# generated using pymatgen
data_RbW48S95
_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   RbW48S95
_chemical_formula_sum   'Rb1 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
  Rb  Rb1  1  0.083334  0.791687  0.240972  1
  W  W2  1  0.003491  0.751823  0.509063  1
  W  W3  1  0.083333  0.871516  0.509058  1
  W  W4  1  0.000136  0.500867  0.501212  1
  W  W5  1  0.083333  0.626834  0.504881  1
  W  W6  1  0.163175  0.751823  0.509063  1
  W  W7  1  0.248320  0.874126  0.504805  1
  W  W8  1  0.000103  0.250039  0.499577  1
  W  W9  1  0.083333  0.375431  0.500105  1
  W  W10  1  0.166531  0.500868  0.501212  1
  W  W11  1  0.249447  0.626048  0.501803  1
  W  W12  1  0.332211  0.749988  0.501699  1
  W  W13  1  0.416018  0.874597  0.501010  1
  W  W14  1  0.000652  -0.000901  0.501800  1
  W  W15  1  0.083333  0.124647  0.500050  1
  W  W16  1  0.166563  0.250039  0.499576  1
  W  W17  1  0.249787  0.375335  0.499831  1
  W  W18  1  0.332988  0.500570  0.500024  1
  W  W19  1  0.416348  0.625275  0.499987  1
  W  W20  1  0.499639  0.749972  0.499834  1
  W  W21  1  0.583333  0.874698  0.499990  1
  W  W22  1  0.166014  -0.000901  0.501800  1
  W  W23  1  0.249610  0.124530  0.499988  1
  W  W24  1  0.333072  0.249908  0.499553  1
  W  W25  1  0.416460  0.375186  0.499577  1
  W  W26  1  0.499888  0.500226  0.499519  1
  W  W27  1  0.583333  0.625181  0.499451  1
  W  W28  1  0.667028  0.749972  0.499834  1
  W  W29  1  0.750648  0.874597  0.501010  1
  W  W30  1  0.332668  -0.000584  0.501129  1
  W  W31  1  0.416387  0.124641  0.499854  1
  W  W32  1  0.499858  0.249860  0.499557  1
  W  W33  1  0.583333  0.375093  0.499537  1
  W  W34  1  0.666778  0.500226  0.499519  1
  W  W35  1  0.750319  0.625275  0.499987  1
  W  W36  1  0.834456  0.749988  0.501699  1
  W  W37  1  0.918346  0.874126  0.504806  1
  W  W38  1  0.499756  -0.000438  0.500156  1
  W  W39  1  0.583333  0.124629  0.499704  1
  W  W40  1  0.666809  0.249860  0.499557  1
  W  W41  1  0.750206  0.375186  0.499578  1
  W  W42  1  0.833679  0.500570  0.500024  1
  W  W43  1  0.917219  0.626048  0.501803  1
  W  W44  1  0.666910  -0.000438  0.500156  1
  W  W45  1  0.750280  0.124641  0.499855  1
  W  W46  1  0.833595  0.249908  0.499554  1
  W  W47  1  0.916880  0.375335  0.499832  1
  W  W48  1  0.833998  -0.000584  0.501130  1
  W  W49  1  0.917056  0.124530  0.499988  1
  S  S50  1  0.164087  0.912649  0.394434  1
  S  S51  1  0.083333  0.543972  0.391976  1
  S  S52  1  0.163938  0.670706  0.394456  1
  S  S53  1  0.244730  0.791750  0.394412  1
  S  S54  1  0.331216  0.915481  0.391835  1
  S  S55  1  0.083333  0.292043  0.389076  1
  S  S56  1  0.166430  0.417710  0.389767  1
  S  S57  1  0.249132  0.543041  0.390268  1
  S  S58  1  0.332277  0.667263  0.390234  1
  S  S59  1  0.415164  0.791591  0.390060  1
  S  S60  1  0.499329  0.916125  0.389721  1
  S  S61  1  0.083333  0.040587  0.390316  1
  S  S62  1  0.166517  0.166322  0.389151  1
  S  S63  1  0.249785  0.291893  0.388997  1
  S  S64  1  0.332967  0.417190  0.389183  1
  S  S65  1  0.416233  0.542058  0.389107  1
  S  S66  1  0.499640  0.666843  0.388956  1
  S  S67  1  0.583333  0.791537  0.389136  1
  S  S68  1  0.667337  0.916125  0.389721  1
  S  S69  1  0.249151  0.040362  0.390247  1
  S  S70  1  0.332933  0.166214  0.389191  1
  S  S71  1  0.416448  0.291662  0.389001  1
  S  S72  1  0.499871  0.416825  0.388948  1
  S  S73  1  0.583333  0.541862  0.388795  1
  S  S74  1  0.667027  0.666843  0.388956  1
  S  S75  1  0.751503  0.791591  0.390061  1
  S  S76  1  0.835451  0.915481  0.391835  1
  S  S77  1  0.415921  0.040872  0.389787  1
  S  S78  1  0.499805  0.166254  0.389134  1
  S  S79  1  0.583333  0.291575  0.389038  1
  S  S80  1  0.666796  0.416825  0.388948  1
  S  S81  1  0.750434  0.542058  0.389107  1
  S  S82  1  0.834389  0.667263  0.390234  1
  S  S83  1  0.921937  0.791750  0.394412  1
  S  S84  1  0.002580  0.912649  0.394434  1
  S  S85  1  0.583333  0.041044  0.389366  1
  S  S86  1  0.666861  0.166254  0.389134  1
  S  S87  1  0.750219  0.291662  0.389001  1
  S  S88  1  0.833700  0.417190  0.389183  1
  S  S89  1  0.917535  0.543041  0.390268  1
  S  S90  1  0.002729  0.670706  0.394456  1
  S  S91  1  0.750746  0.040872  0.389787  1
  S  S92  1  0.833733  0.166214  0.389191  1
  S  S93  1  0.916881  0.291893  0.388998  1
  S  S94  1  0.000236  0.417710  0.389767  1
  S  S95  1  0.917516  0.040362  0.390247  1
  S  S96  1  0.000150  0.166322  0.389152  1
  S  S97  1  0.083333  0.791713  0.623112  1
  S  S98  1  0.165647  0.916918  0.615979  1
  S  S99  1  0.083333  0.541786  0.612961  1
  S  S100  1  0.167474  0.667424  0.616010  1
  S  S101  1  0.249822  0.790746  0.615938  1
  S  S102  1  0.333455  0.916538  0.612817  1
  S  S103  1  0.083333  0.291747  0.610352  1
  S  S104  1  0.166678  0.416871  0.610980  1
  S  S105  1  0.250188  0.542151  0.611639  1
  S  S106  1  0.333575  0.666675  0.611774  1
  S  S107  1  0.416596  0.791273  0.611449  1
  S  S108  1  0.500043  0.916308  0.610942  1
  S  S109  1  0.083333  0.041828  0.611808  1
  S  S110  1  0.166553  0.166701  0.610479  1
  S  S111  1  0.249835  0.291750  0.610222  1
  S  S112  1  0.333212  0.416933  0.610358  1
  S  S113  1  0.416674  0.541861  0.610492  1
  S  S114  1  0.500049  0.666686  0.610409  1
  S  S115  1  0.583333  0.791395  0.610446  1
  S  S116  1  0.666624  0.916308  0.610942  1
  S  S117  1  0.249561  0.041579  0.611574  1
  S  S118  1  0.333051  0.166522  0.610312  1
  S  S119  1  0.416464  0.291669  0.610084  1
  S  S120  1  0.499922  0.416821  0.610126  1
  S  S121  1  0.583333  0.541853  0.610126  1
  S  S122  1  0.666618  0.666686  0.610409  1
  S  S123  1  0.750071  0.791273  0.611449  1
  S  S124  1  0.833212  0.916538  0.612817  1
  S  S125  1  0.416553  0.041451  0.610921  1
  S  S126  1  0.499899  0.166450  0.610205  1
  S  S127  1  0.583333  0.291606  0.610055  1
  S  S128  1  0.666745  0.416822  0.610126  1
  S  S129  1  0.749993  0.541862  0.610492  1
  S  S130  1  0.833092  0.666675  0.611774  1
  S  S131  1  0.916845  0.790745  0.615939  1
  S  S132  1  0.001020  0.916918  0.615979  1
  S  S133  1  0.583333  0.041353  0.610529  1
  S  S134  1  0.666768  0.166450  0.610205  1
  S  S135  1  0.750203  0.291669  0.610084  1
  S  S136  1  0.833454  0.416934  0.610358  1
  S  S137  1  0.916478  0.542151  0.611639  1
  S  S138  1  -0.000808  0.667424  0.616010  1
  S  S139  1  0.750114  0.041451  0.610921  1
  S  S140  1  0.833616  0.166522  0.610312  1
  S  S141  1  0.916831  0.291750  0.610223  1
  S  S142  1  -0.000011  0.416871  0.610980  1
  S  S143  1  0.917105  0.041579  0.611574  1
  S  S144  1  0.000114  0.166701  0.610479  1
