data_TaMoOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.03
_cell_length_b   6.83
_cell_length_c   2.79
_cell_angle_alpha   82.33
_cell_angle_beta   74.52
_cell_angle_gamma   23.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaMoOs
_chemical_formula_sum   'Ta1 Mo1 Os1'
_cell_volume   48.44
_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
  Ta  Ta2  1  0.59  0.29  0.4  1.0
  Mo  Mo0  1  0.59  0.29  0.04  1.0
  Os  Os1  1  0.59  0.29  0.85  1.0

data_TaMoOs
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.19
_cell_length_b   13.29
_cell_length_c   2.79
_cell_angle_alpha   90.0
_cell_angle_beta   124.88
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   TaMoOs
_chemical_formula_sum   'Ta2 Mo2 Os2'
_cell_volume   96.88
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Ta  Ta0  2  0.22  0.5  0.0  1.0
  Mo  Mo1  2  0.08  0.0  0.37  1.0
  Os  Os2  2  0.27  0.0  0.56  1.0

Ta Mo Os