data_SrZn2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.63
_cell_length_b   3.63
_cell_length_c   7.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   97.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrZn2Sb
_chemical_formula_sum   'Sr1 Zn2 Sb1'
_cell_volume   99.62
_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  Sr1  1  0.0  0.0  0.0  1.0
  Zn  Zn2  1  0.39  0.0  0.95  1.0
  Zn  Zn3  1  0.39  0.0  0.68  1.0
  Sb  Sb0  1  0.0  0.0  0.82  1.0

data_SrZn2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.63
_cell_length_b   3.63
_cell_length_c   7.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   97.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrZn2Sb
_chemical_formula_sum   'Sr1 Zn2 Sb1'
_cell_volume   99.62
_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  0.0  1.0
  Zn  Zn1  1  0.39  0.0  0.68  1.0
  Zn  Zn2  1  0.39  0.0  0.95  1.0
  Sb  Sb3  1  0.0  0.0  0.82  1.0

Sr Zn Zn Sb
Sr Zn Zn Sb 0 3 o o - 0 1 o o - 1 3 o o o 1 2 o o o 2 3 o o o 