data_[Zr13Zn2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.9120]
_cell_length_b [7.8519]
_cell_length_c [8.0435]
_cell_angle_alpha [65.2959]
_cell_angle_beta [81.2973]
_cell_angle_gamma [82.2496]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Zr13Zn2]
_chemical_formula_sum '[Zr13 Zn2]'
_cell_volume [334.2380]
_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  2  0.1071  0.4357  0.7453  1.0
  Zr  Zr1  2  0.2002  0.2005  0.1995  1.0
  Zr  Zr2  2  0.2822  0.6272  0.9757  1.0
  Zr  Zr3  2  0.2928  0.9548  0.6268  1.0
  Zr  Zr4  2  0.3946  0.3968  0.4012  1.0
  Zr  Zr5  2  0.4732  0.8334  0.1827  1.0
  Zr  Zr6  1  0.0000  0.0000  0.0000  1.0
  Zn  Zn7  2  0.0805  0.7725  0.4330  1.0
]