data_[Li4Cr1P2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cr  1.6600  1.4000  0.9400
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.8660]
_cell_length_b [5.5121]
_cell_length_c [6.0753]
_cell_angle_alpha [96.6047]
_cell_angle_beta [96.1113]
_cell_angle_gamma [98.0588]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li4Cr(PO4)2]
_chemical_formula_sum '[Li4 Cr1 P2 O8]'
_cell_volume [159.0190]
_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  2  0.1553  0.2972  0.5672  1.0
  Li  Li1  2  0.3288  0.5598  0.1710  1.0
  Cr  Cr2  1  0.0000  0.0000  0.0000  1.0
  P  P3  2  0.3777  0.7917  0.7089  1.0
  O  O4  2  0.2586  0.6843  0.4665  1.0
  O  O5  2  0.2654  0.6020  0.8622  1.0
  O  O6  2  0.2810  0.0466  0.7727  1.0
  O  O7  2  0.2951  0.1841  0.2621  1.0
]