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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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70852 48413952 1 SO3N5C17H21 AB3C5D17E21 -49.71 7.66 -9.56 -1.22 0
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70853 48413954 1 FSO3N4C16H21 ABC3D4E16F21 -119.57 5.51 -9.51 -0.96 0
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70854 48413955 1 ON6C17H20 AB6C17D20 54.45 4.64 -8.95 -0.66 0
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70855 48413956 1 SO3N4C15H18 AB3C4D15E18 -45.31 3.36 -9.59 -0.93 0
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70856 48413958 2 ON2C8H10 AB2C8D10 -40.07 5.43 -9.68 -0.2 0
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70857 48413962 1 OSN5H17C18 ABC5D17E18 80.76 6.29 -8.7 -0.96 0
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70858 48413964 1 SO3N4C16H20 AB3C4D16E20 -63.86 5.58 -9.66 -0.97 0
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70859 48413965 1 FON4H17C21 ABC4D17E21 16.86 1.75 -9.32 -1.18 0
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70860 48413966 1 SN4O4C16H20 AB4C4D16E20 -97.53 5.52 -9.51 -1.08 0
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70861 48413967 1 O3N4C18H18 A3B4C18D18 -40.3 6.46 -9.06 -0.83 0
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70862 48413968 1 SN4O4C19H26 AB4C4D19E26 -118.25 6.83 -9.39 -0.73 0
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70863 48413970 1 ClSO3N4C19H19 ABC3D4E19F19 -44.93 7.49 -8.87 -1.06 0
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70864 48413971 1 FN3O3H16C17 AB3C3D16E17 -72.65 2.91 -9.21 -0.6 0
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70865 48413974 1 SO3N4C18H24 AB3C4D18E24 -82.79 9.39 -9.52 -0.62 0
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70866 48413975 1 FOSN5H16C18 ABCD5E16F18 30.82 1.42 -8.81 -1.08 0
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70867 48413976 1 OSN5H17C19 ABC5D17E19 91.47 7.22 -8.8 -0.83 0
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70868 48413978 1 SO4N5C19H23 AB4C5D19E23 -108.25 3.96 -9.64 -1.38 0
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70869 48413979 1 ON3C19H19 AB3C19D19 33.27 2.24 -9.49 0.0 0
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70870 48413980 1 O2N3H17C18 A2B3C17D18 6.15 5.64 -9.29 -0.47 0
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70871 48413981 1 O2N3C19H27 A2B3C19D27 -61.07 4.94 -8.55 0.42 0
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70872 48413982 1 N3O3C17H23 A3B3C17D23 -78.51 6.08 -8.29 0.28 0
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70873 48413984 1 SN4O5C17H22 AB4C5D17E22 -144.35 1.32 -9.3 -0.78 0
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70874 48413985 1 ClO2N3H18C19 AB2C3D18E19 -9.95 6.51 -9.28 -0.76 0
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70875 48413986 1 ClO2N3H18C19 AB2C3D18E19 -8.21 9.11 -9.21 -0.72 0
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70876 48413987 1 FO2N3H18C19 AB2C3D18E19 -50.21 4.17 -9.24 -0.58 0