# generated using pymatgen
data_CaPtF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.80199970
_cell_length_b   5.80199994
_cell_length_c   5.80200072
_cell_angle_alpha   53.15730875
_cell_angle_beta   53.15730077
_cell_angle_gamma   53.15730590
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaPtF6
_chemical_formula_sum   'Ca1 Pt1 F6'
_cell_volume   115.96896756
_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
  Ca  Ca0  1  0.50000000  0.50000000  0.50000000  1.0
  Pt  Pt1  1  -0.00000000  0.00000000  0.00000000  1.0
  F  F2  1  0.38285761  0.07137991  0.77755345  1.0
  F  F3  1  0.07137991  0.77755345  0.38285761  1.0
  F  F4  1  0.22244655  0.61714239  0.92862009  1.0
  F  F5  1  0.92862009  0.22244655  0.61714239  1.0
  F  F6  1  0.61714239  0.92862009  0.22244655  1.0
  F  F7  1  0.77755345  0.38285761  0.07137991  1.0