# generated using pymatgen
data_Cs2LiMoF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.22108700
_cell_length_b   6.22108779
_cell_length_c   6.22108781
_cell_angle_alpha   60.00000246
_cell_angle_beta   59.99999901
_cell_angle_gamma   59.99999886
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cs2LiMoF6
_chemical_formula_sum   'Cs2 Li1 Mo1 F6'
_cell_volume   170.24875296
_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
  Cs  Cs0  1  0.25000000  0.25000000  0.25000000  1
  Cs  Cs1  1  0.75000000  0.75000000  0.75000000  1
  Li  Li2  1  0.50000000  0.50000000  0.50000000  1
  Mo  Mo3  1  0.00000000  0.00000000  0.00000000  1
  F  F4  1  0.23895100  0.76104900  0.23895100  1
  F  F5  1  0.76104900  0.76104900  0.23895100  1
  F  F6  1  0.76104900  0.23895100  0.76104900  1
  F  F7  1  0.76104900  0.23895100  0.23895100  1
  F  F8  1  0.23895100  0.76104900  0.76104900  1
  F  F9  1  0.23895100  0.23895100  0.76104900  1
