# generated using pymatgen
data_AgW48S95
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   19.14455100
_cell_length_b   22.10622300
_cell_length_c   14.20054100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgW48S95
_chemical_formula_sum   'Ag1 W48 S95'
_cell_volume   6009.86369232
_cell_formula_units_Z   1
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
  Ag  Ag1  1  0.083333  0.791670  0.350039  1
  W  W2  1  0.000940  0.750468  0.503871  1
  W  W3  1  0.083333  0.874091  0.503843  1
  W  W4  1  -0.000044  0.500520  0.500188  1
  W  W5  1  0.083333  0.626561  0.501701  1
  W  W6  1  0.165727  0.750468  0.503871  1
  W  W7  1  0.248474  0.874223  0.501689  1
  W  W8  1  0.000024  0.250169  0.499902  1
  W  W9  1  0.083333  0.375377  0.500002  1
  W  W10  1  0.166710  0.500520  0.500188  1
  W  W11  1  0.249763  0.625490  0.500072  1
  W  W12  1  0.332756  0.749905  0.500072  1
  W  W13  1  0.416306  0.874671  0.500163  1
  W  W14  1  0.000371  -0.000370  0.500062  1
  W  W15  1  0.083333  0.125069  0.499788  1
  W  W16  1  0.166642  0.250169  0.499902  1
  W  W17  1  0.249944  0.375258  0.499915  1
  W  W18  1  0.333233  0.500265  0.499817  1
  W  W19  1  0.416633  0.624975  0.499785  1
  W  W20  1  0.499797  0.749858  0.499744  1
  W  W21  1  0.583333  0.874810  0.499839  1
  W  W22  1  0.166296  -0.000370  0.500062  1
  W  W23  1  0.249787  0.124872  0.499814  1
  W  W24  1  0.333242  0.250038  0.499915  1
  W  W25  1  0.416622  0.375064  0.499937  1
  W  W26  1  0.499978  0.499978  0.499911  1
  W  W27  1  0.583333  0.624936  0.499824  1
  W  W28  1  0.666870  0.749858  0.499744  1
  W  W29  1  0.750360  0.874671  0.500163  1
  W  W30  1  0.332863  -0.000213  0.500187  1
  W  W31  1  0.416511  0.124853  0.499929  1
  W  W32  1  0.499950  0.249930  0.499985  1
  W  W33  1  0.583333  0.374959  0.499999  1
  W  W34  1  0.666688  0.499978  0.499911  1
  W  W35  1  0.750034  0.624975  0.499785  1
  W  W36  1  0.833910  0.749905  0.500072  1
  W  W37  1  0.918193  0.874223  0.501689  1
  W  W38  1  0.499819  -0.000231  0.499984  1
  W  W39  1  0.583333  0.124853  0.499969  1
  W  W40  1  0.666717  0.249930  0.499985  1
  W  W41  1  0.750045  0.375064  0.499937  1
  W  W42  1  0.833434  0.500265  0.499817  1
  W  W43  1  0.916903  0.625490  0.500072  1
  W  W44  1  0.666847  -0.000231  0.499984  1
  W  W45  1  0.750156  0.124853  0.499929  1
  W  W46  1  0.833424  0.250038  0.499915  1
  W  W47  1  0.916722  0.375258  0.499915  1
  W  W48  1  0.833804  -0.000213  0.500188  1
  W  W49  1  0.916880  0.124872  0.499814  1
  S  S50  1  0.165561  0.914730  0.390803  1
  S  S51  1  0.083333  0.542924  0.390272  1
  S  S52  1  0.165255  0.668496  0.390799  1
  S  S53  1  0.247479  0.791800  0.390811  1
  S  S54  1  0.332154  0.916034  0.390294  1
  S  S55  1  0.083333  0.291965  0.389219  1
  S  S56  1  0.166600  0.417156  0.389316  1
  S  S57  1  0.249736  0.542148  0.389238  1
  S  S58  1  0.333202  0.666712  0.389143  1
  S  S59  1  0.416118  0.791573  0.389234  1
  S  S60  1  0.499671  0.916431  0.389306  1
  S  S61  1  0.083333  0.041607  0.389146  1
  S  S62  1  0.166646  0.166778  0.389076  1
  S  S63  1  0.249974  0.291847  0.389166  1
  S  S64  1  0.333297  0.416835  0.389157  1
  S  S65  1  0.416657  0.541644  0.389046  1
  S  S66  1  0.499969  0.666579  0.388999  1
  S  S67  1  0.583333  0.791520  0.389087  1
  S  S68  1  0.666996  0.916431  0.389306  1
  S  S69  1  0.249675  0.041275  0.389263  1
  S  S70  1  0.333213  0.166602  0.389186  1
  S  S71  1  0.416640  0.291667  0.389214  1
  S  S72  1  0.500008  0.416610  0.389183  1
  S  S73  1  0.583333  0.541576  0.389125  1
  S  S74  1  0.666698  0.666579  0.388999  1
  S  S75  1  0.750549  0.791573  0.389234  1
  S  S76  1  0.834512  0.916034  0.390294  1
  S  S77  1  0.416324  0.041379  0.389354  1
  S  S78  1  0.499941  0.166542  0.389238  1
  S  S79  1  0.583333  0.291586  0.389252  1
  S  S80  1  0.666659  0.416610  0.389183  1
  S  S81  1  0.750010  0.541644  0.389046  1
  S  S82  1  0.833465  0.666712  0.389143  1
  S  S83  1  0.919188  0.791800  0.390811  1
  S  S84  1  0.001106  0.914730  0.390803  1
  S  S85  1  0.583333  0.041444  0.389311  1
  S  S86  1  0.666726  0.166542  0.389238  1
  S  S87  1  0.750027  0.291667  0.389214  1
  S  S88  1  0.833370  0.416835  0.389157  1
  S  S89  1  0.916931  0.542148  0.389238  1
  S  S90  1  0.001411  0.668496  0.390799  1
  S  S91  1  0.750343  0.041379  0.389354  1
  S  S92  1  0.833454  0.166602  0.389186  1
  S  S93  1  0.916693  0.291847  0.389166  1
  S  S94  1  0.000067  0.417156  0.389316  1
  S  S95  1  0.916991  0.041275  0.389263  1
  S  S96  1  0.000021  0.166778  0.389076  1
  S  S97  1  0.083333  0.791687  0.613997  1
  S  S98  1  0.165728  0.916910  0.613012  1
  S  S99  1  0.083333  0.542067  0.611041  1
  S  S100  1  0.167343  0.667274  0.613040  1
  S  S101  1  0.249744  0.790843  0.613024  1
  S  S102  1  0.333009  0.916447  0.610994  1
  S  S103  1  0.083333  0.291896  0.610634  1
  S  S104  1  0.166699  0.416978  0.610751  1
  S  S105  1  0.250129  0.542054  0.610782  1
  S  S106  1  0.333366  0.666635  0.610644  1
  S  S107  1  0.416439  0.791327  0.610703  1
  S  S108  1  0.499919  0.916419  0.610656  1
  S  S109  1  0.083333  0.041758  0.610630  1
  S  S110  1  0.166613  0.166756  0.610583  1
  S  S111  1  0.249974  0.291835  0.610637  1
  S  S112  1  0.333304  0.416873  0.610598  1
  S  S113  1  0.416654  0.541700  0.610631  1
  S  S114  1  0.499972  0.666585  0.610557  1
  S  S115  1  0.583333  0.791458  0.610411  1
  S  S116  1  0.666748  0.916418  0.610656  1
  S  S117  1  0.249581  0.041607  0.610740  1
  S  S118  1  0.333161  0.166602  0.610561  1
  S  S119  1  0.416602  0.291672  0.610676  1
  S  S120  1  0.499978  0.416644  0.610718  1
  S  S121  1  0.583333  0.541627  0.610657  1
  S  S122  1  0.666694  0.666585  0.610557  1
  S  S123  1  0.750227  0.791327  0.610703  1
  S  S124  1  0.833658  0.916447  0.610994  1
  S  S125  1  0.416465  0.041517  0.610703  1
  S  S126  1  0.499925  0.166536  0.610663  1
  S  S127  1  0.583333  0.291580  0.610725  1
  S  S128  1  0.666689  0.416644  0.610718  1
  S  S129  1  0.750013  0.541700  0.610631  1
  S  S130  1  0.833301  0.666635  0.610644  1
  S  S131  1  0.916922  0.790843  0.613024  1
  S  S132  1  0.000939  0.916910  0.613012  1
  S  S133  1  0.583333  0.041464  0.610606  1
  S  S134  1  0.666742  0.166536  0.610663  1
  S  S135  1  0.750064  0.291672  0.610676  1
  S  S136  1  0.833362  0.416873  0.610598  1
  S  S137  1  0.916538  0.542054  0.610782  1
  S  S138  1  -0.000676  0.667274  0.613040  1
  S  S139  1  0.750202  0.041517  0.610703  1
  S  S140  1  0.833505  0.166602  0.610561  1
  S  S141  1  0.916692  0.291835  0.610637  1
  S  S142  1  -0.000032  0.416978  0.610751  1
  S  S143  1  0.917085  0.041607  0.610740  1
  S  S144  1  0.000053  0.166756  0.610583  1
