data_[Y4Ga1Te1S2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Ga  1.8100  1.3000  0.7600
  Te  2.1000  1.4000  1.2933
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.1663]
_cell_length_b [3.9936]
_cell_length_c [7.2314]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.4653]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Y4GaTeS2]
_chemical_formula_sum '[Y4 Ga1 Te1 S2]'
_cell_volume [196.3016]
_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  2  0.2633  0.5000  0.2459  1.0
  Y  Y1  2  0.2715  0.0000  0.7767  1.0
  Ga  Ga2  1  0.0000  0.0000  0.0000  1.0
  Te  Te3  1  0.0000  0.5000  0.5000  1.0
  S  S4  1  0.5000  0.0000  0.5000  1.0
  S  S5  1  0.5000  0.5000  0.0000  1.0
]