data_AlNiSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.04
_cell_length_b   4.38
_cell_length_c   4.85
_cell_angle_alpha   90.0
_cell_angle_beta   108.67
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNiSb2
_chemical_formula_sum   'Al1 Ni1 Sb2'
_cell_volume   81.27
_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  0.81  0.0  0.38  1.0
  Ni  Ni1  1  0.2  0.19  0.38  1.0
  Sb  Sb2  1  0.85  0.0  0.24  1.0
  Sb  Sb3  1  0.31  0.19  0.49  1.0

data_AlNiSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.04
_cell_length_b   4.38
_cell_length_c   4.85
_cell_angle_alpha   90.0
_cell_angle_beta   108.67
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNiSb2
_chemical_formula_sum   'Al1 Ni1 Sb2'
_cell_volume   81.27
_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  0.81  0.0  0.38  1.0
  Ni  Ni1  1  0.2  0.19  0.38  1.0
  Sb  Sb2  1  0.31  0.19  0.49  1.0
  Sb  Sb3  1  0.85  0.0  0.24  1.0

Al Ni Sb Sb