# generated using pymatgen data_ZrTiF6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.81026309 _cell_length_b 5.80697966 _cell_length_c 5.83145347 _cell_angle_alpha 59.86026496 _cell_angle_beta 59.87973363 _cell_angle_gamma 59.75300200 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrTiF6 _chemical_formula_sum 'Zr1 Ti1 F6' _cell_volume 138.59183801 _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 Zr Zr0 1 -0.00000026 -0.00000009 0.00000151 1.0 Ti Ti1 1 0.50000146 0.49999919 0.50000057 1.0 F F2 1 0.24792805 0.75160034 0.75477883 1.0 F F3 1 0.75207017 0.24840733 0.75430588 1.0 F F4 1 0.75206837 0.24840251 0.24521576 1.0 F F5 1 0.24646217 0.24749585 0.75301792 1.0 F F6 1 0.75353987 0.75250247 0.24698153 1.0 F F7 1 0.24793017 0.75159240 0.24569799 1.0