data_[Sc4Mn4Zn2Ru10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Mn  1.5500  1.4000  0.6483
  Zn  1.6500  1.3500  0.8800
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [9.5512]
_cell_length_b [9.5512]
_cell_length_c [3.3419]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Sc2Mn2ZnRu5]
_chemical_formula_sum '[Sc4 Mn4 Zn2 Ru10]'
_cell_volume [304.8638]
_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
[
  Sc  Sc0  4  0.1706  0.3294  0.0000  1
  Mn  Mn1  4  0.1318  0.6318  0.0000  1
  Zn  Zn2  2  0.0000  0.0000  0.0000  1
  Ru  Ru3  8  0.0670  0.7970  0.5000  1
  Ru  Ru4  2  0.0000  0.5000  0.5000  1
]