[CIF]
data_ZrTlAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.90893332
_cell_length_b   3.90893332
_cell_length_c   6.66002614
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrTlAs2
_chemical_formula_sum   'Zr1 Tl1 As2'
_cell_volume   101.76359902
_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
  As  As0  1  1.95446666  1.95446666  5.73508098  1
  As  As1  1  0.00000000  0.00000000  2.05428446  1
  Tl  Tl2  1  1.95446666  1.95446666  2.73708160  1
  Zr  Zr3  1  0.00000000  0.00000000  6.12361838  1
[/CIF]
