# generated using pymatgen
data_Li3Cu4NiO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.17974229
_cell_length_b   6.17974229
_cell_length_c   5.59176842
_cell_angle_alpha   64.72407506
_cell_angle_beta   64.72407506
_cell_angle_gamma   53.91705497
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Cu4NiO8
_chemical_formula_sum   'Li3 Cu4 Ni1 O8'
_cell_volume   151.49014388
_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  0.00000000  0.50000000  0.00000000  1
  Li  Li1  1  0.00000000  0.00000000  0.50000000  1
  Li  Li2  1  0.50000000  0.00000000  0.00000000  1
  Cu  Cu3  1  0.50000000  0.50000000  0.50000000  1
  Cu  Cu4  1  0.00000000  0.00000000  0.00000000  1
  Cu  Cu5  1  0.00000000  0.50000000  0.50000000  1
  Cu  Cu6  1  0.50000000  0.00000000  0.50000000  1
  Ni  Ni7  1  0.50000000  0.50000000  0.00000000  1
  O  O8  1  0.28081200  0.28081200  0.25577400  1
  O  O9  1  0.23067700  0.70411000  0.76988000  1
  O  O10  1  0.70411000  0.23067700  0.76988000  1
  O  O11  1  0.79900100  0.79900100  0.24011800  1
  O  O12  1  0.20099900  0.20100000  0.75988200  1
  O  O13  1  0.29589000  0.76932300  0.23012000  1
  O  O14  1  0.76932300  0.29589000  0.23012000  1
  O  O15  1  0.71918800  0.71918800  0.74422600  1
