data_[Li4Ni4P4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ni  1.9100  1.3500  0.7400
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [9.7719]
_cell_length_b [4.7568]
_cell_length_c [6.5010]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.9412]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [LiNiPO4]
_chemical_formula_sum '[Li4 Ni4 P4 O16]'
_cell_volume [294.5117]
_cell_formula_units_Z [4]
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  2  0.0000  0.0228  0.5000  1.0
  Li  Li1  2  0.0000  0.0339  0.0000  1.0
  Ni  Ni2  4  0.1343  0.4724  0.7083  1.0
  P  P3  4  0.1792  0.4967  0.2244  1.0
  O  O4  4  0.0838  0.3879  0.3758  1.0
  O  O5  4  0.1299  0.3678  0.0047  1.0
  O  O6  4  0.1650  0.8999  0.6877  1.0
  O  O7  4  0.1666  0.8209  0.2237  1.0
]