data_[Li2Ca2Zn4F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ca  1.0000  1.8000  1.1400
  Zn  1.6500  1.3500  0.8800
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0981]
_cell_length_b [6.6822]
_cell_length_c [6.5172]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.8430]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiCaZn2F8]
_chemical_formula_sum '[Li2 Ca2 Zn4 F16]'
_cell_volume [308.7363]
_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  0.0000  0.0000  0.0000  1.0
  Ca  Ca1  2  0.0000  0.0000  0.5000  1.0
  Zn  Zn2  4  0.0014  0.5000  0.2361  1.0
  F  F3  8  0.0010  0.2091  0.7684  1.0
  F  F4  4  0.1783  0.5000  0.4882  1.0
  F  F5  4  0.1923  0.5000  0.9944  1.0
]