# generated using pymatgen
data_CrHgF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.58753464
_cell_length_b   5.58173905
_cell_length_c   5.58286394
_cell_angle_alpha   54.31452243
_cell_angle_beta   54.28982014
_cell_angle_gamma   54.37216422
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrHgF6
_chemical_formula_sum   'Cr1 Hg1 F6'
_cell_volume   106.82191339
_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
  Cr  Cr0  1  -0.00000000  -0.00000000  0.00000000  1.0
  Hg  Hg1  1  0.50000000  0.50000000  0.50000000  1.0
  F  F2  1  0.94992165  0.20470738  0.62199961  1.0
  F  F3  1  0.20490421  0.62164537  0.94956784  1.0
  F  F4  1  0.37840728  0.05093570  0.79455271  1.0
  F  F5  1  0.79509579  0.37835463  0.05043216  1.0
  F  F6  1  0.05007835  0.79529262  0.37800039  1.0
  F  F7  1  0.62159272  0.94906430  0.20544729  1.0