# generated using pymatgen data_Ti3Fe4P4W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.55863734 _cell_length_b 5.97932018 _cell_length_c 6.77137537 _cell_angle_alpha 89.69879224 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Fe4P4W _chemical_formula_sum 'Ti3 Fe4 P4 W1' _cell_volume 144.08090543 _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 Ti Ti0 1 0.25000000 0.52216717 0.68275693 1.0 Ti Ti1 1 0.75000000 0.98122276 0.17781483 1.0 Ti Ti2 1 0.75000000 0.47902010 0.31633170 1.0 Fe Fe3 1 0.25000000 0.14506068 0.43927309 1.0 Fe Fe4 1 0.25000000 0.64439729 0.06304259 1.0 Fe Fe5 1 0.75000000 0.85322234 0.56160499 1.0 Fe Fe6 1 0.75000000 0.35748854 0.93413046 1.0 P P7 1 0.25000000 0.77384576 0.37675060 1.0 P P8 1 0.25000000 0.27532090 0.11805929 1.0 P P9 1 0.75000000 0.22418016 0.62055748 1.0 P P10 1 0.75000000 0.72340928 0.88123957 1.0 W W11 1 0.25000000 0.02066402 0.82843846 1.0