data_LaTlW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76
_cell_length_b   5.76
_cell_length_c   5.76
_cell_angle_alpha   144.18
_cell_angle_beta   128.52
_cell_angle_gamma   64.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTlW2
_chemical_formula_sum   'La1 Tl1 W2'
_cell_volume   86.3
_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
  La  La0  1  0.0  0.0  0.0  1.0
  Tl  Tl1  1  0.0  0.0  0.87  1.0
  W  W2  1  0.77  0.0  0.44  1.0
  W  W3  1  0.0  0.5  0.43  1.0

data_LaTlW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   5.0
_cell_length_c   5.76
_cell_angle_alpha   115.74
_cell_angle_beta   107.91
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTlW2
_chemical_formula_sum   'La1 Tl1 W2'
_cell_volume   86.3
_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
  La  La0  1  0.0  0.0  0.0  1.0
  Tl  Tl1  1  0.13  0.13  0.13  1.0
  W  W2  1  0.33  0.56  0.33  1.0
  W  W3  1  0.57  0.07  0.07  1.0

La Tl W W