data_FeNi2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.86
_cell_length_b   4.06
_cell_length_c   4.77
_cell_angle_alpha   90.0
_cell_angle_beta   100.51
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi2Sb
_chemical_formula_sum   'Fe1 Ni2 Sb1'
_cell_volume   54.51
_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
  Fe  Fe0  1  0.0  0.0  0.0  1.0
  Ni  Ni1  1  0.9  0.03  0.1  1.0
  Ni  Ni2  1  0.09  0.03  0.59  1.0
  Sb  Sb3  1  1.0  0.0  0.34  1.0

data_FeNi2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.86
_cell_length_b   4.06
_cell_length_c   4.77
_cell_angle_alpha   90.0
_cell_angle_beta   100.51
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi2Sb
_chemical_formula_sum   'Fe1 Ni2 Sb1'
_cell_volume   54.51
_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
  Fe  Fe0  1  0.0  0.0  0.0  1.0
  Ni  Ni1  1  0.09  0.03  0.59  1.0
  Ni  Ni2  1  0.9  0.03  0.1  1.0
  Sb  Sb3  1  1.0  0.0  0.34  1.0

Fe Ni Ni Sb