# generated using pymatgen
data_BaCr4O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.61746218
_cell_length_b   5.61746218
_cell_length_c   7.94403100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000207
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaCr4O8
_chemical_formula_sum   'Ba1 Cr4 O8'
_cell_volume   217.09602248
_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
  Ba  Ba0  1  0.00000000  0.00000000  0.00000000  1.0
  Cr  Cr1  1  0.33333300  0.66666700  0.76674000  1.0
  Cr  Cr2  1  0.66666700  0.33333300  0.76674000  1.0
  Cr  Cr3  1  0.33333300  0.66666700  0.23326000  1.0
  Cr  Cr4  1  0.66666700  0.33333300  0.23326000  1.0
  O  O5  1  0.36375300  0.36375300  0.71469100  1.0
  O  O6  1  0.63624700  0.00000000  0.71469100  1.0
  O  O7  1  0.00000000  0.63624700  0.71469100  1.0
  O  O8  1  0.63624700  0.63624700  0.28530900  1.0
  O  O9  1  0.00000000  0.36375300  0.28530900  1.0
  O  O10  1  0.36375300  0.00000000  0.28530900  1.0
  O  O11  1  0.33333300  0.66666700  0.00000000  1.0
  O  O12  1  0.66666700  0.33333300  0.00000000  1.0