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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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34049 7889607 1 NO3C26H29 AB3C26D29 -97.76 2.83 -8.84 -0.47 0
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34050 7889608 1 NSO2H23C25 ABC2D23E25 -8.9 2.7 -8.88 -0.82 0
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34051 7889612 1 SN3O6C17H17 AB3C6D17E17 -190.87 12.48 -9.1 -0.94 0
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34052 7889625 1 N2O4C19H26 A2B4C19D26 -171.77 3.65 -9.47 -0.13 0
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34053 7889626 1 N2O4C19H26 A2B4C19D26 -170.21 4.56 -9.48 -0.26 0
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34054 7889630 3 NO2C6H7 AB2C6D7 -235.24 7.48 -9.64 -0.92 0
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34055 7889632 1 N2O4H20C21 A2B4C20D21 -110.84 5.55 -8.98 -0.5 0
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34056 7889633 1 N2O4H20C21 A2B4C20D21 -111.14 6.56 -9.01 -0.53 0
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34057 7889634 1 SN3O4H17C19 AB3C4D17E19 -87.5 5.59 -9.05 -0.75 0
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34058 7889635 1 SN3O4H15C17 AB3C4D15E17 -99.56 6.2 -9.1 -1.32 0
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34059 7889637 1 NO3C22H27 AB3C22D27 -120.76 2.15 -9.14 -0.27 0
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34060 7889639 1 N2O5C16H16 A2B5C16D16 -147.27 2.31 -9.57 -0.68 0
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34061 7889640 1 N3O6C20H21 A3B6C20D21 -178.49 4.36 -9.54 -0.61 0
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34062 7889643 1 N2O4C21H24 A2B4C21D24 -137.42 2.99 -8.92 -0.44 0
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34063 7889644 1 N2O4C21H24 A2B4C21D24 -138.74 6.07 -8.79 -0.65 0
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34064 7889654 1 BrNO3C19H20 ABC3D19E20 -96.18 3.02 -9.25 -1.24 0
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34065 7889655 1 BrNO3C19H20 ABC3D19E20 -96.48 3.1 -9.22 -1.24 0
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34066 7889680 1 Br2O3H12C16 A2B3C12D16 -65.36 1.99 -9.98 -1.22 0
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34067 7889684 1 BrNF3O3H11C16 ABC3D3E11F16 -211.29 4.26 -9.38 -1.41 0
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34068 7889694 1 BrNO3C19H20 ABC3D19E20 -95.65 2.72 -8.68 -1.36 0
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34069 7889697 1 BrO2H15C20 AB2C15D20 -8.74 1.94 -9.2 -0.99 0
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34070 7889704 1 N2O3H16C22 A2B3C16D22 -12.48 7.13 -8.92 -0.82 0
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34071 7889706 1 SN3O6C19H21 AB3C6D19E21 -183.22 7.08 -9.38 -1.55 0
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34072 7889708 1 N4O5H10C15 A4B5C10D15 -5.38 4.49 -10.52 -2.18 0
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34073 7889717 1 N4O6H12C15 A4B6C12D15 -80.86 3.73 -10.23 -1.75 0
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34074 7889720 1 N2O3C16H16 A2B3C16D16 -79.51 1.35 -8.87 -1.3 0
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34075 7889721 1 N2O3C16H16 A2B3C16D16 -79.47 2.51 -9.0 -1.24 0
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34076 7889723 1 N2O3H16C17 A2B3C16D17 -63.39 5.05 -8.71 -0.83 0
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34077 7889726 1 NO4H11C14 AB4C11D14 -87.37 2.12 -8.96 -1.0 0
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34078 7889729 1 ClSN2O5H13C15 ABC2D5E13F15 -152.45 6.28 -9.54 -1.55 0
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34079 7889735 1 N2O3H16C17 A2B3C16D17 -65.39 5.28 -8.74 -0.98 0
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34080 7889737 1 N2O3F6H10C16 A2B3C6D10E16 -384.61 5.42 -9.88 -1.62 0
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34081 7889742 1 SN2O5C18H24 AB2C5D18E24 -190.99 8.37 -10.12 -0.95 0
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34082 7889749 1 ClN3O4H16C21 AB3C4D16E21 -41.09 3.82 -9.27 -1.08 0
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34083 7889751 1 ClN2O3H15C16 AB2C3D15E16 -82.0 2.22 -9.6 -1.29 0
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34084 7889753 1 N2O5C18H20 A2B5C18D20 -165.23 6.75 -9.03 -0.78 0
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34085 7889754 1 SN2O3H14C17 AB2C3D14E17 -27.08 3.85 -8.87 -1.01 0
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34086 7889756 1 NSCl2O3C19H19 ABC2D3E19F19 -122.04 6.35 -9.22 -0.77 0
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34087 7889759 1 SO3C22H28 AB3C22D28 -139.45 2.71 -8.75 -0.36 0
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34088 7889762 1 NSO5C21H25 ABC5D21E25 -173.45 5.23 -8.35 -0.63 0
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34089 7889769 1 N2O2S2C21H22 A2B2C2D21E22 -23.42 2.76 -8.39 -0.54 0
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34090 7889772 1 NSO3C16H17 ABC3D16E17 -85.05 1.44 -8.74 -0.44 0
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34091 7889776 1 ClFNSO3C19H19 ABCDE3F19G19 -157.4 5.29 -9.17 -0.74 0
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34092 7889782 1 FNSO3C19H20 ABCD3E19F20 -145.53 2.36 -9.03 -0.51 0
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34093 7889783 1 NSF3O3C20H20 ABC3D3E20F20 -266.14 8.6 -9.07 -0.67 0
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34094 7889784 1 NSF3O3C20H20 ABC3D3E20F20 -266.82 7.56 -9.35 -0.84 0
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34095 7889791 1 NO2S2C21H21 AB2C2D21E21 -28.4 2.49 -8.7 -0.76 0
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34096 7889795 1 BrNSO3C18H18 ABCD3E18F18 -93.23 6.11 -8.98 -0.7 0
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34097 7889796 1 NF2S2O3C19H19 AB2C2D3E19F19 -198.66 8.08 -9.18 -0.8 0
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34098 7889801 1 BrNSO3C18H18 ABCD3E18F18 -94.92 3.23 -9.04 -0.65 0
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34099 7889804 1 NSCl2O3H17C18 ABC2D3E17F18 -112.62 6.06 -9.1 -0.77 0
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34100 7889810 1 NSCl2O3H17C18 ABC2D3E17F18 -109.12 3.29 -8.95 -0.7 0
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34101 7889814 1 SN2O4C20H22 AB2C4D20E22 -137.76 5.5 -9.01 -0.63 0
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34102 7889816 1 SN2O4C21H24 AB2C4D21E24 -150.34 2.45 -9.06 -0.63 0
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34103 7889818 1 NSO4H23C24 ABC4D23E24 -103.02 5.46 -8.66 -0.54 0
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34104 7889825 1 BrNSO2H16C18 ABCD2E16F18 -20.88 5.11 -9.11 -0.88 0
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34105 7889830 1 FNO7H14C17 ABC7D14E17 -186.34 3.52 -9.62 -1.21 0
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34106 7889831 1 SN2O6C20H20 AB2C6D20E20 -120.36 9.22 -9.07 -1.02 0
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34107 7889838 1 N3O7C13H13 A3B7C13D13 -169.89 8.27 -9.85 -1.2 0
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34108 7889849 1 N2O6C21H24 A2B6C21D24 -139.11 8.02 -9.16 -1.48 0
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34109 7889851 1 NO7H13C16 AB7C13D16 -131.8 6.99 -8.98 -0.99 0
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34110 7889859 1 N4O6H14C19 A4B6C14D19 -57.27 7.77 -9.11 -1.18 0
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34111 7889861 1 ClNO5H14C16 ABC5D14E16 -88.94 5.01 -9.75 -1.14 0
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34112 7889872 1 N2O3C25H26 A2B3C25D26 -86.82 3.49 -8.72 -1.22 0
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34113 7889885 1 N2O3C24H24 A2B3C24D24 -83.42 3.8 -8.68 -1.18 0
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34114 7889890 1 NO3H25C26 AB3C25D26 -75.74 5.75 -9.21 -0.79 0
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34115 7889892 1 N2O3C23H28 A2B3C23D28 -121.53 1.9 -9.47 -1.25 0
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34116 7889893 1 N2O3C23H28 A2B3C23D28 -120.55 3.79 -9.42 -1.17 0
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34117 7889894 1 N2O3C23H28 A2B3C23D28 -122.2 1.76 -9.44 -1.2 0
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34118 7889897 1 N2O3C26H26 A2B3C26D26 -78.67 3.98 -8.72 -0.98 0
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34119 7889901 1 NO3C25H25 AB3C25D25 -80.11 3.27 -9.33 -1.02 0
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34120 7889909 1 ClNO4H20C23 ABC4D20E23 -116.12 3.23 -9.17 -0.97 0
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34121 7889910 1 N2O3H24C25 A2B3C24D25 -69.05 2.64 -8.74 -1.22 0
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34122 7889937 1 N2F3O3C20H21 A2B3C3D20E21 -250.14 3.28 -8.88 -0.77 0
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34123 7889943 1 NSF3O4C14H16 ABC3D4E14F16 -317.67 8.3 -9.97 -0.79 0
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34124 7889947 1 N2F3O4H15C17 A2B3C4D15E17 -213.87 6.74 -9.81 -1.51 0
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34125 7889950 1 N2F3O3C13H13 A2B3C3D13E13 -247.88 3.22 -10.0 -0.81 0
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34126 7889958 1 F3N3O3H20C21 A3B3C3D20E21 -203.08 3.87 -8.92 -0.62 0
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34127 7889960 1 N2O3C24H30 A2B3C24D30 -124.33 4.69 -9.53 -1.14 0
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34128 7889963 1 S2O3N4H18C19 A2B3C4D18E19 -42.16 10.88 -9.44 -1.17 0
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34129 7889969 1 NO2F4H13C16 AB2C4D13E16 -248.39 3.35 -9.04 -0.71 0
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34130 7889973 1 N2O3C24H30 A2B3C24D30 -114.15 5.46 -9.15 -0.72 0
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34131 7889976 1 NO2F3C18H18 AB2C3D18E18 -207.01 2.9 -9.53 -0.68 0
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34132 7889983 1 ClNO2H20C22 ABC2D20E22 -43.18 3.58 -9.31 -1.02 0
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34133 7889985 1 NO2C24H25 AB2C24D25 -46.22 3.44 -9.26 -0.89 0
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34134 7889986 1 NSF3O4H16C17 ABC3D4E16F17 -300.01 2.96 -8.8 -0.91 0
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34135 7889990 1 N2O2F3C15H17 A2B2C3D15E17 -211.84 6.2 -9.91 -0.74 0
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34136 7890005 1 N2F3O5H15C17 A2B3C5D15E17 -245.94 6.9 -9.41 -1.57 0
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34137 7890010 1 N2F3O4H13C16 A2B3C4D13E16 -209.0 5.24 -9.81 -1.63 0
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34138 7890022 1 FN2O4C20H21 AB2C4D20E21 -187.67 2.62 -9.0 -0.86 0
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34139 7890028 1 N2O3F4H14C17 A2B3C4D14E17 -282.8 6.98 -9.08 -0.61 0
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34140 7890033 1 ClFNO4H17C22 ABCD4E17F22 -138.98 6.31 -8.55 -0.83 0
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34141 7890035 1 FSN2O3H19C21 ABC2D3E19F21 -99.74 2.38 -8.64 -1.23 0
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34142 7890039 1 N2F3O3C17H21 A2B3C3D17E21 -295.79 3.71 -9.94 -0.74 0
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34143 7890043 1 N2F3O3C17H21 A2B3C3D17E21 -290.49 7.12 -9.58 -0.42 0
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34144 7890046 1 ClNO2F3H15C17 ABC2D3E15F17 -213.36 2.31 -9.73 -0.7 0
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34145 7890047 2 FNO2H6C8 ABC2D6E8 -208.42 3.04 -9.44 -0.91 0
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34146 7890048 1 ClNO2F3H15C17 ABC2D3E15F17 -213.61 2.73 -9.63 -0.7 1
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34147 7890050 1 N2O2C23H29 A2B2C23D29 -16.36 3.5 0.0 0.0 0
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34148 7890053 1 ClFNO3H17C21 ABCD3E17F21 -114.3 4.91 -9.01 -0.85 0