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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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67851 46507298 1 O2N5C26H27 A2B5C26D27 58.19 1.53 -8.78 -1.15 0
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67852 46507301 1 O2N4H18C21 A2B4C18D21 48.56 2.75 -8.13 -0.99 0
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67853 46507302 1 FNSCl3O3H7C15 ABCD3E3F7G15 -125.94 7.32 -9.72 -1.59 0
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67854 46507303 1 FNSCl3O3H7C15 ABCD3E3F7G15 -124.31 7.12 -9.72 -1.6 0
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67855 46507304 1 O2N5H23C26 A2B5C23D26 43.22 6.55 -9.12 -1.57 0
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67856 46507305 1 ClN3H8C12 AB3C8D12 98.48 1.58 -9.08 -1.32 0
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67857 46507306 1 ClFN3H7C12 ABC3D7E12 50.36 1.02 -9.19 -1.42 0
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67858 46507309 1 O2N3C15H17 A2B3C15D17 -13.87 3.81 -8.36 -0.17 0
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67859 46507310 1 NO2S2H9C13 AB2C2D9E13 5.72 3.13 -8.95 -1.66 0
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67860 46507313 1 ClNSF2O3H8C15 ABCD2E3F8G15 -157.96 7.06 -9.87 -1.52 0
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67861 46507319 1 ClNSF3O3H7C15 ABCD3E3F7G15 -198.67 6.24 -10.01 -1.54 0
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67862 46507320 1 SN3O4C23H25 AB3C4D23E25 -85.47 6.87 -8.39 -0.73 0
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67863 46507321 1 SO2N3C21H21 AB2C3D21E21 -14.45 3.52 -8.73 -0.66 0
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67864 46507322 1 SO2N3C22H23 AB2C3D22E23 -15.19 5.28 -8.94 -1.03 0
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67865 46507323 1 O3N4C23H24 A3B4C23D24 -61.27 4.7 -8.62 -1.06 0
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67866 46507324 1 ClNSF2O3H8C15 ABCD2E3F8G15 -153.83 6.4 -9.72 -1.52 0
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67867 46507336 1 S2F3N3O3H16C18 A2B3C3D3E16F18 -216.23 7.98 -9.45 -1.23 0
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67868 46507338 1 SF2N2O3H18C22 AB2C2D3E18F22 -153.03 3.33 -9.08 -0.95 0
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67869 46507339 1 SF2N2O3H18C22 AB2C2D3E18F22 -147.47 4.14 -9.36 -0.95 0
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67870 46507341 1 SF2N3O3H13C16 AB2C3D3E13F16 -176.47 6.19 -9.24 -1.35 0
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67871 46507342 1 SO3N4H14C15 AB3C4D14E15 -70.18 6.11 -9.23 -1.33 0
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67872 46507343 1 ClO2S2N3H20C26 AB2C2D3E20F26 17.89 5.09 -8.69 -1.64 0
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67873 46507344 1 SO2N3C24H27 AB2C3D24E27 -21.96 4.0 -8.35 -0.26 0
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67874 46507345 1 SN3O5H17C21 AB3C5D17E21 -111.63 4.15 -8.94 -1.72 0
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67875 46507347 1 S2N3O3C18H19 A2B3C3D18E19 -62.84 4.3 -8.95 -0.73 0
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67876 46507348 1 FS2N3O3H16C17 AB2C3D3E16F17 -98.57 6.54 -9.15 -0.77 0
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67877 46507349 1 S2N3O3C15H21 A2B3C3D15E21 -101.78 7.48 -9.52 -0.94 0
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67878 46507351 1 FSN2O3H21C23 ABC2D3E21F23 -112.66 6.51 -9.2 -0.83 0
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67879 46507354 1 F2O2N5H17C24 A2B2C5D17E24 -40.79 6.43 -9.28 -1.69 0
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67880 46507356 1 F3O3N4H9C17 A3B3C4D9E17 -140.28 1.19 -9.75 -2.03 0
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67881 46507358 1 ClN3H12C14 AB3C12D14 79.76 2.63 -8.81 -1.23 0
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67882 46507359 1 O3N5H15C17 A3B5C15D17 6.61 5.47 -8.74 -1.41 0
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67883 46507362 1 N2O2F3H13C18 A2B2C3D13E18 -178.37 7.07 -8.99 -1.4 0
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67884 46507363 1 SO4N5H23C26 AB4C5D23E26 -21.12 5.03 -8.41 -1.47 0
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67885 46507364 1 SO4N5H17C24 AB4C5D17E24 -4.99 5.59 -8.79 -1.49 0
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67886 46507368 1 SN3O4C23H27 AB3C4D23E27 -145.31 2.46 -9.46 -0.92 0
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67887 46507369 1 SN3O4C22H25 AB3C4D22E25 -138.49 2.16 -9.5 -0.92 0
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67888 46507371 1 ClSO2N5H18C24 ABC2D5E18F24 42.5 7.29 -9.04 -1.59 0
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67889 46507372 1 ClSO2N5H16C23 ABC2D5E16F23 50.08 1.61 -8.9 -1.37 0
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67890 46507373 1 ClSO2N5H16C23 ABC2D5E16F23 49.02 6.69 -9.05 -1.58 0
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67891 46507375 1 SO2N5H19C24 AB2C5D19E24 53.21 2.35 -8.86 -1.38 0
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67892 46507376 1 SO2N5H23C26 AB2C5D23E26 40.99 1.81 -8.85 -1.42 0
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67893 46507379 1 ClN2O2H19C20 AB2C2D19E20 -40.22 4.84 -8.63 -0.75 0
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67894 46507380 1 SN2O3C25H26 AB2C3D25E26 -71.66 5.97 -9.29 -0.78 0
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67895 46507381 1 SN2O3C26H28 AB2C3D26E28 -81.26 5.53 -8.95 -0.76 0
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67896 46507382 1 SN2O3C26H28 AB2C3D26E28 -82.79 4.17 -9.22 -0.74 0
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67897 46507383 1 SN2O3C26H28 AB2C3D26E28 -81.91 4.43 -9.06 -0.74 0
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67898 46507384 1 SN2O3C26H28 AB2C3D26E28 -76.43 5.37 -9.2 -0.78 0
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67899 46507385 1 SN2O3C26H28 AB2C3D26E28 -75.03 5.18 -9.31 -0.78 0
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67900 46507386 1 SN2O3C26H28 AB2C3D26E28 -76.71 4.94 -9.17 -0.8 0
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67901 46507387 1 SN2O4C25H26 AB2C4D25E26 -103.58 6.17 -8.88 -0.82 0
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67902 46507388 1 SN2O5C26H28 AB2C5D26E28 -137.75 3.35 -8.4 -0.74 0
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67903 46507389 1 S2N3O5C19H19 A2B3C5D19E19 -126.93 7.6 -8.44 -1.05 0
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67904 46507392 1 SO2N5H15C18 AB2C5D15E18 27.06 3.95 -8.91 -1.47 0
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67905 46507394 1 SO2N5H23C26 AB2C5D23E26 40.28 4.46 -8.86 -1.49 0
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67906 46507397 1 SO2N5H23C26 AB2C5D23E26 40.94 1.24 -8.88 -1.37 0
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67907 46507399 1 SO2N5H21C25 AB2C5D21E25 48.65 4.8 -8.94 -1.45 0
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67908 46507401 1 SO2N5H17C22 AB2C5D17E22 81.17 5.97 -8.96 -1.22 0
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67909 46507404 1 FSN2O3C25H25 ABC2D3E25F25 -119.38 6.58 -9.2 -0.92 0
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67910 46507406 1 SO2F3N5H16C24 AB2C3D5E16F24 -104.21 6.33 -8.95 -1.56 0
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67911 46507409 1 BrSO2N5H14C21 ABC2D5E14F21 90.73 5.39 -9.1 -1.27 0
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67912 46507410 1 BrSO2N5H14C21 ABC2D5E14F21 90.67 4.62 -9.04 -1.26 0
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67913 46507412 1 SO2N5H15C21 AB2C5D15E21 88.61 5.62 -9.02 -1.13 0
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67914 46507414 1 ClOSN4H19C22 ABCD4E19F22 92.7 4.27 -9.06 -1.06 0
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67915 46507415 1 ClSO3N4H19C24 ABC3D4E19F24 30.38 3.04 -9.02 -1.2 0
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67916 46507419 1 SN3O3H25C27 AB3C3D25E27 -15.86 3.82 -8.83 -1.1 0
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67917 46507424 1 N2O5H14C18 A2B5C14D18 -49.54 8.66 -9.64 -1.63 0
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67918 46507427 1 N3O4H13C17 A3B4C13D17 -11.65 5.18 -9.68 -1.88 0
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67919 46507430 1 ClSN4H17C19 ABC4D17E19 96.52 4.26 -8.88 -1.26 0
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67920 46507432 1 OSN5H23C24 ABC5D23E24 88.58 5.39 -8.69 -1.13 0
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67921 46507433 1 SO2N5C26H27 AB2C5D26E27 41.03 5.77 -8.42 -1.15 0
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67922 46507434 1 SO2N5C25H25 AB2C5D25E25 46.4 5.41 -8.61 -1.17 0
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67923 46507435 1 O3N5C25H33 A3B5C25D33 -65.8 1.81 -8.33 -0.72 0
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67924 46507437 1 SN2O2C26H30 AB2C2D26E30 -27.95 4.87 -8.16 -0.2 0
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67925 46507438 1 FSN2O2H21C22 ABC2D2E21F22 -50.62 4.03 -8.26 -0.62 0
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67926 46507441 1 FOSN4H17C21 ABCD4E17F21 66.95 1.65 -9.11 -1.17 0
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67927 46507444 1 ClOSN5H20C23 ABCD5E20F23 89.11 4.86 -8.78 -1.13 0
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67928 46507447 1 SN4C20H20 AB4C20D20 97.18 4.91 -8.72 -1.16 0
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67929 46507449 1 SN2O3C25H26 AB2C3D25E26 -67.77 5.63 -9.35 -0.81 0
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67930 46507450 1 SF2N2O3H16C21 AB2C2D3E16F21 -140.55 4.29 -9.58 -1.0 0
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67931 46507452 1 O2N3C21H21 A2B3C21D21 -18.23 4.35 -8.57 -0.67 0
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67932 46507453 1 ClOSF2N4H11C19 ABCD2E4F11G19 31.08 6.18 -9.26 -1.29 0
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67933 46507455 1 SO2N4C24H24 AB2C4D24E24 66.98 4.77 -8.96 -1.11 0
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67934 46507463 1 BrFOSN4H16C21 ABCDE4F16G21 71.75 5.71 -8.96 -1.16 0
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67935 46507466 1 SO2N4H22C23 AB2C4D22E23 67.11 6.32 -8.87 -1.17 0
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67936 46507468 1 FN2O3H15C18 AB2C3D15E18 -97.27 5.47 -8.35 -0.67 0
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67937 46507471 1 ClN2O3H15C18 AB2C3D15E18 -56.41 3.53 -8.35 -0.75 0
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67938 46507475 1 ClN2O3H15C18 AB2C3D15E18 -56.29 4.31 -8.37 -0.76 0
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67939 46507476 1 ClO3N5H22C23 AB3C5D22E23 -52.81 4.79 -8.99 -0.67 0
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67940 46507477 1 S2N3O3H23C24 A2B3C3D23E24 -10.84 7.59 -8.26 -1.5 1
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67941 46507478 1 O2N3C15H16 A2B3C15D16 -26.52 6.81 0.0 0.0 1
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67942 46507480 1 N2O2H19C21 A2B2C19D21 12.2 8.05 0.0 0.0 1
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67943 46507481 1 FON2H18C20 ABC2D18E20 -10.17 5.82 0.0 0.0 0
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67944 46507483 1 SN2O5H20C23 AB2C5D20E23 -121.51 4.38 -8.93 -0.83 0
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67945 46507486 1 SN2O5H20C23 AB2C5D20E23 -116.07 4.16 -8.96 -0.84 0
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67946 46507487 1 FSN2O4H19C22 ABC2D4E19F22 -131.07 5.56 -9.15 -0.86 0
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67947 46507490 2 ON2C11H13 AB2C11D13 -24.23 5.22 -8.62 -0.78 0
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67948 46507491 1 ClO2N4H21C23 AB2C4D21E23 8.7 6.38 -8.5 -0.73 0
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67949 46507493 1 ClO2S2N3H22C27 AB2C2D3E22F27 15.42 3.8 -8.76 -1.56 0
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67950 46507495 1 O2S2F3N3H20C26 A2B2C3D3E20F26 -137.73 7.48 -8.54 -1.32 0