data_Mn2TlGa
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25
_cell_length_b   5.25
_cell_length_c   2.99
_cell_angle_alpha   102.19
_cell_angle_beta   102.19
_cell_angle_gamma   111.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2TlGa
_chemical_formula_sum   'Mn2 Tl1 Ga1'
_cell_volume   70.81
_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
  Mn  Mn1  1  0.91  0.17  0.38  1.0
  Mn  Mn2  1  0.91  0.83  0.38  1.0
  Tl  Tl3  1  0.95  0.0  0.0  1.0
  Ga  Ga0  1  0.0  0.0  0.0  1.0

data_Mn2TlGa
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.99
_cell_length_b   5.25
_cell_length_c   5.25
_cell_angle_alpha   111.65
_cell_angle_beta   102.19
_cell_angle_gamma   102.19
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2TlGa
_chemical_formula_sum   'Mn2 Tl1 Ga1'
_cell_volume   70.81
_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
  Mn  Mn0  1  0.38  0.91  0.17  1.0
  Mn  Mn1  1  0.38  0.91  0.83  1.0
  Tl  Tl2  1  0.0  0.95  0.0  1.0
  Ga  Ga3  1  0.0  0.0  0.0  1.0

Mn Mn Tl Ga