data_ZrScOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.97
_cell_length_b   5.97
_cell_length_c   5.97
_cell_angle_alpha   148.16
_cell_angle_beta   148.16
_cell_angle_gamma   45.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrScOs
_chemical_formula_sum   'Zr1 Sc1 Os1'
_cell_volume   59.0
_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
  Zr  Zr2  1  0.0  0.0  0.08  1.0
  Sc  Sc1  1  0.0  0.0  0.91  1.0
  Os  Os0  1  0.0  0.0  0.02  1.0

data_ZrScOs
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.63
_cell_length_b   4.63
_cell_length_c   5.97
_cell_angle_alpha   90.0
_cell_angle_beta   112.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ZrScOs
_chemical_formula_sum   'Zr2 Sc2 Os2'
_cell_volume   117.99
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Zr  Zr0  2  0.0  0.0  0.92  1.0
  Sc  Sc1  2  0.0  0.0  0.09  1.0
  Os  Os2  2  0.0  0.0  0.98  1.0

Zr Sc Os
Zr Sc Os 0 2 o o o 1 2 o o + 