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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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446877 135278402 1 SF3N5O6H44C45 AB3C5D6E44F45 -289.11 9.66 -8.73 -1.25 0
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446878 135278409 1 BrSN5O7H42C44 ABC5D7E42F44 -155.73 9.41 -8.54 -1.48 0
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446879 135278417 1 BrN2O4C16H17 AB2C4D16E17 -148.97 4.84 -9.61 -0.73 0
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446880 135278439 1 O7C20H32 A7B20C32 -301.7 5.61 -8.04 0.37 0
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446881 135278443 1 BrSO6C37H39 ABC6D37E39 -143.97 6.25 -8.33 -0.82 0
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446882 135278450 1 BrSO5C27H27 ABC5D27E27 -117.57 7.44 -8.31 -0.84 0
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446883 135278452 1 N2O3C13H18 A2B3C13D18 -113.11 7.69 -9.85 -0.09 0
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446884 135278453 1 N2O3C10H12 A2B3C10D12 -101.18 2.56 -10.38 -0.55 0
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446885 135278455 1 BrNSO2H18C23 ABCD2E18F23 29.54 3.7 -8.67 -1.05 0
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446886 135278456 1 BrFOH14C18 ABCD14E18 -17.85 3.13 -8.64 -0.51 0
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446887 135278457 1 BrOC10H11 ABC10D11 -12.84 3.2 -8.89 -0.27 0
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446888 135278460 1 O4N5C20H25 A4B5C20D25 -138.8 11.97 -9.01 -1.3 0
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446889 135278478 1 BrClSN5O8C48H51 ABCD5E8F48G51 -178.1 8.87 -8.49 -0.95 0
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446890 135278480 1 BrSN6O8C49H51 ABC6D8E49F51 -127.81 7.67 -8.56 -1.01 0
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446891 135278484 1 OSN6H26C28 ABC6D26E28 134.33 3.86 -8.46 -1.89 0
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446892 135278494 1 OSN6H28C30 ABC6D28E30 134.63 4.15 -8.44 -1.86 0
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446893 135278495 1 FN6C14H15 AB6C14D15 49.12 10.3 -9.82 -1.1 0
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446894 135278526 1 F2O2N7C27H27 A2B2C7D27E27 -20.73 8.36 -7.7 -1.17 0
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446895 135278533 1 O3N6C24H32 A3B6C24D32 -44.28 4.25 -8.82 -0.81 0
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446896 135278550 1 OF2N7H25C26 AB2C7D25E26 0.78 4.48 -8.11 -0.97 0
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446897 135278554 1 ON5C18H25 AB5C18D25 42.56 4.77 -8.98 0.25 0
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446898 135278561 1 OF5N7H22C26 AB5C7D22E26 -151.24 3.67 -8.56 -0.78 0
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446899 135278567 1 OF2N7H25C26 AB2C7D25E26 -0.37 3.72 -8.57 -1.07 0
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446900 135278579 1 SF2N2O4C21H22 AB2C2D4E21F22 -158.38 5.23 -8.56 -0.83 0
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446901 135278624 1 SF2N2O4H22C24 AB2C2D4E22F24 -122.7 4.31 -8.69 -1.01 0
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446902 135278634 1 SN2F3O5C24H27 AB2C3D5E24F27 -284.36 6.48 -8.78 -1.08 0
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446903 135278649 1 BrNOF2H12C15 ABCD2E12F15 -59.16 4.74 -8.56 -0.53 0
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446904 135278653 1 BrIPN2C8H9 ABCD2E8F9 16.12 1.87 -8.95 -0.96 1
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446905 135278692 1 SN2O2C26H29 AB2C2D26E29 18.14 3.97 0.0 0.0 1
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446906 135278697 1 SN4O5C21H27 AB4C5D21E27 -114.99 2.75 0.0 0.0 0
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446907 135278715 1 OF2N7C28H35 AB2C7D28E35 -13.89 3.03 -7.89 -0.3 0
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446908 135278718 1 O2N5C21H21 A2B5C21D21 76.41 5.79 -8.45 -0.76 0
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446909 135278719 1 FON8C27H31 ABC8D27E31 70.64 2.37 -7.88 -0.53 0
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446910 135278730 1 SN3C24H31 AB3C24D31 22.41 4.57 -8.09 -0.26 0
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446911 135278731 1 FSN2O4H23C25 ABC2D4E23F25 -53.11 6.41 -8.53 -0.89 0
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446912 135278747 1 SN2O4C21H24 AB2C4D21E24 -72.95 5.21 -8.55 -0.85 0
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446913 135278753 1 SF2N3O4H17C24 AB2C3D4E17F24 -52.29 6.31 -8.48 -1.15 0
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446914 135278755 1 BrFSN3O4H19C22 ABCD3E4F19G22 -61.33 7.92 -8.61 -1.11 0
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446915 135278757 1 SN3O3C24H31 AB3C3D24E31 -51.6 10.93 -8.52 -0.98 0
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446916 135278765 1 SN2O4C25H32 AB2C4D25E32 -92.99 4.75 -8.52 -0.89 0
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446917 135278767 1 SN2O4C23H28 AB2C4D23E28 -82.24 11.28 -8.37 -0.93 0
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446918 135278797 1 IS2N4C17H19 AB2C4D17E19 84.0 4.31 -7.93 -2.42 0
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446919 135278802 1 N2S2O3C13H20 A2B2C3D13E20 -93.63 1.59 -8.85 -0.8 0
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446920 135278807 1 OSN3H21C24 ABC3D21E24 67.5 5.24 -8.54 -0.37 0
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446921 135278810 1 O4N6C29H40 A4B6C29D40 -133.37 2.62 -8.75 -0.74 0
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446922 135278816 1 FSN2O3H15C17 ABC2D3E15F17 -34.04 8.58 -8.67 -1.07 0
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446923 135278820 1 O4N6C27H38 A4B6C27D38 -87.26 3.15 -8.85 -0.44 0
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446924 135278826 1 OSN3F5H16C22 ABC3D5E16F22 -189.54 3.67 -8.69 -1.01 0
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446925 135278833 1 BrSF4H7C9 ABC4D7E9 -190.78 2.3 -9.5 -1.12 1
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446926 135278844 1 SF2O2N3H22C24 AB2C2D3E22F24 -19.12 4.69 0.0 0.0 0
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446927 135278848 1 SN7C34H63 AB7C34D63 -18.13 2.29 -8.12 -0.07 1
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446928 135278853 1 SN3O4C21H26 AB3C4D21E26 -79.49 6.63 0.0 0.0 0
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446929 135278865 1 NSO3C20H25 ABC3D20E25 -85.16 4.87 -8.57 -0.16 0
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446930 135278892 1 ClFN3O5H45C47 ABC3D5E45F47 -105.81 4.58 -8.6 -1.14 1
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446931 135278905 1 N2O2S2C22H23 A2B2C2D22E23 43.54 3.57 0.0 0.0 0
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446932 135278907 1 NSO3C15H19 ABC3D15E19 -78.37 3.79 -8.94 -0.82 0
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446933 135278915 1 NO6C19H39 AB6C19D39 -305.04 4.17 -9.8 0.9 0
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446934 135278931 1 FNO2C17H26 ABC2D17E26 -144.85 2.32 -9.1 0.13 0
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446935 135278932 2 NO3C17H22 AB3C17D22 -186.67 8.74 -8.81 -0.92 0
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446936 135278937 2 NOC7H15 ABC7D15 -144.05 5.12 -8.65 1.23 0
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446937 135278947 1 N5O5C40H41 A5B5C40D41 -97.03 8.94 -8.55 -0.9 0
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446938 135278986 1 IN3O4C13H16 AB3C4D13E16 -168.42 4.43 -9.12 -1.81 1
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446939 135278988 1 SN2O2C16H17 AB2C2D16E17 11.1 1.18 0.0 0.0 1
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446940 135278989 1 SN2O2C21H25 AB2C2D21E25 -6.16 3.23 0.0 0.0 0
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446941 135279013 1 ClN2O2C23H27 AB2C2D23E27 -21.94 7.58 -9.44 -0.72 1
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446942 135279016 1 SO2N3H22C24 AB2C3D22E24 74.39 5.03 0.0 0.0 0
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446943 135279020 1 NS2O6C19H31 AB2C6D19E31 -233.04 1.89 -8.01 -0.08 0
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446944 135279022 1 O2N3C25H25 A2B3C25D25 25.43 6.92 -8.48 -0.75 0
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446945 135279025 1 IOF2N2S2H21C24 ABC2D2E2F21G24 -33.13 3.58 -8.73 -2.45 1
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446946 135279029 1 SF2O2N3C26H26 AB2C2D3E26F26 -23.62 5.84 0.0 0.0 0
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446947 135279030 1 PSF2O2N3H24C25 ABC2D2E3F24G25 -57.38 6.36 -8.58 -0.48 0
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446948 135279033 1 SF2N3H25C26 AB2C3D25E26 0.09 3.66 -8.4 -0.36 0
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446949 135279037 1 N2O9C34H72 A2B9C34D72 -468.44 1.4 -8.57 1.24 0
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446950 135279049 1 SN3O3C25H33 AB3C3D25E33 -55.13 10.12 -8.55 -0.97 0
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446951 135279064 1 SN3O3C23H29 AB3C3D23E29 -47.41 5.8 -8.63 -1.03 0