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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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215130 85084202 1 N5O7C40H47 A5B7C40D47 -205.83 2.71 -8.92 -0.98 0
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215131 85084203 1 N9O9C32H55 A9B9C32D55 -393.24 9.36 -9.61 -1.06 0
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215132 85084204 1 S4O6N7H27C30 A4B6C7D27E30 5.42 2.24 -8.93 -1.51 0
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215133 85084205 1 NO6C45H59 AB6C45D59 -183.7 4.98 -8.42 -0.51 0
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215134 85084206 1 O13C37H58 A13B37C58 -635.87 4.0 -9.69 0.24 0
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215135 85084207 1 O7N8C36H54 A7B8C36D54 -304.21 5.06 -9.26 0.19 0
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215136 85084208 2 SiO3C20H39 AB3C20D39 -459.73 4.73 -8.71 0.75 0
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215137 85084212 1 O11C39H68 A11B39C68 -611.19 5.7 -9.42 0.51 0
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215138 85084219 1 N4O12C35H50 A4B12C35D50 -408.02 12.05 -9.34 -2.25 0
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215139 85084234 1 SCl2F3P3N5O13C14H19 AB2C3D3E5F13G14H19 -839.68 6.67 -9.22 -1.15 0
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215140 85084241 1 PSCl2N4O7C32H35 ABC2D4E7F32G35 -276.89 3.34 -8.65 -0.57 0
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215141 85084242 1 PN5O9C36H44 AB5C9D36E44 -417.42 4.37 -8.82 -1.0 0
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215143 85084248 1 NO11C41H41 AB11C41D41 -365.61 5.2 -8.63 -1.64 0
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215144 85084251 1 N2O9C42H48 A2B9C42D48 -243.71 5.07 -9.35 -0.11 1
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215145 85084255 1 PSN2O7C32H58 ABC2D7E32F58 -409.0 9.43 0.0 0.0 0
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215146 85084260 1 N2O10C41H46 A2B10C41D46 -277.09 5.64 -9.38 -0.01 0
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215147 85084263 1 SSi2N5O11C29H43 AB2C5D11E29F43 -581.23 12.32 -9.52 -0.99 -1
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215149 85084270 2 O2N4C21H24 A2B4C21D24 -58.59 5.37 -8.39 -0.37 0
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215150 85084271 1 N2O9C41H64 A2B9C41D64 -398.22 4.42 -9.12 -0.16 0
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215151 85084273 4 O2C11H18 A2B11C18 -450.16 3.72 -9.56 0.32 0
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215152 85084274 1 PN3O9C39H44 AB3C9D39E44 -371.84 6.11 -9.18 -0.34 0
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215153 85084276 1 N3O9C40H63 A3B9C40D63 -383.72 3.18 -8.96 -0.43 0
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215154 85084278 2 O7C19H25 A7B19C25 -469.87 8.07 -9.38 0.2 0
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215155 85084280 1 O10C41H78 A10B41C78 -569.36 2.01 -9.44 0.84 0
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215156 85084281 1 S2N5O13H29C30 A2B5C13D29E30 -383.9 18.98 -9.43 -1.33 0