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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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322124 126668760 1 N2O3C17H28 A2B3C17D28 -114.5 5.17 -8.35 0.38 0
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322125 126668765 1 NO3C16H17 AB3C16D17 -5.73 2.97 -9.59 -0.77 0
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322126 126668770 1 ClSF3O3N6C30H30 ABC3D3E6F30G30 -169.8 3.86 -8.58 -1.26 0
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322127 126668771 1 ON2C8H14 AB2C8D14 -44.53 4.37 -9.3 2.31 0
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322128 126668773 1 FN3O5C31H32 AB3C5D31E32 -23.21 2.54 -8.64 -0.86 0
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322129 126668775 1 NSO2F9H14C27 ABC2D9E14F27 -392.14 5.53 -9.48 -1.81 0
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322130 126668777 1 BrNSF3H7C11 ABCD3E7F11 -115.73 3.15 -8.83 -1.16 0
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322131 126668782 2 PN2C6H11 AB2C6D11 103.71 3.88 -8.34 0.37 0
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322132 126668784 1 SO4F9H19C26 AB4C9D19E26 -534.21 9.43 -9.72 -1.37 0
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322133 126668785 1 SO6F8H24C33 AB6C8D24E33 -551.61 9.15 -9.73 -1.36 0
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322134 126668823 1 ISN3O3F4H14C20 ABC3D3E4F14G20 -216.89 6.46 -9.47 -1.62 0
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322135 126668826 1 SF3N4O5H19C23 AB3C4D5E19F23 -268.49 8.53 -9.28 -1.16 0
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322136 126668828 1 SN3O3F4H27C31 AB3C3D4E27F31 -223.5 5.59 -9.03 -0.97 0
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322137 126668829 1 SN3F4O5H21C25 AB3C4D5E21F25 -325.57 9.69 -9.38 -1.21 0
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322138 126668831 1 SN3O3F5H20C23 AB3C3D5E20F23 -309.3 7.63 -9.38 -0.98 0
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322139 126668849 1 ON2C14H30 AB2C14D30 -77.24 2.85 -8.71 2.42 0
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322140 126668850 1 ON3C21H41 AB3C21D41 -93.04 4.65 -8.44 1.11 0
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322141 126668853 1 INO3H10C12 ABC3D10E12 -76.61 9.63 -9.29 -1.57 0
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322142 126668854 1 NO2C16H23 AB2C16D23 -65.3 3.52 -7.96 0.31 1
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322143 126668874 1 BrNOF4H7C12 ABCD4E7F12 -166.51 2.26 0.0 0.0 0
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322144 126668875 1 NSO3F8H13C22 ABC3D8E13F22 -417.12 8.51 -9.26 -1.42 0
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322145 126668876 1 NO2F3H10C11 AB2C3D10E11 -225.23 4.57 -9.58 -0.71 0
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322146 126668879 1 SF3O3N5H20C24 AB3C3D5E20F24 -150.57 4.86 -9.67 -1.23 0
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322147 126668900 1 SF3O3N4H19C24 AB3C3D4E19F24 -141.21 3.15 -8.74 -0.79 0
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322148 126668903 1 SN3O3F4H19C25 AB3C3D4E19F25 -206.97 9.02 -9.09 -0.89 0
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322149 126668908 1 FO2S2N3C25H28 AB2C2D3E25F28 -48.58 6.93 -8.56 -0.57 0
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322150 126668915 1 SO2N3F4H21C25 AB2C3D4E21F25 -210.51 7.75 -8.99 -1.06 0
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322151 126668936 1 NO3C15H19 AB3C15D19 -73.16 5.29 -8.96 -0.31 0
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322152 126668941 1 NOC14H27 ABC14D27 -82.99 3.38 -8.58 2.69 0
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322153 126668944 1 NSO4F8H21C30 ABC4D8E21F30 -441.73 8.51 -9.38 -1.39 0
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322154 126668954 1 SF3N4O4H27C28 AB3C4D4E27F28 -221.42 6.88 -8.84 -1.13 0
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322155 126668961 1 SF3N4O4H21C24 AB3C4D4E21F24 -205.24 8.4 -9.44 -1.05 0
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322156 126668962 1 N2S2F4O5H22C24 A2B2C4D5E22F24 -345.55 12.2 -9.2 -0.85 0
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322157 126668967 1 S2F3O3N4H17C23 A2B3C3D4E17F23 -153.48 8.63 -9.34 -1.35 0
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322158 126668977 1 SN3O3F4H21C23 AB3C3D4E21F23 -242.8 5.28 -9.51 -1.2 0
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322159 126669019 1 FNO3C14H16 ABC3D14E16 -159.12 3.81 -9.65 -0.26 0
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322160 126669020 1 FNO2C12H14 ABC2D12E14 -126.63 3.49 -9.78 -0.28 0
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322161 126669027 1 ClS2O7N8C46H55 AB2C7D8E46F55 -128.59 8.42 -8.46 -0.68 0
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322162 126669029 1 ClNF2O2C11H12 ABC2D2E11F12 -177.64 3.76 -9.54 -0.84 0
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322163 126669036 1 ISN3O3C4H6 ABC3D3E4F6 -52.67 6.53 -10.0 -3.2 0
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322164 126669037 1 IOC3N3H4 ABC3D3E4 26.82 4.72 -9.98 -3.23 1
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322165 126669040 1 S2N11O21C78H102 A2B11C21D78E102 -844.98 6.74 0.0 0.0 0
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322166 126669041 1 INSO3C18H26 ABCD3E18F26 -83.27 2.84 -8.42 -2.31 0
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322167 126669042 1 NO2C16H35 AB2C16D35 -131.9 2.65 -9.08 1.51 0
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322168 126669043 1 N3O6C11H19 A3B6C11D19 -293.14 7.2 -10.29 0.13 0
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322169 126669044 1 PN2O2C5H13 AB2C2D5E13 -148.64 5.85 -9.29 1.22 0
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322170 126669045 1 SF3O3N6C31H33 AB3C3D6E31F33 -171.7 1.42 -8.16 -1.18 0
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322171 126669051 1 SF3O4N6H31C32 AB3C4D6E31F32 -141.33 2.62 -8.17 -1.25 0
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322172 126669056 2 CClNH2 ABCD2 26.4 2.76 -9.69 -0.34 0
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322173 126669059 1 ISO2N4C16H23 ABC2D4E16F23 4.87 3.83 -8.72 -2.41 0
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322174 126669061 1 NO3C11H13 AB3C11D13 -106.97 3.56 -9.45 -0.13 0
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322175 126669079 1 ClF3O3N5C13H21 AB3C3D5E13F21 -249.37 8.17 -9.62 -1.17 0
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322176 126669087 1 N2O9C26H38 A2B9C26D38 -416.45 6.63 -9.62 0.06 0
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322177 126669092 1 OC14H20 AB14C20 -52.38 2.24 -8.72 0.44 0
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322178 126669095 1 OC18H36 AB18C36 -119.11 2.92 -9.39 1.01 0
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322179 126669104 1 O5C12H20 A5B12C20 -246.96 6.72 -11.0 0.37 0
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322180 126669107 1 ON2C13H28 AB2C13D28 -63.54 1.31 -8.63 1.58 0
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322181 126669122 1 N2O3C14H26 A2B3C14D26 -146.68 2.33 -8.96 0.32 0
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322182 126669144 1 SO4N5C23H33 AB4C5D23E33 -94.35 4.24 -8.55 -0.08 0
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322183 126669164 1 OPN2C7H11 ABC2D7E11 16.63 2.43 -8.68 -0.24 0
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322184 126669166 1 N2O2C11H16 A2B2C11D16 -23.77 6.59 -8.09 -1.05 0
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322185 126669169 1 ON4C14H26 AB4C14D26 14.56 1.01 -9.15 0.61 0
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322186 126669171 1 NOC14H19 ABC14D19 -9.44 1.15 -8.6 0.08 0
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322187 126669175 1 S2N3O3C15H17 A2B3C3D15E17 -66.05 8.09 -9.16 -1.1 0
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322188 126669176 1 NO2C20H35 AB2C20D35 -121.85 2.43 -8.69 0.38 0
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322189 126669177 1 SN3O4C11H15 AB3C4D11E15 -52.46 5.49 -8.75 -0.62 0
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322190 126669178 1 NOC29H35 ABC29D35 0.11 2.52 -8.68 0.18 0
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322191 126669180 1 FNO7C14H16 ABC7D14E16 -247.51 4.35 -9.25 -0.63 0
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322192 126669184 1 NO3C33H41 AB3C33D41 -91.96 1.41 -8.68 0.19 0
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322193 126669185 1 FNO7H14C15 ABC7D14E15 -221.71 3.6 -9.51 -0.76 0
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322194 126669189 1 FNO3C13H16 ABC3D13E16 -152.2 4.43 -9.46 -0.07 0
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322195 126669190 1 FNO4C14H16 ABC4D14E16 -144.86 3.57 -9.38 -0.31 0
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322196 126669195 1 N2O3C13H24 A2B3C13D24 -107.73 1.91 -9.69 -0.17 0
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322197 126669196 1 FN2O4C13H15 AB2C4D13E15 -189.0 5.83 -9.1 -0.26 0
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322198 126669197 1 NOC12H17 ABC12D17 -1.69 0.27 -8.77 -0.09 0