# generated using pymatgen
data_Mn3CuO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85424595
_cell_length_b   5.85424595
_cell_length_c   5.85424572
_cell_angle_alpha   59.74248256
_cell_angle_beta   59.74248256
_cell_angle_gamma   59.74247953
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3CuO8
_chemical_formula_sum   'Mn3 Cu1 O8'
_cell_volume   141.04272190
_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
  Mn  Mn0  1  0.50000000  0.00000000  0.50000000  1.0
  Mn  Mn1  1  0.50000000  0.50000000  0.00000000  1.0
  Mn  Mn2  1  0.00000000  0.50000000  0.50000000  1.0
  Cu  Cu3  1  0.50000000  0.50000000  0.50000000  1.0
  O  O4  1  0.26496800  0.26496800  0.26496800  1.0
  O  O5  1  0.70540000  0.26246400  0.26246400  1.0
  O  O6  1  0.26246400  0.26246400  0.70540000  1.0
  O  O7  1  0.26246400  0.70540000  0.26246400  1.0
  O  O8  1  0.73753600  0.29460000  0.73753600  1.0
  O  O9  1  0.73753600  0.73753600  0.29460000  1.0
  O  O10  1  0.29460000  0.73753600  0.73753600  1.0
  O  O11  1  0.73503200  0.73503200  0.73503200  1.0