data_[Li4Mn4P4O20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mn  1.5500  1.4000  0.6483
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [7.5934]
_cell_length_b [6.1195]
_cell_length_c [7.8301]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [LiMnPO5]
_chemical_formula_sum '[Li4 Mn4 P4 O20]'
_cell_volume [363.8509]
_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  4  0.1402  0.7500  0.1700  1
  Mn  Mn1  4  0.0000  0.0000  0.5000  1
  P  P2  4  0.1321  0.2500  0.1658  1
  O  O3  8  0.1263  0.0407  0.2799  1
  O  O4  4  0.0107  0.7500  0.9667  1
  O  O5  4  0.1087  0.2500  0.5897  1
  O  O6  4  0.1795  0.7500  0.5761  1
]