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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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74677 48422278 1 BrN4O4C16H17 AB4C4D16E17 -102.23 3.06 -9.46 -0.54 0
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74678 48422279 1 NO2C15H21 AB2C15D21 -67.87 3.37 -8.69 0.21 0
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74679 48422280 1 N2O6C17H24 A2B6C17D24 -180.29 2.09 -8.69 -0.38 0
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74680 48422282 1 N2O3C14H26 A2B3C14D26 -145.73 4.86 -9.41 0.56 0
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74681 48422284 1 NO2C22H27 AB2C22D27 -38.55 2.93 -9.39 0.15 0
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74682 48422285 1 ClNO2C14H18 ABC2D14E18 -69.75 3.96 -9.02 -0.19 0
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74683 48422286 1 NO2C13H23 AB2C13D23 -97.33 3.36 -9.22 1.02 0
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74684 48422288 1 SN3O6C16H21 AB3C6D16E21 -222.78 6.85 -9.74 -0.3 0
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74685 48422292 1 N2O3C19H22 A2B3C19D22 -98.96 3.91 -8.96 -0.16 0
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74686 48422293 2 NO3C10H15 AB3C10D15 -200.96 3.02 -8.65 -0.39 0
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74687 48422296 1 N2O5C16H20 A2B5C16D20 -138.72 2.21 -8.99 -0.14 0
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74688 48422297 1 NO3C21H25 AB3C21D25 -64.69 4.74 -8.85 0.03 0
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74689 48422298 1 NO2S2C18H21 AB2C2D18E21 -26.19 2.4 -8.88 -0.48 0
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74690 48422299 1 NF3O3C14H16 AB3C3D14E16 -253.4 0.71 -9.27 -0.69 0
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74691 48422300 1 NO2C16H23 AB2C16D23 -70.51 4.51 -8.62 0.2 0
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74692 48422301 1 NO2C15H29 AB2C15D29 -122.92 2.86 -9.56 1.18 0
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74693 48422302 1 NO2C12H23 AB2C12D23 -106.61 3.56 -9.62 1.2 0
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74694 48422303 1 N3O4C22H27 A3B4C22D27 -154.39 5.03 -8.23 -0.11 0
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74695 48422304 1 N2O3C18H26 A2B3C18D26 -119.66 5.7 -8.24 0.0 0
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74696 48422306 1 SN3O4C15H27 AB3C4D15E27 -157.13 3.08 -9.15 -0.09 0
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74697 48422307 1 NO3C17H25 AB3C17D25 -93.33 4.67 -9.29 -0.08 0
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74698 48422310 1 NO2C18H25 AB2C18D25 -66.12 3.44 -9.17 0.22 0
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74699 48422312 1 NO4C21H29 AB4C21D29 -145.09 4.08 -8.67 0.1 0
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74700 48422313 1 NSO2F3C15H18 ABC2D3E15F18 -221.3 3.06 -9.16 -0.74 0
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74701 48422314 1 N3O5C17H27 A3B5C17D27 -191.28 3.33 -9.44 -0.36 0