# generated using pymatgen data_ZrTiNi _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.21438833 _cell_length_b 5.23088730 _cell_length_c 8.41077400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 60.56404043 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrTiNi _chemical_formula_sum 'Zr4 Ti4 Ni4' _cell_volume 199.79552282 _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 Zr Zr0 1 0.32205800 0.32134400 0.56947700 1.0 Zr Zr1 1 0.65472200 0.65531900 0.45800800 1.0 Zr Zr2 1 0.65472200 0.65531900 0.04199200 1.0 Zr Zr3 1 0.32205800 0.32134400 0.93052300 1.0 Ti Ti4 1 0.86076900 0.86061800 0.75000000 1.0 Ti Ti5 1 0.15724200 0.66173300 0.25000000 1.0 Ti Ti6 1 0.66241600 0.15611500 0.25000000 1.0 Ti Ti7 1 0.16766600 0.16986900 0.25000000 1.0 Ni Ni8 1 0.00070500 0.00091400 0.50122900 1.0 Ni Ni9 1 0.00070500 0.00091400 0.99877100 1.0 Ni Ni10 1 0.84106000 0.35537500 0.75000000 1.0 Ni Ni11 1 0.35587800 0.84113500 0.75000000 1.0