# generated using pymatgen
data_BaLiYCu2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.84925621
_cell_length_b   3.84927021
_cell_length_c   9.97890300
_cell_angle_alpha   90.00394865
_cell_angle_beta   90.00250668
_cell_angle_gamma   89.96222212
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaLiYCu2O5
_chemical_formula_sum   'Ba1 Li1 Y1 Cu2 O5'
_cell_volume   147.85564957
_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  0.99998200  0.99996400  0.05950300  1
  Li  Li1  1  0.00001600  0.00003300  0.69231200  1
  Y  Y2  1  0.00000800  0.00001200  0.42769900  1
  Cu  Cu3  1  0.50000900  0.50002000  0.61805700  1
  Cu  Cu4  1  0.49999300  0.49998700  0.25406100  1
  O  O5  1  0.00001000  0.50001300  0.60265000  1
  O  O6  1  0.50000400  0.00002000  0.60264300  1
  O  O7  1  0.99999700  0.49999300  0.30117200  1
  O  O8  1  0.49999700  0.99999300  0.30116700  1
  O  O9  1  0.49997900  0.49996000  0.03698700  1
