data_[K1Tm4In4Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Tm  1.2500  1.7500  1.0950
  In  1.7800  1.5500  0.9400
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [8.4306]
_cell_length_b [3.6094]
_cell_length_c [9.4207]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.1929]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [KTm4(In2Ru)2]
_chemical_formula_sum '[K1 Tm4 In4 Ru2]'
_cell_volume [286.2253]
_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
[
  K  K0  1  0.5000  0.0000  0.0000  1
  Tm  Tm1  2  0.1658  0.5000  0.1827  1
  Tm  Tm2  2  0.2040  0.5000  0.5921  1
  In  In3  2  0.1340  0.0000  0.8807  1
  In  In4  2  0.4242  0.0000  0.3585  1
  Ru  Ru5  2  0.0676  0.0000  0.3742  1
]