data_SnW5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.06
_cell_length_b   7.06
_cell_length_c   4.53
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   153.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnW5
_chemical_formula_sum   'Sn1 W5'
_cell_volume   100.91
_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
  W  W1  1  0.62  0.4  0.0  1.0
  W  W2  1  0.62  0.6  0.0  1.0
  W  W3  1  0.62  0.0  0.27  1.0
  W  W4  1  0.62  0.41  0.27  1.0
  W  W5  1  0.62  0.59  0.27  1.0

data_SnW5
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.24
_cell_length_b   4.53
_cell_length_c   7.06
_cell_angle_alpha   90.0
_cell_angle_beta   103.27
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnW5
_chemical_formula_sum   'Sn1 W5'
_cell_volume   100.91
_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
  W  W1  1  0.0  0.73  0.38  1.0
  W  W2  1  0.4  -0.0  0.78  1.0
  W  W3  1  0.41  0.73  0.79  1.0
  W  W4  1  0.59  0.73  0.97  1.0
  W  W5  1  0.6  0.0  0.98  1.0

Sn W W W W W
Sn W W W W W 0 2 - - o 0 3 - o o 1 4 o o o 1 2 o o o 1 3 o o o 2 5 o o o 2 3 o + o 3 3 + + o 3 4 o o o 3 5 o - o 4 5 o o o 