data_Li2YCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.5
_cell_length_b   5.5
_cell_length_c   5.85
_cell_angle_alpha   115.7
_cell_angle_beta   115.7
_cell_angle_gamma   34.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2YCl
_chemical_formula_sum   'Li2 Y1 Cl1'
_cell_volume   89.38
_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  Li1  1  0.74  0.0  0.12  1.0
  Li  Li2  1  0.99  0.0  0.25  1.0
  Y  Y3  1  0.17  0.0  0.19  1.0
  Cl  Cl0  1  0.36  0.0  0.25  1.0

data_Li2YCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.27
_cell_length_b   5.5
_cell_length_c   5.85
_cell_angle_alpha   115.7
_cell_angle_beta   90.0
_cell_angle_gamma   107.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2YCl
_chemical_formula_sum   'Li2 Y1 Cl1'
_cell_volume   89.38
_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  0.01  0.75  1.0
  Li  Li1  1  0.0  0.26  0.88  1.0
  Y  Y2  1  0.0  0.83  0.81  1.0
  Cl  Cl3  1  0.0  0.64  0.75  1.0

Li Li Y Cl