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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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79955 49831814 1 PN4O12C14H23 AB4C12D14E23 -575.05 3.2 -9.96 -0.81 0
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79956 49831815 1 PN4O12C14H23 AB4C12D14E23 -573.8 5.16 -9.61 -0.71 0
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79957 49831816 1 O4C11H14 A4B11C14 -170.31 3.72 -8.94 -0.25 0
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79958 49831826 1 BrO4C18H23 AB4C18D23 -141.8 5.33 -9.22 -0.79 0
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79959 49831827 1 O2N3C7H9 A2B3C7D9 -16.73 2.2 -10.46 -1.36 0
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79960 49831834 1 BrO2H9C11 AB2C9D11 -7.53 3.03 -9.59 -0.32 0
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79961 49831850 2 OC7H12 AB7C12 -107.3 4.29 -8.97 0.32 0
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79962 49831853 1 O4N5H17C24 A4B5C17D24 64.85 3.0 -9.29 -1.85 0
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79963 49831866 1 BrNOH6C10 ABCD6E10 41.18 3.77 -9.7 -1.23 0
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79964 49831868 1 NSCl3O4H14C16 ABC3D4E14F16 -144.71 6.64 -9.65 -0.77 0
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79965 49831872 1 NO3C18H23 AB3C18D23 -120.5 4.63 -9.75 -1.03 0
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79966 49831877 1 ClON2H13C14 ABC2D13E14 30.94 1.65 -8.47 -0.35 0
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79967 49831888 1 SiCo2O9C26H36 AB2C9D26E36 -442.18 38.07 -9.6 -5.35 0
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79968 49831896 1 BrFO3N4H14C27 ABC3D4E14F27 36.13 7.93 -9.4 -1.78 2
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79969 49831905 1 FeP3N9C30H50 AB3C9D30E50 123.74 8.21 -5.52 -3.45 2
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79970 49831907 1 FeP3N9C31H52 AB3C9D31E52 -212.89 18.5 -5.39 -0.27 0
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79971 49831916 1 NO4C28H29 AB4C28D29 -108.48 4.04 -8.62 -0.58 0
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79972 49831917 1 IC11H19 AB11C19 -18.91 3.11 -9.12 -0.55 0
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79973 49831923 2 FOH8C9 ABC8D9 -113.86 3.23 -9.05 -0.26 0
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79974 49831930 1 ClNOH14C17 ABCD14E17 42.44 4.72 -9.52 -0.57 0
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79975 49831931 1 OSiC15H16 ABC15D16 1.35 0.39 -8.68 -0.64 0
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79976 49831933 1 SiO3C26H44 AB3C26D44 -232.32 1.51 -8.66 0.54 0
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79977 49831942 1 P3N7O18C26H42 A3B7C18D26E42 -932.95 4.61 -9.36 -0.88 0
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79978 49831943 1 P3N7O18C28H46 A3B7C18D28E46 -949.88 12.83 -9.19 -0.74 0
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79979 49831963 1 N2O3H22C29 A2B3C22D29 0.21 2.5 -8.67 -0.7 0
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79980 49831967 1 BrClNO2C10H13 ABCD2E10F13 -100.43 5.12 -9.52 -0.2 0
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79981 49831969 1 ClNSO2C8H12 ABCD2E8F12 -96.65 4.74 -8.97 -0.12 0
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79982 49831970 1 O2F4H12C13 A2B4C12D13 -252.09 1.88 -10.39 -1.38 0
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79983 49831971 1 SF4O4H16C19 AB4C4D16E19 -307.04 3.0 -9.64 -1.87 0
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79984 49831986 1 O5C29H34 A5B29C34 -176.98 3.62 -9.31 -0.62 0
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79985 49831987 1 O5C33H42 A5B33C42 -195.23 2.47 -9.09 -0.89 0
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79986 49832000 1 N2O5C20H28 A2B5C20D28 -204.24 6.2 -9.96 -0.72 0
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79987 49832009 1 NO3C17H21 AB3C17D21 -126.17 8.93 -9.55 -1.57 0
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79988 49832014 1 N2O3H28C29 A2B3C28D29 -52.05 4.11 -8.66 -0.68 0
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79989 49832035 1 SH14C19 AB14C19 130.81 0.71 -8.84 -0.35 0
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79990 49832043 1 NO9C30H45 AB9C30D45 -196.64 10.02 -9.08 -1.69 0
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79991 49832044 1 O4C23H36 A4B23C36 -221.56 5.64 -10.08 0.79 0
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79992 49832045 1 O3C23H38 A3B23C38 -165.76 2.49 -9.43 1.05 0
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79993 49832048 1 SN2O6C19H28 AB2C6D19E28 -234.75 6.29 -10.11 -0.46 0
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79994 49832049 1 IN2O5H25C26 AB2C5D25E26 -101.66 4.73 -8.4 -0.82 0
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79995 49832069 1 N2O6C35H50 A2B6C35D50 -269.72 5.34 -8.63 -0.58 0
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79996 49832071 1 O2N5C25H25 A2B5C25D25 28.66 3.59 -9.06 -0.89 0
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79997 49832081 1 NO2F3C27H28 AB2C3D27E28 -211.82 4.74 -8.91 -0.72 0
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79998 49832082 1 NO2F3C27H28 AB2C3D27E28 -211.37 1.77 -8.74 -0.62 0
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79999 49832093 1 FO3N5C21H22 AB3C5D21E22 -57.59 4.27 -9.54 -1.03 0
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80000 49832151 1 ClON2C22H27 ABC2D22E27 -37.47 5.44 -8.79 -0.26 0
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80001 49832153 1 N2O2C23H30 A2B2C23D30 -60.82 4.73 -8.46 0.18 0
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80002 49832155 1 O13N14C54H88 A13B14C54D88 -498.96 9.02 -8.15 -0.66 0
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80003 49832156 1 SO2N4C20H20 AB2C4D20E20 26.35 1.56 -8.58 -0.98 0
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80004 49832159 1 OS2N4H20C26 AB2C4D20E26 114.06 2.6 -8.44 -1.0 0
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80005 49832161 1 OSN4C20H20 ABC4D20E20 59.64 2.08 -8.5 -0.8 0
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80006 49832164 1 BN3O6C19H24 AB3C6D19E24 -285.0 6.39 -9.25 -0.96 0
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80007 49832168 1 BN3O6C23H24 AB3C6D23E24 -247.99 6.64 -9.48 -0.91 0
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80008 49832175 1 N5O13C24H45 A5B13C24D45 -577.81 4.31 -9.52 0.21 0
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80009 49832176 1 N6O13C28H52 A6B13C28D52 -585.4 8.03 -9.49 0.49 0
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80010 49832178 3 N2O5C8H16 A2B5C8D16 -652.83 7.21 -9.44 -0.05 0
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80011 49832179 1 FN3O4C29H32 AB3C4D29E32 -174.85 4.57 -8.86 -0.38 0
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80012 49832186 1 ClSN4O11C40H49 ABC4D11E40F49 -441.98 7.52 -9.31 -0.93 0
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80013 49832227 1 N5O5C28H29 A5B5C28D29 -83.01 3.79 -8.76 -1.1 0
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80014 49832228 1 ON7H27C28 AB7C27D28 106.23 5.16 -8.53 -1.0 0
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80015 49832229 1 OF2N8H22C25 AB2C8D22E25 0.62 2.06 -8.7 -1.1 0
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80016 49832231 1 F2O2N7H27C28 A2B2C7D27E28 -65.13 4.91 -8.6 -1.08 0
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80017 49832234 1 N10O17C40H66 A10B17C40D66 -850.35 11.75 -9.76 -0.28 0
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80018 49832236 1 SO3F4N5H23C24 AB3C4D5E23F24 -243.93 6.87 -9.08 -1.1 0
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80019 49832245 1 O3N4C25H26 A3B4C25D26 -44.65 4.99 -8.44 -0.56 0
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80020 49832246 1 O2F3N6C26H27 A2B3C6D26E27 -160.94 8.01 -8.57 -0.74 0
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80021 49832259 1 FSN4O6C22H27 ABC4D6E22F27 -220.89 4.17 -9.84 -1.08 0
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80022 49832263 1 Cl2O3N9H29C36 A2B3C9D29E36 93.89 8.56 -9.41 -1.2 0
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80023 49832265 1 FCl2O4N8H31C38 AB2C4D8E31F38 -29.76 6.97 -9.44 -1.33 0
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80024 49832266 1 ClF3O3N9H31C38 AB3C3D9E31F38 -51.26 10.04 -9.13 -1.06 0
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80025 49832276 1 SO3N7C27H33 AB3C7D27E33 -27.16 4.2 -8.67 -1.07 0
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80026 49832280 1 N3O4H13C15 A3B4C13D15 -97.44 7.93 -9.44 -1.23 0
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80027 49832292 1 F3N4O4H13C16 A3B4C4D13E16 -239.89 4.97 -8.63 -1.36 0
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80028 49832294 2 OF2N2H5C7 AB2C2D5E7 -200.36 3.74 -8.76 -1.78 0
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80029 49832295 1 FO2N4H13C18 AB2C4D13E18 -18.37 8.36 -8.61 -1.2 0
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80030 49832297 1 ClO2N4H13C18 AB2C4D13E18 20.34 7.64 -8.52 -1.3 0
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80031 49832298 2 ClON2H6C9 ABC2D6E9 14.99 6.27 -8.54 -1.51 0
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80032 49832318 1 BrON8C26H31 ABC8D26E31 64.2 5.67 -7.73 -0.32 0
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80033 49832319 1 ClON8C26H31 ABC8D26E31 57.04 4.35 -7.79 -0.32 0
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80034 49832320 1 ClO7N10C35H47 AB7C10D35E47 -224.23 9.0 -8.65 -0.52 0
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80035 49832322 1 O5C20H22 A5B20C22 -168.89 10.03 -9.13 -1.16 0
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80036 49832353 1 ClSN4O11C41H57 ABC4D11E41F57 -494.19 6.1 -9.84 -0.64 0
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80037 49832355 1 SN4O11C40H56 AB4C11D40E56 -491.17 6.51 -9.57 -0.36 0
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80039 49832369 1 F2O7C35H36 A2B7C35D36 -329.4 4.91 -9.81 -0.7 0
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80040 49832374 1 FSO2N4C26H31 ABC2D4E26F31 -55.54 8.45 -8.94 -0.66 0
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80041 49832382 1 ON10C42H44 AB10C42D44 152.3 9.77 -7.88 -0.79 0
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80042 49832400 1 O6N13C36H49 A6B13C36D49 -170.82 11.98 -8.45 -0.14 0
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80043 49832402 1 Cl2N3O3C31H31 A2B3C3D31E31 -62.43 6.73 -8.73 -0.46 0
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80044 49832417 1 NO2F4C21H23 AB2C4D21E23 -261.66 1.25 -8.94 -0.7 0
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80045 49832423 1 FCl2O3N9H30C37 AB2C3D9E30F37 53.17 14.26 -9.14 -0.97 0
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80046 49832428 1 FCl2O3N8H29C38 AB2C3D8E29F38 41.0 7.78 -9.41 -1.26 0
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80047 49832430 1 ClSO4N5C21H22 ABC4D5E21F22 -58.84 8.25 -8.65 -0.8 0
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80048 49832446 2 ClON2H6C9 ABC2D6E9 12.22 6.46 -8.44 -1.48 0
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80049 49832464 1 ClO2N5C25H28 AB2C5D25E28 -17.95 5.8 -8.49 -0.73 0
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80050 49832468 1 BrSO2N8C27H33 ABC2D8E27F33 35.23 9.18 -7.97 -0.92 0
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80051 49832478 1 BrSO3N9C31H40 ABC3D9E31F40 -0.34 9.23 -7.78 -0.82 0
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80052 49832484 1 N2O6H12C15 A2B6C12D15 -36.67 6.71 -9.4 -1.85 0
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80053 49832491 1 OSN3C22H23 ABC3D22E23 46.03 5.11 -8.34 -0.44 0
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80054 49832507 1 SN3O3C24H31 AB3C3D24E31 -87.04 4.48 -8.33 -0.27 0
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80055 49832508 1 ClSN3O4C24H30 ABC3D4E24F30 -126.22 6.17 -8.55 -0.36 0