# generated using pymatgen
data_RhW48S95
_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   RhW48S95
_chemical_formula_sum   'Rh1 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
  Rh  Rh1  1  0.083330  0.791493  0.372832  1
  W  W2  1  0.000614  0.750668  0.506103  1
  W  W3  1  0.083329  0.873372  0.505933  1
  W  W4  1  -0.000129  0.500221  0.500290  1
  W  W5  1  0.083333  0.625193  0.503133  1
  W  W6  1  0.166061  0.750659  0.506104  1
  W  W7  1  0.250003  0.874968  0.503088  1
  W  W8  1  -0.000005  0.249933  0.498872  1
  W  W9  1  0.083333  0.375061  0.499277  1
  W  W10  1  0.166797  0.500221  0.500291  1
  W  W11  1  0.249674  0.625382  0.500996  1
  W  W12  1  0.332939  0.750122  0.500823  1
  W  W13  1  0.416652  0.874808  0.500347  1
  W  W14  1  -0.000029  -0.000407  0.500856  1
  W  W15  1  0.083334  0.124569  0.499283  1
  W  W16  1  0.166672  0.249933  0.498872  1
  W  W17  1  0.249975  0.375064  0.499071  1
  W  W18  1  0.333250  0.500261  0.499199  1
  W  W19  1  0.416389  0.625185  0.499179  1
  W  W20  1  0.499920  0.749960  0.499051  1
  W  W21  1  0.583333  0.874859  0.499361  1
  W  W22  1  0.166695  -0.000407  0.500856  1
  W  W23  1  0.249832  0.124822  0.499293  1
  W  W24  1  0.333247  0.249945  0.498992  1
  W  W25  1  0.416578  0.375127  0.498867  1
  W  W26  1  0.499995  0.500157  0.498668  1
  W  W27  1  0.583333  0.625140  0.498602  1
  W  W28  1  0.666746  0.749960  0.499051  1
  W  W29  1  0.750015  0.874809  0.500347  1
  W  W30  1  0.333160  -0.000139  0.500462  1
  W  W31  1  0.416625  0.124928  0.499452  1
  W  W32  1  0.499958  0.250015  0.499156  1
  W  W33  1  0.583334  0.375166  0.498832  1
  W  W34  1  0.666672  0.500156  0.498668  1
  W  W35  1  0.750279  0.625186  0.499179  1
  W  W36  1  0.833725  0.750123  0.500822  1
  W  W37  1  0.916662  0.874969  0.503089  1
  W  W38  1  0.499951  -0.000101  0.499776  1
  W  W39  1  0.583333  0.124919  0.499485  1
  W  W40  1  0.666708  0.250015  0.499156  1
  W  W41  1  0.750089  0.375127  0.498867  1
  W  W42  1  0.833416  0.500261  0.499198  1
  W  W43  1  0.916993  0.625380  0.500995  1
  W  W44  1  0.666715  -0.000101  0.499777  1
  W  W45  1  0.750041  0.124928  0.499452  1
  W  W46  1  0.833420  0.249946  0.498991  1
  W  W47  1  0.916692  0.375064  0.499071  1
  W  W48  1  0.833506  -0.000139  0.500463  1
  W  W49  1  0.916834  0.124822  0.499294  1
  S  S50  1  0.165826  0.914024  0.392543  1
  S  S51  1  0.083334  0.542558  0.390774  1
  S  S52  1  0.164705  0.668930  0.392495  1
  S  S53  1  0.247140  0.792245  0.392224  1
  S  S54  1  0.332704  0.916237  0.390626  1
  S  S55  1  0.083333  0.291745  0.388247  1
  S  S56  1  0.166591  0.417144  0.388805  1
  S  S57  1  0.249473  0.542544  0.389409  1
  S  S58  1  0.332501  0.667156  0.389370  1
  S  S59  1  0.415775  0.791697  0.389195  1
  S  S60  1  0.499685  0.916507  0.389022  1
  S  S61  1  0.083333  0.040664  0.389338  1
  S  S62  1  0.166585  0.166305  0.388388  1
  S  S63  1  0.249955  0.291707  0.388227  1
  S  S64  1  0.333165  0.416923  0.388345  1
  S  S65  1  0.416341  0.541962  0.388240  1
  S  S66  1  0.499683  0.666797  0.388079  1
  S  S67  1  0.583334  0.791714  0.388279  1
  S  S68  1  0.666982  0.916507  0.389022  1
  S  S69  1  0.249669  0.040880  0.389359  1
  S  S70  1  0.333250  0.166385  0.388551  1
  S  S71  1  0.416635  0.291626  0.388378  1
  S  S72  1  0.499929  0.416765  0.388119  1
  S  S73  1  0.583333  0.541839  0.387856  1
  S  S74  1  0.666984  0.666797  0.388079  1
  S  S75  1  0.750890  0.791698  0.389194  1
  S  S76  1  0.833962  0.916238  0.390625  1
  S  S77  1  0.416363  0.041313  0.389180  1
  S  S78  1  0.499948  0.166492  0.388720  1
  S  S79  1  0.583333  0.291609  0.388450  1
  S  S80  1  0.666737  0.416765  0.388119  1
  S  S81  1  0.750325  0.541962  0.388240  1
  S  S82  1  0.834167  0.667157  0.389370  1
  S  S83  1  0.919524  0.792248  0.392226  1
  S  S84  1  0.000837  0.914026  0.392540  1
  S  S85  1  0.583333  0.041487  0.388928  1
  S  S86  1  0.666718  0.166492  0.388720  1
  S  S87  1  0.750031  0.291626  0.388378  1
  S  S88  1  0.833502  0.416922  0.388344  1
  S  S89  1  0.917194  0.542544  0.389409  1
  S  S90  1  0.001964  0.668929  0.392499  1
  S  S91  1  0.750304  0.041313  0.389180  1
  S  S92  1  0.833416  0.166385  0.388551  1
  S  S93  1  0.916712  0.291707  0.388226  1
  S  S94  1  0.000076  0.417144  0.388805  1
  S  S95  1  0.916997  0.040880  0.389357  1
  S  S96  1  0.000081  0.166305  0.388388  1
  S  S97  1  0.083336  0.791510  0.617113  1
  S  S98  1  0.166949  0.917274  0.613679  1
  S  S99  1  0.083334  0.540787  0.611803  1
  S  S100  1  0.167187  0.666133  0.614105  1
  S  S101  1  0.250920  0.791563  0.614304  1
  S  S102  1  0.334310  0.916993  0.612124  1
  S  S103  1  0.083333  0.291504  0.609619  1
  S  S104  1  0.166771  0.416396  0.610217  1
  S  S105  1  0.250409  0.541589  0.610890  1
  S  S106  1  0.333649  0.666593  0.611042  1
  S  S107  1  0.417079  0.791316  0.610810  1
  S  S108  1  0.500325  0.916535  0.610520  1
  S  S109  1  0.083333  0.041728  0.610911  1
  S  S110  1  0.166584  0.166646  0.609783  1
  S  S111  1  0.249936  0.291635  0.609630  1
  S  S112  1  0.333360  0.416746  0.609693  1
  S  S113  1  0.416773  0.541754  0.609690  1
  S  S114  1  0.500103  0.666607  0.609598  1
  S  S115  1  0.583333  0.791444  0.609869  1
  S  S116  1  0.666341  0.916535  0.610520  1
  S  S117  1  0.249929  0.041953  0.610901  1
  S  S118  1  0.333178  0.166691  0.609898  1
  S  S119  1  0.416549  0.291780  0.609630  1
  S  S120  1  0.499972  0.416867  0.609442  1
  S  S121  1  0.583334  0.541830  0.609293  1
  S  S122  1  0.666563  0.666607  0.609597  1
  S  S123  1  0.749588  0.791316  0.610810  1
  S  S124  1  0.832356  0.916993  0.612128  1
  S  S125  1  0.416822  0.041781  0.610603  1
  S  S126  1  0.499930  0.166751  0.610018  1
  S  S127  1  0.583333  0.291850  0.609667  1
  S  S128  1  0.666695  0.416867  0.609443  1
  S  S129  1  0.749893  0.541754  0.609690  1
  S  S130  1  0.833019  0.666593  0.611041  1
  S  S131  1  0.915747  0.791563  0.614298  1
  S  S132  1  -0.000282  0.917274  0.613681  1
  S  S133  1  0.583333  0.041673  0.610342  1
  S  S134  1  0.666736  0.166751  0.610018  1
  S  S135  1  0.750117  0.291780  0.609630  1
  S  S136  1  0.833306  0.416746  0.609693  1
  S  S137  1  0.916257  0.541587  0.610890  1
  S  S138  1  -0.000520  0.666133  0.614098  1
  S  S139  1  0.749846  0.041781  0.610603  1
  S  S140  1  0.833489  0.166692  0.609898  1
  S  S141  1  0.916731  0.291635  0.609630  1
  S  S142  1  -0.000104  0.416397  0.610217  1
  S  S143  1  0.916738  0.041953  0.610901  1
  S  S144  1  0.000083  0.166646  0.609783  1
