data_SrFeSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54
_cell_length_b   5.54
_cell_length_c   5.54
_cell_angle_alpha   135.93
_cell_angle_beta   110.08
_cell_angle_gamma   86.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrFeSb2
_chemical_formula_sum   'Sr1 Fe1 Sb2'
_cell_volume   106.51
_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
  Sr  Sr3  1  0.0  0.0  0.04  1.0
  Fe  Fe0  1  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.0  0.17  0.56  1.0
  Sb  Sb2  1  0.08  0.0  0.48  1.0

data_SrFeSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.16
_cell_length_b   5.54
_cell_length_c   5.54
_cell_angle_alpha   69.92
_cell_angle_beta   67.96
_cell_angle_gamma   67.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrFeSb2
_chemical_formula_sum   'Sr1 Fe1 Sb2'
_cell_volume   106.51
_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
  Sr  Sr0  1  0.0  0.0  0.04  1.0
  Fe  Fe1  1  0.0  0.0  0.0  1.0
  Sb  Sb2  1  0.0  0.92  0.48  1.0
  Sb  Sb3  1  0.17  -0.0  0.38  1.0

Sr Fe Sb Sb