# generated using pymatgen
data_W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.78307104
_cell_length_b   13.02454166
_cell_length_c   48.13990495
_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   3534.1746495
_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  0.044269  0.748924  0.278037  1
  W  W2  1  0.205652  0.071983  0.295254  1
  W  W3  1  0.362927  0.386111  0.313336  1
  W  W4  1  0.362927  0.886111  0.313336  1
  W  W5  1  0.044269  0.248924  0.278037  1
  W  W6  1  0.205652  0.571983  0.295254  1
  W  W7  1  0.862927  0.886111  0.313336  1
  W  W8  1  0.544269  0.248924  0.278037  1
  W  W9  1  0.705652  0.571983  0.295254  1
  W  W10  1  0.544269  0.748924  0.278037  1
  W  W11  1  0.705652  0.071983  0.295254  1
  W  W12  1  0.862927  0.386111  0.313336  1
  W  W13  1  0.521002  0.702135  0.333935  1
  W  W14  1  0.678591  0.017084  0.353084  1
  W  W15  1  0.837036  0.333826  0.372904  1
  W  W16  1  0.837036  0.833826  0.372904  1
  W  W17  1  0.521002  0.202135  0.333935  1
  W  W18  1  0.678591  0.517084  0.353084  1
  W  W19  1  0.337036  0.833826  0.372904  1
  W  W20  1  0.021002  0.202135  0.333935  1
  W  W21  1  0.178591  0.517084  0.353084  1
  W  W22  1  0.021002  0.702135  0.333935  1
  W  W23  1  0.178591  0.017084  0.353084  1
  W  W24  1  0.337036  0.333826  0.372904  1
  W  W25  1  0.994791  0.649138  0.392643  1
  W  W26  1  0.152879  0.965152  0.412312  1
  W  W27  1  0.310874  0.280963  0.431994  1
  W  W28  1  0.310874  0.780963  0.431994  1
  W  W29  1  0.994791  0.149138  0.392643  1
  W  W30  1  0.152879  0.465152  0.412312  1
  W  W31  1  0.810874  0.780963  0.431994  1
  W  W32  1  0.494791  0.149138  0.392643  1
  W  W33  1  0.652879  0.465152  0.412312  1
  W  W34  1  0.494791  0.649138  0.392643  1
  W  W35  1  0.652879  0.965152  0.412312  1
  W  W36  1  0.810874  0.280963  0.431994  1
  W  W37  1  0.468879  0.596802  0.451712  1
  W  W38  1  0.626876  0.912621  0.471395  1
  W  W39  1  0.784892  0.228480  0.491092  1
  W  W40  1  0.784892  0.728480  0.491092  1
  W  W41  1  0.468879  0.096802  0.451712  1
  W  W42  1  0.626876  0.412621  0.471395  1
  W  W43  1  0.284892  0.728480  0.491092  1
  W  W44  1  0.968879  0.096802  0.451712  1
  W  W45  1  0.126876  0.412621  0.471395  1
  W  W46  1  0.968879  0.596802  0.451712  1
  W  W47  1  0.126876  0.912621  0.471395  1
  W  W48  1  0.284892  0.228480  0.491092  1
  W  W49  1  0.942886  0.544293  0.510789  1
  W  W50  1  0.100902  0.860151  0.530487  1
  W  W51  1  0.258899  0.175971  0.550169  1
  W  W52  1  0.258899  0.675971  0.550169  1
  W  W53  1  0.942886  0.044293  0.510789  1
  W  W54  1  0.100902  0.360151  0.530487  1
  W  W55  1  0.758899  0.675971  0.550169  1
  W  W56  1  0.442886  0.044293  0.510789  1
  W  W57  1  0.600902  0.360151  0.530487  1
  W  W58  1  0.442886  0.544293  0.510789  1
  W  W59  1  0.600902  0.860151  0.530487  1
  W  W60  1  0.758899  0.175971  0.550169  1
  W  W61  1  0.416905  0.491810  0.569888  1
  W  W62  1  0.574900  0.807621  0.589570  1
  W  W63  1  0.732988  0.123634  0.609238  1
  W  W64  1  0.732988  0.623634  0.609238  1
  W  W65  1  0.416905  0.991810  0.569888  1
  W  W66  1  0.574900  0.307621  0.589570  1
  W  W67  1  0.232988  0.623634  0.609238  1
  W  W68  1  0.916905  0.991810  0.569888  1
  W  W69  1  0.074900  0.307621  0.589570  1
  W  W70  1  0.916905  0.491810  0.569888  1
  W  W71  1  0.074900  0.807621  0.589570  1
  W  W72  1  0.232988  0.123634  0.609238  1
  W  W73  1  0.890743  0.438946  0.628978  1
  W  W74  1  0.049188  0.755688  0.648798  1
  W  W75  1  0.206777  0.070638  0.667946  1
  W  W76  1  0.206777  0.570638  0.667946  1
  W  W77  1  0.890743  0.938946  0.628978  1
  W  W78  1  0.049188  0.255688  0.648798  1
  W  W79  1  0.706777  0.570638  0.667946  1
  W  W80  1  0.390743  0.938946  0.628978  1
  W  W81  1  0.549188  0.255688  0.648798  1
  W  W82  1  0.390743  0.438946  0.628978  1
  W  W83  1  0.549188  0.755688  0.648798  1
  W  W84  1  0.706777  0.070638  0.667946  1
  W  W85  1  0.364852  0.386662  0.688546  1
  W  W86  1  0.522127  0.700789  0.706628  1
  W  W87  1  0.683509  0.023848  0.723845  1
  W  W88  1  0.683509  0.523848  0.723845  1
  W  W89  1  0.364852  0.886662  0.688546  1
  W  W90  1  0.522127  0.200789  0.706628  1
  W  W91  1  0.183509  0.523848  0.723845  1
  W  W92  1  0.864852  0.886662  0.688546  1
  W  W93  1  0.022127  0.200789  0.706628  1
  W  W94  1  0.864852  0.386662  0.688546  1
  W  W95  1  0.022127  0.700789  0.706628  1
  W  W96  1  0.183509  0.023848  0.723845  1
