data_ZrSbOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28
_cell_length_b   5.28
_cell_length_c   4.82
_cell_angle_alpha   108.36
_cell_angle_beta   108.36
_cell_angle_gamma   34.33
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrSbOs2
_chemical_formula_sum   'Zr1 Sb1 Os2'
_cell_volume   71.51
_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
  Zr  Zr3  1  0.12  0.0  0.21  1.0
  Sb  Sb2  1  0.41  0.0  0.26  1.0
  Os  Os0  1  0.43  0.0  0.24  1.0
  Os  Os1  1  0.29  0.0  0.65  1.0

data_ZrSbOs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.12
_cell_length_b   4.82
_cell_length_c   5.28
_cell_angle_alpha   108.36
_cell_angle_beta   107.16
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrSbOs2
_chemical_formula_sum   'Zr1 Sb1 Os2'
_cell_volume   71.51
_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
  Zr  Zr0  1  0.0  0.21  0.12  1.0
  Sb  Sb1  1  0.0  0.26  0.41  1.0
  Os  Os2  1  0.0  0.24  0.43  1.0
  Os  Os3  1  0.0  0.65  0.29  1.0

Zr Sb Os Os
Zr Sb Os Os 0 2 o o o 0 1 o o o 0 3 o o o 1 2 o o o 1 3 o o o 2 3 o o o 