data_LiUO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.24
_cell_length_b   4.24
_cell_length_c   4.24
_cell_angle_alpha   87.43
_cell_angle_beta   87.43
_cell_angle_gamma   87.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiUO3
_chemical_formula_sum   'Li1 U1 O3'
_cell_volume   76.04
_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
  Li  Li0  1  0.0  0.0  0.0  1.0
  U  U4  1  0.0  0.0  0.83  1.0
  O  O1  1  0.0  0.69  0.56  1.0
  O  O2  1  0.47  0.15  0.56  1.0
  O  O3  1  0.53  0.15  0.56  1.0

data_LiUO3
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.24
_cell_length_b   4.24
_cell_length_c   4.24
_cell_angle_alpha   87.43
_cell_angle_beta   87.43
_cell_angle_gamma   87.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiUO3
_chemical_formula_sum   'Li1 U1 O3'
_cell_volume   76.04
_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
  Li  Li0  1  0.0  0.0  0.0  1.0
  U  U1  1  0.0  0.0  0.17  1.0
  O  O2  1  0.31  0.0  0.44  1.0
  O  O3  1  0.85  0.47  0.44  1.0
  O  O4  1  0.85  0.53  0.44  1.0

Li U O O O