# generated using pymatgen
data_Ba2YMgMn3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.00622904
_cell_length_b   4.00524411
_cell_length_c   14.61360905
_cell_angle_alpha   89.99417669
_cell_angle_beta   90.00844213
_cell_angle_gamma   90.01744587
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2YMgMn3O8
_chemical_formula_sum   'Ba2 Y1 Mg1 Mn3 O8'
_cell_volume   234.48886414
_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  0.50017396  0.50022578  0.24562949  1.0
  Ba  Ba1  1  0.50019883  0.50016981  0.75457619  1.0
  Y  Y2  1  0.50016827  0.50014366  0.50007142  1.0
  Mg  Mg3  1  0.49973157  0.49971088  0.00029075  1.0
  Mn  Mn4  1  0.00035510  0.00004879  0.37274142  1.0
  Mn  Mn5  1  -0.00077260  -0.00061425  0.99863170  1.0
  Mn  Mn6  1  -0.00003278  0.00027412  0.62750544  1.0
  O  O7  1  0.00027976  0.50004610  0.40266787  1.0
  O  O8  1  0.50036315  0.00011014  0.40261830  1.0
  O  O9  1  0.49950406  -0.00033139  0.99976427  1.0
  O  O10  1  0.00045815  -0.00008978  0.22945408  1.0
  O  O11  1  0.00006882  0.50024690  0.59759084  1.0
  O  O12  1  0.49999278  0.00019980  0.59764214  1.0
  O  O13  1  -0.00020630  0.00030688  0.77105393  1.0
  O  O14  1  -0.00028478  0.49955255  0.99976416  1.0