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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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224872 85532721 1 SN4O10H30C48 AB4C10D30E48 -176.46 10.12 -9.1 -2.88 0
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224873 85538723 1 O3H16C21 A3B16C21 -24.71 1.72 -9.02 -0.36 0
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224874 85540280 1 NOBr2C12H13 ABC2D12E13 -19.96 3.84 -9.47 -0.87 -1
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224875 85542273 1 O4C7H9 A4B7C9 -151.36 1.77 0.0 0.0 0
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224876 85543066 1 BrO2N4H7C9 AB2C4D7E9 27.57 3.62 -10.27 -2.25 0
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224877 85547195 1 ON3H25C32 AB3C25D32 129.64 4.35 -8.68 -0.6 0
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224878 85548096 1 O4C41H74 A4B41C74 -311.48 2.34 -9.48 -0.44 0
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224879 85548125 1 NO2S3C10H11 AB2C3D10E11 -36.7 4.4 -9.35 -1.01 0
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224880 85548918 1 ClSiO2C11H19 ABC2D11E19 -141.9 3.06 -8.84 -0.79 0
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224882 85560552 1 NO2C16H25 AB2C16D25 -106.11 3.44 -8.68 0.14 0
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224883 85561784 1 SnO3C19H42 AB3C19D42 -205.87 4.86 -9.17 0.61 0
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224884 85575077 2 OC6H10 AB6C10 -97.87 1.9 -9.1 0.25 0
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224885 85583237 1 NS2O6C32H59 AB2C6D32E59 -362.2 1.84 -9.45 -1.01 0
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224887 85595963 2 OC6H9 AB6C9 -97.99 3.33 -9.45 1.14 0
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224889 85611036 1 N2O3C6H6 A2B3C6D6 -122.02 3.64 -11.1 -1.45 0
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224890 85612588 1 OSN4C7H8 ABC4D7E8 89.92 6.56 -8.37 -1.41 0
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224892 85612722 2 HOC2N2S2 ABC2D2E2 3.31 1.55 -9.52 -2.19 0
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224893 85626378 1 NOC19H23 ABC19D23 3.52 1.26 -9.22 0.17 0
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224894 85629918 1 BrFNC16H17 ABCD16E17 -7.27 1.59 -8.27 -0.25 0
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224895 85630402 2 NSO3C6H10 ABC3D6E10 -277.28 4.26 -9.82 -1.96 0
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224896 85643456 1 N2O3H10C13 A2B3C10D13 -13.38 5.34 -8.91 -1.5 0
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224897 85645418 1 SO2N3H7C9 AB2C3D7E9 69.95 3.22 -9.52 -1.8 0
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224898 85661978 1 BNO2C6H16 ABC2D6E16 -181.45 3.94 -9.48 1.66 0
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224899 85663231 1 OC6F6H8 AB6C6D8 -350.19 1.31 -11.43 1.34 0
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224900 85663233 1 OF5C6H9 AB5C6D9 -310.97 2.87 -11.43 1.47 0
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224902 85663279 1 OF6C8H12 AB6C8D12 -367.77 0.81 -11.34 1.08 0
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224903 85663384 1 O2C15H18 A2B15C18 -73.08 3.61 -9.66 -0.5 0
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224904 85664043 1 ClN3H12C16 AB3C12D16 84.45 3.63 -8.79 -0.86 0
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224905 85667296 1 NSO3C19H29 ABC3D19E29 -126.16 6.49 -8.48 0.04 0
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224906 85668183 1 SGe2C16H36 AB2C16D36 -69.59 2.97 -6.44 -1.47 0
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224907 85670095 1 NSCl2O2H13C18 ABC2D2E13F18 -4.56 4.67 -9.5 -2.53 0
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224908 85676910 2 NO2F3H7C13 AB2C3D7E13 -320.27 3.59 -9.24 -1.72 0
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224909 85679123 1 O5C14H26 A5B14C26 -265.76 3.58 -10.59 0.4 0
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224910 85684038 1 SO8H46C64 AB8C46D64 -85.77 7.2 -9.08 -0.67 0
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224911 85688297 1 BrNO3C17H30 ABC3D17E30 -191.77 3.46 -10.46 -0.01 0
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224912 85692356 1 PN3O4C16H26 AB3C4D16E26 -191.94 3.15 -9.3 -0.73 0
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224913 85695113 1 SN4C8H20 AB4C8D20 4.91 6.88 -8.3 0.51 0
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224914 85696267 1 O2F3C12H19 A2B3C12D19 -279.96 4.43 -10.95 -0.82 0
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224915 85706071 1 NO4H19C20 AB4C19D20 -81.18 4.44 -8.86 -1.29 0
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224916 85707222 1 O4C13H22 A4B13C22 -170.15 2.61 -9.82 -0.7 0
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224917 85709739 1 IC9H19 AB9C19 -33.9 2.0 -9.74 -0.74 0
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224918 85709765 1 SN2O2C13H14 AB2C2D13E14 -62.7 4.3 -8.82 -0.45 0
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224920 85710119 1 NO4C19H29 AB4C19D29 -190.27 2.91 -9.76 -0.14 0
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224921 85718613 1 AlCMgNOSiWH7 ABCDEFGH7 -175.05 4.11 0.0 0.0 0
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224922 85719204 1 FSN2O3H19C20 ABC2D3E19F20 -83.72 3.28 -8.96 -0.92 0
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224923 85729274 1 OS2N3C13H15 AB2C3D13E15 28.77 2.22 -8.65 -0.87 0
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224924 85730453 1 ClOSN2C8H13 ABCD2E8F13 -12.24 2.95 -9.41 -0.86 0
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224925 85730895 2 FC14H16 AB14C16 -4.43 2.89 -8.86 -0.86 0
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224926 85730901 1 NPO5H36C41 ABC5D36E41 -193.49 5.02 -7.96 -1.08 0
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224927 85730909 1 F2O2C23H24 A2B2C23D24 -107.55 3.12 -9.2 -1.05 0
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224928 85730914 2 FOC12H13 ABC12D13 -112.64 3.04 -9.19 -1.05 0
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224929 85730916 2 H4C13 A4B13 706.93 4.53 -8.11 -0.98 0
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224930 85730919 1 PO5C27H37 AB5C27D37 -255.44 3.72 -9.35 -0.16 0
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224931 85730926 1 O4C19H28 A4B19C28 -180.12 1.58 -8.65 0.02 0
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224932 85730941 2 O2N3H17C18 A2B3C17D18 -11.75 2.8 -8.01 -1.53 0
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224933 85730947 1 ClON2F3H6C11 ABC2D3E6F11 -80.84 1.64 -9.66 -1.02 0
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224934 85730949 1 OCl2N2F3H5C11 AB2C2D3E5F11 -91.17 2.22 -9.94 -1.4 0
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224935 85730950 1 FN2O4H15C16 AB2C4D15E16 -85.41 3.37 -8.92 -0.4 0
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224936 85731218 1 NSC2O4H5 ABC2D4E5 -125.71 5.63 -10.92 -0.86 0
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224937 85732279 1 ClN2H25C27 AB2C25D27 70.0 0.91 -8.55 -0.7 0
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224938 85732561 1 NSO3H15C16 ABC3D15E16 -78.88 5.8 -8.99 -0.71 0
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224939 85732577 1 IS2H13C16 AB2C13D16 77.29 2.79 -8.45 -1.54 0
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224940 85734687 2 NO6C28H32 AB6C28D32 -202.41 1.65 -8.37 -2.38 0
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224941 85734956 1 ClO2C18H19 AB2C18D19 -78.44 1.47 -8.93 -0.16 0
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224942 85734957 1 BH23C28 AB23C28 81.92 0.35 -8.2 -0.97 0
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224944 85734962 1 BCl2H29C32 AB2C29D32 17.32 0.64 -8.66 -0.84 0
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224945 85734966 1 BCl4H27C32 AB4C27D32 1.91 1.6 -8.81 -1.07 0
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224946 85735092 1 FNO2C16H24 ABC2D16E24 -150.25 3.28 -9.6 -0.22 0
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224947 85735093 1 ClFNO3H17C18 ABCD3E17F18 -140.52 1.38 -9.57 -0.21 0
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224948 85735097 1 ClFNO3H21C22 ABCD3E21F22 -133.81 3.57 -9.41 -0.59 0
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224949 85735104 1 ClFNO2C21H35 ABCD2E21F35 -203.53 4.14 -9.54 -0.15 0
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224950 85735108 1 FNO3C15H22 ABC3D15E22 -173.81 3.64 -9.78 -0.4 0
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224951 85735116 1 ClFNO4C14H21 ABCD4E14F21 -241.6 6.23 -9.65 -0.25 0
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224952 85735121 1 FNO2C12H16 ABC2D12E16 -130.94 3.93 -9.57 -0.13 0
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224953 85735122 1 ClFNO2C18H29 ABCD2E18F29 -188.87 3.79 -9.52 -0.13 0