data_SnPtW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.89
_cell_length_b   4.31
_cell_length_c   5.5
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnPtW2
_chemical_formula_sum   'Sn1 Pt1 W2'
_cell_volume   68.51
_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
  Sn  Sn1  1  0.0  0.0  0.0  1.0
  Pt  Pt0  1  0.0  0.0  0.75  1.0
  W  W2  1  0.44  0.16  0.45  1.0
  W  W3  1  0.44  0.16  0.06  1.0

data_SnPtW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.89
_cell_length_b   4.31
_cell_length_c   5.5
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnPtW2
_chemical_formula_sum   'Sn1 Pt1 W2'
_cell_volume   68.51
_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
  Sn  Sn0  1  0.0  0.0  0.0  1.0
  Pt  Pt1  1  0.0  0.0  0.75  1.0
  W  W2  1  0.44  0.16  0.06  1.0
  W  W3  1  0.44  0.16  0.45  1.0

Sn Pt W W
Sn Pt W W 0 1 o o - 0 3 o o o 0 3 - o o 1 2 o o o 1 2 - o o 2 3 o o o 