# generated using pymatgen data_K2Fe(CuSe2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.65291423 _cell_length_b 5.65291423 _cell_length_c 13.37565665 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural K2Fe(CuSe2)2 _chemical_formula_sum 'K4 Fe2 Cu4 Se8' _cell_volume 427.42498351 _cell_formula_units_Z 2 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 K K0 1 0.25100085 0.25100085 0.00000000 1.0 K K1 1 0.74899915 0.74899915 0.00000000 1.0 K K2 1 0.74899915 0.25100085 0.50000000 1.0 K K3 1 0.25100085 0.74899915 0.50000000 1.0 Fe Fe4 1 0.00000000 0.00000000 0.25000000 1.0 Fe Fe5 1 0.00000000 0.00000000 0.75000000 1.0 Cu Cu6 1 0.00000000 0.50000000 0.25000000 1.0 Cu Cu7 1 0.00000000 0.50000000 0.75000000 1.0 Cu Cu8 1 0.50000000 0.00000000 0.75000000 1.0 Cu Cu9 1 0.50000000 0.00000000 0.25000000 1.0 Se Se10 1 0.24405716 0.24405716 0.35249462 1.0 Se Se11 1 0.75594284 0.75594284 0.64750538 1.0 Se Se12 1 0.75594284 0.75594284 0.35249462 1.0 Se Se13 1 0.75594284 0.24405716 0.85249462 1.0 Se Se14 1 0.75594284 0.24405716 0.14750538 1.0 Se Se15 1 0.24405716 0.24405716 0.64750538 1.0 Se Se16 1 0.24405716 0.75594284 0.14750538 1.0 Se Se17 1 0.24405716 0.75594284 0.85249462 1.0