data_[Zr4Ti10Co4Ni2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Ti  1.5400  1.4000  0.8517
  Co  1.8800  1.3500  0.7683
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.3527]
_cell_length_b [10.3527]
_cell_length_c [3.0396]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Zr2Ti5Co2Ni]
_chemical_formula_sum '[Zr4 Ti10 Co4 Ni2]'
_cell_volume [325.7786]
_cell_formula_units_Z [2]
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  4  0.1773  0.3227  0.0000  1
  Ti  Ti1  8  0.0561  0.7999  0.5000  1
  Ti  Ti2  2  0.0000  0.5000  0.5000  1
  Co  Co3  4  0.1302  0.6302  0.0000  1
  Ni  Ni4  2  0.0000  0.0000  0.0000  1
]