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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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215002 85083979 2 NO3H18C21 AB3C18D21 -133.73 5.29 -8.84 -0.77 0
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215003 85083981 1 SiN2O8C36H48 AB2C8D36E48 -249.1 7.39 -8.93 -1.32 0
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215004 85083982 1 SO5N6C35H48 AB5C6D35E48 -204.79 7.63 -8.45 -0.04 0
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215005 85083983 1 ClISO4N6H22C25 ABCD4E6F22G25 -11.19 4.57 -9.05 -1.06 0
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215006 85083984 2 SiO3C19H28 AB3C19D28 -337.79 3.08 -8.82 0.13 0
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215007 85083985 1 SnO4C37H38 AB4C37D38 -46.75 3.06 -8.98 0.35 0
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215008 85083986 1 S4N5O10H19C24 A4B5C10D19E24 -231.48 5.85 -9.05 -1.47 0
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215009 85083987 1 F3N5O7C32H42 A3B5C7D32E42 -464.79 3.24 -9.26 -0.24 0
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215010 85083989 1 BrSiO4C37H49 ABC4D37E49 -203.48 4.67 -8.95 -0.21 0
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215011 85083991 1 SN5O5C37H39 AB5C5D37E39 -134.36 8.08 -8.7 -0.55 0
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215012 85083992 1 S2F3O3N5C32H42 A2B3C3D5E32F42 -222.28 9.45 -8.13 -1.29 0
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215013 85083994 1 NO12C32H39 AB12C32D39 -480.14 4.77 -8.96 -1.85 0
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215014 85083995 2 NVO4H12C16 ABC4D12E16 -90.12 9.1 -7.18 -1.74 0
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215015 85083999 3 N2O3C11H14 A2B3C11D14 -310.4 9.83 -9.72 -0.86 0
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215016 85084002 1 N2O9C36H62 A2B9C36D62 -426.91 3.08 -8.93 0.33 0
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215017 85084003 2 S2C20H29 A2B20C29 41.54 1.58 -8.28 -1.27 0
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215018 85084004 3 NPO5C7H14 ABC5D7E14 -895.74 8.2 -9.39 -0.68 0
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215019 85084005 1 NPSi2O7C34H46 ABC2D7E34F46 -360.55 6.32 -8.83 -0.54 0
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215020 85084006 1 O2N5C42H61 A2B5C42D61 -49.4 9.77 -8.31 -0.1 0
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215021 85084007 1 N8O9C30H52 A8B9C30D52 -450.77 7.25 -9.6 0.04 0
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215022 85084009 1 SO5C41H64 AB5C41D64 -257.99 5.15 -8.8 -0.33 0
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215023 85084013 1 O3N5C41H59 A3B5C41D59 -82.98 9.32 -8.48 -0.11 0
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215024 85084015 1 F2N3O5H33C35 A2B3C5D33E35 -204.77 7.76 -9.03 -1.08 0
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215025 85084016 1 SiO11C35H45 AB11C35D45 -395.66 5.37 0.0 0.0 0
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215026 85084017 1 O12C35H58 A12B35C58 -605.82 5.54 -9.31 1.0 0
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215027 85084024 4 NO2C9H14 AB2C9D14 -418.87 1.96 -9.67 -0.34 0
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215028 85084025 1 O6C43H60 A6B43C60 -232.66 3.66 -9.07 -0.64 0
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215029 85084026 1 N3F4O9H27C32 A3B4C9D27E32 -466.37 5.76 -8.77 -1.08 0
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215030 85084027 1 N5O12C30H51 A5B12C30D51 -572.92 7.61 -9.99 -0.56 0
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215031 85084028 1 N9O10C28H51 A9B10C28D51 -488.69 0.23 -9.77 -0.44 0
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215032 85084030 1 NO4H43C46 AB4C43D46 42.2 1.68 -8.56 0.12 0
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215033 85084031 1 N3O8C37H59 A3B8C37D59 -297.17 3.58 -9.37 -1.45 0
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215034 85084032 1 OSN7C28H33 ABC7D28E33 128.41 12.02 -8.9 -0.65 0
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215035 85084034 1 F3O3N8C35H41 A3B3C8D35E41 -99.27 5.19 -8.2 -0.34 0
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215036 85084035 1 PN2O6H39C40 AB2C6D39E40 -201.26 2.4 -9.07 -0.23 -1
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215038 85084041 1 NO10C37H57 AB10C37D57 -456.73 11.26 -9.72 -0.4 0
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215039 85084042 1 BClF3N3O4C35H46 ABC3D3E4F35G46 -417.31 8.4 -9.42 -0.25 0
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215040 85084045 2 SN2O3C17H26 AB2C3D17E26 -294.17 4.86 -8.6 -0.72 0
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215041 85084046 2 SiO3C19H34 AB3C19D34 -391.82 5.4 -8.37 0.36 0
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215042 85084047 1 NO14C33H43 AB14C33D43 -495.13 1.87 -9.83 -0.66 0
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215043 85084048 1 O8N11C29H47 A8B11C29D47 -331.12 7.15 -9.17 -0.1 0
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215044 85084049 1 NO10C37H59 AB10C37D59 -434.32 3.66 -9.02 0.26 0
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215045 85084050 1 NSiO8C37H63 ABC8D37E63 -394.42 6.66 -8.53 -0.78 0
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215046 85084051 1 Cl2N3S3O4C31H33 A2B3C3D4E31F33 -34.63 7.63 -8.62 -0.95 0
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215047 85084054 2 O5C19H31 A5B19C31 -464.79 1.76 -8.81 -0.3 0
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215048 85084055 1 N2O9C37H62 A2B9C37D62 -411.09 4.27 -8.95 0.29 0
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215049 85084056 1 SiO5C43H54 AB5C43D54 -193.79 3.42 -8.72 0.06 0
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215050 85084057 1 BSnC39H81 ABC39D81 -153.46 0.71 -8.84 0.62 0
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215051 85084059 1 N7O12C29H41 A7B12C29D41 -543.39 11.74 -10.1 -0.46 0
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215052 85084060 1 N7O8C34H45 A7B8C34D45 -218.33 11.57 -8.62 -0.78 0