# generated using pymatgen
data_Li7CuO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.68673800
_cell_length_b   6.68673800
_cell_length_c   4.73103000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li7CuO4
_chemical_formula_sum   'Li14 Cu2 O8'
_cell_volume   211.53601367
_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  0.75133100  0.75133100  0.00000000  1
  Li  Li1  1  0.24866900  0.75133100  0.00000000  1
  Li  Li2  1  0.50000000  0.00000000  0.50979300  1
  Li  Li3  1  0.00000000  0.00000000  0.00000000  1
  Li  Li4  1  0.50000000  0.00000000  0.00979300  1
  Li  Li5  1  0.75133100  0.24866900  0.00000000  1
  Li  Li6  1  0.24866900  0.24866900  0.00000000  1
  Li  Li7  1  0.25133100  0.25133100  0.50000000  1
  Li  Li8  1  0.74866900  0.25133100  0.50000000  1
  Li  Li9  1  0.00000000  0.50000000  0.49020700  1
  Li  Li10  1  0.50000000  0.50000000  0.50000000  1
  Li  Li11  1  0.00000000  0.50000000  0.99020700  1
  Li  Li12  1  0.25133100  0.74866900  0.50000000  1
  Li  Li13  1  0.74866900  0.74866900  0.50000000  1
  Cu  Cu14  1  0.00000000  0.00000000  0.50000000  1
  Cu  Cu15  1  0.50000000  0.50000000  0.00000000  1
  O  O16  1  0.50000000  0.75855400  0.26229100  1
  O  O17  1  0.74144600  0.00000000  0.76229100  1
  O  O18  1  0.25855400  0.00000000  0.76229100  1
  O  O19  1  0.50000000  0.24144600  0.26229100  1
  O  O20  1  0.00000000  0.25855400  0.23770900  1
  O  O21  1  0.24144600  0.50000000  0.73770900  1
  O  O22  1  0.75855400  0.50000000  0.73770900  1
  O  O23  1  0.00000000  0.74144600  0.23770900  1
