# generated using pymatgen
data_MoO2F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.51239084
_cell_length_b   5.53609299
_cell_length_c   7.49050704
_cell_angle_alpha   89.99932847
_cell_angle_beta   90.00255236
_cell_angle_gamma   89.99983094
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoO2F
_chemical_formula_sum   'Mo4 O8 F4'
_cell_volume   228.58861454
_cell_formula_units_Z   4
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
  Mo  Mo0  1  0.49881855  0.03047051  0.99968857  1.0
  Mo  Mo1  1  0.99878264  0.46963797  0.00031202  1.0
  Mo  Mo2  1  0.00118219  0.53037284  0.50030607  1.0
  Mo  Mo3  1  0.50121410  0.96954450  0.49968338  1.0
  O  O4  1  0.25399694  0.74636833  0.50089597  1.0
  O  O5  1  0.75401982  0.75359704  0.49908241  1.0
  O  O6  1  0.24598449  0.24641302  0.99908111  1.0
  O  O7  1  0.74592833  0.25372693  0.00089952  1.0
  O  O8  1  0.00158225  0.49992160  0.25012541  1.0
  O  O9  1  0.50175153  0.99998676  0.74988552  1.0
  O  O10  1  0.49842941  0.99995147  0.24984610  1.0
  O  O11  1  0.99826568  0.50003864  0.75014325  1.0
  F  F12  1  0.74537285  0.25449195  0.49894208  1.0
  F  F13  1  0.24533534  0.24537179  0.50103223  1.0
  F  F14  1  0.75468818  0.75464421  0.00111818  1.0
  F  F15  1  0.25464670  0.74546045  0.99895616  1.0