data_Sr2TlIn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.92
_cell_length_b   6.92
_cell_length_c   6.92
_cell_angle_alpha   145.27
_cell_angle_beta   131.52
_cell_angle_gamma   61.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2TlIn
_chemical_formula_sum   'Sr2 Tl1 In1'
_cell_volume   139.67
_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  Sr1  1  0.0  0.84  0.73  1.0
  Sr  Sr2  1  0.0  0.0  0.22  1.0
  Tl  Tl3  1  0.0  0.84  0.32  1.0
  In  In0  1  0.0  0.0  0.61  1.0

data_Sr2TlIn
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.13
_cell_length_b   5.68
_cell_length_c   6.92
_cell_angle_alpha   114.24
_cell_angle_beta   107.36
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2TlIn
_chemical_formula_sum   'Sr2 Tl1 In1'
_cell_volume   139.67
_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  1  0.0  0.22  0.22  1.0
  Sr  Sr1  1  0.16  0.89  0.89  1.0
  Tl  Tl2  1  0.16  0.48  0.48  1.0
  In  In3  1  0.0  0.61  0.61  1.0

Sr Sr Tl In