data_[Zn10Ni2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.9149]
_cell_length_b [2.7111]
_cell_length_c [6.3553]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.3877]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Zn5Ni]
_chemical_formula_sum '[Zn10 Ni2]'
_cell_volume [165.4751]
_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
[
  Zn  Zn0  2  0.0551  0.0000  0.6168  1.0
  Zn  Zn1  2  0.1636  0.5000  0.3268  1.0
  Zn  Zn2  2  0.2148  0.5000  0.9490  1.0
  Zn  Zn3  2  0.3398  0.0000  0.6827  1.0
  Zn  Zn4  2  0.3946  0.0000  0.2625  1.0
  Ni  Ni5  2  0.4987  0.5000  0.9956  1.0
]