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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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229065 87566864 1 N2O3C10H22 A2B3C10D22 -133.74 4.07 -9.67 0.35 0
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229066 87566869 1 FSO3N5C24H30 ABC3D5E24F30 -52.97 7.38 -9.27 -0.79 0
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229067 87566876 1 O5C9H20 A5B9C20 -251.83 2.23 -10.63 0.19 0
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229068 87566877 1 O9C14H28 A9B14C28 -433.55 6.66 -9.98 -0.06 0
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229069 87566880 1 ClOSN4C19H21 ABCD4E19F21 27.66 4.72 -8.69 -0.9 0
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229070 87566885 4 ON2C9H11 AB2C9D11 -93.2 8.96 -8.54 -0.53 0
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229071 87566888 2 O3C4H9 A3B4C9 -277.34 6.57 -10.16 0.42 0
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229072 87566890 1 ClFSN3O4C23H29 ABCD3E4F23G29 -179.21 2.37 -8.96 -0.16 0
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229073 87566891 1 N3O3C6H7 A3B3C6D7 -53.69 5.58 -10.93 -1.82 0
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229074 87566892 1 NF3O4C21H34 AB3C4D21E34 -400.82 5.42 -9.79 -0.35 0
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229075 87566896 1 P2N3O19C44H67 A2B3C19D44E67 -951.6 4.92 -9.61 -0.32 0
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229076 87566897 1 NO2C11H19 AB2C11D19 -75.57 1.49 -9.25 -0.16 0
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229077 87566898 1 NO2C11H19 AB2C11D19 -82.1 3.45 -8.54 0.04 0
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229078 87566905 1 NO6C14H25 AB6C14D25 -314.41 6.3 -10.38 -0.19 0
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229079 87566906 1 NSO5C14H29 ABC5D14E29 -234.62 14.93 -9.79 -0.39 0
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229080 87566910 1 F3O3N5H14C16 A3B3C5D14E16 -190.92 8.19 -8.44 -1.42 0
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229081 87566914 2 O3C14H18 A3B14C18 -199.76 6.31 -9.81 -0.91 0
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229083 87566917 1 PSF2N2O10C32H39 ABC2D2E10F32G39 -537.18 10.53 -9.19 -1.01 0
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229084 87566918 1 PSF2N2O10C32H39 ABC2D2E10F32G39 -537.62 9.22 -9.21 -1.04 0
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229085 87566919 1 PSF2N2O10C32H39 ABC2D2E10F32G39 -541.82 3.13 -9.35 -0.82 0
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229086 87566921 1 ClS2N4O5H21C22 AB2C4D5E21F22 -121.14 9.38 -8.94 -1.34 0
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229087 87566922 1 NSO4C22H37 ABC4D22E37 -177.96 6.48 -9.59 0.04 1
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229088 87566925 1 SN3F6O6H16C23 AB3C6D6E16F23 -433.85 7.43 0.0 0.0 -4
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229090 87566932 1 ZrCl2Si3C36H40 AB2C3D36E40 -76.43 19.08 -7.09 -1.29 0
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229091 87566934 1 NH2I5C6 AB2C5D6 119.03 1.03 -8.76 -3.35 0