# generated using pymatgen data_Mg14NbCoO16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.62355532 _cell_length_b 8.65505545 _cell_length_c 4.26905880 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg14NbCoO16 _chemical_formula_sum 'Mg14 Nb1 Co1 O16' _cell_volume 318.63123357 _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 0.50000000 0.00000000 0.00000000 1.0 Mg Mg1 1 0.50000000 0.50000000 0.00000000 1.0 Mg Mg2 1 0.00000000 0.23447672 0.50000000 1.0 Mg Mg3 1 0.00000000 0.76552328 0.50000000 1.0 Mg Mg4 1 0.50000000 0.24659875 0.50000000 1.0 Mg Mg5 1 0.50000000 0.75340125 0.50000000 1.0 Mg Mg6 1 0.24730757 0.00000000 0.50000000 1.0 Mg Mg7 1 0.25810770 0.50000000 0.50000000 1.0 Mg Mg8 1 0.75269243 0.00000000 0.50000000 1.0 Mg Mg9 1 0.74189230 0.50000000 0.50000000 1.0 Mg Mg10 1 0.25077269 0.24174103 0.00000000 1.0 Mg Mg11 1 0.25077269 0.75825897 0.00000000 1.0 Mg Mg12 1 0.74922731 0.24174103 0.00000000 1.0 Mg Mg13 1 0.74922731 0.75825897 0.00000000 1.0 Nb Nb14 1 0.00000000 0.50000000 0.00000000 1.0 Co Co15 1 0.00000000 0.00000000 0.00000000 1.0 O O16 1 0.26372201 0.00000000 0.00000000 1.0 O O17 1 0.25678329 0.50000000 0.00000000 1.0 O O18 1 0.73627799 0.00000000 0.00000000 1.0 O O19 1 0.74321671 0.50000000 0.00000000 1.0 O O20 1 0.24825073 0.25125372 0.50000000 1.0 O O21 1 0.24825073 0.74874628 0.50000000 1.0 O O22 1 0.75174927 0.25125372 0.50000000 1.0 O O23 1 0.75174927 0.74874628 0.50000000 1.0 O O24 1 0.00000000 0.00000000 0.50000000 1.0 O O25 1 0.00000000 0.50000000 0.50000000 1.0 O O26 1 0.50000000 0.00000000 0.50000000 1.0 O O27 1 0.50000000 0.50000000 0.50000000 1.0 O O28 1 0.00000000 0.25243893 0.00000000 1.0 O O29 1 0.00000000 0.74756107 0.00000000 1.0 O O30 1 0.50000000 0.25241589 0.00000000 1.0 O O31 1 0.50000000 0.74758411 0.00000000 1.0