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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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182002 76825877 1 FN6O15C61H75 AB6C15D61E75 -494.91 4.82 -7.19 -1.23 0
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182003 76826152 2 SO2N3C13H19 AB2C3D13E19 -120.71 5.13 -8.59 -0.34 0
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182004 76827717 1 ON6C23H26 AB6C23D26 85.71 6.96 -8.24 -1.41 0
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182005 76827718 1 O2N5C29H41 A2B5C29D41 -20.7 7.23 -8.06 -1.22 0
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182006 76827719 1 O2N4C23H24 A2B4C23D24 34.29 7.19 -8.49 -1.51 0
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182007 76827729 1 ON4C22H26 AB4C22D26 34.74 3.76 -8.01 -1.22 0
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182008 76827730 2 ON2C11H14 AB2C11D14 -2.44 4.24 -8.06 -1.26 0
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182009 76827746 2 ON2C12H16 AB2C12D16 -18.01 10.26 -8.45 -1.54 0
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182010 76827860 1 O3N4C24H32 A3B4C24D32 -56.31 7.88 -8.2 -1.38 0
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182011 76827878 1 O2N4C23H30 A2B4C23D30 -7.62 4.0 -8.01 -1.19 0
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182012 76827997 1 SN2O6C25H30 AB2C6D25E30 -206.15 6.89 -9.01 -0.66 0
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182013 76827998 1 ClN2O6C26H27 AB2C6D26E27 -182.36 4.52 -8.86 -0.91 0
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182014 76827999 1 N3O5C27H31 A3B5C27D31 -119.6 4.37 -8.48 -0.51 0
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182015 76828000 1 N3O5C27H29 A3B5C27D29 -110.74 5.97 -8.79 -0.6 0
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182016 76828186 1 ClO2N4C9H13 AB2C4D9E13 -18.71 3.59 -8.64 -0.46 1
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182017 76828545 1 AgPF4 ABC4 -369.72 8.44 -8.55 -1.18 1
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182018 76828817 1 SN2O3C32H33 AB2C3D32E33 -6.11 10.65 0.0 0.0 0
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182019 76828992 1 ON7C20H23 AB7C20D23 92.33 6.27 -9.19 -1.57 0
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182020 76829247 2 ON4C9H10 AB4C9D10 80.35 3.9 -9.64 -2.02 0
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182021 76829321 1 SO2N4C20H24 AB2C4D20E24 29.99 10.6 -9.51 -0.93 0
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182022 76829509 1 ClO2N5C10H12 AB2C5D10E12 73.99 3.08 -8.93 -1.68 0
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182023 76829523 1 BrFO3N6C15H18 ABC3D6E15F18 -7.49 6.89 -8.89 -1.86 0
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182024 76830453 1 N5O6C25H35 A5B6C25D35 -223.23 4.35 -8.89 0.03 1
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182025 76830459 1 N5O6C35H50 A5B6C35D50 -205.3 7.57 0.0 0.0 0
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182026 76830460 1 N5O6C35H49 A5B6C35D49 -219.82 8.87 -8.74 0.12 0