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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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259150 103158384 1 NOC14H27 ABC14D27 -68.32 1.55 -9.06 2.56 0
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259151 103158391 1 ClNOF3C15H19 ABCD3E15F19 -219.9 3.95 -9.06 -0.76 0
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259152 103158392 1 ClON2C17H21 ABC2D17E21 -30.39 1.19 -8.27 -0.79 0
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259153 103158394 1 BrON2C17H21 ABC2D17E21 -18.35 2.41 -8.36 -0.86 0
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259154 103158397 1 NO2C15H23 AB2C15D23 -91.67 2.29 -9.08 0.09 0
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259155 103158398 1 N2O2C15H30 A2B2C15D30 -121.65 1.29 -8.67 1.93 0
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259156 103158400 2 NO2C6H12 AB2C6D12 -207.98 2.59 -9.3 0.59 0
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259157 103158406 1 NOC14H27 ABC14D27 -91.62 2.31 -9.02 2.66 0
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259158 103158417 1 FNO2C15H22 ABC2D15E22 -135.25 5.84 -8.32 0.21 0
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259159 103158419 1 NO2C14H29 AB2C14D29 -138.47 1.21 -8.83 2.38 0
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259160 103158434 1 N2O4C15H20 A2B4C15D20 -159.4 4.43 -8.82 0.21 0
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259161 103158437 2 FNO2C6H7 ABC2D6E7 -247.78 9.08 -9.5 -0.67 0
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259162 103158438 1 N2O4C11H22 A2B4C11D22 -212.09 3.12 -9.8 0.56 0
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259163 103158443 2 NO2C7H10 AB2C7D10 -163.87 2.48 -8.83 0.18 0
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259164 103158444 2 NO2C7H10 AB2C7D10 -171.3 3.58 -8.66 0.17 0
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259165 103158460 1 SN2O4C12H18 AB2C4D12E18 -161.24 7.87 -9.49 -0.48 0
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259166 103158467 1 FN2O4C13H17 AB2C4D13E17 -215.19 1.59 -9.05 -0.22 0
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259167 103158468 1 N3O5C12H23 A3B5C12D23 -224.21 4.42 -9.02 0.45 0
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259168 103158470 1 N2O4C15H20 A2B4C15D20 -163.24 8.23 -9.62 -0.06 0
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259169 103158472 1 N2O4C13H24 A2B4C13D24 -209.49 3.19 -9.46 0.67 0
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259170 103158473 1 ON2C12H22 AB2C12D22 -47.34 4.3 -9.33 1.1 0
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259171 103158474 2 NO2C7H10 AB2C7D10 -172.54 3.46 -8.76 0.06 0
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259172 103158476 1 FN2O4C13H17 AB2C4D13E17 -215.82 1.89 -8.95 -0.15 0
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259173 103158481 1 ON2C13H24 AB2C13D24 -54.55 4.7 -9.11 1.47 0
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259174 103158485 1 N3O4C13H25 A3B4C13D25 -198.37 4.14 -8.78 0.64 0
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259175 103158486 1 ON3C15H27 AB3C15D27 -44.59 2.78 -8.75 1.06 0
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259176 103158493 2 NO2C7H10 AB2C7D10 -172.72 3.86 -8.92 0.09 0
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259177 103158494 1 ON2C13H22 AB2C13D22 -46.92 6.27 -9.38 1.37 0
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259178 103158495 2 NO2C7H10 AB2C7D10 -171.09 3.6 -9.38 0.06 0
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259179 103158497 1 N2O5C11H22 A2B5C11D22 -240.66 4.34 -9.81 0.69 0
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259180 103158506 1 N2O2C13H22 A2B2C13D22 -76.13 4.3 -9.28 0.54 0
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259181 103158510 1 FN2O4C14H19 AB2C4D14E19 -208.44 2.44 -9.71 -0.23 0
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259182 103158517 1 N3O4C12H17 A3B4C12D17 -150.1 9.84 -10.14 -0.6 0
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259183 103158518 1 NO2C15H19 AB2C15D19 -54.66 4.77 -9.49 -0.8 0
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259184 103158519 1 NO2C15H19 AB2C15D19 -54.05 5.19 -9.42 -0.65 0
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259185 103158520 1 BrN2O4C13H17 AB2C4D13E17 -157.54 6.76 -9.87 -0.66 0
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259186 103158523 1 NO2C17H23 AB2C17D23 -70.53 5.22 -9.55 -0.69 0
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259187 103158524 1 N2O5C12H22 A2B5C12D22 -239.62 10.42 -9.81 0.54 0
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259188 103158529 1 N2O4C15H18 A2B4C15D18 -57.55 5.71 -10.19 -1.71 0
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259189 103158536 2 FNO2C6H7 ABC2D6E7 -244.74 7.6 -9.81 -0.83 0
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259190 103158537 1 FN2O4C13H17 AB2C4D13E17 -213.85 5.16 -9.05 -0.23 0
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259191 103158546 1 NO2C17H29 AB2C17D29 -126.72 2.35 -8.92 0.65 0
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259192 103158564 1 N2O4C13H24 A2B4C13D24 -209.05 2.3 -9.38 0.56 0
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259193 103158565 2 NO2C6H11 AB2C6D11 -198.89 2.82 -9.56 0.68 0
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259194 103158566 1 N2O4C11H22 A2B4C11D22 -204.92 2.46 -9.42 0.57 0
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259195 103158576 1 O3C18H26 A3B18C26 -141.53 4.36 -8.82 0.11 0
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259196 103158577 1 SN2O4C11H20 AB2C4D11E20 -189.15 4.09 -8.8 0.28 0
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259197 103158578 1 N2O4C11H20 A2B4C11D20 -187.49 8.09 -10.18 0.55 0
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259198 103158579 1 O4C17H24 A4B17C24 -162.62 2.68 -8.68 -0.49 0
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259199 103158581 1 O3C17H24 A3B17C24 -132.36 4.86 -9.44 -0.57 0