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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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321319 126665799 1 F4O4N6C35H36 A4B4C6D35E36 -264.33 7.56 -9.46 -1.27 0
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321320 126665800 1 ClOF3N5H27C37 ABC3D5E27F37 4.93 3.1 -8.49 -1.4 0
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321321 126665801 1 O2F3N4H23C26 A2B3C4D23E26 -120.37 1.69 -9.26 -1.3 0
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321322 126665802 1 FO3N5C30H30 AB3C5D30E30 -25.48 2.08 -9.2 -0.95 0
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321323 126665803 1 O2F4N4H22C29 A2B4C4D22E29 -113.11 3.5 -9.25 -1.48 0
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321324 126665805 1 O2F3N4H19C24 A2B3C4D19E24 -110.2 1.94 -9.09 -1.08 0
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321325 126665806 1 OF4N7H25C30 AB4C7D25E30 -72.48 5.17 -9.37 -1.48 0
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321326 126665808 1 O2N5F6H27C30 A2B5C6D27E30 -260.75 4.85 -9.16 -1.17 0
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321327 126665811 2 OSN2C6H6 ABC2D6E6 24.26 1.69 -8.68 -0.96 0
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321328 126665812 1 F3N4O6C26H29 A3B4C6D26E29 -360.42 3.82 -9.65 -1.47 0
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321329 126665813 1 O3F4N6H36C40 A3B4C6D36E40 -124.19 10.12 -8.47 -0.88 0
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321330 126665814 1 SF4O5N7C39H45 AB4C5D7E39F45 -307.64 8.13 -8.79 -1.08 0
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321331 126665815 1 O3F4N6H36C40 A3B4C6D36E40 -129.74 9.26 -8.48 -0.99 0
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321332 126665818 1 F4N5O6C35H37 A4B5C6D35E37 -398.62 2.48 -8.87 -1.38 0
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321333 126665819 1 F4O4N5C34H37 A4B4C5D34E37 -290.52 5.97 -9.17 -1.17 0
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321334 126665821 1 F3O3N5C35H38 A3B3C5D35E38 -180.52 7.03 -9.04 -0.98 0
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321335 126665825 1 SO2F4N6C33H36 AB2C4D6E33F36 -150.31 4.55 -8.56 -1.13 0
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321336 126665826 1 ClN4O4H21C23 AB4C4D21E23 -43.71 2.83 -8.48 -1.18 0
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321337 126665827 1 BrClN3O3H11C14 ABC3D3E11F14 -9.39 3.07 -9.64 -1.53 0
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321338 126665831 1 SF4O4N6C38H44 AB4C4D6E38F44 -263.49 6.3 -8.23 -1.42 0
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321339 126665833 1 O3F4N4H20C24 A3B4C4D20E24 -209.45 5.78 -9.14 -1.42 0
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321340 126665834 1 BrO2F3N3H11C15 AB2C3D3E11F15 -138.87 3.46 -9.83 -1.56 0
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321341 126665838 1 F3O3N7H28C30 A3B3C7D28E30 -115.52 6.25 -9.65 -1.34 0
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321342 126665840 1 O3F4N4H26C29 A3B4C4D26E29 -192.25 3.85 -9.14 -0.85 0
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321343 126665841 1 ClSN4O4H19C21 ABC4D4E19F21 -43.59 5.91 -9.04 -1.37 0
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321344 126665843 1 F3O4N5H28C29 A3B4C5D28E29 -230.54 7.16 -9.44 -1.33 0
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321345 126665844 1 NOC17H19 ABC17D19 14.33 1.96 -8.35 0.33 0
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321346 126665845 1 ClFO2N4H14C19 ABC2D4E14F19 7.7 3.77 -9.55 -1.62 0
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321347 126665846 1 O4C9H10 A4B9C10 -130.6 3.66 -10.38 -0.9 0
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321348 126665847 1 O2F3N5C28H28 A2B3C5D28E28 -127.66 8.79 -9.12 -0.94 0
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321349 126665848 1 N3F4O4H17C22 A3B4C4D17E22 -226.55 3.39 -8.47 -1.32 0
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321350 126665849 1 F4N5O6C36H37 A4B5C6D36E37 -342.74 9.6 -9.09 -0.85 0
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321351 126665850 1 OF3N6H23C28 AB3C6D23E28 -16.29 2.96 -9.34 -1.47 0
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321352 126665851 1 SF3O3N6C31H33 AB3C3D6E31F33 -153.69 9.57 -9.21 -1.17 0
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321353 126665852 1 O2F4N4H10C19 A2B4C4D10E19 -137.08 2.67 -9.65 -1.55 0
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321354 126665855 2 F2N2O2H10C13 A2B2C2D10E13 -201.97 3.55 -9.68 -1.29 0
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321355 126665857 1 O2F4N5H25C29 A2B4C5D25E29 -148.38 7.54 -9.45 -1.3 0
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321356 126665859 1 F3O3N6H23C29 A3B3C6D23E29 -24.3 5.27 -9.25 -1.58 0
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321357 126665860 1 F3O3N6H23C29 A3B3C6D23E29 -33.28 8.15 -9.55 -1.64 0
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321358 126665866 1 OF3N6H27C28 AB3C6D27E28 -45.31 3.27 -8.98 -0.97 0
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321359 126665869 1 SO2N3C16H23 AB2C3D16E23 -33.91 1.81 -8.45 -1.07 0
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321360 126665874 1 F3O3N4H31C34 A3B3C4D31E34 -128.59 5.56 -8.63 -1.01 0
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321361 126665876 1 ClN3O4H22C24 AB3C4D22E24 -11.58 2.25 -8.45 -1.14 0
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321362 126665883 1 O2F3N7H20C25 A2B3C7D20E25 -55.93 2.35 -9.47 -1.19 0
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321363 126665885 1 ClN4O4H23C25 AB4C4D23E25 -24.24 0.59 -8.53 -1.12 0
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321364 126665888 1 F3N4O4H21C24 A3B4C4D21E24 -199.39 2.28 -8.55 -1.23 0
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321365 126665891 1 F3O3N5C38H38 A3B3C5D38E38 -156.93 4.99 -8.98 -1.04 0
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321366 126665893 1 ClN3O4H20C22 AB3C4D20E22 -34.96 1.73 -8.51 -1.15 0
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321367 126665894 1 SO2N5C17H21 AB2C5D17E21 -5.53 5.93 -8.64 -0.32 0
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321368 126665897 1 F3O4N5H34C37 A3B4C5D34E37 -166.15 4.06 -8.9 -1.19 0
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321369 126665898 1 ClF2O2N4H15C20 AB2C2D4E15F20 -50.15 3.92 -8.93 -1.44 0
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321370 126665900 1 F3O4N5H34C37 A3B4C5D34E37 -166.04 3.74 -8.92 -1.24 0
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321371 126665903 1 O2H3N3C5 A2B3C3D5 25.39 6.56 -10.34 -1.86 0
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321372 126665904 1 ClFO2N3H11C14 ABC2D3E11F14 -30.67 1.54 -9.71 -1.32 0
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321373 126665905 1 NOC16H19 ABC16D19 -23.3 1.77 -8.59 0.16 0
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321374 126665906 1 OF4N7H25C30 AB4C7D25E30 -49.71 6.91 -9.31 -1.36 0
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321375 126665917 1 BrO3F4N4C29H31 AB3C4D4E29F31 -264.6 6.43 -9.6 -1.23 0
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321376 126665918 1 O3F4N5C35H37 A3B4C5D35E37 -228.33 6.54 -9.45 -1.26 0
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321377 126665919 1 O2F3N4H27C29 A2B3C4D27E29 -112.5 3.11 -8.76 -1.16 0
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321378 126665920 1 O3F4N4H18C26 A3B4C4D18E26 -174.42 6.32 -9.19 -1.46 0
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321379 126665926 1 OF3N5C32H32 AB3C5D32E32 -44.03 5.43 -8.89 -0.97 0
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321380 126665928 1 OF3N5H32C35 AB3C5D32E35 -40.41 3.24 -9.05 -1.2 0
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321381 126665930 1 F4O5N6C40H46 A4B5C6D40E46 -343.5 8.23 -9.37 -0.98 0
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321382 126665931 1 SO2F4N7C35H35 AB2C4D7E35F35 -120.31 8.27 -8.48 -1.29 0
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321383 126665936 1 OF4N7H27C31 AB4C7D27E31 -63.02 7.35 -9.48 -1.44 0
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321384 126665937 1 OSN3C23H29 ABC3D23E29 42.56 7.49 -8.27 -0.46 0
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321385 126665938 1 SF4O4N5C39H45 AB4C4D5E39F45 -272.33 7.03 -8.56 -1.12 0
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321386 126665939 1 OSN3C23H29 ABC3D23E29 44.35 8.38 -8.22 -0.67 0
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321387 126665940 1 ClO3N4H17C21 AB3C4D17E21 -0.75 2.99 -9.45 -1.46 0
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321388 126665942 1 O3F4N6C33H34 A3B4C6D33E34 -192.72 8.04 -9.51 -0.94 0
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321389 126665943 1 O3F4N6C33H34 A3B4C6D33E34 -208.92 4.76 -9.57 -1.01 0
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321390 126665944 1 NO5C8H11 AB5C8D11 -151.34 4.26 -10.2 -1.01 0
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321391 126665945 2 OF2N3C16H16 AB2C3D16E16 -156.62 4.24 -9.49 -1.08 0
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321392 126665946 1 ClF3N4O4H28C30 AB3C4D4E28F30 -213.72 3.47 -9.52 -1.6 0
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321393 126665948 1 O2F4N4H12C19 A2B4C4D12E19 -157.21 0.9 -9.51 -1.46 0
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321394 126665949 1 O2F3N5C29H30 A2B3C5D29E30 -136.3 5.79 -9.38 -1.23 0
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321395 126665950 1 ON3H11C14 AB3C11D14 47.35 2.96 -9.0 -0.83 0
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321396 126665951 1 O2F3N5H30C36 A2B3C5D30E36 -33.42 1.17 -8.66 -1.46 0
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321397 126665952 1 ClOSN3C6H10 ABCD3E6F10 -34.42 3.96 -9.52 -0.75 0
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321398 126665953 1 ClOH5N5F9C13 ABC5D5E9F13 -396.61 2.16 -9.56 -1.69 0
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321399 126665954 1 ClON5F7H7C13 ABC5D7E7F13 -312.39 2.09 -9.54 -1.47 0
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321400 126665955 1 ClON5C17H20 ABC5D17E20 -5.0 4.89 -8.98 -0.46 0
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321401 126665956 1 F4O4N5H29C30 A4B4C5D29E30 -292.51 6.97 -8.71 -0.85 1
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321402 126665957 1 ClFON5C14H16 ABCD5E14F16 -14.71 4.24 0.0 0.0 0
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321403 126665958 1 F3O3N7C31H34 A3B3C7D31E34 -152.01 6.29 -9.14 -1.27 0
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321404 126665959 1 F3O3N7C31H34 A3B3C7D31E34 -161.46 7.64 -9.25 -1.19 0
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321405 126665960 1 F3O4N5C34H36 A3B4C5D34E36 -216.1 7.84 -8.92 -1.0 0
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321406 126665961 1 F3O4N5C34H36 A3B4C5D34E36 -224.77 5.94 -8.75 -1.02 0
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321407 126665964 1 O3N5F6C35H35 A3B5C6D35E35 -341.07 5.86 -9.47 -1.34 0
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321408 126665966 1 SF3O3N5H26C30 AB3C3D5E26F30 -105.96 5.68 -8.97 -1.52 0
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321409 126665967 1 FOSN3C21H28 ABCD3E21F28 -24.12 3.17 -8.29 -0.14 0
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321410 126665970 1 O2F3N5H20C24 A2B3C5D20E24 -112.4 3.57 -9.33 -1.06 0
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321411 126665971 1 OF3N7H22C26 AB3C7D22E26 3.42 1.36 -9.18 -1.46 0
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321412 126665972 1 ClO3N4H19C22 AB3C4D19E22 -10.86 4.84 -9.02 -1.18 0
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321413 126665974 1 F2O2N3H11C14 A2B2C3D11E14 -68.85 1.54 -9.71 -1.32 0
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321414 126665975 1 F3O4N5C34H36 A3B4C5D34E36 -217.79 4.25 -9.26 -0.99 0
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321415 126665976 1 ClSN4O4H17C20 ABC4D4E17F20 -33.41 3.03 -9.49 -1.46 0
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321416 126665977 1 F3O4N5C34H36 A3B4C5D34E36 -218.18 4.21 -9.21 -1.04 0
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321417 126665978 1 ClN3O4H20C23 AB3C4D20E23 -6.1 1.9 -8.47 -1.18 0
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321418 126665979 1 O3F4N6H26C28 A3B4C6D26E28 -216.72 8.79 -9.43 -0.96 0