# generated using pymatgen data_CuTeAs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.19216217 _cell_length_b 5.72375777 _cell_length_c 12.34245495 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CuTeAs _chemical_formula_sum 'Cu4 Te4 As4' _cell_volume 296.15622892 _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 0.25000000 0.61056119 0.83666339 1.0 Cu Cu1 1 0.75000000 0.38943881 0.16333661 1.0 Cu Cu2 1 0.75000000 0.11056119 0.66333661 1.0 Cu Cu3 1 0.25000000 0.88943881 0.33666339 1.0 Te Te4 1 0.25000000 0.86192352 0.66506497 1.0 Te Te5 1 0.75000000 0.13807648 0.33493503 1.0 Te Te6 1 0.75000000 0.36192352 0.83493503 1.0 Te Te7 1 0.25000000 0.63807648 0.16506497 1.0 As As8 1 0.25000000 0.87472305 0.98229137 1.0 As As9 1 0.75000000 0.12527695 0.01770863 1.0 As As10 1 0.75000000 0.37472305 0.51770863 1.0 As As11 1 0.25000000 0.62527695 0.48229137 1.0