# generated using pymatgen
data_Ba2LaMn2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.86810436
_cell_length_b   10.86810436
_cell_length_c   10.86810436
_cell_angle_alpha   158.74976900
_cell_angle_beta   158.74976900
_cell_angle_gamma   30.22982780
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2LaMn2O7
_chemical_formula_sum   'Ba2 La1 Mn2 O7'
_cell_volume   168.52674362
_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  0.68137200  0.68137200  0.00000000  1.0
  Ba  Ba1  1  0.31862800  0.31862800  0.00000000  1.0
  La  La2  1  0.50000000  0.50000000  0.00000000  1.0
  Mn  Mn3  1  0.90676000  0.90676000  0.00000000  1.0
  Mn  Mn4  1  0.09324000  0.09324000  0.00000000  1.0
  O  O5  1  0.81373700  0.81373700  0.00000000  1.0
  O  O6  1  0.18626300  0.18626300  0.00000000  1.0
  O  O7  1  0.91361800  0.41361800  0.50000000  1.0
  O  O8  1  0.41361800  0.91361800  0.50000000  1.0
  O  O9  1  0.08638200  0.58638200  0.50000000  1.0
  O  O10  1  0.58638200  0.08638200  0.50000000  1.0
  O  O11  1  0.00000000  0.00000000  0.00000000  1.0