# generated using pymatgen
data_LiNi4O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.10153091
_cell_length_b   5.10153091
_cell_length_c   5.10153091
_cell_angle_alpha   99.59762802
_cell_angle_beta   99.59762802
_cell_angle_gamma   131.80089730
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNi4O5
_chemical_formula_sum   'Li1 Ni4 O5'
_cell_volume   90.34883671
_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  0.00000000  1
  Ni  Ni1  1  0.39884900  0.79649200  0.19534100  1
  Ni  Ni2  1  0.79649200  0.60115100  0.39764300  1
  Ni  Ni3  1  0.20350800  0.39884900  0.60235700  1
  Ni  Ni4  1  0.60115100  0.20350800  0.80465900  1
  O  O5  1  0.30903800  0.10286100  0.41189900  1
  O  O6  1  0.69096200  0.89713900  0.58810100  1
  O  O7  1  0.10286100  0.69096200  0.79382300  1
  O  O8  1  0.50000000  0.50000000  0.00000000  1
  O  O9  1  0.89713900  0.30903800  0.20617700  1
