data_[Sr4Ga8B4S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ga  1.8100  1.3000  0.7600
  B  2.0400  0.8500  0.4100
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.5126]
_cell_length_b [11.8952]
_cell_length_c [7.4937]
_cell_angle_alpha [90.0000]
_cell_angle_beta [120.1023]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [SrGa2BS6]
_chemical_formula_sum '[Sr4 Ga8 B4 S24]'
_cell_volume [964.9334]
_cell_formula_units_Z [4]
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
[
  Sr  Sr0  4  0.0000  0.1496  0.2500  1
  Ga  Ga1  8  0.1845  0.4194  0.0764  1
  B  B2  4  0.0000  0.1721  0.7500  1
  S  S3  8  0.0991  0.2458  0.0081  1
  S  S4  8  0.1068  0.0722  0.6959  1
  S  S5  8  0.1280  0.4371  0.3443  1
]