data_[Nb4Zn5Co2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nb  1.6000  1.4500  0.8200
  Zn  1.6500  1.3500  0.8800
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.7819]
_cell_length_b [2.7705]
_cell_length_c [8.9341]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.0210]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Nb4Zn5Co2]
_chemical_formula_sum '[Nb4 Zn5 Co2]'
_cell_volume [167.6325]
_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
[
  Nb  Nb0  2  0.1474  0.5000  0.8832  1
  Nb  Nb1  2  0.2550  0.5000  0.4526  1
  Zn  Zn2  2  0.2086  0.0000  0.1679  1
  Zn  Zn3  2  0.4343  0.0000  0.7050  1
  Zn  Zn4  1  0.5000  0.0000  0.0000  1
  Co  Co5  2  0.0583  0.0000  0.6401  1
]