data_[Er2In2Pd1Pt3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  In  1.7800  1.5500  0.9400
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [4.5798]
_cell_length_b [4.5798]
_cell_length_c [8.9557]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [Er2In2PdPt3]
_chemical_formula_sum '[Er2 In2 Pd1 Pt3]'
_cell_volume [162.6742]
_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
[
  Er  Er0  1  0.0000  0.0000  0.7483  1
  Er  Er1  1  0.3333  0.6667  0.2539  1
  In  In2  1  0.6667  0.3333  0.4992  1
  In  In3  1  0.6667  0.3333  0.9988  1
  Pd  Pd4  1  0.0000  0.0000  0.0888  1
  Pt  Pt5  1  0.0000  0.0000  0.4053  1
  Pt  Pt6  1  0.3333  0.6667  0.5938  1
  Pt  Pt7  1  0.3333  0.6667  0.9118  1
]