# generated using pymatgen
data_Ba2YCr3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97443462
_cell_length_b   3.97277700
_cell_length_c   11.80775584
_cell_angle_alpha   90.00262722
_cell_angle_beta   89.93614925
_cell_angle_gamma   89.99933745
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2YCr3O8
_chemical_formula_sum   'Ba2 Y1 Cr3 O8'
_cell_volume   186.43894591
_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  0.49998700  0.49999300  0.16193000  1.0
  Ba  Ba1  1  0.50002500  0.49999400  0.83805500  1.0
  Y  Y2  1  0.49999300  0.50000700  0.50000100  1.0
  Cr  Cr3  1  0.00001100  0.00000300  0.34243000  1.0
  Cr  Cr4  1  0.00001600  0.99999700  0.99992300  1.0
  Cr  Cr5  1  0.99997600  0.00000800  0.65759100  1.0
  O  O6  1  0.99997500  0.50000400  0.38078900  1.0
  O  O7  1  0.49999000  0.00000900  0.38079700  1.0
  O  O8  1  0.50001500  0.99999100  0.99998200  1.0
  O  O9  1  0.00001200  0.99999600  0.18033900  1.0
  O  O10  1  0.00001000  0.50000600  0.61925200  1.0
  O  O11  1  0.49999700  0.00000400  0.61924500  1.0
  O  O12  1  0.99998500  0.99999800  0.81968400  1.0
  O  O13  1  0.00000900  0.49998900  0.99998300  1.0