# generated using pymatgen
data_Zr(GaFe)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.99004655
_cell_length_b   8.42454494
_cell_length_c   8.59730044
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr(GaFe)6
_chemical_formula_sum   'Zr2 Ga12 Fe12'
_cell_volume   361.42080770
_cell_formula_units_Z   2
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  0.00000000  0.00000000  0.00000000  1
  Zr  Zr1  1  0.50000000  0.50000000  0.50000000  1
  Ga  Ga2  1  0.00000000  0.00000000  0.34076400  1
  Ga  Ga3  1  0.00000000  0.00000000  0.65923600  1
  Ga  Ga4  1  0.50000000  0.50000000  0.84076400  1
  Ga  Ga5  1  0.50000000  0.50000000  0.15923600  1
  Ga  Ga6  1  0.00000000  0.33171400  0.00000000  1
  Ga  Ga7  1  0.00000000  0.66828600  0.00000000  1
  Ga  Ga8  1  0.50000000  0.83171400  0.50000000  1
  Ga  Ga9  1  0.50000000  0.16828600  0.50000000  1
  Ga  Ga10  1  0.00000000  0.50000000  0.32631400  1
  Ga  Ga11  1  0.00000000  0.50000000  0.67368600  1
  Ga  Ga12  1  0.50000000  0.00000000  0.82631400  1
  Ga  Ga13  1  0.50000000  0.00000000  0.17368600  1
  Fe  Fe14  1  0.25000000  0.25000000  0.25000000  1
  Fe  Fe15  1  0.75000000  0.75000000  0.75000000  1
  Fe  Fe16  1  0.75000000  0.75000000  0.25000000  1
  Fe  Fe17  1  0.25000000  0.25000000  0.75000000  1
  Fe  Fe18  1  0.25000000  0.75000000  0.75000000  1
  Fe  Fe19  1  0.75000000  0.25000000  0.25000000  1
  Fe  Fe20  1  0.75000000  0.25000000  0.75000000  1
  Fe  Fe21  1  0.25000000  0.75000000  0.25000000  1
  Fe  Fe22  1  0.00000000  0.25492900  0.50000000  1
  Fe  Fe23  1  0.00000000  0.74507100  0.50000000  1
  Fe  Fe24  1  0.50000000  0.75492900  0.00000000  1
  Fe  Fe25  1  0.50000000  0.24507100  0.00000000  1
