# generated using pymatgen
data_W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.47699710
_cell_length_b   4.47699710
_cell_length_c   45.51081213
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   W
_chemical_formula_sum   W22
_cell_volume   789.984997837
_cell_formula_units_Z   22
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
  W  W1  1  0.916598  0.916530  0.312212  1
  W  W2  1  0.583265  0.583197  0.293737  1
  W  W3  1  0.583265  0.583197  0.351697  1
  W  W4  1  0.249932  0.249863  0.330312  1
  W  W5  1  0.249932  0.249863  0.391320  1
  W  W6  1  0.916598  0.916530  0.371450  1
  W  W7  1  0.916598  0.916530  0.431603  1
  W  W8  1  0.583265  0.583197  0.411646  1
  W  W9  1  0.583265  0.583197  0.471777  1
  W  W10  1  0.249932  0.249863  0.451671  1
  W  W11  1  0.249932  0.249863  0.511907  1
  W  W12  1  0.916598  0.916530  0.491825  1
  W  W13  1  0.916598  0.916530  0.552061  1
  W  W14  1  0.583265  0.583197  0.531955  1
  W  W15  1  0.583265  0.583197  0.592087  1
  W  W16  1  0.249932  0.249863  0.572129  1
  W  W17  1  0.249932  0.249863  0.632282  1
  W  W18  1  0.916598  0.916530  0.612412  1
  W  W19  1  0.916598  0.916530  0.673420  1
  W  W20  1  0.583265  0.583197  0.652036  1
  W  W21  1  0.583265  0.583197  0.709995  1
  W  W22  1  0.249932  0.249863  0.691520  1
