data_[La2Pm6Ho4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pm  1.1300  1.8500  1.1100
  Ho  1.2300  1.7500  1.0410
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.9288]
_cell_length_b [12.0329]
_cell_length_c [6.9383]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5643]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LaPm3(HoS3)2]
_chemical_formula_sum '[La2 Pm6 Ho4 S12]'
_cell_volume [545.0810]
_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
[
  La  La0  2  0.0000  0.0000  0.0000  1
  Pm  Pm1  4  0.0000  0.1618  0.5000  1
  Pm  Pm2  2  0.0000  0.5000  0.5000  1
  Ho  Ho3  4  0.0000  0.3331  0.0000  1
  S  S4  8  0.2456  0.3271  0.7555  1
  S  S5  4  0.2337  0.5000  0.2393  1
]