data_ZnCr2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.91
_cell_length_b   4.91
_cell_length_c   4.91
_cell_angle_alpha   144.5
_cell_angle_beta   130.73
_cell_angle_gamma   62.19
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCr2Os
_chemical_formula_sum   'Zn1 Cr2 Os1'
_cell_volume   51.53
_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
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  Cr  Cr0  1  0.5  0.0  0.16  1.0
  Cr  Cr1  1  0.0  0.05  0.05  1.0
  Os  Os2  1  0.0  0.0  0.2  1.0

data_ZnCr2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.99
_cell_length_b   4.09
_cell_length_c   4.91
_cell_angle_alpha   114.64
_cell_angle_beta   107.75
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCr2Os
_chemical_formula_sum   'Zn1 Cr2 Os1'
_cell_volume   51.53
_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
  Zn  Zn0  1  0.0  0.0  0.0  1.0
  Cr  Cr1  1  0.34  0.84  0.34  1.0
  Cr  Cr2  1  0.95  1.0  1.0  1.0
  Os  Os3  1  0.8  0.8  0.8  1.0

Zn Cr Cr Os