data_[Re10Ni2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Re  1.9000  1.3500  0.7125
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.0009]
_cell_length_b [2.7811]
_cell_length_c [6.4524]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5748]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Re5Ni]
_chemical_formula_sum '[Re10 Ni2]'
_cell_volume [173.6895]
_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
[
  Re  Re0  2  0.0534  0.0000  0.6160  1.0
  Re  Re1  2  0.1642  0.5000  0.3312  1.0
  Re  Re2  2  0.2196  0.5000  0.9464  1.0
  Re  Re3  2  0.3381  0.0000  0.6676  1.0
  Re  Re4  2  0.3919  0.0000  0.2708  1.0
  Ni  Ni5  2  0.4994  0.5000  0.0013  1.0
]