data_Y2ReCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64
_cell_length_b   5.64
_cell_length_c   5.64
_cell_angle_alpha   142.27
_cell_angle_beta   111.03
_cell_angle_gamma   81.39
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2ReCl
_chemical_formula_sum   'Y2 Re1 Cl1'
_cell_volume   99.47
_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
  Y  Y2  1  0.82  0.0  0.09  1.0
  Y  Y3  1  0.0  0.19  0.19  1.0
  Re  Re1  1  0.0  0.0  0.27  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_Y2ReCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.65
_cell_length_b   5.64
_cell_length_c   5.64
_cell_angle_alpha   68.97
_cell_angle_beta   71.13
_cell_angle_gamma   71.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2ReCl
_chemical_formula_sum   'Y2 Re1 Cl1'
_cell_volume   99.47
_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
  Y  Y0  1  0.0  0.18  0.09  1.0
  Y  Y1  1  0.19  0.0  0.99  1.0
  Re  Re2  1  0.0  0.0  0.27  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Y Y Re Cl