# generated using pymatgen
data_BaYMgMnCuO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.95755265
_cell_length_b   3.95755504
_cell_length_c   9.60841850
_cell_angle_alpha   90.14100777
_cell_angle_beta   90.13205080
_cell_angle_gamma   90.00178544
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaYMgMnCuO5
_chemical_formula_sum   'Ba1 Y1 Mg1 Mn1 Cu1 O5'
_cell_volume   150.48842833
_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  0.99976400  0.99973200  0.03802900  1.0
  Y  Y1  1  0.00109200  0.00116000  0.40257900  1.0
  Mg  Mg2  1  0.99961900  0.99960300  0.68826700  1.0
  Mn  Mn3  1  0.49996700  0.49997300  0.73276100  1.0
  Cu  Cu4  1  0.50017400  0.50018100  0.26968800  1.0
  O  O5  1  0.99961100  0.49926300  0.63106900  1.0
  O  O6  1  0.49930200  0.99959100  0.63106900  1.0
  O  O7  1  0.00024800  0.50013900  0.28527500  1.0
  O  O8  1  0.50013500  0.00026300  0.28527300  1.0
  O  O9  1  0.50008200  0.50009200  0.94890700  1.0