data_Li5Y
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.2
_cell_length_b   8.32
_cell_length_c   8.32
_cell_angle_alpha   22.21
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Y
_chemical_formula_sum   'Li5 Y1'
_cell_volume   136.24
_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  0.09  1.0
  Li  Li1  1  0.0  0.0  0.97  1.0
  Li  Li2  1  0.0  0.0  0.27  1.0
  Li  Li3  1  0.6  0.0  0.22  1.0
  Li  Li4  1  0.6  0.0  0.5  1.0
  Y  Y5  1  0.6  0.0  0.51  1.0

data_Li5Y
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.21
_cell_length_b   5.2
_cell_length_c   8.32
_cell_angle_alpha   90.0
_cell_angle_beta   101.1
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Y
_chemical_formula_sum   'Li5 Y1'
_cell_volume   136.24
_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  0.03  0.0  0.03  1.0
  Li  Li1  1  0.5  0.6  0.5  1.0
  Li  Li2  1  0.73  0.0  0.73  1.0
  Li  Li3  1  0.78  0.6  0.78  1.0
  Li  Li4  1  0.91  0.0  0.91  1.0
  Y  Y5  1  0.49  0.6  0.49  1.0

Li Li Li Li Li Y