# generated using pymatgen data_HfSc(Ni2As)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.01065852 _cell_length_b 7.01065852 _cell_length_c 3.72581362 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.53240212 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfSc(Ni2As)4 _chemical_formula_sum 'Hf1 Sc1 Ni8 As4' _cell_volume 183.11515563 _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 Hf Hf0 1 0.00000000 0.00000000 0.50000000 1.0 Sc Sc1 1 0.50000000 0.50000000 0.00000000 1.0 Ni Ni2 1 0.59132849 0.15427893 0.50000000 1.0 Ni Ni3 1 0.40867151 0.84572107 0.50000000 1.0 Ni Ni4 1 0.08952584 0.34399338 0.00000000 1.0 Ni Ni5 1 0.91047416 0.65600662 0.00000000 1.0 Ni Ni6 1 0.15427893 0.59132849 0.50000000 1.0 Ni Ni7 1 0.84572107 0.40867151 0.50000000 1.0 Ni Ni8 1 0.34399338 0.08952584 0.00000000 1.0 Ni Ni9 1 0.65600662 0.91047416 0.00000000 1.0 As As10 1 0.71828542 0.71828542 0.50000000 1.0 As As11 1 0.28171458 0.28171458 0.50000000 1.0 As As12 1 0.21509305 0.78490695 0.00000000 1.0 As As13 1 0.78490695 0.21509305 0.00000000 1.0