data_[Ta1Ni5Rh6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Ni  1.9100  1.3500  0.7400
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.5154]
_cell_length_b [5.4339]
_cell_length_c [6.4985]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.1441]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [TaNi5Rh6]
_chemical_formula_sum '[Ta1 Ni5 Rh6]'
_cell_volume [159.2086]
_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
[
  Ta  Ta0  1  0.0000  0.0000  0.0000  1
  Ni  Ni1  2  0.3338  0.5000  0.6741  1
  Ni  Ni2  2  0.3360  0.0000  0.6661  1
  Ni  Ni3  1  0.0000  0.5000  0.0000  1
  Rh  Rh4  4  0.1679  0.2530  0.3373  1
  Rh  Rh5  2  0.5000  0.2548  0.0000  1
]