data_[Cs2Tc2Sn2Hg2As2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tc  1.9000  1.3500  0.7417
  Sn  1.9600  1.4500  0.8300
  Hg  2.0000  1.5000  1.2450
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [I4mm]
_cell_length_a [3.4446]
_cell_length_b [3.4446]
_cell_length_c [22.3061]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [107]
_chemical_formula_structural [CsTcSnHgAs]
_chemical_formula_sum '[Cs2 Tc2 Sn2 Hg2 As2]'
_cell_volume [264.6728]
_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
[
  Cs  Cs0  2  0.0000  0.0000  0.2374  1
  Tc  Tc1  2  0.0000  0.0000  0.8776  1
  Sn  Sn2  2  0.0000  0.0000  0.0044  1
  Hg  Hg3  2  0.0000  0.0000  0.6086  1
  As  As4  2  0.0000  0.0000  0.4045  1
]