# generated using pymatgen data_Mg14ZrNb _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.43094577 _cell_length_b 6.14600844 _cell_length_c 10.17707383 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 118.54484587 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg14ZrNb _chemical_formula_sum 'Mg14 Zr1 Nb1' _cell_volume 353.34967222 _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 0.16553346 0.33276623 0.62500000 1.0 Mg Mg1 1 0.16375525 0.83187712 0.62500000 1.0 Mg Mg2 1 0.65705659 0.32653264 0.12500000 1.0 Mg Mg3 1 0.66415802 0.33320862 0.62500000 1.0 Mg Mg4 1 0.65705659 0.83052295 0.12500000 1.0 Mg Mg5 1 0.66415802 0.83094840 0.62500000 1.0 Mg Mg6 1 0.33446651 0.16355624 0.37067022 1.0 Mg Mg7 1 0.33446651 0.16355624 0.87932978 1.0 Mg Mg8 1 0.33446651 0.67091127 0.37067022 1.0 Mg Mg9 1 0.33446651 0.67091127 0.87932978 1.0 Mg Mg10 1 0.83997046 0.16998573 0.37492926 1.0 Mg Mg11 1 0.83997046 0.16998573 0.87507074 1.0 Mg Mg12 1 0.84600130 0.67300115 0.36754180 1.0 Mg Mg13 1 0.84600130 0.67300115 0.88245820 1.0 Zr Zr14 1 0.15838988 0.32919444 0.12500000 1.0 Nb Nb15 1 0.16008261 0.83004080 0.12500000 1.0