# generated using pymatgen
data_W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.16907225
_cell_length_b   9.16455466
_cell_length_c   47.00707222
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   W
_chemical_formula_sum   W96
_cell_volume   3870.21934965
_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  0.951126  0.703341  0.343884  1
  W  W2  1  0.450763  0.203344  0.345249  1
  W  W3  1  0.534113  0.786106  0.310019  1
  W  W4  1  0.032208  0.282842  0.309531  1
  W  W5  1  0.702263  0.952191  0.343875  1
  W  W6  1  0.202253  0.451848  0.345248  1
  W  W7  1  0.281739  0.033324  0.309531  1
  W  W8  1  0.785005  0.535261  0.310022  1
  W  W9  1  0.993627  0.994689  0.326965  1
  W  W10  1  0.493001  0.494055  0.325694  1
  W  W11  1  0.558400  0.077004  0.295429  1
  W  W12  1  0.075797  0.559601  0.295430  1
  W  W13  1  0.659393  0.660437  0.361788  1
  W  W14  1  0.319541  0.320747  0.294580  1
  W  W15  1  0.242247  0.741596  0.325680  1
  W  W16  1  0.740536  0.243321  0.325680  1
  W  W17  1  0.783848  0.535050  0.415798  1
  W  W18  1  0.284254  0.034479  0.415774  1
  W  W19  1  0.368372  0.619013  0.379663  1
  W  W20  1  0.867218  0.119283  0.379548  1
  W  W21  1  0.534090  0.784804  0.415798  1
  W  W22  1  0.033523  0.285207  0.415774  1
  W  W23  1  0.118288  0.868221  0.379550  1
  W  W24  1  0.618014  0.369377  0.379664  1
  W  W25  1  0.825998  0.826988  0.397778  1
  W  W26  1  0.326119  0.327108  0.398525  1
  W  W27  1  0.410140  0.910229  0.361593  1
  W  W28  1  0.909189  0.411179  0.361594  1
  W  W29  1  0.492302  0.493229  0.433850  1
  W  W30  1  0.159334  0.160374  0.362124  1
  W  W31  1  0.075256  0.577557  0.398056  1
  W  W32  1  0.576573  0.076237  0.398053  1
  W  W33  1  0.616558  0.366911  0.487766  1
  W  W34  1  0.116043  0.867326  0.487770  1
  W  W35  1  0.199824  0.451361  0.451931  1
  W  W36  1  0.700422  0.950792  0.451862  1
  W  W37  1  0.366068  0.617402  0.487767  1
  W  W38  1  0.866482  0.116886  0.487769  1
  W  W39  1  0.949889  0.701326  0.451863  1
  W  W40  1  0.450462  0.200724  0.451930  1
  W  W41  1  0.658214  0.659089  0.469844  1
  W  W42  1  0.158107  0.158977  0.469679  1
  W  W43  1  0.242060  0.743018  0.433750  1
  W  W44  1  0.742094  0.242983  0.433749  1
  W  W45  1  0.324255  0.325068  0.505644  1
  W  W46  1  0.992070  0.992994  0.433629  1
  W  W47  1  0.908122  0.409051  0.469771  1
  W  W48  1  0.408179  0.908995  0.469771  1
  W  W49  1  0.448003  0.199574  0.559513  1
  W  W50  1  0.948870  0.699041  0.559755  1
  W  W51  1  0.032535  0.282865  0.523714  1
  W  W52  1  0.532087  0.783451  0.523774  1
  W  W53  1  0.198846  0.448731  0.559511  1
  W  W54  1  0.698303  0.949611  0.559756  1
  W  W55  1  0.782659  0.532877  0.523772  1
  W  W56  1  0.282077  0.033324  0.523715  1
  W  W57  1  0.490503  0.491260  0.541493  1
  W  W58  1  0.990504  0.991269  0.541982  1
  W  W59  1  0.074205  0.575285  0.505771  1
  W  W60  1  0.574468  0.075022  0.505771  1
  W  W61  1  0.156677  0.157386  0.577881  1
  W  W62  1  0.824364  0.825185  0.505873  1
  W  W63  1  0.741078  0.240557  0.541797  1
  W  W64  1  0.239797  0.741840  0.541799  1
  W  W65  1  0.279153  0.032488  0.632207  1
  W  W66  1  0.781601  0.531696  0.631390  1
  W  W67  1  0.865690  0.114075  0.596338  1
  W  W68  1  0.364798  0.615628  0.595227  1
  W  W69  1  0.031855  0.279790  0.632206  1
  W  W70  1  0.531074  0.782238  0.631394  1
  W  W71  1  0.614954  0.365466  0.595227  1
  W  W72  1  0.113393  0.866370  0.596338  1
  W  W73  1  0.322989  0.323640  0.613747  1
  W  W74  1  0.822732  0.823398  0.613397  1
  W  W75  1  0.907226  0.406126  0.577763  1
  W  W76  1  0.405422  0.907936  0.577766  1
  W  W77  1  0.983981  0.984574  0.652464  1
  W  W78  1  0.656669  0.657377  0.577532  1
  W  W79  1  0.570370  0.075572  0.613285  1
  W  W80  1  0.074919  0.571014  0.613277  1
  W  W81  1  0.130031  0.869130  0.701378  1
  W  W82  1  0.620048  0.376353  0.699297  1
  W  W83  1  0.692625  0.955209  0.665758  1
  W  W84  1  0.202232  0.448382  0.667609  1
  W  W85  1  0.868668  0.130578  0.701386  1
  W  W86  1  0.375859  0.620527  0.699295  1
  W  W87  1  0.447789  0.202829  0.667612  1
  W  W88  1  0.954619  0.693179  0.665741  1
  W  W89  1  0.158240  0.158807  0.684808  1
  W  W90  1  0.662903  0.663470  0.684999  1
  W  W91  1  0.739347  0.242445  0.649050  1
  W  W92  1  0.241856  0.739927  0.649047  1
  W  W93  1  0.849696  0.850134  0.710889  1
  W  W94  1  0.491377  0.491955  0.648748  1
  W  W95  1  0.409149  0.909036  0.684303  1
  W  W96  1  0.908473  0.409743  0.684303  1
