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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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11007 109789 1 SN2O4C8H8 AB2C4D8E8 -119.51 3.43 -9.78 -1.14 0
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11008 109790 1 BrC11H15 AB11C15 -12.41 1.69 -9.12 0.22 0
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11009 109791 1 SN2O4C14H14 AB2C4D14E14 -121.39 10.55 -9.13 -1.03 0
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11010 109792 1 IO4N6C20H21 AB4C6D20E21 46.27 13.75 -8.37 -1.65 0
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11011 109793 1 BrO3N5C19H20 AB3C5D19E20 40.7 7.91 -8.54 -1.71 0
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11012 109811 1 N2O2C7H14 A2B2C7D14 -76.15 4.93 -9.06 0.27 0
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11013 109832 1 SO4N6C24H24 AB4C6D24E24 26.78 2.42 -8.37 -1.6 0
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11014 109833 1 NaSN5O5C30H30 ABC5D5E30F30 -59.55 8.65 -7.78 -0.69 0
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11015 109834 1 SN5O5C30H31 AB5C5D30E31 -21.19 5.83 -8.01 -0.98 0
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11016 109835 1 NaSN2O7H9C14 ABC2D7E9F14 -272.77 9.43 -8.25 -1.81 0
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11018 109950 1 FSO2C10H21 ABC2D10E21 -180.24 5.51 -11.14 0.07 0
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11019 109958 2 OC8H9 AB8C9 -77.32 0.45 -7.97 -0.31 0
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11020 109962 1 NSO2H8F9C11 ABC2D8E9F11 -496.26 4.85 -10.0 -1.13 0
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11021 109964 1 NSO2H8C13F13 ABC2D8E13F13 -688.02 4.91 -9.88 -1.16 0
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11022 109976 2 NNaO3C9H16 ABC3D9E16 -396.56 8.36 -8.22 0.26 0
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11023 110035 1 S4N7O13H27C40 A4B7C13D27E40 -225.06 23.43 -8.92 -1.79 0
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11024 110090 1 SO2N6C20H22 AB2C6D20E22 46.0 3.13 -8.11 -1.32 0
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11025 110096 1 ClN2C27H32 AB2C27D32 48.04 3.34 0.0 0.0 1
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11026 110099 1 ClO2N3C20H22 AB2C3D20E22 20.55 12.12 -8.43 -1.71 0
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11027 110102 1 O3N5C19H20 A3B5C19D20 96.75 16.46 0.0 0.0 1
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11028 110120 1 NC14H20 AB14C20 4.06 1.35 0.0 0.0 1
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11029 110130 2 N2O2H9C12 A2B2C9D12 40.67 7.78 -8.52 -2.06 0
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11030 110131 1 ClN4O4H15C17 AB4C4D15E17 -4.47 1.42 -8.87 -1.98 0
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11031 110132 1 BaN2S2O7H12C20 AB2C2D7E12F20 -319.64 15.81 -9.02 -2.51 0
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11032 110141 1 N3S4O14H21C24 A3B4C14D21E24 -460.52 8.25 -9.02 -2.15 0
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11033 110146 1 BrNOCl2H8C9 ABCD2E8F9 -47.29 3.9 -9.26 -0.78 0
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11034 110154 1 SiN2O3C5H16 AB2C3D5E16 -246.51 1.57 -8.75 1.31 0
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11035 110155 1 ZnS2Cl4N4O4C28H42 AB2C4D4E4F28G42 -147.53 4.66 -8.57 -2.25 0
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11036 110159 1 CuN3S3O10H19C23 AB3C3D10E19F23 -180.67 8.03 0.0 0.0 0
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11037 110164 1 S3N5O11H24C28 A3B5C11D24E28 -251.85 9.83 0.0 0.0 1
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11038 110168 1 N4O4H13C18 A4B4C13D18 -3.91 4.81 0.0 0.0 1
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11039 110171 1 ClSN3O4C14H16 ABC3D4E14F16 -113.39 8.79 -8.53 -1.62 0
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11040 110175 1 S3N5O9H17C22 A3B5C9D17E22 -180.98 9.5 -8.69 -2.36 0
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11041 110187 1 N2O5C16H24 A2B5C16D24 -129.4 8.19 -8.5 -0.62 0
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11042 110189 2 OC6H8 AB6C8 -83.42 4.83 -9.8 -0.62 0
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11043 110201 1 NC16H27 AB16C27 -30.67 1.45 -8.24 0.47 0
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11044 110206 1 ZnP2O4S4C20H44 AB2C4D4E20F44 -402.46 6.78 -9.29 -0.79 0
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11045 110212 1 ClSN4O4C12H13 ABC4D4E12F13 -106.35 5.54 -9.74 -1.4 0
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11046 110214 1 ZnN2O2Cl3C8H9 AB2C2D3E8F9 -91.01 12.5 -9.77 -2.11 0
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11047 110215 1 ZnN2O2Cl3C8H9 AB2C2D3E8F9 -77.84 13.71 -9.66 -2.64 0
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11048 110219 1 ZnCl6N6C16H18 AB6C6D16E18 44.45 13.25 -8.89 -1.73 0
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11050 110230 1 ClPN3F6C10H13 ABC3D6E10F13 -379.14 14.86 -9.46 -2.22 0
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11051 110249 1 SN3O6C20H21 AB3C6D20E21 -168.72 16.71 -8.62 -1.32 0
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11052 110263 2 O2C3H7 A2B3C7 -195.1 5.16 -10.24 1.47 0
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11053 110281 1 TiO5C35H74 AB5C35D74 -344.87 14.31 -6.36 -1.35 0
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11058 110313 1 ClKSN5O5H17C23 ABCD5E5F17G23 -98.42 7.32 -8.58 -0.53 0
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11059 110315 1 NaSN4O6H17C26 ABC4D6E17F26 -79.94 24.9 -8.52 -2.38 0
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11060 110416 1 SN2O7H12C17 AB2C7D12E17 -112.72 6.43 -9.75 -2.78 0
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11061 110430 1 ClSN2O5C39H53 ABC2D5E39F53 -209.23 4.81 -9.02 -1.49 0
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11062 110495 1 ZnCl3N3O3H6C7 AB3C3D3E6F7 -38.03 13.37 -9.89 -3.34 0