data_[Ta3B2Rh2N3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  B  2.0400  0.8500  0.4100
  Rh  2.2800  1.3500  0.7450
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [3.7871]
_cell_length_b [3.8129]
_cell_length_c [8.5201]
_cell_angle_alpha [78.3503]
_cell_angle_beta [79.1072]
_cell_angle_gamma [89.1732]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Ta3B2Rh2N3]
_chemical_formula_sum '[Ta3 B2 Rh2 N3]'
_cell_volume [118.2885]
_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  0.2453  0.0287  0.9587  1
  Ta  Ta1  1  0.3814  0.3037  0.2457  1
  Ta  Ta2  1  0.6650  0.6149  0.7484  1
  B  B3  1  0.1646  0.1421  0.6808  1
  B  B4  1  0.8288  0.8099  0.3515  1
  Rh  Rh5  1  0.2743  0.7257  0.5123  1
  Rh  Rh6  1  0.7880  0.2522  0.4820  1
  N  N7  1  0.4257  0.5094  0.0005  1
  N  N8  1  0.8355  0.0774  0.8312  1
  N  N9  1  0.8914  0.0358  0.1888  1
]