data_[Li4Mn1P2O8]
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 [5.0248]
_cell_length_b [5.2353]
_cell_length_c [6.2167]
_cell_angle_alpha [93.4958]
_cell_angle_beta [94.2215]
_cell_angle_gamma [97.7111]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li4Mn(PO4)2]
_chemical_formula_sum '[Li4 Mn1 P2 O8]'
_cell_volume [161.2038]
_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  0.1516  0.2932  0.5110  1.0
  Li  Li1  2  0.3663  0.6239  0.2115  1.0
  Mn  Mn2  1  0.0000  0.0000  0.0000  1.0
  P  P3  2  0.3674  0.8181  0.7305  1.0
  O  O4  2  0.2316  0.6914  0.9236  1.0
  O  O5  2  0.2426  0.6722  0.5144  1.0
  O  O6  2  0.2994  0.1020  0.7402  1.0
  O  O7  2  0.3245  0.1991  0.2454  1.0
]