data_[Li4Ni6P4]
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
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.8201]
_cell_length_b [3.5146]
_cell_length_c [6.1722]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.6856]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2Ni3P2]
_chemical_formula_sum '[Li4 Ni6 P4]'
_cell_volume [175.2139]
_cell_formula_units_Z [2]
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  4  0.1434  0.0000  0.7821  1.0
  Ni  Ni1  4  0.1339  0.5000  0.4381  1.0
  Ni  Ni2  2  0.0000  0.5000  0.0000  1.0
  P  P3  4  0.1448  0.0000  0.2248  1.0
]