data_[Sb4Te12Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  Te  2.1000  1.4000  1.2933
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.2697]
_cell_length_b [4.0890]
_cell_length_c [11.7370]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.5883]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SbTe3Pd]
_chemical_formula_sum '[Sb4 Te12 Pd4]'
_cell_volume [576.8497]
_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
[
  Sb  Sb0  4  0.0254  0.0000  0.1372  1
  Te  Te1  4  0.0674  0.5000  0.6703  1
  Te  Te2  4  0.1567  0.0000  0.4027  1
  Te  Te3  4  0.1924  0.5000  0.1255  1
  Pd  Pd4  4  0.2104  0.0000  0.6423  1
]