# generated using pymatgen
data_W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.67513376
_cell_length_b   12.72733527
_cell_length_c   49.93379147
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   W
_chemical_formula_sum   W96
_cell_volume   3515.36101975
_cell_formula_units_Z   96
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  0.608132  0.712172  0.305510  1
  W  W2  1  0.765782  0.027388  0.323168  1
  W  W3  1  0.448556  0.392863  0.287747  1
  W  W4  1  0.448556  0.892863  0.287747  1
  W  W5  1  0.608132  0.212172  0.305510  1
  W  W6  1  0.765782  0.527388  0.323168  1
  W  W7  1  0.948556  0.892863  0.287747  1
  W  W8  1  0.108132  0.212172  0.305510  1
  W  W9  1  0.265782  0.527388  0.323168  1
  W  W10  1  0.108132  0.712172  0.305510  1
  W  W11  1  0.265782  0.027388  0.323168  1
  W  W12  1  0.948556  0.392863  0.287747  1
  W  W13  1  0.081134  0.658172  0.360592  1
  W  W14  1  0.239242  0.974391  0.379087  1
  W  W15  1  0.923440  0.342739  0.342312  1
  W  W16  1  0.923440  0.842739  0.342312  1
  W  W17  1  0.081134  0.158172  0.360592  1
  W  W18  1  0.239242  0.474391  0.379087  1
  W  W19  1  0.423440  0.842739  0.342312  1
  W  W20  1  0.581134  0.158172  0.360592  1
  W  W21  1  0.739242  0.474391  0.379087  1
  W  W22  1  0.581134  0.658172  0.360592  1
  W  W23  1  0.739242  0.974391  0.379087  1
  W  W24  1  0.423440  0.342739  0.342312  1
  W  W25  1  0.554898  0.605753  0.416270  1
  W  W26  1  0.712814  0.921603  0.434809  1
  W  W27  1  0.397010  0.289954  0.397780  1
  W  W28  1  0.397010  0.789954  0.397780  1
  W  W29  1  0.554898  0.105753  0.416270  1
  W  W30  1  0.712814  0.421603  0.434809  1
  W  W31  1  0.897010  0.789954  0.397780  1
  W  W32  1  0.054898  0.105753  0.416270  1
  W  W33  1  0.212814  0.421603  0.434809  1
  W  W34  1  0.054898  0.605753  0.416270  1
  W  W35  1  0.212814  0.921603  0.434809  1
  W  W36  1  0.897010  0.289954  0.397780  1
  W  W37  1  0.028558  0.553133  0.471933  1
  W  W38  1  0.186448  0.868936  0.490480  1
  W  W39  1  0.870673  0.237343  0.453397  1
  W  W40  1  0.870673  0.737343  0.453397  1
  W  W41  1  0.028558  0.053133  0.471933  1
  W  W42  1  0.186448  0.368936  0.490480  1
  W  W43  1  0.370673  0.737343  0.453397  1
  W  W44  1  0.528558  0.053133  0.471933  1
  W  W45  1  0.686448  0.368936  0.490480  1
  W  W46  1  0.528558  0.553133  0.471933  1
  W  W47  1  0.686448  0.868936  0.490480  1
  W  W48  1  0.370673  0.237343  0.453397  1
  W  W49  1  0.502210  0.500501  0.527595  1
  W  W50  1  0.660095  0.816291  0.546132  1
  W  W51  1  0.344319  0.184699  0.509048  1
  W  W52  1  0.344319  0.684699  0.509048  1
  W  W53  1  0.502210  1.000501  0.527595  1
  W  W54  1  0.660095  0.316291  0.546132  1
  W  W55  1  0.844319  0.684699  0.509048  1
  W  W56  1  1.002210  1.000501  0.527595  1
  W  W57  1  0.160095  0.316291  0.546132  1
  W  W58  1  1.002210  0.500501  0.527595  1
  W  W59  1  0.160095  0.816291  0.546132  1
  W  W60  1  0.844319  0.184699  0.509048  1
  W  W61  1  0.975869  0.447881  0.583258  1
  W  W62  1  0.133757  0.763680  0.601749  1
  W  W63  1  0.817953  0.132031  0.564719  1
  W  W64  1  0.817953  0.632031  0.564719  1
  W  W65  1  0.975869  0.947881  0.583258  1
  W  W66  1  0.133757  0.263680  0.601749  1
  W  W67  1  0.317953  0.632031  0.564719  1
  W  W68  1  0.475869  0.947881  0.583258  1
  W  W69  1  0.633757  0.263680  0.601749  1
  W  W70  1  0.475869  0.447881  0.583258  1
  W  W71  1  0.633757  0.763680  0.601749  1
  W  W72  1  0.317953  0.132031  0.564719  1
  W  W73  1  0.449634  0.395463  0.638936  1
  W  W74  1  0.607328  0.710895  0.657217  1
  W  W75  1  0.291526  0.079243  0.620442  1
  W  W76  1  0.291526  0.579243  0.620442  1
  W  W77  1  0.449634  0.895463  0.638936  1
  W  W78  1  0.607328  0.210895  0.657217  1
  W  W79  1  0.791526  0.579243  0.620442  1
  W  W80  1  0.949634  0.895463  0.638936  1
  W  W81  1  0.107328  0.210895  0.657217  1
  W  W82  1  0.949634  0.395463  0.638936  1
  W  W83  1  0.107328  0.710895  0.657217  1
  W  W84  1  0.791526  0.079243  0.620442  1
  W  W85  1  0.922636  0.341462  0.694018  1
  W  W86  1  0.082212  0.660771  0.711782  1
  W  W87  1  0.764986  0.026247  0.676361  1
  W  W88  1  0.764986  0.526247  0.676361  1
  W  W89  1  0.922636  0.841462  0.694018  1
  W  W90  1  0.082212  0.160771  0.711782  1
  W  W91  1  0.264986  0.526247  0.676361  1
  W  W92  1  0.422636  0.841462  0.694018  1
  W  W93  1  0.582212  0.160771  0.711782  1
  W  W94  1  0.422636  0.341462  0.694018  1
  W  W95  1  0.582212  0.660771  0.711782  1
  W  W96  1  0.264986  0.026247  0.676361  1
