# generated using pymatgen
data_LiCuO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.58691800
_cell_length_b   7.79196124
_cell_length_c   7.92809403
_cell_angle_alpha   66.06330812
_cell_angle_beta   81.64451584
_cell_angle_gamma   82.98311741
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCuO2
_chemical_formula_sum   'Li8 Cu8 O16'
_cell_volume   367.06545168
_cell_formula_units_Z   8
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  0.58654100  0.84709600  0.31503000  1
  Li  Li1  1  0.83578400  0.58247500  0.53245700  1
  Li  Li2  1  0.91362100  0.61929800  0.83554200  1
  Li  Li3  1  0.67402400  0.90189100  0.95579200  1
  Li  Li4  1  0.32597600  0.09810900  0.04420800  1
  Li  Li5  1  0.08637900  0.38070200  0.16445800  1
  Li  Li6  1  0.16421600  0.41752500  0.46754300  1
  Li  Li7  1  0.41345900  0.15290400  0.68497000  1
  Cu  Cu8  1  0.36518500  0.67183300  0.07969900  1
  Cu  Cu9  1  0.87579600  0.08337300  0.17422200  1
  Cu  Cu10  1  0.62389700  0.42136600  0.32195200  1
  Cu  Cu11  1  0.12472500  0.83766000  0.42650600  1
  Cu  Cu12  1  0.87527500  0.16234000  0.57349400  1
  Cu  Cu13  1  0.37610300  0.57863400  0.67804800  1
  Cu  Cu14  1  0.12420400  0.91662700  0.82577800  1
  Cu  Cu15  1  0.63481500  0.32816700  0.92030100  1
  O  O16  1  0.88366400  0.83340700  0.33498100  1
  O  O17  1  0.87440800  0.91492500  0.74962400  1
  O  O18  1  0.86507400  0.33803200  0.02430700  1
  O  O19  1  0.60308200  0.67670500  0.17386100  1
  O  O20  1  0.88350100  0.40925900  0.39888400  1
  O  O21  1  0.37055600  0.82575300  0.51436000  1
  O  O22  1  0.63872700  0.57031500  0.74541000  1
  O  O23  1  0.36853600  0.92277800  0.91523500  1
  O  O24  1  0.63146400  0.07722200  0.08476500  1
  O  O25  1  0.36127300  0.42968500  0.25459000  1
  O  O26  1  0.62944400  0.17424700  0.48564000  1
  O  O27  1  0.11649900  0.59074100  0.60111600  1
  O  O28  1  0.39691800  0.32329500  0.82613900  1
  O  O29  1  0.13492600  0.66196800  0.97569300  1
  O  O30  1  0.12559200  0.08507500  0.25037600  1
  O  O31  1  0.11633600  0.16659300  0.66501900  1
