# generated using pymatgen
data_Li2Mn3CuO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81911064
_cell_length_b   5.82266096
_cell_length_c   9.67334918
_cell_angle_alpha   87.36334489
_cell_angle_beta   91.31878777
_cell_angle_gamma   120.02018187
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Mn3CuO8
_chemical_formula_sum   'Li4 Mn6 Cu2 O16'
_cell_volume   283.48967460
_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
  Li  Li0  1  0.33340500  0.65743500  0.89053900  1
  Li  Li1  1  0.99961000  0.01299000  0.99657500  1
  Li  Li2  1  0.00039000  0.01338000  0.49657500  1
  Li  Li3  1  0.66659500  0.32403000  0.39053900  1
  Mn  Mn4  1  0.16770200  0.83238200  0.21549400  1
  Mn  Mn5  1  0.17061900  0.33877500  0.21444800  1
  Mn  Mn6  1  0.66293300  0.83026700  0.21518700  1
  Mn  Mn7  1  0.33706700  0.16733500  0.71518700  1
  Mn  Mn8  1  0.83229800  0.66468000  0.71549400  1
  Mn  Mn9  1  0.82938100  0.16815600  0.71444800  1
  Cu  Cu10  1  0.33255900  0.66900200  0.49381200  1
  Cu  Cu11  1  0.66744100  0.33644300  0.99381200  1
  O  O12  1  0.15687900  0.84930300  0.60763700  1
  O  O13  1  0.03608600  0.50875000  0.33057500  1
  O  O14  1  0.33286000  0.67507600  0.10837300  1
  O  O15  1  0.00033700  0.99405700  0.31213400  1
  O  O16  1  0.99966300  0.99372000  0.81213400  1
  O  O17  1  0.15939100  0.32503000  0.60454100  1
  O  O18  1  0.48147500  0.95386500  0.33519100  1
  O  O19  1  0.48451100  0.50603400  0.32420200  1
  O  O20  1  0.31629300  0.16451400  0.10521200  1
  O  O21  1  0.68370700  0.84822100  0.60521200  1
  O  O22  1  0.51852500  0.47239000  0.83519100  1
  O  O23  1  0.51548900  0.02152300  0.82420200  1
  O  O24  1  0.66714000  0.34221700  0.60837300  1
  O  O25  1  0.84312100  0.69242300  0.10763700  1
  O  O26  1  0.96391400  0.47266400  0.83057500  1
  O  O27  1  0.84060900  0.16563800  0.10454100  1
