# generated using pymatgen
data_W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.48304397
_cell_length_b   14.48215425
_cell_length_c   46.93928897
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.07978686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   W
_chemical_formula_sum   W252
_cell_volume   9367.6765717
_cell_formula_units_Z   252
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  0.928747  0.095960  0.303765  1
  W  W2  1  0.262205  0.762918  0.303685  1
  W  W3  1  0.296511  0.135313  0.283722  1
  W  W4  1  0.557360  0.057198  0.324301  1
  W  W5  1  0.889302  0.724032  0.323652  1
  W  W6  1  0.223422  0.390676  0.323881  1
  W  W7  1  0.595588  0.429337  0.303723  1
  W  W8  1  0.517668  0.684819  0.344693  1
  W  W9  1  0.966476  0.466164  0.283535  1
  W  W10  1  0.762151  0.262556  0.303765  1
  W  W11  1  0.095528  0.929396  0.303723  1
  W  W12  1  0.132348  0.300291  0.283535  1
  W  W13  1  0.390218  0.223115  0.323651  1
  W  W14  1  0.723386  0.891172  0.324301  1
  W  W15  1  0.056861  0.557237  0.323882  1
  W  W16  1  0.429110  0.596014  0.303685  1
  W  W17  1  0.351005  0.851482  0.344693  1
  W  W18  1  0.801499  0.630328  0.283723  1
  W  W19  1  0.947949  0.281759  0.293480  1
  W  W20  1  0.280764  0.948961  0.293565  1
  W  W21  1  0.203598  0.204397  0.334456  1
  W  W22  1  0.576336  0.243321  0.313988  1
  W  W23  1  0.909511  0.910145  0.313988  1
  W  W24  1  0.243116  0.576925  0.313935  1
  W  W25  1  0.615152  0.614578  0.293565  1
  W  W26  1  0.537278  0.871094  0.334231  1
  W  W27  1  0.870583  0.537413  0.334456  1
  W  W28  1  0.742914  0.076723  0.314041  1
  W  W29  1  0.076239  0.743536  0.313937  1
  W  W30  1  0.114322  0.115235  0.293473  1
  W  W31  1  0.370677  0.037711  0.334125  1
  W  W32  1  0.703896  0.704493  0.334125  1
  W  W33  1  0.037109  0.370924  0.334430  1
  W  W34  1  0.409727  0.410049  0.313937  1
  W  W35  1  0.446918  0.780731  0.293800  1
  W  W36  1  0.781425  0.448133  0.293473  1
  W  W37  1  0.811306  0.978251  0.365713  1
  W  W38  1  0.144448  0.645040  0.365578  1
  W  W39  1  0.183641  0.017389  0.345083  1
  W  W40  1  0.438950  0.939360  0.386389  1
  W  W41  1  0.772119  0.606150  0.386476  1
  W  W42  1  0.105532  0.272673  0.386579  1
  W  W43  1  0.477716  0.311659  0.365594  1
  W  W44  1  0.399569  0.566765  0.407405  1
  W  W45  1  0.850215  0.350654  0.345121  1
  W  W46  1  0.644434  0.145122  0.365713  1
  W  W47  1  0.977842  0.811533  0.365594  1
  W  W48  1  0.016839  0.184030  0.345121  1
  W  W49  1  0.272331  0.105938  0.386476  1
  W  W50  1  0.605541  0.772769  0.386389  1
  W  W51  1  0.938854  0.439351  0.386579  1
  W  W52  1  0.311224  0.478264  0.365577  1
  W  W53  1  0.232944  0.733389  0.407406  1
  W  W54  1  0.683575  0.517456  0.345083  1
  W  W55  1  0.830674  0.164489  0.355426  1
  W  W56  1  0.164206  0.831212  0.355344  1
  W  W57  1  0.085883  0.086280  0.397097  1
  W  W58  1  0.458334  0.125532  0.375944  1
  W  W59  1  0.791713  0.792152  0.375944  1
  W  W60  1  0.125138  0.458956  0.375999  1
  W  W61  1  0.497397  0.498021  0.355344  1
  W  W62  1  0.419318  0.753137  0.396915  1
  W  W63  1  0.752461  0.419703  0.397097  1
  W  W64  1  0.624982  0.958800  0.375996  1
  W  W65  1  0.958360  0.625663  0.375945  1
  W  W66  1  0.997399  0.997790  0.355400  1
  W  W67  1  0.252714  0.919656  0.396986  1
  W  W68  1  0.585837  0.586534  0.396986  1
  W  W69  1  0.919152  0.252972  0.397117  1
  W  W70  1  0.291846  0.292178  0.375945  1
  W  W71  1  0.330816  0.664631  0.355356  1
  W  W72  1  0.663975  0.331215  0.355400  1
  W  W73  1  0.693699  0.860863  0.428248  1
  W  W74  1  0.027069  0.527619  0.428241  1
  W  W75  1  0.066216  0.899912  0.407479  1
  W  W76  1  0.321293  0.821713  0.449135  1
  W  W77  1  0.654499  0.488449  0.449171  1
  W  W78  1  0.987893  0.155000  0.449207  1
  W  W79  1  0.360428  0.194194  0.428239  1
  W  W80  1  0.282025  0.449193  0.470009  1
  W  W81  1  0.732757  0.233309  0.407525  1
  W  W82  1  0.527040  0.027522  0.428248  1
  W  W83  1  0.860372  0.694251  0.428239  1
  W  W84  1  0.899489  0.066577  0.407525  1
  W  W85  1  0.154625  0.988323  0.449171  1
  W  W86  1  0.487889  0.655117  0.449135  1
  W  W87  1  0.821176  0.321718  0.449207  1
  W  W88  1  0.193796  0.360892  0.428241  1
  W  W89  1  0.115366  0.615851  0.470009  1
  W  W90  1  0.566092  0.400037  0.407479  1
  W  W91  1  0.713199  0.047020  0.417876  1
  W  W92  1  0.046609  0.713751  0.417825  1
  W  W93  1  0.968264  0.968689  0.459632  1
  W  W94  1  0.340913  0.007962  0.438686  1
  W  W95  1  0.674139  0.674736  0.438686  1
  W  W96  1  0.007526  0.341350  0.438736  1
  W  W97  1  0.379930  0.380431  0.417824  1
  W  W98  1  0.301632  0.635457  0.459573  1
  W  W99  1  0.634864  0.302089  0.459632  1
  W  W100  1  0.507521  0.841345  0.438675  1
  W  W101  1  0.840805  0.508075  0.438713  1
  W  W102  1  0.879914  0.880340  0.417859  1
  W  W103  1  0.134979  0.802061  0.459595  1
  W  W104  1  0.468236  0.468805  0.459595  1
  W  W105  1  0.801547  0.135373  0.459644  1
  W  W106  1  0.174251  0.174628  0.438713  1
  W  W107  1  0.213297  0.547119  0.417811  1
  W  W108  1  0.546518  0.213735  0.417859  1
  W  W109  1  0.576157  0.743362  0.490898  1
  W  W110  1  0.909502  0.410051  0.490890  1
  W  W111  1  0.948668  0.782476  0.470034  1
  W  W112  1  0.203667  0.704122  0.511776  1
  W  W113  1  0.536918  0.370832  0.511788  1
  W  W114  1  0.870295  0.037421  0.511800  1
  W  W115  1  0.242899  0.076634  0.490894  1
  W  W116  1  0.164526  0.331662  0.532616  1
  W  W117  1  0.615293  0.115797  0.470052  1
  W  W118  1  0.409533  0.909986  0.490898  1
  W  W119  1  0.742805  0.576727  0.490894  1
  W  W120  1  0.781970  0.949120  0.470052  1
  W  W121  1  0.037001  0.870748  0.511788  1
  W  W122  1  0.370292  0.537498  0.511776  1
  W  W123  1  0.703590  0.204126  0.511800  1
  W  W124  1  0.076222  0.243330  0.490890  1
  W  W125  1  0.997830  0.498358  0.532616  1
  W  W126  1  0.448649  0.282495  0.470034  1
  W  W127  1  0.595746  0.929574  0.480469  1
  W  W128  1  0.929092  0.596298  0.480448  1
  W  W129  1  0.850721  0.851201  0.522233  1
  W  W130  1  0.223285  0.890357  0.501340  1
  W  W131  1  0.556528  0.557115  0.501340  1
  W  W132  1  0.889894  0.223723  0.501348  1
  W  W133  1  0.262471  0.262920  0.480448  1
  W  W134  1  0.184084  0.517915  0.522198  1
  W  W135  1  0.517369  0.184553  0.522233  1
  W  W136  1  0.389911  0.723741  0.501338  1
  W  W137  1  0.723184  0.390442  0.501344  1
  W  W138  1  0.762405  0.762935  0.480464  1
  W  W139  1  0.017412  0.684555  0.522211  1
  W  W140  1  0.350724  0.351244  0.522211  1
  W  W141  1  0.684038  0.017869  0.522242  1
  W  W142  1  0.056612  0.057013  0.501344  1
  W  W143  1  0.095797  0.429624  0.480439  1
  W  W144  1  0.429107  0.096233  0.480463  1
  W  W145  1  0.458532  0.625760  0.553543  1
  W  W146  1  0.791861  0.292458  0.553492  1
  W  W147  1  0.831128  0.665013  0.532644  1
  W  W148  1  0.086136  0.586613  0.574407  1
  W  W149  1  0.419418  0.253305  0.574429  1
  W  W150  1  0.752781  0.919935  0.574453  1
  W  W151  1  0.125303  0.958986  0.553522  1
  W  W152  1  0.047010  0.214080  0.595134  1
  W  W153  1  0.497824  0.998299  0.532664  1
  W  W154  1  0.291925  0.792366  0.553543  1
  W  W155  1  0.625151  0.459137  0.553522  1
  W  W156  1  0.664466  0.831656  0.532664  1
  W  W157  1  0.919469  0.753254  0.574429  1
  W  W158  1  0.252777  0.419972  0.574407  1
  W  W159  1  0.586098  0.086617  0.574453  1
  W  W160  1  0.958623  0.125695  0.553492  1
  W  W161  1  0.880241  0.380849  0.595134  1
  W  W162  1  0.331180  0.164960  0.532644  1
  W  W163  1  0.478204  0.812037  0.543094  1
  W  W164  1  0.811496  0.478775  0.543053  1
  W  W165  1  0.733208  0.733796  0.584837  1
  W  W166  1  0.105692  0.772753  0.563996  1
  W  W167  1  0.438918  0.439527  0.563996  1
  W  W168  1  0.772292  0.106127  0.563984  1
  W  W169  1  0.144941  0.145329  0.543053  1
  W  W170  1  0.066587  0.400424  0.584764  1
  W  W171  1  0.399958  0.067045  0.584837  1
  W  W172  1  0.272312  0.606148  0.563999  1
  W  W173  1  0.605558  0.272866  0.563986  1
  W  W174  1  0.644824  0.645416  0.543085  1
  W  W175  1  0.899872  0.567115  0.584792  1
  W  W176  1  0.233277  0.233709  0.584792  1
  W  W177  1  0.566597  0.900434  0.584857  1
  W  W178  1  0.939031  0.939394  0.563986  1
  W  W179  1  0.978237  0.312070  0.543030  1
  W  W180  1  0.311583  0.978658  0.543085  1
  W  W181  1  0.340878  0.508143  0.616286  1
  W  W182  1  0.674159  0.174938  0.616177  1
  W  W183  1  0.713476  0.547486  0.595213  1
  W  W184  1  0.968550  0.469043  0.636902  1
  W  W185  1  0.302001  0.135722  0.636967  1
  W  W186  1  0.635398  0.802742  0.637087  1
  W  W187  1  0.007724  0.841309  0.616267  1
  W  W188  1  0.929706  0.096677  0.657543  1
  W  W189  1  0.380303  0.880724  0.595249  1
  W  W190  1  0.174303  0.674718  0.616286  1
  W  W191  1  0.507469  0.341564  0.616267  1
  W  W192  1  0.546885  0.714142  0.595249  1
  W  W193  1  0.801879  0.635843  0.636967  1
  W  W194  1  0.135200  0.302393  0.636902  1
  W  W195  1  0.468899  0.969241  0.637087  1
  W  W196  1  0.841098  0.007999  0.616177  1
  W  W197  1  0.762833  0.263550  0.657543  1
  W  W198  1  0.213647  0.047315  0.595213  1
  W  W199  1  0.360533  0.694372  0.605744  1
  W  W200  1  0.693744  0.361211  0.605654  1
  W  W201  1  0.615704  0.616328  0.647265  1
  W  W202  1  0.988239  0.655272  0.626661  1
  W  W203  1  0.321431  0.322080  0.626662  1
  W  W204  1  0.654805  0.988646  0.626765  1
  W  W205  1  0.027371  0.027583  0.605654  1
  W  W206  1  0.949104  0.282948  0.647223  1
  W  W207  1  0.282484  0.949548  0.647265  1
  W  W208  1  0.154820  0.488661  0.626651  1
  W  W209  1  0.488103  0.155393  0.626718  1
  W  W210  1  0.527119  0.527770  0.605736  1
  W  W211  1  0.782251  0.449656  0.647257  1
  W  W212  1  0.115812  0.116094  0.647258  1
  W  W213  1  0.449150  0.782994  0.647277  1
  W  W214  1  0.821551  0.821944  0.626717  1
  W  W215  1  0.860634  0.194473  0.605564  1
  W  W216  1  0.193930  0.860959  0.605736  1
  W  W217  1  0.222744  0.390193  0.678328  1
  W  W218  1  0.556153  0.057873  0.678964  1
  W  W219  1  0.595435  0.429500  0.657941  1
  W  W220  1  0.850996  0.351565  0.698882  1
  W  W221  1  0.184204  0.018251  0.698926  1
  W  W222  1  0.517873  0.685033  0.698919  1
  W  W223  1  0.890032  0.722781  0.678349  1
  W  W224  1  0.812489  0.983156  0.718877  1
  W  W225  1  0.262270  0.762675  0.657942  1
  W  W226  1  0.056345  0.556591  0.678328  1
  W  W227  1  0.388935  0.223879  0.678350  1
  W  W228  1  0.428831  0.596114  0.657941  1
  W  W229  1  0.684402  0.518055  0.698926  1
  W  W230  1  0.017715  0.184845  0.698882  1
  W  W231  1  0.351183  0.851723  0.698919  1
  W  W232  1  0.724026  0.889999  0.678963  1
  W  W233  1  0.649315  0.146334  0.718877  1
  W  W234  1  0.095656  0.929278  0.657941  1
  W  W235  1  0.242583  0.576427  0.668445  1
  W  W236  1  0.575658  0.243392  0.668487  1
  W  W237  1  0.499555  0.500451  0.708833  1
  W  W238  1  0.870362  0.537339  0.688605  1
  W  W239  1  0.203489  0.204212  0.688605  1
  W  W240  1  0.537081  0.870931  0.688711  1
  W  W241  1  0.909548  0.909501  0.668487  1
  W  W242  1  0.832100  0.165948  0.709150  1
  W  W243  1  0.166606  0.833399  0.708834  1
  W  W244  1  0.036938  0.370788  0.688584  1
  W  W245  1  0.370121  0.037642  0.688670  1
  W  W246  1  0.408992  0.410024  0.668437  1
  W  W247  1  0.665663  0.332202  0.709052  1
  W  W248  1  0.998353  0.999507  0.709052  1
  W  W249  1  0.333153  0.666997  0.708837  1
  W  W250  1  0.703793  0.703970  0.688670  1
  W  W251  1  0.742810  0.076654  0.668149  1
  W  W252  1  0.076181  0.742835  0.668437  1
