# generated using pymatgen data_HfCoAs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.79517913 _cell_length_b 6.42264666 _cell_length_c 7.18765567 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfCoAs _chemical_formula_sum 'Hf4 Co4 As4' _cell_volume 175.19978665 _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 Hf Hf0 1 0.25000000 0.51914567 0.81238678 1.0 Hf Hf1 1 0.75000000 0.48085433 0.18761322 1.0 Hf Hf2 1 0.25000000 0.01914567 0.68761322 1.0 Hf Hf3 1 0.75000000 0.98085433 0.31238678 1.0 Co Co4 1 0.25000000 0.63848224 0.43616397 1.0 Co Co5 1 0.75000000 0.36151776 0.56383603 1.0 Co Co6 1 0.25000000 0.13848224 0.06383603 1.0 Co Co7 1 0.75000000 0.86151776 0.93616397 1.0 As As8 1 0.75000000 0.73165207 0.61473337 1.0 As As9 1 0.25000000 0.26834793 0.38526663 1.0 As As10 1 0.75000000 0.23165207 0.88526663 1.0 As As11 1 0.25000000 0.76834793 0.11473337 1.0