data_[Mn6Sn9Ru6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Sn  1.9600  1.4500  0.8300
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.5029]
_cell_length_b [4.5029]
_cell_length_c [22.2636]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Mn2Sn3Ru2]
_chemical_formula_sum '[Mn6 Sn9 Ru6]'
_cell_volume [390.9380]
_cell_formula_units_Z [3]
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
[
  Mn  Mn0  3  0.0000  0.0000  0.2501  1
  Mn  Mn1  3  0.0000  0.0000  0.7574  1
  Sn  Sn2  3  0.0000  0.0000  0.1330  1
  Sn  Sn3  3  0.0000  0.0000  0.3719  1
  Sn  Sn4  3  0.0000  0.0000  0.6135  1
  Ru  Ru5  3  0.0000  0.0000  0.0067  1
  Ru  Ru6  3  0.0000  0.0000  0.4923  1
]