# generated using pymatgen
data_Li4Mn5CuO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15589976
_cell_length_b   5.15589976
_cell_length_c   10.30300139
_cell_angle_alpha   89.20257307
_cell_angle_beta   89.20257307
_cell_angle_gamma   120.82292067
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn5CuO12
_chemical_formula_sum   'Li4 Mn5 Cu1 O12'
_cell_volume   235.10906916
_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
  Li  Li0  1  0.33632900  0.84077000  0.75025200  1
  Li  Li1  1  0.15923000  0.66367100  0.24974800  1
  Li  Li2  1  0.84077000  0.33632900  0.75025200  1
  Li  Li3  1  0.66367000  0.15923000  0.24974800  1
  Mn  Mn4  1  0.16400600  0.83599400  0.50000000  1
  Mn  Mn5  1  0.66439900  0.33560100  0.00000000  1
  Mn  Mn6  1  0.33560100  0.66439900  0.00000000  1
  Mn  Mn7  1  0.83599400  0.16400600  0.50000000  1
  Mn  Mn8  1  0.50000000  0.50000000  0.50000000  1
  Cu  Cu9  1  0.00000000  0.00000000  0.00000000  1
  O  O10  1  0.36651000  0.99353000  0.10663600  1
  O  O11  1  0.00647000  0.63349000  0.89336400  1
  O  O12  1  0.48247300  0.84510600  0.39307400  1
  O  O13  1  0.84510600  0.48247300  0.39307400  1
  O  O14  1  0.15489400  0.51752700  0.60692600  1
  O  O15  1  0.82431100  0.82431100  0.59330500  1
  O  O16  1  0.51752700  0.15489400  0.60692600  1
  O  O17  1  0.99353000  0.36651000  0.10663600  1
  O  O18  1  0.66034800  0.66034800  0.09244700  1
  O  O19  1  0.63349000  0.00647000  0.89336400  1
  O  O20  1  0.33965200  0.33965200  0.90755300  1
  O  O21  1  0.17568900  0.17568900  0.40669500  1
