# generated using pymatgen data_Na5Ti3F14 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.60057600 _cell_length_b 7.60057600 _cell_length_c 10.53940300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na5Ti3F14 _chemical_formula_sum 'Na10 Ti6 F28' _cell_volume 608.84819536 _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 Na Na0 1 0.00000000 0.00000000 0.50000000 1.0 Na Na1 1 0.50000000 0.50000000 0.00000000 1.0 Na Na2 1 0.27344500 0.77344500 0.25000000 1.0 Na Na3 1 0.72655500 0.22655500 0.75000000 1.0 Na Na4 1 0.72655500 0.22655500 0.25000000 1.0 Na Na5 1 0.27344500 0.77344500 0.75000000 1.0 Na Na6 1 0.22655500 0.27344500 0.25000000 1.0 Na Na7 1 0.77344500 0.72655500 0.75000000 1.0 Na Na8 1 0.77344500 0.72655500 0.25000000 1.0 Na Na9 1 0.22655500 0.27344500 0.75000000 1.0 Ti Ti10 1 0.00000000 0.00000000 0.00000000 1.0 Ti Ti11 1 0.50000000 0.50000000 0.50000000 1.0 Ti Ti12 1 0.00000000 0.50000000 0.00000000 1.0 Ti Ti13 1 0.50000000 0.00000000 0.00000000 1.0 Ti Ti14 1 0.50000000 0.00000000 0.50000000 1.0 Ti Ti15 1 0.00000000 0.50000000 0.50000000 1.0 F F16 1 0.00000000 0.00000000 0.18456700 1.0 F F17 1 0.00000000 0.00000000 0.81543300 1.0 F F18 1 0.50000000 0.50000000 0.31543300 1.0 F F19 1 0.50000000 0.50000000 0.68456700 1.0 F F20 1 0.07322900 0.24834800 0.00000000 1.0 F F21 1 0.92677100 0.75165200 0.00000000 1.0 F F22 1 0.75165200 0.07322900 0.00000000 1.0 F F23 1 0.24834800 0.92677100 0.00000000 1.0 F F24 1 0.42677100 0.74834800 0.50000000 1.0 F F25 1 0.57322900 0.25165200 0.50000000 1.0 F F26 1 0.74834800 0.57322900 0.50000000 1.0 F F27 1 0.25165200 0.42677100 0.50000000 1.0 F F28 1 0.18923500 0.53444500 0.12687200 1.0 F F29 1 0.81076500 0.46555500 0.87312800 1.0 F F30 1 0.81076500 0.46555500 0.12687200 1.0 F F31 1 0.18923500 0.53444500 0.87312800 1.0 F F32 1 0.46555500 0.18923500 0.12687200 1.0 F F33 1 0.53444500 0.81076500 0.87312800 1.0 F F34 1 0.53444500 0.81076500 0.12687200 1.0 F F35 1 0.46555500 0.18923500 0.87312800 1.0 F F36 1 0.31076500 0.03444500 0.37312800 1.0 F F37 1 0.68923500 0.96555500 0.62687200 1.0 F F38 1 0.68923500 0.96555500 0.37312800 1.0 F F39 1 0.31076500 0.03444500 0.62687200 1.0 F F40 1 0.03444500 0.68923500 0.37312800 1.0 F F41 1 0.96555500 0.31076500 0.62687200 1.0 F F42 1 0.96555500 0.31076500 0.37312800 1.0 F F43 1 0.03444500 0.68923500 0.62687200 1.0