data_[Li8Mn4P16O48]
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 [9.5757]
_cell_length_b [9.3763]
_cell_length_c [10.2583]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Li2Mn(PO3)4]
_chemical_formula_sum '[Li8 Mn4 P16 O48]'
_cell_volume [921.0390]
_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  8  0.0036  0.1026  0.6709  1
  Mn  Mn1  4  0.0120  0.2500  0.3020  1
  P  P2  8  0.2083  0.5374  0.8894  1
  P  P3  4  0.1954  0.7500  0.1064  1
  P  P4  4  0.2279  0.2500  0.0167  1
  O  O5  8  0.1157  0.5716  0.7751  1
  O  O6  8  0.1358  0.0596  0.3791  1
  O  O7  8  0.1487  0.6161  0.0175  1
  O  O8  8  0.1732  0.1239  0.9235  1
  O  O9  4  0.0999  0.7500  0.2217  1
  O  O10  4  0.1145  0.7500  0.5210  1
  O  O11  4  0.1457  0.2500  0.1392  1
  O  O12  4  0.1494  0.2500  0.6254  1
]