# generated using pymatgen data_YMg6Zr _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.18384500 _cell_length_b 6.55161500 _cell_length_c 11.38668000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YMg6Zr _chemical_formula_sum 'Y2 Mg12 Zr2' _cell_volume 386.72076467 _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 Y Y0 1 0.00000000 0.50000000 0.33160200 1.0 Y Y1 1 0.00000000 0.00000000 0.83160200 1.0 Mg Mg2 1 0.00000000 0.25722500 0.08453400 1.0 Mg Mg3 1 0.00000000 0.74277500 0.08453400 1.0 Mg Mg4 1 0.00000000 0.00000000 0.33504000 1.0 Mg Mg5 1 0.50000000 0.75187900 0.41738100 1.0 Mg Mg6 1 0.50000000 0.24812100 0.41738100 1.0 Mg Mg7 1 0.50000000 0.00000000 0.16515800 1.0 Mg Mg8 1 0.00000000 0.75722500 0.58453400 1.0 Mg Mg9 1 0.00000000 0.24277500 0.58453400 1.0 Mg Mg10 1 0.00000000 0.50000000 0.83504000 1.0 Mg Mg11 1 0.50000000 0.25187900 0.91738100 1.0 Mg Mg12 1 0.50000000 0.74812100 0.91738100 1.0 Mg Mg13 1 0.50000000 0.50000000 0.66515800 1.0 Zr Zr14 1 0.50000000 0.50000000 0.16437000 1.0 Zr Zr15 1 0.50000000 0.00000000 0.66437000 1.0