data_[Ba1Li1Mg2Al1Si3O10F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Li  0.9800  1.4500  0.9000
  Mg  1.3100  1.5000  0.8600
  Al  1.6100  1.2500  0.6750
  Si  1.9000  1.1000  0.5400
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.3075]
_cell_length_b [5.3182]
_cell_length_c [10.2960]
_cell_angle_alpha [95.5599]
_cell_angle_beta [94.6606]
_cell_angle_gamma [119.8260]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [BaLiMg2AlSi3(O5F)2]
_chemical_formula_sum '[Ba1 Li1 Mg2 Al1 Si3 O10 F2]'
_cell_volume [248.1008]
_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
[
  Ba  Ba0  1  0.9911  0.9914  0.9735  1.0
  Li  Li1  1  0.4923  0.4989  0.5058  1.0
  Mg  Mg2  1  0.1681  0.8350  0.5030  1.0
  Mg  Mg3  1  0.8390  0.1706  0.5022  1.0
  Al  Al4  1  0.2584  0.5917  0.7675  1.0
  Si  Si5  1  0.4090  0.7457  0.2294  1.0
  Si  Si6  1  0.5957  0.2592  0.7786  1.0
  Si  Si7  1  0.7420  0.4082  0.2292  1.0
  O  O8  1  0.0533  0.5699  0.1621  1.0
  O  O9  1  0.1942  0.5358  0.5998  1.0
  O  O10  1  0.4244  0.9610  0.8474  1.0
  O  O11  1  0.4650  0.8119  0.3858  1.0
  O  O12  1  0.4873  0.4776  0.8445  1.0
  O  O13  1  0.5355  0.5359  0.1643  1.0
  O  O14  1  0.5414  0.1967  0.6192  1.0
  O  O15  1  0.5696  0.0524  0.1603  1.0
  O  O16  1  0.7990  0.4587  0.3855  1.0
  O  O17  1  0.9424  0.4143  0.8467  1.0
  F  F18  1  0.1183  0.1093  0.3917  1.0
  F  F19  1  0.8740  0.8758  0.6036  1.0
]