data_[Li6Mg2P2C2O14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mg  1.3100  1.5000  0.8600
  P  2.1900  1.0000  0.5500
  C  2.5500  0.7000  0.3000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1]
_cell_length_a [5.0675]
_cell_length_b [6.4249]
_cell_length_c [8.3151]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.1559]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [4]
_chemical_formula_structural [Li3MgPCO7]
_chemical_formula_sum '[Li6 Mg2 P2 C2 O14]'
_cell_volume [270.5319]
_cell_formula_units_Z [2]
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  0.0174  0.0021  0.9996  1
  Li  Li1  2  0.4468  0.0569  0.5021  1
  Li  Li2  2  0.4562  0.3168  0.8279  1
  Mg  Mg3  2  0.0233  0.7513  0.7195  1
  P  P4  2  0.0365  0.7527  0.3328  1
  C  C5  2  0.4972  0.2596  0.1395  1
  O  O6  2  0.0096  0.0565  0.7703  1
  O  O7  2  0.0895  0.4378  0.7658  1
  O  O8  2  0.1091  0.2255  0.5072  1
  O  O9  2  0.2512  0.2308  0.0948  1
  O  O10  2  0.3245  0.7695  0.9690  1
  O  O11  2  0.3363  0.7924  0.3672  1
  O  O12  2  0.4347  0.7734  0.7085  1
]