data_[Zr4As2Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  As  2.1800  1.1500  0.6600
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.4368]
_cell_length_b [3.9880]
_cell_length_c [7.5635]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.7964]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Zr2AsRu]
_chemical_formula_sum '[Zr4 As2 Ru2]'
_cell_volume [153.3076]
_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
[
  Zr  Zr0  2  0.2373  0.7500  0.4401  1
  Zr  Zr1  2  0.3125  0.2500  0.0909  1
  As  As2  2  0.1158  0.7500  0.7943  1
  Ru  Ru3  2  0.3734  0.2500  0.7116  1
]