# generated using pymatgen
data_GaFe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.95984694
_cell_length_b   4.13509252
_cell_length_c   19.89441014
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaFe4
_chemical_formula_sum   'Ga4 Fe16'
_cell_volume   243.49247910
_cell_formula_units_Z   4
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
  Ga  Ga0  1  0.00000000  0.00000000  0.00000000  1
  Ga  Ga1  1  0.00000000  0.50000000  0.50000000  1
  Ga  Ga2  1  0.50000000  0.00000000  0.50000000  1
  Ga  Ga3  1  0.50000000  0.50000000  0.00000000  1
  Fe  Fe4  1  0.50000000  0.00000000  0.89837100  1
  Fe  Fe5  1  0.00000000  0.00000000  0.79989500  1
  Fe  Fe6  1  0.50000000  0.00000000  0.70010500  1
  Fe  Fe7  1  0.00000000  0.00000000  0.60162900  1
  Fe  Fe8  1  0.50000000  0.50000000  0.39837100  1
  Fe  Fe9  1  0.00000000  0.50000000  0.29989500  1
  Fe  Fe10  1  0.50000000  0.50000000  0.20010500  1
  Fe  Fe11  1  0.00000000  0.50000000  0.10162900  1
  Fe  Fe12  1  0.00000000  0.00000000  0.39837100  1
  Fe  Fe13  1  0.50000000  0.00000000  0.29989500  1
  Fe  Fe14  1  0.00000000  0.00000000  0.20010500  1
  Fe  Fe15  1  0.50000000  0.00000000  0.10162900  1
  Fe  Fe16  1  0.00000000  0.50000000  0.89837100  1
  Fe  Fe17  1  0.50000000  0.50000000  0.79989500  1
  Fe  Fe18  1  0.00000000  0.50000000  0.70010500  1
  Fe  Fe19  1  0.50000000  0.50000000  0.60162900  1
