# generated using pymatgen
data_Ba2LiLaCu3O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.00145336
_cell_length_b   4.23173400
_cell_length_c   11.50491710
_cell_angle_alpha   90.00000000
_cell_angle_beta   87.85270137
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2LiLaCu3O7
_chemical_formula_sum   'Ba2 Li1 La1 Cu3 O7'
_cell_volume   194.67695603
_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  0.50360500  0.50000000  0.82390500  1
  Ba  Ba1  1  0.37892900  0.50000000  0.16069000  1
  Li  Li2  1  0.75535100  0.00000000  0.19305900  1
  La  La3  1  0.53792900  0.50000000  0.49753300  1
  Cu  Cu4  1  0.01988200  0.00000000  0.64737200  1
  Cu  Cu5  1  0.05632100  0.00000000  0.36743200  1
  Cu  Cu6  1  0.97535900  0.00000000  0.98951700  1
  O  O7  1  0.52403900  0.00000000  0.61266700  1
  O  O8  1  0.01985400  0.50000000  0.62794600  1
  O  O9  1  0.55535200  0.00000000  0.34281900  1
  O  O10  1  0.04148700  0.50000000  0.36380400  1
  O  O11  1  0.95002500  0.50000000  0.01001500  1
  O  O12  1  0.49737700  0.00000000  0.04848400  1
  O  O13  1  0.01782300  0.00000000  0.82053700  1
