# generated using pymatgen
data_GaFe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.01582212
_cell_length_b   4.23472748
_cell_length_c   11.89875128
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaFe2
_chemical_formula_sum   'Ga4 Fe8'
_cell_volume   151.96115156
_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  0.00000000  0.00000000  0.33003300  1
  Fe  Fe5  1  0.50000000  0.00000000  0.16996700  1
  Fe  Fe6  1  0.00000000  0.50000000  0.83003300  1
  Fe  Fe7  1  0.50000000  0.50000000  0.66996700  1
  Fe  Fe8  1  0.50000000  0.00000000  0.83003300  1
  Fe  Fe9  1  0.00000000  0.00000000  0.66996700  1
  Fe  Fe10  1  0.50000000  0.50000000  0.33003300  1
  Fe  Fe11  1  0.00000000  0.50000000  0.16996700  1
