# generated using pymatgen data_Cu2As2O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.47239046 _cell_length_b 5.47239046 _cell_length_c 4.90070662 _cell_angle_alpha 76.26769414 _cell_angle_beta 76.26769414 _cell_angle_gamma 97.72577552 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cu2As2O7 _chemical_formula_sum 'Cu2 As2 O7' _cell_volume 135.63142354 _cell_formula_units_Z 1 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 0.68514044 0.31485956 0.50000000 1.0 Cu Cu1 1 0.31485956 0.68514044 0.50000000 1.0 As As2 1 0.79287837 0.79287837 0.90370877 1.0 As As3 1 0.20712163 0.20712163 0.09629123 1.0 O O4 1 0.96046492 0.62300557 0.71440583 1.0 O O5 1 0.37699443 0.03953508 0.28559417 1.0 O O6 1 0.03953508 0.37699443 0.28559417 1.0 O O7 1 0.62300557 0.96046492 0.71440583 1.0 O O8 1 0.00000000 0.00000000 -0.00000000 1.0 O O9 1 0.59867634 0.59867634 0.23068669 1.0 O O10 1 0.40132366 0.40132366 0.76931331 1.0