data_[Ta6Rh10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.1573]
_cell_length_b [7.1215]
_cell_length_c [7.7509]
_cell_angle_alpha [86.5535]
_cell_angle_beta [71.5923]
_cell_angle_gamma [71.3570]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Ta3Rh5]
_chemical_formula_sum '[Ta6 Rh10]'
_cell_volume [255.6724]
_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
[
  Ta  Ta0  1  0.1479  0.5321  0.1462  1
  Ta  Ta1  1  0.2886  0.9351  0.9755  1
  Ta  Ta2  1  0.3367  0.8704  0.5162  1
  Ta  Ta3  1  0.6092  0.2085  0.5275  1
  Ta  Ta4  1  0.7738  0.9439  0.0067  1
  Ta  Ta5  1  0.7952  0.5264  0.8633  1
  Rh  Rh6  1  0.0221  0.1816  0.7138  1
  Rh  Rh7  1  0.2341  0.5181  0.4780  1
  Rh  Rh8  1  0.2710  0.6456  0.7943  1
  Rh  Rh9  1  0.2819  0.1571  0.2873  1
  Rh  Rh10  1  0.4210  0.2565  0.8855  1
  Rh  Rh11  1  0.5508  0.6855  0.1977  1
  Rh  Rh12  1  0.7512  0.5230  0.4786  1
  Rh  Rh13  1  0.7772  0.8540  0.6758  1
  Rh  Rh14  1  0.8016  0.2782  0.1420  1
  Rh  Rh15  1  0.9376  0.8906  0.3118  1
]