# generated using pymatgen
data_Li3CuNi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.72036300
_cell_length_b   5.76699130
_cell_length_c   5.83804977
_cell_angle_alpha   91.96484896
_cell_angle_beta   118.70171548
_cell_angle_gamma   118.40318876
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3CuNi3O8
_chemical_formula_sum   'Li3 Cu1 Ni3 O8'
_cell_volume   139.71360549
_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  0.50000000  0.50000000  0.50000000  1
  Li  Li1  1  0.50000000  0.00000000  0.50000000  1
  Li  Li2  1  0.00000000  0.00000000  0.50000000  1
  Cu  Cu3  1  0.00000000  0.00000000  0.00000000  1
  Ni  Ni4  1  0.50000000  0.00000000  0.00000000  1
  Ni  Ni5  1  0.50000000  0.50000000  0.00000000  1
  Ni  Ni6  1  0.00000000  0.50000000  0.00000000  1
  O  O7  1  0.53990300  0.28839300  0.77955300  1
  O  O8  1  0.99217000  0.23486700  0.78324400  1
  O  O9  1  0.04075800  0.79063900  0.78266000  1
  O  O10  1  0.46009700  0.71160700  0.22044700  1
  O  O11  1  0.50860100  0.74888400  0.78756100  1
  O  O12  1  0.00783000  0.76513300  0.21675600  1
  O  O13  1  0.95924200  0.20936100  0.21734000  1
  O  O14  1  0.49139900  0.25111600  0.21243900  1
