# generated using pymatgen
data_BaYMnCuO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.83927901
_cell_length_b   8.89314567
_cell_length_c   7.86964103
_cell_angle_alpha   63.73676273
_cell_angle_beta   89.99014986
_cell_angle_gamma   89.99510018
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaYMnCuO5
_chemical_formula_sum   'Ba2 Y2 Mn2 Cu2 O10'
_cell_volume   240.95798756
_cell_formula_units_Z   2
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  0.99999700  0.99304600  0.50339900  1.0
  Ba  Ba1  1  0.99999100  0.99305800  0.00356300  1.0
  Y  Y2  1  0.99998400  0.45968900  0.27011800  1.0
  Y  Y3  1  0.99999200  0.45971300  0.77014100  1.0
  Mn  Mn4  1  0.49999900  0.70382500  0.89812200  1.0
  Mn  Mn5  1  0.50002500  0.70502100  0.39754100  1.0
  Cu  Cu6  1  0.50000800  0.24694100  0.62647100  1.0
  Cu  Cu7  1  0.50001700  0.24712800  0.12628400  1.0
  O  O8  1  0.49999100  0.94626100  0.77691300  1.0
  O  O9  1  0.49999700  0.94727700  0.27638300  1.0
  O  O10  1  0.99998800  0.65869200  0.92069100  1.0
  O  O11  1  0.99999800  0.66081900  0.41966300  1.0
  O  O12  1  0.49999600  0.61942900  0.19059000  1.0
  O  O13  1  0.49999400  0.61944200  0.69012200  1.0
  O  O14  1  0.00000900  0.29521400  0.10238300  1.0
  O  O15  1  0.00000100  0.29728900  0.60135300  1.0
  O  O16  1  0.50001800  0.26147500  0.36871400  1.0
  O  O17  1  0.49998400  0.26151600  0.86963800  1.0