data_[Nd8In2Ru4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  In  1.7800  1.5500  0.9400
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.1553]
_cell_length_b [7.2209]
_cell_length_c [8.1655]
_cell_angle_alpha [107.0346]
_cell_angle_beta [104.2341]
_cell_angle_gamma [102.8173]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Nd4InRu2]
_chemical_formula_sum '[Nd8 In2 Ru4]'
_cell_volume [370.8240]
_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
[
  Nd  Nd0  1  0.0942  0.7322  0.6197  1.0
  Nd  Nd1  1  0.1897  0.3541  0.8545  1.0
  Nd  Nd2  1  0.2932  0.0877  0.4562  1.0
  Nd  Nd3  1  0.5310  0.8629  0.0954  1.0
  Nd  Nd4  1  0.5528  0.4541  0.2847  1.0
  Nd  Nd5  1  0.6468  0.8865  0.6843  1.0
  Nd  Nd6  1  0.6997  0.4478  0.8403  1.0
  Nd  Nd7  1  0.9682  0.3174  0.1933  1.0
  In  In8  1  0.0567  0.8856  0.0202  1.0
  In  In9  1  0.8245  0.1711  0.4858  1.0
  Ru  Ru10  1  0.2248  0.6618  0.2260  1.0
  Ru  Ru11  1  0.3425  0.4951  0.5629  1.0
  Ru  Ru12  1  0.4438  0.1141  0.8871  1.0
  Ru  Ru13  1  0.8822  0.7796  0.2896  1.0
]