data_MnGe2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.91
_cell_length_b   4.63
_cell_length_c   4.26
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnGe2Os
_chemical_formula_sum   'Mn1 Ge2 Os1'
_cell_volume   57.46
_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
  Mn  Mn2  1  0.0  0.0  0.04  1.0
  Ge  Ge0  1  0.46  0.0  0.16  1.0
  Ge  Ge1  1  0.0  0.32  0.28  1.0
  Os  Os3  1  0.46  0.32  0.17  1.0

data_MnGe2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.91
_cell_length_b   4.26
_cell_length_c   4.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnGe2Os
_chemical_formula_sum   'Mn1 Ge2 Os1'
_cell_volume   57.46
_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
  Mn  Mn0  1  0.0  0.96  0.0  1.0
  Ge  Ge1  1  0.0  0.72  0.68  1.0
  Ge  Ge2  1  0.54  0.84  0.0  1.0
  Os  Os3  1  0.54  0.83  0.68  1.0

Mn Ge Ge Os
Mn Ge Ge Os 0 1 - o o 0 1 o o o 1 3 o o o 2 3 - o o 2 3 o o o 