# generated using pymatgen
data_Ti4Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.75966914
_cell_length_b   10.63976192
_cell_length_c   2.82272606
_cell_angle_alpha   84.84034644
_cell_angle_beta   80.01361647
_cell_angle_gamma   15.14603709
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti4Fe
_chemical_formula_sum   'Ti4 Fe1'
_cell_volume   79.29576794
_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  0.41697800  0.41697800  0.58302200  1.0
  Ti  Ti1  1  0.80343500  0.80343500  0.19656500  1.0
  Ti  Ti2  1  0.19656500  0.19656500  0.80343500  1.0
  Ti  Ti3  1  0.58302200  0.58302200  0.41697800  1.0
  Fe  Fe4  1  0.00000000  0.00000000  0.00000000  1.0