data_InOs2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.79
_cell_length_b   4.47
_cell_length_c   5.28
_cell_angle_alpha   90.0
_cell_angle_beta   99.1
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InOs2W
_chemical_formula_sum   'In1 Os2 W1'
_cell_volume   64.92
_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
  In  In0  1  0.0  0.0  0.0  1.0
  Os  Os1  1  0.88  0.23  0.31  1.0
  Os  Os2  1  0.07  0.23  0.91  1.0
  W  W3  1  0.98  0.0  0.61  1.0

data_InOs2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.79
_cell_length_b   4.47
_cell_length_c   5.28
_cell_angle_alpha   90.0
_cell_angle_beta   99.1
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InOs2W
_chemical_formula_sum   'In1 Os2 W1'
_cell_volume   64.92
_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
  In  In0  1  0.0  0.0  0.0  1.0
  Os  Os1  1  0.07  0.23  0.91  1.0
  Os  Os2  1  0.88  0.23  0.31  1.0
  W  W3  1  0.98  0.0  0.61  1.0

In Os Os W
In Os Os W 0 2 o o - 0 1 - o o 0 3 - o - 1 3 o o o 1 2 + o - 2 3 - o o 