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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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74302 48421696 2 NO2C10H12 AB2C10D12 -131.4 2.97 -8.91 0.03 0
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74303 48421697 1 NO3C16H23 AB3C16D23 -94.51 3.16 -8.83 0.19 0
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74304 48421698 1 FN2O3C19H21 AB2C3D19E21 -138.84 2.76 -9.5 -0.12 0
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74305 48421699 1 NO4C11H19 AB4C11D19 -172.84 2.6 -9.93 0.7 0
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74306 48421700 1 O3N4C19H26 A3B4C19D26 -96.75 2.97 -8.99 -0.02 0
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74307 48421701 2 NO2C10H12 AB2C10D12 -131.04 3.97 -8.94 0.09 0
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74308 48421702 2 NO2C10H12 AB2C10D12 -140.16 3.51 -8.51 0.03 0
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74309 48421703 1 N2O3C21H26 A2B3C21D26 -104.28 2.49 -9.21 0.24 0
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74310 48421704 1 N2O5C21H24 A2B5C21D24 -170.9 2.75 -8.56 0.14 0
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74311 48421705 1 NO3C17H25 AB3C17D25 -102.51 1.96 -8.69 0.27 0
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74312 48421706 1 NO3C16H23 AB3C16D23 -101.2 3.57 -8.8 0.08 0
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74313 48421707 1 NO4C16H23 AB4C16D23 -128.14 2.74 -8.34 0.25 0
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74314 48421708 1 O2N3C15H25 A2B3C15D25 -58.69 5.83 -9.09 0.82 0
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74315 48421710 1 NO2C17H25 AB2C17D25 -67.7 3.01 -9.14 0.3 0
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74316 48421711 1 FN2O3C19H21 AB2C3D19E21 -135.97 1.79 -9.48 -0.23 0
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74317 48421712 1 FNO2C15H20 ABC2D15E20 -102.66 4.33 -9.51 -0.11 0
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74318 48421714 1 SN2O3C17H20 AB2C3D17E20 -83.31 2.17 -9.31 -0.38 0
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74319 48421715 1 N2O4C19H22 A2B4C19D22 -117.98 3.26 -9.18 0.08 0
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74320 48421716 1 NO3C15H21 AB3C15D21 -87.96 2.37 -8.96 0.25 0
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74321 48421717 1 NO4C17H23 AB4C17D23 -134.6 3.06 -8.65 0.09 0
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74322 48421718 1 N2O4C21H26 A2B4C21D26 -137.19 4.49 -8.76 0.2 0
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74323 48421719 1 N2O5C20H24 A2B5C20D24 -167.52 2.93 -8.43 -0.02 0
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74324 48421723 1 N2O3C11H20 A2B3C11D20 -136.31 4.48 -9.61 0.6 0
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74325 48421724 1 SN3O3C19H25 AB3C3D19E25 -83.21 4.63 -8.96 0.0 0
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74326 48421726 1 N3O4C19H29 A3B4C19D29 -167.1 3.94 -8.85 0.11 0