data_AgRu2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64
_cell_length_b   4.64
_cell_length_c   4.64
_cell_angle_alpha   127.62
_cell_angle_beta   127.62
_cell_angle_gamma   77.23
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgRu2W
_chemical_formula_sum   'Ag1 Ru2 W1'
_cell_volume   60.73
_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
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Ru  Ru1  1  0.05  0.0  0.81  1.0
  Ru  Ru2  1  0.0  0.05  0.81  1.0
  W  W3  1  0.0  0.0  0.62  1.0

data_AgRu2W
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.79
_cell_length_b   5.79
_cell_length_c   4.64
_cell_angle_alpha   90.0
_cell_angle_beta   128.62
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   AgRu2W
_chemical_formula_sum   'Ag2 Ru4 W2'
_cell_volume   121.46
_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
  Ag  Ag0  2  0.0  0.0  0.0  1.0
  Ru  Ru1  4  0.48  0.48  0.77  1.0
  W  W2  2  0.0  0.0  0.62  1.0

Ag Ru Ru W
Ag Ru Ru W 0 2 o o - 0 1 o o - 1 2 o o o 1 3 o o o 2 3 o o o 