data_[Er4Sc6Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Sc  1.3600  1.6000  0.8850
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.5115]
_cell_length_b [4.4298]
_cell_length_c [7.5272]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.1357]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Er2Sc3Pt2]
_chemical_formula_sum '[Er4 Sc6 Pt4]'
_cell_volume [322.3064]
_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
[
  Er  Er0  4  0.1429  0.0000  0.7981  1.0
  Sc  Sc1  4  0.1328  0.5000  0.4443  1.0
  Sc  Sc2  2  0.0000  0.5000  0.0000  1.0
  Pt  Pt3  4  0.1544  0.0000  0.2050  1.0
]