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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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36777 8012586 1 NO5C18H23 AB5C18D23 -200.5 3.51 -9.31 -1.03 0
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36778 8012591 1 FO6H17C23 AB6C17D23 -195.33 3.7 -9.15 -0.81 0
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36779 8012608 1 SN4H18C20 AB4C18D20 145.34 5.93 -9.02 -0.69 0
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36780 8012611 1 SN4H18C20 AB4C18D20 145.89 4.91 -9.15 -0.78 2
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36781 8012631 3 NOC8H11 ABC8D11 -42.24 8.32 -6.98 -0.59 0
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36782 8012633 1 O6H14C17 A6B14C17 -168.67 2.26 -9.08 -0.75 0
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36783 8012639 1 ON2S2H20C24 AB2C2D20E24 74.09 5.31 -8.83 -0.68 0
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36784 8012658 1 SO3N4C16H24 AB3C4D16E24 -102.35 3.13 -9.48 -0.91 0
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36785 8012659 1 NO5H17C20 AB5C17D20 -131.3 3.29 -8.74 -0.81 0
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36786 8012701 1 N3O4C21H29 A3B4C21D29 -170.17 2.15 -8.77 0.02 0
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36787 8012707 1 SN2O5C21H24 AB2C5D21E24 -162.9 8.32 -8.41 -0.77 0
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36788 8012708 1 SN2O5C21H24 AB2C5D21E24 -163.09 9.1 -8.28 -0.75 0
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36789 8012709 1 N2O3H16C19 A2B3C16D19 -30.87 3.19 -9.0 -1.36 0
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36790 8012721 1 O2F3N4C17H19 A2B3C4D17E19 -181.24 3.82 -9.09 -0.78 0
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36791 8012749 1 SN2O3C19H20 AB2C3D19E20 -84.06 2.93 -8.77 -0.66 0
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36792 8012761 1 N3O4H21C22 A3B4C21D22 -45.18 5.14 -9.38 -1.81 0
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36793 8012771 2 ON3C10H10 AB3C10D10 52.49 3.94 -9.27 -0.79 0
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36794 8012772 1 ON2F3H11C12 AB2C3D11E12 -173.67 5.93 -8.83 -0.33 0
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36795 8012799 1 NSO7C19H19 ABC7D19E19 -216.17 6.37 -9.25 -0.93 0
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36796 8012861 1 N3O3H15C17 A3B3C15D17 -46.95 0.92 -8.57 -1.23 0
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36797 8012882 1 N2O5C22H22 A2B5C22D22 -120.62 2.55 -9.15 -0.68 1
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36798 8012884 1 O2N3C21H28 A2B3C21D28 -17.46 4.09 0.0 0.0 0
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36799 8012886 1 N2O6C21H22 A2B6C21D22 -194.61 6.21 -9.06 -1.3 0
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36800 8012888 2 NO3C10H10 AB3C10D10 -194.73 3.1 -9.2 -1.07 0
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36801 8012890 1 SCl2N2O3H14C16 AB2C2D3E14F16 -82.44 3.54 -9.02 -1.35 0