.0 0
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219749 85164783 1 N7O7C27H49 A7B7C27D49 -376.78 6.41 -9.55 0.03 0
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219750 85164818 1 NSSiF3O5C27H52 ABCD3E5F27G52 -432.23 11.01 -9.91 -0.88 0
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219751 85164823 1 Si2F3O5C29H47 A2B3C5D29E47 -481.86 4.28 -8.82 -0.41 0
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219752 85164828 1 Cl2N3O7C27H41 A2B3C7D27E41 -367.34 2.01 -9.64 -0.85 0
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219753 85164829 1 FO6N8H27C28 AB6C8D27E28 -87.72 9.68 -9.44 -1.64 0
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219754 85164852 1 N2O7C34H44 A2B7C34D44 -273.93 4.51 -8.79 -0.38 0
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219755 85164855 2 N3O3C15H26 A3B3C15D26 -280.42 4.74 -9.18 -0.17 0
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219756 85164857 1 SiO4C38H44 AB4C38D44 -119.03 3.78 -9.0 0.07 0
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219757 85164858 2 NSiO3C15H26 ABC3D15E26 -305.45 3.18 -8.85 -0.63 1
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219758 85164859 1 N2Si2O6C30H53 A2B2C6D30E53 -302.41 4.75 0.0 0.0 0
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219759 85164860 1 Si2O4C35H52 A2B4C35D52 -240.18 1.37 -8.74 0.17 0
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219760 85164863 1 SN3O8C30H31 AB3C8D30E31 -199.7 5.57 -9.08 -1.06 0
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219761 85164867 1 SO5N7C29H35 AB5C7D29E35 -111.73 6.89 -8.7 -0.74 1
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219762 85164869 1 OS2N3C23H24 AB2C3D23E24 48.09 3.51 0.0 0.0 0
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219763 85164870 1 ClS2O3N5H28C29 AB2C3D5E28F29 5.24 5.89 -8.6 -0.91 0
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219764 85164872 2 O4H17C18 A4B17C18 -197.05 1.82 -8.43 -0.75 0
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219765 85164873 1 SiO14C25H42 AB14C25D42 -677.67 6.54 -9.81 0.43 0
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219766 85164874 1 N4O7C32H42 A4B7C32D42 -292.67 5.28 -9.21 -0.27 0
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219767 85164875 2 O5C16H25 A5B16C25 -409.23 13.45 -9.29 -2.38 0
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219768 85164877 1 SiO7C34H46 AB7C34D46 -281.15 2.56 -8.04 -0.41 0
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219769 85164878 3 NO2C12H13 AB2C12D13 94.3 2.81 -8.6 -1.12 0
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219770 85164879 1 N3O9C31H37 A3B9C31D37 -334.47 8.77 -9.59 -1.31 0
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219771 85164880 1 N3O5H29C37 A3B5C29D37 12.29 9.16 -9.06 -0.87 0
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219772 85164881 1 SN7O8C25H37 AB7C8D25E37 -310.51 6.04 -9.2 -0.68 0
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219773 85164882 1 N3O7C33H45 A3B7C33D45 -317.62 3.64 -9.58 -0.06 0
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219774 85164883 1 SO4N5C32H45 AB4C5D32E45 -162.22 5.85 -8.16 -0.62 0
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219775 85164884 1 Cl2N3O4C32H35 A2B3C4D32E35 -155.91 3.66 -9.4 -0.4 0
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219776 85164885 1 SN4O12C24H28 AB4C12D24E28 -279.48 6.45 -10.08 -1.35 0
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219777 85164886 1 F4N4O4H28C31 A4B4C4D28E31 -276.65 1.95 -8.91 -0.81 0
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219778 85164887 1 SiO10C31H36 AB10C31D36 -370.27 5.76 -9.58 -0.83 0
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219779 85164888 1 SiO6C34H64 AB6C34D64 -391.02 5.16 -8.52 0.39 0
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219780 85164889 1 SnN2O3C29H54 AB2C3D29E54 -168.97 6.36 -9.46 0.01 0
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219781 85164890 1 O6N11C26H35 A6B11C26D35 -126.79 4.4 -8.58 -1.16 0
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219782 85164891 1 N3O8C32H43 A3B8C32D43 -305.56 3.02 -8.85 -0.11 0
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219783 85164892 1 N5O5C34H39 A5B5C34D39 -159.71 6.29 -8.61 -0.18 0
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219784 85164893 1 N3S3O6H27C28 A3B3C6D27E28 -96.53 5.46 -8.94 -0.83 0
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219785 85164894 1 NSSiO7C31H39 ABCD7E31F39 -251.05 4.41 -8.84 -0.04 0
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219786 85164895 1 ClSO4N5H24C31 ABC4D5E24F31 -6.12 9.42 -8.32 -1.02 0
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219787 85164896 2 S2F3O3C10H10 A2B3C3D10E10 -476.97 10.78 -9.51 -1.54 2
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219788 85164897 2 SC9H10 AB9C10 56.3 0.1 -8.76 -0.12 0
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219789 85164898 1 N4O9C30H38 A4B9C30D38 -375.05 10.07 -9.72 -0.25 0
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219790 85164899 1 N4O5C35H42 A4B5C35D42 -100.13 3.67 -7.8 -1.04 0
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219791 85164900 1 O2N4C39H42 A2B4C39D42 48.84 7.46 -8.87 -0.2 0