# 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  0.080101  0.789135  0.261739  1
  W  W2  1  0.000567  0.750192  0.513288  1
  W  W3  1  0.086685  0.870934  0.509541  1
  W  W4  1  -0.000125  0.500435  0.500875  1
  W  W5  1  0.082569  0.626570  0.505469  1
  W  W6  1  0.164145  0.754512  0.509623  1
  W  W7  1  0.249786  0.874923  0.506256  1
  W  W8  1  0.000138  0.249791  0.497956  1
  W  W9  1  0.083246  0.375219  0.498639  1
  W  W10  1  0.166309  0.500730  0.500400  1
  W  W11  1  0.249016  0.626388  0.502041  1
  W  W12  1  0.332308  0.750471  0.502777  1
  W  W13  1  0.416626  0.875055  0.502640  1
  W  W14  1  0.001060  -0.001327  0.501870  1
  W  W15  1  0.083595  0.124520  0.499055  1
  W  W16  1  0.166653  0.249956  0.497987  1
  W  W17  1  0.249734  0.375334  0.498117  1
  W  W18  1  0.332631  0.500712  0.498915  1
  W  W19  1  0.416074  0.625460  0.500123  1
  W  W20  1  0.499614  0.750189  0.501210  1
  W  W21  1  0.583543  0.874983  0.501617  1
  W  W22  1  0.166667  -0.000911  0.501974  1
  W  W23  1  0.250003  0.124716  0.499178  1
  W  W24  1  0.333219  0.250085  0.497843  1
  W  W25  1  0.416368  0.375310  0.497661  1
  W  W26  1  0.499610  0.500257  0.498435  1
  W  W27  1  0.582993  0.625150  0.499946  1
  W  W28  1  0.666738  0.750010  0.501517  1
  W  W29  1  0.750534  0.874689  0.502513  1
  W  W30  1  0.333375  -0.000059  0.501824  1
  W  W31  1  0.416749  0.125022  0.499170  1
  W  W32  1  0.499975  0.250091  0.497730  1
  W  W33  1  0.583205  0.375086  0.497591  1
  W  W34  1  0.666484  0.500054  0.498734  1
  W  W35  1  0.749840  0.624995  0.501038  1
  W  W36  1  0.833748  0.749830  0.504130  1
  W  W37  1  0.918029  0.873670  0.505934  1
  W  W38  1  0.500206  -0.000017  0.500920  1
  W  W39  1  0.583564  0.124931  0.498945  1
  W  W40  1  0.666809  0.249910  0.497679  1
  W  W41  1  0.750033  0.374956  0.497819  1
  W  W42  1  0.833342  0.500117  0.499610  1
  W  W43  1  0.916675  0.625374  0.503500  1
  W  W44  1  0.667109  -0.000214  0.500649  1
  W  W45  1  0.750415  0.124673  0.498833  1
  W  W46  1  0.833598  0.249719  0.497760  1
  W  W47  1  0.916733  0.375010  0.498351  1
  W  W48  1  0.834115  -0.000595  0.501209  1
  W  W49  1  0.917202  0.124237  0.498863  1
  S  S50  1  0.166011  0.912566  0.394279  1
  S  S51  1  0.082924  0.544196  0.391900  1
  S  S52  1  0.163455  0.672145  0.395679  1
  S  S53  1  0.245695  0.793111  0.394594  1
  S  S54  1  0.332352  0.915914  0.393028  1
  S  S55  1  0.083340  0.291899  0.387436  1
  S  S56  1  0.166223  0.417842  0.388337  1
  S  S57  1  0.248652  0.543646  0.389668  1
  S  S58  1  0.331889  0.667885  0.390816  1
  S  S59  1  0.415474  0.792063  0.391478  1
  S  S60  1  0.499810  0.916275  0.391078  1
  S  S61  1  0.083703  0.039956  0.390117  1
  S  S62  1  0.166772  0.166024  0.387941  1
  S  S63  1  0.249806  0.291886  0.387196  1
  S  S64  1  0.332764  0.417561  0.387507  1
  S  S65  1  0.415942  0.542599  0.388417  1
  S  S66  1  0.499489  0.667344  0.389661  1
  S  S67  1  0.583371  0.791791  0.390795  1
  S  S68  1  0.667427  0.916019  0.390915  1
  S  S69  1  0.249782  0.040232  0.390248  1
  S  S70  1  0.333266  0.166125  0.387993  1
  S  S71  1  0.416478  0.291792  0.386982  1
  S  S72  1  0.499732  0.417146  0.387119  1
  S  S73  1  0.583148  0.542285  0.388280  1
  S  S74  1  0.666856  0.667105  0.390096  1
  S  S75  1  0.751278  0.791476  0.391911  1
  S  S76  1  0.835448  0.915048  0.392868  1
  S  S77  1  0.416510  0.040909  0.389987  1
  S  S78  1  0.500058  0.166209  0.387867  1
  S  S79  1  0.583364  0.291622  0.386891  1
  S  S80  1  0.666706  0.417024  0.387256  1
  S  S81  1  0.750238  0.542307  0.389030  1
  S  S82  1  0.834065  0.667287  0.392135  1
  S  S83  1  0.921220  0.790820  0.396437  1
  S  S84  1  0.003827  0.911480  0.395753  1
  S  S85  1  0.583596  0.040922  0.389488  1
  S  S86  1  0.666973  0.166057  0.387737  1
  S  S87  1  0.750249  0.291527  0.386978  1
  S  S88  1  0.833590  0.417215  0.387823  1
  S  S89  1  0.917167  0.543101  0.390500  1
  S  S90  1  0.001423  0.670615  0.396034  1
  S  S91  1  0.750814  0.040526  0.389564  1
  S  S92  1  0.833881  0.165777  0.387767  1
  S  S93  1  0.916907  0.291670  0.387217  1
  S  S94  1  0.000076  0.417730  0.388560  1
  S  S95  1  0.917842  0.039632  0.389868  1
  S  S96  1  0.000338  0.165856  0.387858  1
  S  S97  1  0.082641  0.791362  0.623972  1
  S  S98  1  0.166540  0.917592  0.617087  1
  S  S99  1  0.083262  0.541211  0.612673  1
  S  S100  1  0.166855  0.667670  0.615701  1
  S  S101  1  0.250529  0.791266  0.617413  1
  S  S102  1  0.334445  0.917507  0.614488  1
  S  S103  1  0.083336  0.291520  0.608781  1
  S  S104  1  0.166658  0.416490  0.609618  1
  S  S105  1  0.249875  0.542029  0.610975  1
  S  S106  1  0.333181  0.666568  0.612018  1
  S  S107  1  0.416704  0.791486  0.612884  1
  S  S108  1  0.500514  0.917024  0.612467  1
  S  S109  1  0.083506  0.041959  0.611312  1
  S  S110  1  0.166698  0.166912  0.609326  1
  S  S111  1  0.249952  0.291800  0.608559  1
  S  S112  1  0.333138  0.416833  0.608758  1
  S  S113  1  0.416348  0.541567  0.609715  1
  S  S114  1  0.499655  0.666431  0.611086  1
  S  S115  1  0.583156  0.791535  0.612107  1
  S  S116  1  0.666826  0.916910  0.612313  1
  S  S117  1  0.249918  0.042284  0.611601  1
  S  S118  1  0.333316  0.167123  0.609295  1
  S  S119  1  0.416583  0.291924  0.608318  1
  S  S120  1  0.499793  0.416598  0.608495  1
  S  S121  1  0.582946  0.541309  0.609645  1
  S  S122  1  0.666087  0.666273  0.611507  1
  S  S123  1  0.749426  0.791428  0.613394  1
  S  S124  1  0.833454  0.916926  0.613638  1
  S  S125  1  0.417084  0.042443  0.611324  1
  S  S126  1  0.500208  0.167178  0.609217  1
  S  S127  1  0.583384  0.291747  0.608261  1
  S  S128  1  0.666506  0.416323  0.608650  1
  S  S129  1  0.749528  0.541025  0.610445  1
  S  S130  1  0.832405  0.665976  0.613467  1
  S  S131  1  0.914966  0.791458  0.618734  1
  S  S132  1  0.001425  0.916496  0.615762  1
  S  S133  1  0.583768  0.042184  0.610838  1
  S  S134  1  0.667021  0.166947  0.609070  1
  S  S135  1  0.750152  0.291509  0.608323  1
  S  S136  1  0.833151  0.416161  0.609171  1
  S  S137  1  0.916054  0.540906  0.611966  1
  S  S138  1  -0.001125  0.665182  0.618385  1
  S  S139  1  0.750461  0.042009  0.610825  1
  S  S140  1  0.833816  0.166614  0.609012  1
  S  S141  1  0.916740  0.291399  0.608605  1
  S  S142  1  -0.000159  0.416164  0.609900  1
  S  S143  1  0.917504  0.041617  0.611159  1
  S  S144  1  0.000222  0.166661  0.609163  1
