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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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147321 53786977 1 NO3C26H33 AB3C26D33 -86.37 6.99 -8.28 -0.09 0
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147322 53786978 2 NOC5H7 ABC5D7 -61.45 5.72 -8.93 -0.1 0
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147323 53786979 1 ClN3O6C8H14 AB3C6D8E14 -239.82 4.21 -10.3 -0.96 0
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147324 53786980 1 O5N6C21H34 A5B6C21D34 -202.72 11.34 -9.21 -0.19 -3
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147325 53786981 1 P3N6O21C43H78 A3B6C21D43E78 -1024.1 12.93 0.0 0.0 0
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147326 53786982 2 NC6H11 AB6C11 -5.27 2.58 -7.85 1.24 0
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147327 53786983 1 SO2C29H34 AB2C29D34 -43.83 3.4 -8.57 -0.64 0
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147328 53786984 1 N8O14C39H52 A8B14C39D52 -526.78 8.65 -9.86 -0.87 0
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147329 53786985 1 NO3C11H21 AB3C11D21 -161.66 2.74 -9.36 0.59 0
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147330 53786986 1 S2O9N11C68H79 A2B9C11D68E79 -278.65 3.61 -8.7 -1.19 1
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147331 53786987 1 SO3N5C19H26 AB3C5D19E26 -12.51 5.04 0.0 0.0 0
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147332 53786988 1 N2O5C28H40 A2B5C28D40 -130.7 4.53 -9.04 -1.76 0
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147333 53786989 1 SCl3N4O10H33C35 AB3C4D10E33F35 -330.96 6.08 -9.1 -0.66 0
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147334 53786990 1 NO2C15H15 AB2C15D15 -27.49 3.12 -8.83 -1.22 0
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147335 53786991 1 IO2C5H9 AB2C5D9 -90.33 1.52 -9.89 -1.23 0
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147336 53786992 1 OC17H30 AB17C30 -67.73 2.18 -9.17 0.4 0
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147337 53786993 1 NO5C19H37 AB5C19D37 -295.92 2.33 -9.32 0.04 0
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147338 53786994 1 ClSN2O3C17H17 ABC2D3E17F17 -82.46 6.66 -8.9 -0.91 0
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147339 53786995 1 SN3O9H39C49 AB3C9D39E49 -114.47 8.81 -8.85 -0.7 0
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147340 53786996 1 SN3O9H39C49 AB3C9D39E49 -125.32 6.07 -9.08 -0.98 0
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147341 53786997 1 SN3O9H39C49 AB3C9D39E49 -122.49 8.7 -8.9 -0.84 0
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147342 53786998 1 O3C18H20 A3B18C20 -73.0 5.99 -8.58 -0.98 1
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147343 53786999 1 N3O4C20H26 A3B4C20D26 -73.41 7.65 0.0 0.0 0
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147344 53787000 1 NO2C17H21 AB2C17D21 -46.39 2.61 -8.83 0.04 0
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147345 53787001 1 SO4F18H62C76 AB4C18D62E76 -940.42 15.33 -8.71 -0.86 0