# generated using pymatgen
data_W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.94939469
_cell_length_b   12.94412685
_cell_length_c   48.43971075
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.26082953
_symmetry_Int_Tables_number   1
_chemical_formula_structural   W
_chemical_formula_sum   W216
_cell_volume   8078.69787795
_cell_formula_units_Z   216
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  0.111513  0.278854  0.332807  1
  W  W2  1  0.444847  0.945520  0.332807  1
  W  W3  1  0.504155  0.338204  0.284714  1
  W  W4  1  0.778180  0.612187  0.332807  1
  W  W5  1  0.837488  0.004870  0.284714  1
  W  W6  1  0.807962  0.308624  0.306503  1
  W  W7  1  0.170822  0.671537  0.284714  1
  W  W8  1  0.141295  0.975291  0.306503  1
  W  W9  1  0.474629  0.641958  0.306503  1
  W  W10  1  0.944847  0.445520  0.332807  1
  W  W11  1  0.278180  0.112187  0.332807  1
  W  W12  1  0.337488  0.504870  0.284714  1
  W  W13  1  0.611513  0.778854  0.332807  1
  W  W14  1  0.670822  0.171537  0.284714  1
  W  W15  1  0.641295  0.475291  0.306503  1
  W  W16  1  0.004155  0.838204  0.284714  1
  W  W17  1  0.974629  0.141958  0.306503  1
  W  W18  1  0.307962  0.808624  0.306503  1
  W  W19  1  0.141295  0.475291  0.306503  1
  W  W20  1  0.474629  0.141958  0.306503  1
  W  W21  1  0.444847  0.445520  0.332807  1
  W  W22  1  0.807962  0.808624  0.306503  1
  W  W23  1  0.778180  0.112187  0.332807  1
  W  W24  1  0.837488  0.504870  0.284714  1
  W  W25  1  0.111513  0.778854  0.332807  1
  W  W26  1  0.170822  0.171537  0.284714  1
  W  W27  1  0.504155  0.838204  0.284714  1
  W  W28  1  0.004155  0.338204  0.284714  1
  W  W29  1  0.337488  0.004870  0.284714  1
  W  W30  1  0.307962  0.308624  0.306503  1
  W  W31  1  0.670822  0.671537  0.284714  1
  W  W32  1  0.641295  0.975291  0.306503  1
  W  W33  1  0.611513  0.278854  0.332807  1
  W  W34  1  0.974629  0.641958  0.306503  1
  W  W35  1  0.944847  0.945520  0.332807  1
  W  W36  1  0.278180  0.612187  0.332807  1
  W  W37  1  0.019496  0.186777  0.409812  1
  W  W38  1  0.352830  0.853444  0.409812  1
  W  W39  1  0.414146  0.248122  0.357965  1
  W  W40  1  0.686163  0.520111  0.409812  1
  W  W41  1  0.747479  0.914789  0.357965  1
  W  W42  1  0.716973  0.217607  0.384217  1
  W  W43  1  0.080812  0.581456  0.357965  1
  W  W44  1  0.050306  0.884273  0.384217  1
  W  W45  1  0.383639  0.550940  0.384217  1
  W  W46  1  0.852830  0.353444  0.409812  1
  W  W47  1  0.186163  0.020111  0.409812  1
  W  W48  1  0.247479  0.414789  0.357965  1
  W  W49  1  0.519496  0.686777  0.409812  1
  W  W50  1  0.580812  0.081456  0.357965  1
  W  W51  1  0.550306  0.384273  0.384217  1
  W  W52  1  0.914146  0.748122  0.357965  1
  W  W53  1  0.883639  0.050940  0.384217  1
  W  W54  1  0.216973  0.717607  0.384217  1
  W  W55  1  0.050306  0.384273  0.384217  1
  W  W56  1  0.383639  0.050940  0.384217  1
  W  W57  1  0.352830  0.353444  0.409812  1
  W  W58  1  0.716973  0.717607  0.384217  1
  W  W59  1  0.686163  0.020111  0.409812  1
  W  W60  1  0.747479  0.414789  0.357965  1
  W  W61  1  0.019496  0.686777  0.409812  1
  W  W62  1  0.080812  0.081456  0.357965  1
  W  W63  1  0.414146  0.748122  0.357965  1
  W  W64  1  0.914146  0.248122  0.357965  1
  W  W65  1  0.247479  0.914789  0.357965  1
  W  W66  1  0.216973  0.217607  0.384217  1
  W  W67  1  0.580812  0.581456  0.357965  1
  W  W68  1  0.550306  0.884273  0.384217  1
  W  W69  1  0.519496  0.186777  0.409812  1
  W  W70  1  0.883639  0.550940  0.384217  1
  W  W71  1  0.852830  0.853444  0.409812  1
  W  W72  1  0.186163  0.520111  0.409812  1
  W  W73  1  0.927430  0.094663  0.487450  1
  W  W74  1  0.260763  0.761330  0.487450  1
  W  W75  1  0.322189  0.156122  0.435800  1
  W  W76  1  0.594097  0.427996  0.487450  1
  W  W77  1  0.655522  0.822789  0.435800  1
  W  W78  1  0.624773  0.125356  0.461543  1
  W  W79  1  0.988856  0.489456  0.435800  1
  W  W80  1  0.958107  0.792023  0.461543  1
  W  W81  1  0.291440  0.458689  0.461543  1
  W  W82  1  0.760763  0.261330  0.487450  1
  W  W83  1  0.094097  0.927996  0.487450  1
  W  W84  1  0.155522  0.322789  0.435800  1
  W  W85  1  0.427430  0.594663  0.487450  1
  W  W86  1  0.488856  0.989456  0.435800  1
  W  W87  1  0.458107  0.292023  0.461543  1
  W  W88  1  0.822189  0.656122  0.435800  1
  W  W89  1  0.791440  0.958689  0.461543  1
  W  W90  1  0.124773  0.625356  0.461543  1
  W  W91  1  0.958107  0.292023  0.461543  1
  W  W92  1  0.291440  0.958689  0.461543  1
  W  W93  1  0.260763  0.261330  0.487450  1
  W  W94  1  0.624773  0.625356  0.461543  1
  W  W95  1  0.594097  0.927996  0.487450  1
  W  W96  1  0.655522  0.322789  0.435800  1
  W  W97  1  0.927430  0.594663  0.487450  1
  W  W98  1  0.988856  0.989456  0.435800  1
  W  W99  1  0.322189  0.656122  0.435800  1
  W  W100  1  0.822189  0.156122  0.435800  1
  W  W101  1  0.155522  0.822789  0.435800  1
  W  W102  1  0.124773  0.125356  0.461543  1
  W  W103  1  0.488856  0.489456  0.435800  1
  W  W104  1  0.458107  0.792023  0.461543  1
  W  W105  1  0.427430  0.094663  0.487450  1
  W  W106  1  0.791440  0.458689  0.461543  1
  W  W107  1  0.760763  0.761330  0.487450  1
  W  W108  1  0.094097  0.427996  0.487450  1
  W  W109  1  0.835271  1.002453  0.564880  1
  W  W110  1  0.168604  0.669120  0.564880  1
  W  W111  1  0.230030  0.063912  0.513229  1
  W  W112  1  0.501938  0.335786  0.564880  1
  W  W113  1  0.563363  0.730579  0.513229  1
  W  W114  1  0.532687  0.033219  0.539136  1
  W  W115  1  0.896697  0.397246  0.513229  1
  W  W116  1  0.866020  0.699886  0.539136  1
  W  W117  1  0.199353  0.366553  0.539136  1
  W  W118  1  0.668604  0.169120  0.564880  1
  W  W119  1  1.001938  0.835786  0.564880  1
  W  W120  1  0.063363  0.230579  0.513229  1
  W  W121  1  0.335271  0.502453  0.564880  1
  W  W122  1  0.396697  0.897246  0.513229  1
  W  W123  1  0.366020  0.199886  0.539136  1
  W  W124  1  0.730030  0.563912  0.513229  1
  W  W125  1  0.699353  0.866553  0.539136  1
  W  W126  1  0.032687  0.533219  0.539136  1
  W  W127  1  0.866020  0.199886  0.539136  1
  W  W128  1  0.199353  0.866553  0.539136  1
  W  W129  1  0.168604  0.169120  0.564880  1
  W  W130  1  0.532687  0.533219  0.539136  1
  W  W131  1  0.501938  0.835786  0.564880  1
  W  W132  1  0.563363  0.230579  0.513229  1
  W  W133  1  0.835271  0.502453  0.564880  1
  W  W134  1  0.896697  0.897246  0.513229  1
  W  W135  1  0.230030  0.563912  0.513229  1
  W  W136  1  0.730030  0.063912  0.513229  1
  W  W137  1  0.063363  0.730579  0.513229  1
  W  W138  1  0.032687  0.033219  0.539136  1
  W  W139  1  0.396697  0.397246  0.513229  1
  W  W140  1  0.366020  0.699886  0.539136  1
  W  W141  1  0.335271  1.002453  0.564880  1
  W  W142  1  0.699353  0.366553  0.539136  1
  W  W143  1  0.668604  0.669120  0.564880  1
  W  W144  1  1.001938  0.335786  0.564880  1
  W  W145  1  0.743314  0.910453  0.642715  1
  W  W146  1  0.076648  0.577120  0.642715  1
  W  W147  1  0.137964  0.971798  0.590867  1
  W  W148  1  0.409981  0.243787  0.642715  1
  W  W149  1  0.471297  0.638465  0.590867  1
  W  W150  1  0.440487  0.940969  0.616462  1
  W  W151  1  0.804630  0.305131  0.590867  1
  W  W152  1  0.773821  0.607635  0.616462  1
  W  W153  1  0.107154  0.274302  0.616462  1
  W  W154  1  0.576648  0.077120  0.642715  1
  W  W155  1  0.909981  0.743787  0.642715  1
  W  W156  1  0.971297  0.138465  0.590867  1
  W  W157  1  0.243314  0.410453  0.642715  1
  W  W158  1  0.304630  0.805131  0.590867  1
  W  W159  1  0.273821  0.107635  0.616462  1
  W  W160  1  0.637964  0.471798  0.590867  1
  W  W161  1  0.607154  0.774302  0.616462  1
  W  W162  1  0.940487  0.440969  0.616462  1
  W  W163  1  0.773821  0.107635  0.616462  1
  W  W164  1  0.107154  0.774302  0.616462  1
  W  W165  1  0.076648  0.077120  0.642715  1
  W  W166  1  0.440487  0.440969  0.616462  1
  W  W167  1  0.409981  0.743787  0.642715  1
  W  W168  1  0.471297  0.138465  0.590867  1
  W  W169  1  0.743314  0.410453  0.642715  1
  W  W170  1  0.804630  0.805131  0.590867  1
  W  W171  1  0.137964  0.471798  0.590867  1
  W  W172  1  0.637964  0.971798  0.590867  1
  W  W173  1  0.971297  0.638465  0.590867  1
  W  W174  1  0.940487  0.940969  0.616462  1
  W  W175  1  0.304630  0.305131  0.590867  1
  W  W176  1  0.273821  0.607635  0.616462  1
  W  W177  1  0.243314  0.910453  0.642715  1
  W  W178  1  0.607154  0.274302  0.616462  1
  W  W179  1  0.576648  0.577120  0.642715  1
  W  W180  1  0.909981  0.243787  0.642715  1
  W  W181  1  0.653305  0.820372  0.715965  1
  W  W182  1  0.986638  0.487038  0.715965  1
  W  W183  1  0.045947  0.879722  0.667872  1
  W  W184  1  0.319972  0.153705  0.715965  1
  W  W185  1  0.379280  0.546388  0.667872  1
  W  W186  1  0.349498  0.849951  0.694176  1
  W  W187  1  0.712614  0.213055  0.667872  1
  W  W188  1  0.682831  0.516618  0.694176  1
  W  W189  1  0.016165  0.183284  0.694176  1
  W  W190  1  0.486638  0.987038  0.715965  1
  W  W191  1  0.819972  0.653705  0.715965  1
  W  W192  1  0.879280  0.046388  0.667872  1
  W  W193  1  0.153305  0.320372  0.715965  1
  W  W194  1  0.212614  0.713055  0.667872  1
  W  W195  1  0.182831  0.016618  0.694176  1
  W  W196  1  0.545947  0.379722  0.667872  1
  W  W197  1  0.516165  0.683284  0.694176  1
  W  W198  1  0.849498  0.349951  0.694176  1
  W  W199  1  0.682831  0.016618  0.694176  1
  W  W200  1  0.016165  0.683284  0.694176  1
  W  W201  1  0.986638  0.987038  0.715965  1
  W  W202  1  0.349498  0.349951  0.694176  1
  W  W203  1  0.319972  0.653705  0.715965  1
  W  W204  1  0.379280  0.046388  0.667872  1
  W  W205  1  0.653305  0.320372  0.715965  1
  W  W206  1  0.712614  0.713055  0.667872  1
  W  W207  1  0.045947  0.379722  0.667872  1
  W  W208  1  0.545947  0.879722  0.667872  1
  W  W209  1  0.879280  0.546388  0.667872  1
  W  W210  1  0.849498  0.849951  0.694176  1
  W  W211  1  0.212614  0.213055  0.667872  1
  W  W212  1  0.182831  0.516618  0.694176  1
  W  W213  1  0.153305  0.820372  0.715965  1
  W  W214  1  0.516165  0.183284  0.694176  1
  W  W215  1  0.486638  0.487038  0.715965  1
  W  W216  1  0.819972  0.153705  0.715965  1
