# generated using pymatgen data_Mg14ZrCu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.37314513 _cell_length_b 6.24399449 _cell_length_c 10.05103901 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.33188428 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg14ZrCu _chemical_formula_sum 'Mg14 Zr1 Cu1' _cell_volume 348.69245500 _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 Mg Mg0 1 0.17187400 0.33593650 0.62500000 1.0 Mg Mg1 1 0.16631511 0.83315706 0.62500000 1.0 Mg Mg2 1 0.64167274 0.30769609 0.12500000 1.0 Mg Mg3 1 0.66644051 0.33791976 0.62500000 1.0 Mg Mg4 1 0.64167274 0.83397565 0.12500000 1.0 Mg Mg5 1 0.66644051 0.82851975 0.62500000 1.0 Mg Mg6 1 0.33163885 0.16459787 0.36741769 1.0 Mg Mg7 1 0.33163885 0.16459787 0.88258231 1.0 Mg Mg8 1 0.33163885 0.66704198 0.36741769 1.0 Mg Mg9 1 0.33163885 0.66704198 0.88258231 1.0 Mg Mg10 1 0.83943968 0.16972034 0.37860179 1.0 Mg Mg11 1 0.83943968 0.16972034 0.87139821 1.0 Mg Mg12 1 0.85201521 0.67600810 0.35284379 1.0 Mg Mg13 1 0.85201521 0.67600810 0.89715621 1.0 Zr Zr14 1 0.14455903 0.32227901 0.12500000 1.0 Cu Cu15 1 0.19156018 0.84577959 0.12500000 1.0