data_[Zr13Co2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.7061]
_cell_length_b [5.9718]
_cell_length_c [9.7639]
_cell_angle_alpha [96.3279]
_cell_angle_beta [98.3165]
_cell_angle_gamma [90.7983]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Zr13Co2]
_chemical_formula_sum '[Zr13 Co2]'
_cell_volume [327.0531]
_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  0.0884  0.9232  0.3200  1.0
  Zr  Zr1  2  0.2043  0.6656  0.5732  1.0
  Zr  Zr2  2  0.2318  0.4160  0.2620  1.0
  Zr  Zr3  2  0.2628  0.4207  0.8998  1.0
  Zr  Zr4  2  0.3888  0.1979  0.5849  1.0
  Zr  Zr5  2  0.4275  0.9213  0.8466  1.0
  Zr  Zr6  1  0.0000  0.0000  0.0000  1.0
  Co  Co7  2  0.2918  0.7245  0.1108  1.0
]