data_HfMn2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.06
_cell_length_b   5.06
_cell_length_c   5.06
_cell_angle_alpha   145.8
_cell_angle_beta   128.45
_cell_angle_gamma   63.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfMn2Os
_chemical_formula_sum   'Hf1 Mn2 Os1'
_cell_volume   56.24
_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
  Hf  Hf0  1  0.0  0.0  0.51  1.0
  Mn  Mn1  1  0.49  0.0  0.22  1.0
  Mn  Mn2  1  0.0  0.0  0.03  1.0
  Os  Os3  1  0.49  0.0  0.16  1.0

data_HfMn2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.97
_cell_length_b   4.4
_cell_length_c   5.06
_cell_angle_alpha   115.77
_cell_angle_beta   107.1
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfMn2Os
_chemical_formula_sum   'Hf1 Mn2 Os1'
_cell_volume   56.24
_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
  Hf  Hf0  1  0.49  0.49  0.49  1.0
  Mn  Mn1  1  0.27  0.78  0.27  1.0
  Mn  Mn2  1  0.97  0.97  0.97  1.0
  Os  Os3  1  0.33  0.84  0.33  1.0

Hf Mn Mn Os