# generated using pymatgen data_Cu2CO5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.67693600 _cell_length_b 2.99668200 _cell_length_c 8.96475085 _cell_angle_alpha 84.54163924 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu2CO5 _chemical_formula_sum 'Cu8 C4 O20' _cell_volume 339.01540551 _cell_formula_units_Z 4 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Cu Cu0 1 0.22177900 0.10328200 0.00323000 1.0 Cu Cu1 1 0.72177900 0.89671800 0.49677000 1.0 Cu Cu2 1 0.77822100 0.89671800 0.99677000 1.0 Cu Cu3 1 0.27822100 0.10328200 0.50323000 1.0 Cu Cu4 1 0.11826200 0.61232000 0.73420000 1.0 Cu Cu5 1 0.61826200 0.38768000 0.76580000 1.0 Cu Cu6 1 0.88173800 0.38768000 0.26580000 1.0 Cu Cu7 1 0.38173800 0.61232000 0.23420000 1.0 C C8 1 0.36926800 0.53750800 0.77438200 1.0 C C9 1 0.86926800 0.46249200 0.72561800 1.0 C C10 1 0.63073200 0.46249200 0.22561800 1.0 C C11 1 0.13073200 0.53750800 0.27438200 1.0 O O12 1 0.36876500 0.70891900 0.63475300 1.0 O O13 1 0.86876500 0.29108100 0.86524700 1.0 O O14 1 0.63123500 0.29108100 0.36524700 1.0 O O15 1 0.13123500 0.70891900 0.13475300 1.0 O O16 1 0.27819900 0.54266500 0.84720400 1.0 O O17 1 0.77819900 0.45733500 0.65279600 1.0 O O18 1 0.72180100 0.45733500 0.15279600 1.0 O O19 1 0.22180100 0.54266500 0.34720400 1.0 O O20 1 0.44996500 0.36172600 0.83506900 1.0 O O21 1 0.94996500 0.63827400 0.66493100 1.0 O O22 1 0.55003500 0.63827400 0.16493100 1.0 O O23 1 0.05003500 0.36172600 0.33506900 1.0 O O24 1 0.15163100 0.13205200 0.60818100 1.0 O O25 1 0.65163100 0.86794800 0.89181900 1.0 O O26 1 0.84836900 0.86794800 0.39181900 1.0 O O27 1 0.34836900 0.13205200 0.10818100 1.0 O O28 1 0.10428000 0.08641100 0.86840100 1.0 O O29 1 0.60428000 0.91358900 0.63159900 1.0 O O30 1 0.89572000 0.91358900 0.13159900 1.0 O O31 1 0.39572000 0.08641100 0.36840100 1.0