data_[Pm2Y6In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Y  1.2200  1.8000  1.0400
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [5.2557]
_cell_length_b [9.8597]
_cell_length_c [6.7624]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [PmY3In2]
_chemical_formula_sum '[Pm2 Y6 In4]'
_cell_volume [350.4269]
_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
[
  Pm  Pm0  2  0.5000  0.4633  0.5331  1
  Y  Y1  2  0.0000  0.0392  0.4695  1
  Y  Y2  2  0.0000  0.3177  0.8115  1
  Y  Y3  2  0.5000  0.1778  0.1878  1
  In  In4  2  0.0000  0.3538  0.2836  1
  In  In5  2  0.5000  0.1420  0.7145  1
]