data_NbAlRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86
_cell_length_b   4.86
_cell_length_c   4.86
_cell_angle_alpha   147.34
_cell_angle_beta   128.4
_cell_angle_gamma   62.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbAlRe
_chemical_formula_sum   'Nb1 Al1 Re1'
_cell_volume   48.07
_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
  Nb  Nb1  1  0.0  0.0  0.53  1.0
  Al  Al0  1  0.0  0.0  0.27  1.0
  Re  Re2  1  0.0  0.0  0.83  1.0

data_NbAlRe
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   4.23
_cell_length_c   4.86
_cell_angle_alpha   115.8
_cell_angle_beta   106.33
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbAlRe
_chemical_formula_sum   'Nb1 Al1 Re1'
_cell_volume   48.07
_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
  Nb  Nb0  1  0.47  0.47  0.47  1.0
  Al  Al1  1  0.73  0.73  0.73  1.0
  Re  Re2  1  0.17  0.17  0.17  1.0

Nb Al Re