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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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49285 11532651 1 NO3H25C29 AB3C25D29 -37.74 2.82 -9.48 -0.91 0
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49286 11532652 1 FNSO5C24H24 ABCD5E24F24 -194.41 9.63 -9.45 -1.3 0
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49287 11532653 1 SN3O5C23H27 AB3C5D23E27 -110.39 6.82 -8.68 -2.0 0
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49288 11532657 1 FO2N5C25H36 AB2C5D25E36 -136.33 8.52 -8.41 0.01 0
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49289 11532662 1 BrN3O3C22H24 AB3C3D22E24 -51.92 5.8 -8.7 -1.01 0
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49290 11532663 1 BrON7C20H24 ABC7D20E24 56.11 4.12 -8.16 -0.42 0
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49291 11532664 1 SN4O9C17H22 AB4C9D17E22 -354.13 15.89 -8.84 -0.73 0
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49292 11532669 1 SO3N4H22C25 AB3C4D22E25 -14.27 4.29 -8.18 -0.8 0
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49293 11532670 1 SO3N4H22C25 AB3C4D22E25 51.24 8.34 -9.04 -1.1 0
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49294 11532672 2 NOC15H19 ABC15D19 -11.94 4.21 -8.29 0.28 0
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49295 11532673 1 O4C29H46 A4B29C46 -257.24 4.7 -10.2 0.67 0
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49296 11532676 1 ClFO2N6C22H24 ABC2D6E22F24 -34.15 5.43 -9.05 -1.13 0
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49297 11532700 1 ClO2N3H26C27 AB2C3D26E27 -13.77 11.7 -8.52 -0.24 0
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49298 11532711 1 FOSN4H25C26 ABCD4E25F26 6.83 1.12 -8.22 -0.85 0
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49299 11532715 1 ClFN2O5H22C23 ABC2D5E22F23 -222.74 10.2 -9.3 -1.75 0
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49300 11532725 1 S2N3O5C21H23 A2B3C5D21E23 -134.86 9.75 -8.51 -0.52 0
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49301 11532739 2 NO3C13H13 AB3C13D13 -193.63 1.95 -8.89 -0.79 0
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49302 11532746 1 SN4O4H22C24 AB4C4D22E24 -77.45 5.63 -8.4 -0.74 0
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49303 11532748 1 N2O5C27H30 A2B5C27D30 -165.27 2.54 -8.79 -1.02 0
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49304 11532749 1 N4O6C23H34 A4B6C23D34 -226.51 7.21 -9.47 -0.4 0
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49305 11532758 1 OSN6C25H30 ABC6D25E30 45.83 6.13 -8.38 -0.74 0
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49306 11532768 1 ON5C29H29 AB5C29D29 51.98 7.36 -8.89 -1.01 0
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49307 11532773 1 ClO2N3C25H54 AB2C3D25E54 -213.24 4.26 -9.17 0.93 0
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49308 11532778 1 SN2O3F4H16C22 AB2C3D4E16F22 -245.04 4.85 -9.95 -1.29 0
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49309 11532779 1 OCl2N5C23H31 AB2C5D23E31 -8.97 7.77 -8.64 -0.24 0
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49310 11532783 1 N4O5C25H28 A4B5C25D28 -110.89 6.87 -8.72 -0.77 0
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49311 11532784 1 O2N6H24C27 A2B6C24D27 56.23 8.0 -8.57 -0.49 0
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49312 11532793 2 ON2C14H20 AB2C14D20 -77.1 2.71 -8.53 -0.24 0
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49313 11532794 1 S3O4C23H28 A3B4C23D28 -150.66 8.49 -8.77 -0.58 0
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49314 11532795 1 ClO2N4H17C27 AB2C4D17E27 81.28 9.54 -8.96 -1.84 0
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49315 11532800 1 OF3N3H26C27 AB3C3D26E27 -109.52 8.54 -8.51 -0.72 0
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49316 11532806 1 SN5O5C21H31 AB5C5D21E31 -179.01 7.12 -9.16 -2.11 0
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49317 11532808 1 SO3N5C24H27 AB3C5D24E27 -20.8 1.87 -8.3 -0.99 0
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49318 11532812 1 NSiO4C27H35 ABC4D27E35 -188.91 7.2 -9.01 -0.1 0
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49319 11532814 1 ClSN3O6C20H20 ABC3D6E20F20 -124.43 8.49 -8.7 -2.11 0
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49320 11532816 1 ClS2N3O4C19H32 AB2C3D4E19F32 -172.76 5.63 -8.95 -0.16 0
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49321 11532822 1 ON2F6H20C24 AB2C6D20E24 -277.94 5.94 -8.48 -1.38 0
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49322 11532831 1 ON4C30H34 AB4C30D34 44.62 4.54 -8.76 -0.82 0
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49323 11532836 1 ClSN4O5C20H23 ABC4D5E20F23 -160.81 6.16 -9.36 -1.25 0
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49324 11532841 1 OF4N5H17C24 AB4C5D17E24 -126.29 4.11 -8.81 -1.26 0
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49325 11532853 1 FO2S2N3H22C24 AB2C2D3E22F24 -37.56 2.13 -8.51 -1.31 0
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49326 11532855 1 N3O3C28H41 A3B3C28D41 -128.1 2.17 -8.68 -0.19 0
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49327 11532856 1 ON3C31H37 AB3C31D37 11.51 4.43 -8.96 -0.61 0
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49328 11532857 1 NSiO4C27H37 ABC4D27E37 -166.99 1.14 -8.18 0.09 0
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49329 11532859 1 F2N2Cl3H19C23 A2B2C3D19E23 -37.65 3.77 -8.69 -0.53 0
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49330 11532862 1 ClSO2N3C25H26 ABC2D3E25F26 -37.77 1.87 -8.44 -0.9 0
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49331 11532863 1 SCl2O2F3N5H14C16 AB2C2D3E5F14G16 -133.38 3.26 -9.34 -1.89 0
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49332 11532864 1 O2F3N6H19C23 A2B3C6D19E23 -135.32 3.63 -8.75 -1.01 0
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49333 11532865 2 FN2O2H11C12 AB2C2D11E12 -180.72 5.34 -9.84 -1.13 0
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49334 11532867 1 FN4O5C24H25 AB4C5D24E25 -142.65 3.71 -8.75 -1.01 0
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49335 11532868 2 N2O5C9H18 A2B5C9D18 -463.62 1.58 -9.69 0.64 0
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49336 11532870 1 SN2O6C24H24 AB2C6D24E24 -100.16 5.87 -9.09 -1.41 0
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49337 11532871 1 O2N6C27H28 A2B6C27D28 85.81 3.96 -8.27 -0.58 0
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49338 11532872 1 SN4O4C24H28 AB4C4D24E28 -94.23 2.62 -8.36 -1.03 0
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49339 11532873 1 SO2N4H24C27 AB2C4D24E27 68.58 3.73 -8.8 -1.09 0
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49340 11532874 1 N2O5C27H36 A2B5C27D36 -231.06 7.08 -8.84 -0.56 0
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49341 11532875 2 N2O2C13H18 A2B2C13D18 -175.89 6.48 -8.69 -1.24 0
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49342 11532877 1 ON4C30H36 AB4C30D36 25.92 3.78 -8.13 -0.02 0
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49343 11532879 1 NSO3F9H12C16 ABC3D9E12F16 -519.59 3.92 -9.77 -0.67 0
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49344 11532881 1 NSO6C25H27 ABC6D25E27 -179.83 8.72 -8.51 -1.12 0
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49345 11532882 1 ON3H27C32 AB3C27D32 82.35 5.97 -9.11 -1.09 0
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49346 11532883 1 O2N5C28H31 A2B5C28D31 -1.12 4.93 -9.28 -0.99 0
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49347 11532889 1 ClO2N5C25H32 AB2C5D25E32 -54.41 2.33 -8.77 -0.32 0
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49348 11532892 1 BrNSO3H20C23 ABCD3E20F23 -46.97 6.02 -8.64 -0.92 0
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49349 11532896 1 FN4O5C24H27 AB4C5D24E27 -152.11 14.71 -8.63 -0.92 0
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49350 11532897 1 SF2O2N6H20C22 AB2C2D6E20F22 -28.2 3.45 -8.18 -1.9 0
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49351 11532898 1 N2O7C25H30 A2B7C25D30 -227.7 6.91 -9.06 -0.52 0
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49352 11532900 1 OF3N4C26H29 AB3C4D26E29 -139.2 3.4 -8.88 -1.05 0
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49353 11532901 1 FSO3H23C29 ABC3D23E29 -77.79 5.03 -9.0 -0.79 0
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49354 11532903 2 FNOC14H18 ABCD14E18 -174.7 1.29 -8.65 -0.47 0
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49355 11532904 1 N2O5C27H38 A2B5C27D38 -201.36 7.43 -8.54 -0.3 0
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49356 11532905 1 N2S2O6C21H30 A2B2C6D21E30 -219.31 9.08 -8.82 -0.25 0
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49357 11532908 2 O2C15H23 A2B15C23 -237.22 6.03 -9.68 0.6 0
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49358 11532910 1 ClN4O5C23H23 AB4C5D23E23 -107.13 5.4 -9.58 -0.74 0
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49359 11532912 1 SN2O6C21H26 AB2C6D21E26 -163.38 3.88 -8.95 -0.84 0
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49360 11532914 1 BrF2O6H17C20 AB2C6D17E20 -296.29 2.32 -10.31 -1.0 0
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49361 11532915 1 IN3O3H14C20 AB3C3D14E20 4.66 4.04 -9.0 -1.69 0
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49362 11532916 1 Cl2F4N4H16C21 A2B4C4D16E21 -147.07 5.92 -8.94 -1.13 0
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49363 11532917 1 ClF4N4H15C21 AB4C4D15E21 -112.85 6.78 -8.65 -1.03 0
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49364 11532920 1 OCl2N6C23H24 AB2C6D23E24 70.87 2.89 -8.85 -0.91 0
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49365 11532921 1 INSiO5C16H30 ABCD5E16F30 -286.06 5.16 -9.15 -1.62 0
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49366 11532922 1 BrN2S2O3C19H23 AB2C2D3E19F23 -81.04 5.43 -9.57 -0.68 0
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49367 11532925 1 NO6H25C28 AB6C25D28 -110.05 4.99 -8.78 -1.11 0
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49368 11532926 3 NOH7C10 ABC7D10 25.55 9.12 -9.62 -1.07 0
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49369 11532927 1 NO5C29H29 AB5C29D29 -140.95 5.42 -8.25 -0.28 0
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49370 11532929 1 NSO6C25H29 ABC6D25E29 -234.39 3.49 -8.89 -1.2 -1
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49371 11532930 1 N2S2O7C20H27 A2B2C7D20E27 -244.48 8.64 0.0 0.0 0
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49372 11532932 1 SN3O3H25C27 AB3C3D25E27 -16.22 7.15 -9.57 -1.04 0
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49373 11532934 1 NSO7C23H37 ABC7D23E37 -356.41 6.38 -8.95 0.0 0
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49374 11532936 1 ClSO2N5C23H26 ABC2D5E23F26 29.25 2.45 -8.74 -1.12 0
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49375 11532937 1 Br2F2N4H14C17 A2B2C4D14E17 6.19 5.03 -8.36 -0.78 0
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49376 11532940 1 Cl2O2N3C25H27 A2B2C3D25E27 -34.82 4.27 -8.63 -0.76 0
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49377 11532941 1 Cl2O2N3C25H27 A2B2C3D25E27 -40.28 2.07 -8.68 -0.81 0
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49378 11532942 1 O8H20C27 A8B20C27 -193.85 14.11 -8.87 -1.39 0
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49379 11532946 2 F2N2C13H14 A2B2C13D14 -135.86 6.01 -8.51 -0.43 0
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49380 11532948 2 N2O3C12H16 A2B3C12D16 -209.27 1.13 -9.12 -1.09 0
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49381 11532949 1 N4O4C27H28 A4B4C27D28 -98.89 10.92 -8.67 -0.9 0
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49382 11532950 1 SN2O6C24H28 AB2C6D24E28 -200.76 4.97 -9.54 -1.21 0
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49383 11532951 1 N2O4C29H32 A2B4C29D32 -74.78 3.41 -9.11 -0.02 0
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49384 11532953 1 O2N6C27H32 A2B6C27D32 -2.51 4.07 -8.54 -0.89 0