data_[Ac2In1Ag3Sn4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.7642]
_cell_length_b [4.7642]
_cell_length_c [11.8547]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Ac2InAg3Sn4]
_chemical_formula_sum '[Ac2 In1 Ag3 Sn4]'
_cell_volume [269.0724]
_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
[
  Ac  Ac0  2  0.0000  0.5000  0.7553  1
  In  In1  1  0.5000  0.5000  0.5000  1
  Ag  Ag2  2  0.0000  0.5000  0.1319  1
  Ag  Ag3  1  0.0000  0.0000  0.5000  1
  Sn  Sn4  2  0.0000  0.5000  0.3583  1
  Sn  Sn5  1  0.0000  0.0000  0.0000  1
  Sn  Sn6  1  0.5000  0.5000  0.0000  1
]