data_LaTaRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.9
_cell_length_b   7.66
_cell_length_c   3.02
_cell_angle_alpha   83.27
_cell_angle_beta   74.42
_cell_angle_gamma   22.31
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTaRe
_chemical_formula_sum   'La1 Ta1 Re1'
_cell_volume   62.43
_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  0.65  0.53  0.12  1.0
  Ta  Ta2  1  0.65  0.53  0.67  1.0
  Re  Re1  1  0.65  0.53  0.19  1.0

data_LaTaRe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.29
_cell_length_b   14.97
_cell_length_c   3.02
_cell_angle_alpha   90.0
_cell_angle_beta   123.04
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LaTaRe
_chemical_formula_sum   'La2 Ta2 Re2'
_cell_volume   124.87
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.12  0.0  0.77  1.0
  Ta  Ta1  2  0.17  0.5  0.31  1.0
  Re  Re2  2  0.19  0.0  0.83  1.0

La Ta Re