# generated using pymatgen
data_YCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.62553535
_cell_length_b   9.62553535
_cell_length_c   9.62553560
_cell_angle_alpha   22.45433794
_cell_angle_beta   22.45433794
_cell_angle_gamma   22.45433782
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YCl
_chemical_formula_sum   'Y2 Cl2'
_cell_volume   114.11227939
_cell_formula_units_Z   2
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  0.21622693  0.21622693  0.21622693  1.0
  Y  Y1  1  0.78377307  0.78377307  0.78377307  1.0
  Cl  Cl2  1  0.38952443  0.38952443  0.38952443  1.0
  Cl  Cl3  1  0.61047557  0.61047557  0.61047557  1.0