# generated using pymatgen
data_LiCo3NiO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.67796409
_cell_length_b   5.67796409
_cell_length_c   5.91259561
_cell_angle_alpha   61.75503496
_cell_angle_beta   61.75503496
_cell_angle_gamma   60.63946711
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCo3NiO8
_chemical_formula_sum   'Li1 Co3 Ni1 O8'
_cell_volume   138.94207564
_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  0.00000000  0.50000000  1
  Co  Co1  1  0.00000000  0.50000000  0.00000000  1
  Co  Co2  1  0.50000000  0.50000000  0.00000000  1
  Co  Co3  1  0.50000000  0.00000000  0.00000000  1
  Ni  Ni4  1  0.00000000  0.00000000  0.00000000  1
  O  O5  1  0.21372700  0.74333000  0.79893800  1
  O  O6  1  0.22813700  0.22813700  0.80884500  1
  O  O7  1  0.74333000  0.21372700  0.79893800  1
  O  O8  1  0.74053500  0.74053500  0.79829900  1
  O  O9  1  0.25946500  0.25946500  0.20170100  1
  O  O10  1  0.25667000  0.78627300  0.20106200  1
  O  O11  1  0.77186300  0.77186300  0.19115500  1
  O  O12  1  0.78627300  0.25667000  0.20106200  1
