data_SiRuW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.62
_cell_length_b   4.62
_cell_length_c   4.62
_cell_angle_alpha   144.28
_cell_angle_beta   131.48
_cell_angle_gamma   61.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SiRuW
_chemical_formula_sum   'Si1 Ru1 W1'
_cell_volume   42.66
_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
  Si  Si1  1  0.0  0.0  0.28  1.0
  Ru  Ru0  1  0.0  0.0  0.03  1.0
  W  W2  1  0.0  0.0  0.62  1.0

data_SiRuW
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.83
_cell_length_b   3.8
_cell_length_c   4.62
_cell_angle_alpha   114.26
_cell_angle_beta   107.86
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SiRuW
_chemical_formula_sum   'Si1 Ru1 W1'
_cell_volume   42.66
_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
  Si  Si0  1  0.0  0.28  0.28  1.0
  Ru  Ru1  1  0.0  0.03  0.03  1.0
  W  W2  1  0.0  0.62  0.62  1.0

Si Ru W
Si Ru W 0 1 o o o 0 2 o o o 1 2 o o - 