data_[Tl2In4Ga1Hg2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.6563]
_cell_length_b [6.7955]
_cell_length_c [6.8945]
_cell_angle_alpha [67.0204]
_cell_angle_beta [70.9718]
_cell_angle_gamma [62.8910]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tl2In4GaHg2]
_chemical_formula_sum '[Tl2 In4 Ga1 Hg2]'
_cell_volume [251.3607]
_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
[
  Tl  Tl0  2  0.2419  0.2281  0.1757  1.0
  In  In1  2  0.2109  0.3312  0.6649  1.0
  In  In2  2  0.2849  0.8167  0.6354  1.0
  Ga  Ga3  1  0.0000  0.0000  0.0000  1.0
  Hg  Hg4  2  0.3496  0.6645  0.2150  1.0
]