data_[Li4Mn12P12H8O48]
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
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.0816]
_cell_length_b [12.6083]
_cell_length_c [6.6857]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.0143]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiMn3P3(HO6)2]
_chemical_formula_sum '[Li4 Mn12 P12 H8 O48]'
_cell_volume [922.8991]
_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  0.0000  0.0047  0.7500  1
  Mn  Mn1  8  0.2059  0.1608  0.1202  1
  Mn  Mn2  4  0.0000  0.2898  0.2500  1
  P  P3  8  0.2067  0.1089  0.6036  1
  P  P4  4  0.0000  0.3236  0.7500  1
  H  H5  8  0.1271  0.4995  0.3127  1
  O  O6  8  0.0370  0.2538  0.9604  1
  O  O7  8  0.1076  0.3957  0.7632  1
  O  O8  8  0.1348  0.0036  0.5744  1
  O  O9  8  0.1492  0.1723  0.3852  1
  O  O10  8  0.1548  0.4166  0.3531  1
  O  O11  8  0.2094  0.1746  0.7985  1
]