# generated using pymatgen data_CaMg14Nb _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.47816055 _cell_length_b 6.47816001 _cell_length_c 10.17850746 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000273 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaMg14Nb _chemical_formula_sum 'Ca1 Mg14 Nb1' _cell_volume 369.92875989 _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 Ca Ca0 1 0.16666700 0.33333300 0.12500000 1.0 Mg Mg1 1 0.17316033 0.83657967 0.12500000 1.0 Mg Mg2 1 0.16639610 0.83319755 0.62500000 1.0 Mg Mg3 1 0.66342033 0.32683967 0.12500000 1.0 Mg Mg4 1 0.66680245 0.33360390 0.62500000 1.0 Mg Mg5 1 0.66342033 0.83657967 0.12500000 1.0 Mg Mg6 1 0.66680245 0.83319755 0.62500000 1.0 Mg Mg7 1 0.33143128 0.16856872 0.38790448 1.0 Mg Mg8 1 0.33143128 0.16856872 0.86209552 1.0 Mg Mg9 1 0.33143128 0.66286356 0.38790448 1.0 Mg Mg10 1 0.33143128 0.66286356 0.86209552 1.0 Mg Mg11 1 0.83713644 0.16856872 0.38790448 1.0 Mg Mg12 1 0.83713644 0.16856872 0.86209552 1.0 Mg Mg13 1 0.83333300 0.66666700 0.37143859 1.0 Mg Mg14 1 0.83333300 0.66666700 0.87856141 1.0 Nb Nb15 1 0.16666700 0.33333300 0.62500000 1.0