# generated using pymatgen
data_CuMoF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.42680693
_cell_length_b   5.42680822
_cell_length_c   5.42680656
_cell_angle_alpha   55.41292438
_cell_angle_beta   55.41290216
_cell_angle_gamma   55.41287494
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuMoF6
_chemical_formula_sum   'Cu1 Mo1 F6'
_cell_volume   100.96977159
_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
  Cu  Cu0  1  -0.00000000  0.00000000  0.00000000  1.0
  Mo  Mo1  1  0.50000000  0.50000000  0.50000000  1.0
  F  F2  1  0.39987367  0.11425775  0.74470312  1.0
  F  F3  1  0.60012633  0.88574225  0.25529688  1.0
  F  F4  1  0.88574125  0.25529688  0.60012533  1.0
  F  F5  1  0.11425875  0.74470312  0.39987467  1.0
  F  F6  1  0.74470312  0.39987467  0.11425875  1.0
  F  F7  1  0.25529688  0.60012533  0.88574125  1.0