data_[Pm2Mg3In1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Mg  1.3100  1.5000  0.8600
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.4827]
_cell_length_b [5.1816]
_cell_length_c [8.9674]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Pm2Mg3In]
_chemical_formula_sum '[Pm2 Mg3 In1]'
_cell_volume [161.8246]
_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
[
  Pm  Pm0  1  0.0000  0.0000  0.4942  1
  Pm  Pm1  1  0.0000  0.5000  0.0059  1
  Mg  Mg2  1  0.5000  0.0000  0.1631  1
  Mg  Mg3  1  0.5000  0.0000  0.8311  1
  Mg  Mg4  1  0.5000  0.5000  0.6699  1
  In  In5  1  0.5000  0.5000  0.3357  1
]