# generated using pymatgen
data_BaYMn2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97661371
_cell_length_b   3.97661371
_cell_length_c   7.78664800
_cell_angle_alpha   89.99999480
_cell_angle_beta   89.99999480
_cell_angle_gamma   89.98567550
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaYMn2O5
_chemical_formula_sum   'Ba1 Y1 Mn2 O5'
_cell_volume   123.13381648
_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  0.50000000  0.99996600  1.0
  Y  Y1  1  0.00000000  0.50000000  0.50000300  1.0
  Mn  Mn2  1  0.50000000  0.00000000  0.26711300  1.0
  Mn  Mn3  1  0.50000000  0.00000000  0.73295200  1.0
  O  O4  1  0.50000000  0.00000000  0.99999500  1.0
  O  O5  1  0.00000000  0.00000000  0.31837900  1.0
  O  O6  1  0.50000000  0.50000000  0.31837900  1.0
  O  O7  1  0.00000000  0.00000000  0.68160700  1.0
  O  O8  1  0.50000000  0.50000000  0.68160700  1.0