data_[U1H2F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  H  2.2000  0.2500  0.0000
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [3.8940]
_cell_length_b [3.8820]
_cell_length_c [7.6035]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.1778]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [UH2F4]
_chemical_formula_sum '[U1 H2 F4]'
_cell_volume [114.7631]
_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
[
  U  U0  1  0.5000  0.0000  0.0000  1
  H  H1  2  0.0264  0.5000  0.5482  1
  F  F2  2  0.0173  0.0000  0.1609  1
  F  F3  2  0.4825  0.5000  0.8382  1
]