data_[Li2Mn1P4O12]
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 [P-1]
_cell_length_a [5.2614]
_cell_length_b [7.2680]
_cell_length_c [7.3321]
_cell_angle_alpha [108.2533]
_cell_angle_beta [93.6412]
_cell_angle_gamma [109.3348]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li2Mn(PO3)4]
_chemical_formula_sum '[Li2 Mn1 P4 O12]'
_cell_volume [246.8408]
_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  0.3497  0.2791  0.4465  1.0
  Mn  Mn1  1  0.0000  0.0000  0.0000  1.0
  P  P2  2  0.1479  0.5858  0.7771  1.0
  P  P3  2  0.3285  0.7923  0.2057  1.0
  O  O4  2  0.0202  0.2780  0.2091  1.0
  O  O5  2  0.0399  0.6415  0.2294  1.0
  O  O6  2  0.2765  0.9870  0.2079  1.0
  O  O7  2  0.3083  0.5556  0.6176  1.0
  O  O8  2  0.3588  0.6736  0.9838  1.0
  O  O9  2  0.4324  0.1857  0.6603  1.0
]