data_[Sr6Sb6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [15.5898]
_cell_length_b [4.5629]
_cell_length_c [8.3758]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0878]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [SrSb]
_chemical_formula_sum '[Sr6 Sb6]'
_cell_volume [569.4995]
_cell_formula_units_Z [6]
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  2  0.0365  0.0000  0.0358  1
  Sr  Sr1  2  0.2909  0.5000  0.9370  1
  Sr  Sr2  2  0.4569  0.5000  0.4940  1
  Sb  Sb3  2  0.0790  0.5000  0.7761  1
  Sb  Sb4  2  0.3904  0.0000  0.7346  1
  Sb  Sb5  2  0.4129  0.0000  0.1892  1
]