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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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74777 48422453 1 N2O4C19H22 A2B4C19D22 -136.45 4.26 -8.26 -0.06 0
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74778 48422454 1 NO3C18H27 AB3C18D27 -112.21 5.03 -8.73 0.24 0
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74779 48422455 1 NO2C17H25 AB2C17D25 -72.46 3.11 -9.46 0.27 0
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74780 48422456 1 ClNO2C17H24 ABC2D17E24 -82.37 3.3 -9.47 -0.23 0
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74781 48422457 1 N3O5C21H25 A3B5C21D25 -167.95 3.96 -9.48 -0.27 0
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74782 48422458 1 N2O4C17H24 A2B4C17D24 -132.25 5.27 -9.63 -0.31 0
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74783 48422459 1 FNO2C17H22 ABC2D17E22 -106.03 4.44 -9.31 0.07 0
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74784 48422460 1 N3O4C20H23 A3B4C20D23 -128.41 5.71 -9.23 -0.4 0
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74785 48422461 1 N2O3C18H20 A2B3C18D20 -98.32 2.58 -8.58 -0.09 0
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74786 48422462 1 NO2C14H19 AB2C14D19 -62.85 2.74 -8.55 0.15 0
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74787 48422470 1 NO3C14H19 AB3C14D19 -93.02 2.52 -8.25 0.14 0
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74788 48422472 1 N2O3H20C21 A2B3C20D21 -73.38 3.66 -8.49 -0.39 0
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74789 48422473 1 ClN2O3C17H17 AB2C3D17E17 -99.25 5.61 -8.84 -0.36 0
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74790 48422474 1 ClNO2C13H16 ABC2D13E16 -64.26 4.56 -8.86 -0.3 0
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74791 48422477 1 ClNO3C14H18 ABC3D14E18 -101.7 5.63 -8.61 -0.28 0
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74792 48422478 1 N2O5C19H20 A2B5C19D20 -174.02 2.78 -9.4 -0.79 0
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74793 48422480 1 N2O3C19H20 A2B3C19D20 -84.61 2.46 -8.78 -0.09 0
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74794 48422481 1 NO2C15H19 AB2C15D19 -48.93 5.07 -8.57 0.12 0
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74795 48422482 1 NO3C19H21 AB3C19D21 -62.56 4.51 -8.78 -0.1 0
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74796 48422483 1 N2O4C19H20 A2B4C19D20 -130.98 6.93 -9.06 -0.51 0
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74797 48422484 1 NO3C15H19 AB3C15D19 -96.54 1.56 -9.05 -0.59 0
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74798 48422485 1 NO2C18H27 AB2C18D27 -78.67 2.82 -9.42 0.24 0
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74799 48422486 1 N3O4C15H21 A3B4C15D21 -146.98 2.61 -9.41 -0.01 0
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74800 48422489 1 F2N2O3H16C17 A2B2C3D16E17 -181.02 6.57 -9.14 -0.49 0
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74801 48422499 1 ClN2O4C18H19 AB2C4D18E19 -134.73 4.46 -8.57 -0.33 0