data_AlTl2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.28
_cell_length_b   5.53
_cell_length_c   5.53
_cell_angle_alpha   39.34
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlTl2Os
_chemical_formula_sum   'Al1 Tl2 Os1'
_cell_volume   82.95
_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
  Al  Al0  1  0.0  0.0  0.97  1.0
  Tl  Tl2  1  0.0  0.0  0.47  1.0
  Tl  Tl3  1  0.14  0.0  0.11  1.0
  Os  Os1  1  0.14  0.0  0.21  1.0

data_AlTl2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.72
_cell_length_b   4.28
_cell_length_c   5.53
_cell_angle_alpha   90.0
_cell_angle_beta   109.67
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlTl2Os
_chemical_formula_sum   'Al1 Tl2 Os1'
_cell_volume   82.95
_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
  Al  Al0  1  0.03  0.0  0.03  1.0
  Tl  Tl1  1  0.53  0.0  0.53  1.0
  Tl  Tl2  1  0.89  0.14  0.89  1.0
  Os  Os3  1  0.79  0.14  0.79  1.0

Al Tl Tl Os