data_[Zr4Ge1Sb7]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Ge  2.0100  1.2500  0.7700
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [7.3808]
_cell_length_b [3.9931]
_cell_length_c [9.6827]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.4492]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Zr4GeSb7]
_chemical_formula_sum '[Zr4 Ge1 Sb7]'
_cell_volume [285.3651]
_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
[
  Zr  Zr0  1  0.2416  0.0000  0.6605  1.0
  Zr  Zr1  1  0.2601  0.5000  0.1652  1.0
  Zr  Zr2  1  0.7364  0.0000  0.8317  1.0
  Zr  Zr3  1  0.7582  0.5000  0.3414  1.0
  Ge  Ge4  1  0.6319  0.0000  0.5456  1.0
  Sb  Sb5  1  0.0690  0.0000  0.3548  1.0
  Sb  Sb6  1  0.1314  0.0000  0.9532  1.0
  Sb  Sb7  1  0.3858  0.5000  0.4608  1.0
  Sb  Sb8  1  0.4318  0.5000  0.8498  1.0
  Sb  Sb9  1  0.5673  0.0000  0.1496  1.0
  Sb  Sb10  1  0.8658  0.5000  0.0460  1.0
  Sb  Sb11  1  0.9207  0.5000  0.6413  1.0
]