data_Cr2GeOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.74
_cell_length_b   3.86
_cell_length_c   5.0
_cell_angle_alpha   90.0
_cell_angle_beta   91.23
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2GeOs
_chemical_formula_sum   'Cr2 Ge1 Os1'
_cell_volume   52.81
_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
  Cr  Cr0  1  0.31  0.93  0.78  1.0
  Cr  Cr1  1  0.32  0.93  0.22  1.0
  Ge  Ge2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.95  0.0  0.5  1.0

data_Cr2GeOs
_symmetry_space_group_name_H-M   Pm
_cell_length_a   2.74
_cell_length_b   5.0
_cell_length_c   3.86
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Cr2GeOs
_chemical_formula_sum   'Cr2 Ge1 Os1'
_cell_volume   52.82
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Cr  Cr0  2  0.31  0.22  0.93  1.0
  Ge  Ge1  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.95  0.5  0.0  1.0

Cr Cr Ge Os
Cr Cr Ge Os 0 3 - + o 0 2 o + + 1 2 o + o 1 3 - + o 