data_[Ni6Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2]
_cell_length_a [4.6255]
_cell_length_b [8.0014]
_cell_length_c [4.6502]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.7453]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [3]
_chemical_formula_structural [NiPt]
_chemical_formula_sum '[Ni6 Pt6]'
_cell_volume [161.9869]
_cell_formula_units_Z [6]
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
[
  Ni  Ni0  1  0.0000  0.0104  0.0000  1.0
  Ni  Ni1  1  0.0000  0.1714  0.5000  1.0
  Ni  Ni2  1  0.0000  0.3238  0.0000  1.0
  Ni  Ni3  1  0.0000  0.4947  0.5000  1.0
  Ni  Ni4  1  0.5000  0.1681  0.0000  1.0
  Ni  Ni5  1  0.5000  0.6645  0.5000  1.0
  Pt  Pt6  1  0.0000  0.6573  0.0000  1.0
  Pt  Pt7  1  0.0000  0.8348  0.5000  1.0
  Pt  Pt8  1  0.5000  0.0094  0.5000  1.0
  Pt  Pt9  1  0.5000  0.3352  0.5000  1.0
  Pt  Pt10  1  0.5000  0.4916  0.0000  1.0
  Pt  Pt11  1  0.5000  0.8389  0.0000  1.0
]