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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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44879 10506305 2 OSN3C13H17 ABC3D13E17 18.21 7.0 -8.75 -1.08 1
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44880 10506328 1 NPO7C26H55 ABC7D26E55 -437.04 2.67 0.0 0.0 0
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44881 10506333 1 ClSi2O4N5C22H38 AB2C4D5E22F38 -291.04 4.28 -8.92 -0.63 0
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44882 10506341 3 O2C11H12 A2B11C12 -145.67 5.08 -8.79 0.1 0
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44883 10506347 1 N2S2O5C27H32 A2B2C5D27E32 -124.62 5.14 -9.26 -0.54 0
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44884 10506348 2 NOC18H18 ABC18D18 0.47 2.85 -8.86 -0.92 0
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44885 10506350 1 O2S2N4H28C29 A2B2C4D28E29 -7.54 5.79 -8.24 -0.24 0
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44886 10506359 1 ClSN2O6H25C26 ABC2D6E25F26 -183.4 7.2 -9.49 -0.6 0
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44887 10506363 1 INSO4C22H28 ABCD4E22F28 -129.04 3.08 -8.48 -0.42 0
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44888 10506375 1 NO4C34H43 AB4C34D43 -85.88 2.95 -8.22 0.5 0
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44889 10506377 1 NSiO4C32H39 ABC4D32E39 -164.1 2.51 -8.87 -0.74 0
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44890 10506379 1 NO3C35H47 AB3C35D47 -115.94 4.65 -8.19 0.5 0
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44891 10506381 1 ClSN3O5C26H28 ABC3D5E26F28 -148.93 8.56 -8.51 -0.17 0
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44892 10506385 1 O12C25H38 A12B25C38 -577.53 5.22 -10.01 -0.23 0
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44893 10506399 1 O3C37H38 A3B37C38 -81.78 4.75 -8.84 -0.92 0
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44894 10506403 2 O3C16H25 A3B16C25 -298.88 5.56 -9.4 0.54 0
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44895 10506404 1 SO5C31H46 AB5C31D46 -208.81 3.64 -8.88 -1.16 0
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44896 10506406 1 O5C33H54 A5B33C54 -273.0 2.77 -9.46 -0.46 0
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44897 10506407 1 ClS2N6O7C18H19 AB2C6D7E18F19 -177.7 4.53 -9.21 -1.48 0
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44898 10506412 1 N3O10C25H29 A3B10C25D29 -355.55 3.4 -9.2 -0.34 0
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44899 10506440 1 O7C31H48 A7B31C48 -394.16 3.88 -9.94 0.84 0
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44900 10506444 1 O3C36H52 A3B36C52 -181.59 2.93 -9.49 -0.59 0
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44901 10506456 1 NPSO7C26H32 ABCD7E26F32 -320.14 2.36 -8.78 -0.53 0
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44902 10506457 1 N3O5H27C32 A3B5C27D32 -115.01 7.76 -9.29 -0.63 0
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44903 10506459 1 PN3O3C31H40 AB3C3D31E40 -112.2 12.02 -7.14 -0.44 0
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44904 10506460 1 NO6C32H39 AB6C32D39 -233.33 3.56 -8.52 -1.39 0
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44905 10506462 1 NSi2O5C28H47 AB2C5D28E47 -317.48 3.52 -8.83 -0.03 0
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44906 10506463 1 ClNOPF3H20C30 ABCDE3F20G30 -31.47 9.05 -8.76 -0.56 1
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44907 10506464 1 ClNOPF3H21C30 ABCDE3F21G30 -28.34 12.59 0.0 0.0 0
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44908 10506465 1 NC38H63 AB38C63 -1.95 3.3 -9.88 -0.03 0
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44909 10506467 1 ClOS2N5H24C27 ABC2D5E24F27 90.63 4.35 -8.93 -1.43 0
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44911 10506483 1 O4N8C27H34 A4B8C27D34 6.56 3.68 -8.18 -0.13 1
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44912 10506494 1 N4O6H23C27 A4B6C23D27 -116.5 10.55 0.0 0.0 0
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44913 10506496 1 NPO6C30H34 ABC6D30E34 -259.98 2.96 -9.24 0.06 0
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44914 10506504 1 N3O7C28H45 A3B7C28D45 -329.36 11.43 -9.07 0.16 0
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44915 10506507 1 NSiO2C35H41 ABC2D35E41 -61.96 2.31 -9.1 -0.04 0
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44916 10506512 1 BrNO7C25H30 ABC7D25E30 -216.45 3.26 -8.88 -1.46 0
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44917 10506522 1 SN2O8C26H36 AB2C8D26E36 -315.5 11.05 -9.56 -0.77 0
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44918 10506523 1 SO3N4H28C31 AB3C4D28E31 85.9 8.9 -8.19 -1.13 0
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44919 10506527 1 SN2O4C31H40 AB2C4D31E40 -111.59 5.7 -8.59 0.08 0
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44920 10506535 2 SiO2C15H28 AB2C15D28 -285.19 3.06 -8.7 0.58 1
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44921 10506537 1 SO2N4C24H29 AB2C4D24E29 -17.93 4.55 0.0 0.0 0
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44922 10506544 1 N5O6C28H35 A5B6C28D35 -184.71 5.7 -9.39 -0.96 0
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44923 10506548 1 NSO7C29H31 ABC7D29E31 -242.27 5.93 -9.0 -0.65 0
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44924 10506549 1 S2N5O6C23H31 A2B5C6D23E31 -233.47 12.43 -8.41 -0.79 0
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44925 10506550 1 S2N5O6C23H31 A2B5C6D23E31 -227.0 6.43 -8.67 -1.25 0
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44926 10506552 1 NPO7C27H56 ABC7D27E56 -435.85 13.37 -8.91 -0.38 0
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44927 10506603 1 N5O9C24H37 A5B9C24D37 -277.24 8.3 -9.23 -1.53 0
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44928 10506610 1 NO5C33H49 AB5C33D49 -268.92 5.87 -8.81 0.75 1
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44929 10506627 1 ClRhSN2O2C23H34 ABCD2E2F23G34 -84.91 12.98 -9.1 -4.44 0
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44930 10506628 1 SN2O2C13H20 AB2C2D13E20 -82.22 5.69 -9.23 -0.28 0
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44931 10506629 1 ClN4O8C24H33 AB4C8D24E33 -335.56 2.29 -9.53 -0.97 0
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44932 10506630 1 ClN2O6C29H33 AB2C6D29E33 -246.5 6.81 -8.62 -1.36 0
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44933 10506631 1 ClSO2N4H25C30 ABC2D4E25F30 64.92 7.72 -8.49 -1.39 0
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44934 10506632 1 BrIN2O2C21H22 ABC2D2E21F22 -24.28 10.78 -6.82 -1.49 0
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44935 10506635 1 INSO3C24H32 ABCD3E24F32 -97.07 12.08 -7.21 -2.05 0
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44936 10506657 1 SiN3O8C25H43 AB3C8D25E43 -403.67 5.28 -8.74 -1.06 0
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44937 10506670 1 SN2O6H26C30 AB2C6D26E30 -137.63 4.45 -8.49 -0.91 0
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44938 10506674 2 O2N3C15H17 A2B3C15D17 -19.21 8.27 -9.06 -1.22 0
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44939 10506680 1 SN4O5C28H38 AB4C5D28E38 -208.21 4.04 -9.09 -0.08 0
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44940 10506682 1 O3N8C28H46 A3B8C28D46 -119.45 3.49 -9.36 -1.0 0
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44941 10506683 1 O6C33H50 A6B33C50 -326.16 4.63 -9.35 0.68 1
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44942 10506692 1 OS2N6C21H27 AB2C6D21E27 52.15 4.85 0.0 0.0 0
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44943 10506715 1 NSnO2C28H43 ABC2D28E43 -70.2 5.66 -8.63 0.02 0
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44944 10506716 1 OSiBr2C26H28 ABC2D26E28 -36.09 1.76 -9.11 -0.79 0
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44945 10506726 1 N2O7C31H32 A2B7C31D32 -206.52 2.09 -8.35 -0.73 0
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44946 10506739 1 SiF3O4C29H47 AB3C4D29E47 -413.0 7.09 -9.09 -0.93 0
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44947 10506740 8 NC4H6 AB4C6 231.82 2.58 -8.22 1.38 0
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44948 10506762 1 SN3O7C27H35 AB3C7D27E35 -278.92 8.46 -8.68 -1.06 0
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44949 10506777 1 N2P2Na3C13O13H23 A2B2C3D13E13F23 -897.17 12.96 -8.68 0.49 0
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44950 10506786 2 NO4C15H15 AB4C15D15 -237.43 5.54 -9.32 -0.17 0
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44951 10506788 1 F3N4O4C28H33 A3B4C4D28E33 -233.87 5.23 -8.4 -0.81 0
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44952 10506799 1 NO16C20H37 AB16C20D37 -710.75 3.78 -9.53 0.17 0
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44953 10506808 1 N7O7C25H37 A7B7C25D37 -227.07 11.02 -9.3 -0.74 0
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44954 10506813 1 IN2O6C22H33 AB2C6D22E33 -205.22 39.63 -4.75 -2.95 0
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44955 10506815 1 O15C23H32 A15B23C32 -628.27 6.18 -9.57 0.07 0
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44956 10506816 2 PO3C15H15 AB3C15D15 -249.27 6.22 -9.45 -0.03 0
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44957 10506823 1 O10C29H40 A10B29C40 -393.67 2.39 -9.81 -1.12 0
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44958 10506829 1 O7C33H40 A7B33C40 -160.78 5.04 -9.2 -0.05 0
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44959 10506830 1 O3N4C34H36 A3B4C34D36 -65.83 9.03 -8.96 -0.81 0
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44960 10506835 4 OC9H13 AB9C13 -188.89 3.31 -8.91 -1.55 0
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44961 10506846 1 BrO2C33H41 AB2C33D41 47.29 3.81 -8.85 -0.84 0
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44962 10506850 1 N3O4C34H35 A3B4C34D35 -81.44 5.1 -8.77 -0.68 0
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44963 10506863 1 N4O4C33H34 A4B4C33D34 12.21 5.5 -9.59 -0.36 0
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44964 10506868 2 O2N3C15H21 A2B3C15D21 -170.52 12.02 -8.71 -0.41 0
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44965 10506869 2 O2N3C15H21 A2B3C15D21 -159.3 3.79 -8.75 -0.3 0
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44966 10506889 1 N3O6C31H41 A3B6C31D41 -241.48 4.03 -8.78 -0.34 0
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44967 10506892 1 ON3H37C38 AB3C37D38 100.35 3.16 -8.83 0.05 0
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44968 10506920 1 SiBr3H21C22 AB3C21D22 35.37 1.81 -9.33 -0.59 0
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44969 10506929 1 O3N5C33H39 A3B5C33D39 -46.14 3.22 -8.34 -0.22 0
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44970 10506933 1 ClSN3O6C26H36 ABC3D6E26F36 -286.99 4.56 -8.82 -1.01 0
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44971 10506941 1 PN2O10C25H35 AB2C10D25E35 -469.96 2.67 -9.59 -1.65 0
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44972 10506957 1 SN2O4C33H34 AB2C4D33E34 -49.55 6.88 -8.16 -0.55 0
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44973 10506960 1 SiO7C31H42 AB7C31D42 -282.26 0.53 -9.04 0.01 0
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44974 10506961 1 N2O3C36H46 A2B3C36D46 -115.18 3.7 -8.37 -1.09 0
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44975 10506962 1 N2S3O5C26H38 A2B3C5D26E38 -203.6 5.11 -8.71 -1.76 0
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44976 10506967 1 BrO2N4H27C30 AB2C4D27E30 22.77 2.01 -8.93 -0.63 0
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44977 10506968 1 FN5O6H22C29 AB5C6D22E29 -139.33 3.29 -8.82 -1.91 0
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44978 10506969 1 N5O9C26H29 A5B9C26D29 -319.6 6.1 -9.13 -1.09 0
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44979 10506970 1 NPO8C29H34 ABC8D29E34 -315.47 4.76 -8.07 -0.54 0