data_[Sr2Tl4In1Hg2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.7135]
_cell_length_b [6.7991]
_cell_length_c [7.8614]
_cell_angle_alpha [85.2476]
_cell_angle_beta [65.8649]
_cell_angle_gamma [60.4809]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Sr2Tl4InHg2]
_chemical_formula_sum '[Sr2 Tl4 In1 Hg2]'
_cell_volume [281.7661]
_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
[
  Sr  Sr0  2  0.4325  0.3037  0.8453  1.0
  Tl  Tl1  2  0.0534  0.7727  0.6315  1.0
  Tl  Tl2  2  0.4548  0.2216  0.3645  1.0
  In  In3  1  0.0000  0.0000  0.0000  1.0
  Hg  Hg4  2  0.0400  0.6494  0.2541  1.0
]