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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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159142 57260827 1 F2N2O4C21H24 A2B2C4D21E24 -224.2 4.55 -10.13 -1.59 0
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159143 57260893 1 N2F3O6H25C28 A2B3C6D25E28 -291.87 4.22 -9.29 -1.22 0
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159144 57261060 1 ON4C18H18 AB4C18D18 68.69 4.09 -9.06 -1.81 1
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159145 57261283 1 PC3O3H8 AB3C3D8 -138.62 3.8 0.0 0.0 0
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159146 57261284 1 ClNO4C13H14 ABC4D13E14 -160.42 2.8 -9.47 -0.93 0
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159147 57261286 1 NO3C15H23 AB3C15D23 -146.8 4.5 -8.97 0.11 0
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159148 57261303 1 N3O4C13H15 A3B4C13D15 -93.07 3.44 -9.16 -1.69 0
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159149 57261333 1 NSO3C8H13 ABC3D8E13 -128.89 7.27 -9.05 -0.6 0
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159150 57261351 1 SO3N5C23H25 AB3C5D23E25 -36.37 4.23 -9.14 -1.1 0
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159151 57261352 1 NF3H8C11 AB3C8D11 -87.71 0.99 -9.09 -1.03 0
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159152 57261353 1 Br2O2S3H12C16 A2B2C3D12E16 36.72 5.77 -9.07 -1.31 0
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159153 57261406 1 ON3H15C16 AB3C15D16 76.36 5.74 -8.92 -0.98 0
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159154 57261635 1 N3O5C26H31 A3B5C26D31 -96.54 7.87 -9.44 -1.56 0
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159155 57261709 1 N4O5H20C22 A4B5C20D22 -71.08 7.34 -8.91 -1.22 0
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159156 57264261 1 SN5O5C26H33 AB5C5D26E33 -171.54 10.77 -9.19 -0.82 0
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159157 57264265 3 NO2C10H13 AB2C10D13 -207.07 2.45 -8.66 0.2 0
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159158 57264269 1 SN3C16H21 AB3C16D21 35.58 6.06 -8.8 -0.53 0
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159159 57264271 1 OCl2N3H15C18 AB2C3D15E18 52.61 1.33 -9.68 -0.6 0
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159160 57264272 1 SN2O5C23H32 AB2C5D23E32 -232.84 7.35 -9.3 -0.45 0
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159161 57264275 1 I3N4O6C14H15 A3B4C6D14E15 -168.28 4.69 -10.11 -2.33 0
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159162 57264276 1 OF2N2C28H30 AB2C2D28E30 -65.34 3.9 -9.65 -0.4 0
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159163 57264277 1 ClO2N4C11H15 AB2C4D11E15 22.64 1.56 -9.64 -0.92 0
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159164 57264278 2 SO4C8H12 AB4C8D12 -332.35 1.84 -8.33 0.03 0
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159165 57264279 1 O6C21H26 A6B21C26 -234.93 6.64 -9.95 -0.97 0
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159166 57264280 1 NO3C27H29 AB3C27D29 -88.1 4.98 -8.67 0.11 0
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159167 57264281 1 S2N7O9C19H29 A2B7C9D19E29 -289.84 10.65 -8.91 -0.67 0
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159168 57264286 2 NOH6C8 ABC6D8 28.13 2.74 -9.24 -1.09 0
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159169 57264287 1 NOC10H19 ABC10D19 -68.56 3.19 -8.91 0.65 0
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159170 57264288 1 ClNSO4H16C19 ABCD4E16F19 -92.76 4.74 -8.93 -0.94 0
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159171 57264292 1 O2N3C24H33 A2B3C24D33 -72.0 3.7 -8.23 0.17 0
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159172 57264296 1 BrOCl2F3N3H7C15 ABC2D3E3F7G15 -136.59 3.72 -9.16 -1.38 0
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159173 57264299 1 N2O6C11H18 A2B6C11D18 -256.11 6.27 -10.48 -0.27 0
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159174 57264322 1 NO4C8H15 AB4C8D15 -193.28 4.32 -10.16 0.23 0
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159175 57264323 6 CH AB 24.19 0.0 -9.64 0.38 0
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159176 57264324 1 ON2C14H16 AB2C14D16 18.85 2.58 -9.04 -0.55 0
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159177 57264325 1 BrPSN3O5C19H31 ABCD3E5F19G31 -216.49 5.48 -9.57 -1.26 0
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159178 57264326 1 SN2O3C27H34 AB2C3D27E34 -57.99 2.35 -8.32 -0.9 0
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159179 57264327 1 NO3C9H15 AB3C9D15 -83.11 4.25 -9.54 -0.18 0
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159180 57264328 1 N2O2C7H18 A2B2C7D18 -125.63 2.88 -9.66 2.39 0
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159181 57264331 1 NOC8H17 ABC8D17 -26.82 0.92 -9.15 0.79 0
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159182 57264332 1 NO6C22H29 AB6C22D29 -247.77 4.57 -9.68 -0.93 0
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159183 57264336 3 FOC5H5 ABC5D5 -222.65 6.48 -9.41 -0.53 0
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159184 57264341 2 O2C10H11 A2B10C11 -147.89 5.58 -9.31 -0.42 0
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159185 57264342 1 ON3C15H15 AB3C15D15 33.83 2.42 -8.84 -0.01 0
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159186 57264343 1 NO3C18H33 AB3C18D33 -193.34 7.05 -9.79 0.42 0
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159187 57264345 1 N3O4C7H15 A3B4C7D15 -168.03 5.6 -9.37 -0.2 0
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159188 57264347 1 N5C11H15 A5B11C15 88.02 9.16 -10.3 -0.55 1
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159189 57264348 1 ClO2N5C24H33 AB2C5D24E33 -40.75 5.13 0.0 0.0 0
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159190 57264354 1 N3O5C20H27 A3B5C20D27 -150.83 4.28 -8.41 -0.22 0
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159191 57264355 1 O4C17H28 A4B17C28 -202.18 1.55 -10.46 -0.19 0