# generated using pymatgen
data_CrMoF6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.46018193
_cell_length_b   5.46018199
_cell_length_c   5.46018140
_cell_angle_alpha   54.85329768
_cell_angle_beta   54.85329244
_cell_angle_gamma   54.85330478
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrMoF6
_chemical_formula_sum   'Cr1 Mo1 F6'
_cell_volume   101.31598665
_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
  Mo  Mo1  1  0.50000000  0.50000000  0.50000000  1.0
  F  F2  1  0.89794104  0.62238010  0.23908953  1.0
  F  F3  1  0.10205896  0.37761990  0.76091047  1.0
  F  F4  1  0.76091047  0.10205896  0.37761990  1.0
  F  F5  1  0.23908953  0.89794104  0.62238010  1.0
  F  F6  1  0.62238010  0.23908953  0.89794104  1.0
  F  F7  1  0.37761990  0.76091047  0.10205896  1.0