# generated using pymatgen
data_Ba2CrO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.01695600
_cell_length_b   7.73225100
_cell_length_c   10.72422600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2CrO4
_chemical_formula_sum   'Ba8 Cr4 O16'
_cell_volume   498.94047561
_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
  Ba  Ba0  1  0.24328000  0.99734700  0.19596900  1.0
  Ba  Ba1  1  0.74328000  0.00265300  0.80403100  1.0
  Ba  Ba2  1  0.74328000  0.50265300  0.69596900  1.0
  Ba  Ba3  1  0.24328000  0.49734700  0.30403100  1.0
  Ba  Ba4  1  0.23869300  0.65107600  0.93063000  1.0
  Ba  Ba5  1  0.73869300  0.34892400  0.06937000  1.0
  Ba  Ba6  1  0.23869300  0.15107600  0.56937000  1.0
  Ba  Ba7  1  0.73869300  0.84892400  0.43063000  1.0
  Cr  Cr8  1  0.23775900  0.21782100  0.92061000  1.0
  Cr  Cr9  1  0.73775900  0.78217900  0.07939000  1.0
  Cr  Cr10  1  0.23775900  0.71782100  0.57939000  1.0
  Cr  Cr11  1  0.73775900  0.28217900  0.42061000  1.0
  O  O12  1  0.48397600  0.80154200  0.65215600  1.0
  O  O13  1  0.98397600  0.69845800  0.15215600  1.0
  O  O14  1  0.48397600  0.30154200  0.84784400  1.0
  O  O15  1  0.98397600  0.19845800  0.34784400  1.0
  O  O16  1  0.49159600  0.18914400  0.35310700  1.0
  O  O17  1  0.99159600  0.81085600  0.64689300  1.0
  O  O18  1  0.49159600  0.68914400  0.14689300  1.0
  O  O19  1  0.99159600  0.31085600  0.85310700  1.0
  O  O20  1  0.72193600  0.51199500  0.42323500  1.0
  O  O21  1  0.22193600  0.98800500  0.92323500  1.0
  O  O22  1  0.22193600  0.48800500  0.57676500  1.0
  O  O23  1  0.72193600  0.01199500  0.07676500  1.0
  O  O24  1  0.74096000  0.68574900  0.92347100  1.0
  O  O25  1  0.24096000  0.31425100  0.07652900  1.0
  O  O26  1  0.24096000  0.81425100  0.42347100  1.0
  O  O27  1  0.74096000  0.18574900  0.57652900  1.0