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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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182910 76954212 1 NO3C17H21 AB3C17D21 -115.06 5.21 -9.18 -0.36 0
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182911 76954213 1 N3O5C13H19 A3B5C13D19 -242.58 8.35 -9.92 0.04 0
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182912 76954214 1 N3O5C12H17 A3B5C12D17 -229.64 7.32 -10.01 -0.06 0
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182913 76954215 1 FNO3C16H18 ABC3D16E18 -152.12 5.56 -9.52 -0.77 0
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182914 76954216 1 BrNO3C16H18 ABC3D16E18 -102.65 3.65 -9.51 -0.76 0
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182915 76954579 1 SO3N4C12H16 AB3C4D12E16 -96.2 5.91 -9.37 -1.3 0
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182916 76954580 1 SN3O3C14H17 AB3C3D14E17 -111.62 1.75 -9.41 -1.07 0
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182917 76954842 1 BrON4C15H15 ABC4D15E15 42.12 1.81 -8.36 -0.75 0
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182918 76955055 1 ON2C21H34 AB2C21D34 16.8 1.04 -8.32 1.08 0
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182919 76955056 2 O2C6H7 A2B6C7 -146.04 0.97 -9.44 -1.12 0
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182920 76955057 1 O2C27H38 A2B27C38 -65.43 2.37 -9.17 0.37 0
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182921 76955058 1 SiO4C24H42 AB4C24D42 -260.18 1.85 -8.54 -0.28 0
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182922 76955059 1 O3C16H24 A3B16C24 -140.91 1.95 -9.07 -0.25 0
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182923 76955060 1 O3C22H28 A3B22C28 -118.38 1.11 -9.0 -0.27 0
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182924 76955839 1 INO3C13H20 ABC3D13E20 -109.37 6.75 -8.39 -0.07 0
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182925 76955882 1 N2O5C36H44 A2B5C36D44 -158.14 1.99 -8.8 -0.09 0
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182926 76957195 1 ClN2O8C28H29 AB2C8D28E29 -294.63 8.44 -8.79 -1.28 0
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182927 76957369 2 ClO4H13C15 AB4C13D15 -245.84 6.31 -9.01 -0.83 0
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182928 76957535 2 AlHSi2O6 ABC2D6 -962.73 10.42 -10.71 -2.99 0
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182929 76957703 1 NPO5H20C28F42 ABC5D20E28F42 -2384.71 3.17 -9.64 -0.82 0
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182930 76957975 1 NNaO3C23H42 ABC3D23E42 -155.66 110.43 -5.61 -3.18 0
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182931 76957997 1 OC10H20 AB10C20 -75.5 3.1 -9.92 0.43 0
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182932 76958357 1 PSO3C11H17 ABC3D11E17 -193.65 1.44 -9.36 -0.27 0
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182933 76958358 2 PSO3C11H17 ABC3D11E17 -386.51 1.78 -9.25 -0.39 0
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182934 76958543 2 O2C17H34 A2B17C34 -341.1 1.83 -10.62 0.95 0
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182935 76958574 2 NO3C20H23 AB3C20D23 -179.42 2.27 -8.76 -0.21 0
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182936 76958630 2 SF2N3O4C17H17 AB2C3D4E17F17 -334.1 8.68 -8.3 -0.86 0
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182938 76959742 1 IO2C19H29 AB2C19D29 -106.51 1.57 -9.31 -0.76 0
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182939 76959822 2 N5C13H19 A5B13C19 125.91 3.74 -9.61 -0.39 0
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182940 76959823 1 PK2C3O9H13 AB2C3D9E13 -595.92 17.09 -8.89 0.5 0
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182941 76959824 1 PK2C3O9H13 AB2C3D9E13 -590.51 10.6 -8.73 0.52 0
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182942 76959825 2 PK2C3O9H13 AB2C3D9E13 -1201.6 13.04 -8.4 0.56 0
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182943 76959826 2 ClNO4C21H22 ABC4D21E22 -221.87 4.51 -8.4 -0.51 0
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182944 76959827 1 ON2Cl5H23C26 AB2C5D23E26 6.96 14.15 -8.77 -1.22 0
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182945 76960486 2 NO4C23H45 AB4C23D45 -485.26 6.74 -8.22 0.32 0
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182946 76961174 2 BrNOC16H20 ABCD16E20 -111.21 6.65 -8.32 -0.32 0
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182947 76961700 1 BrNOC20H32 ABCD20E32 -65.23 10.66 -7.67 0.04 0
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182948 76962070 1 HgNaN4O8C21H21 ABC4D8E21F21 -213.9 19.12 -9.27 -2.2 0
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182949 76962081 1 NO2C21H25 AB2C21D25 -48.43 3.46 -8.8 -0.28 2
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182951 76962180 2 SN7O8C25H36 AB7C8D25E36 -680.22 8.99 -9.21 -1.79 0
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182952 76962186 1 O5N6C36H52 A5B6C36D52 -230.21 5.11 -9.13 0.34 0
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182953 76962526 4 OS3C9H14 AB3C9D14 56.0 4.91 -8.43 -1.21 0
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182954 76962822 1 ClN2O3C10H23 AB2C3D10E23 -138.85 17.67 -7.01 -1.12 0
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182956 76963289 1 N2S2O11C13H22 A2B2C11D13E22 -461.16 5.82 -9.52 -0.9 0
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182957 76963290 2 NaN2S2O11C13H21 AB2C2D11E13F21 -1069.72 11.19 -9.01 -0.85 0
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182958 76963291 2 O5C21H40 A5B21C40 -610.65 4.18 -10.51 0.43 0
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182959 76963292 2 OH4C5 AB4C5 -35.22 4.52 -9.43 -0.3 0
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182960 76963918 2 O5C15H18 A5B15C18 -443.31 8.46 -8.91 -0.21 0
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182961 76963919 1 KPC3O6H8 ABC3D6E8 -378.44 10.25 -9.74 0.18 0
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182962 76963920 1 ClON2C16H19 ABC2D16E19 35.46 7.23 -9.01 -0.5 0