# 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  0.083333  0.791842  0.372998  1
  W  W2  1  0.000550  0.750685  0.506069  1
  W  W3  1  0.083333  0.873568  0.506170  1
  W  W4  1  -0.000126  0.500148  0.500141  1
  W  W5  1  0.083333  0.625170  0.502903  1
  W  W6  1  0.166117  0.750685  0.506069  1
  W  W7  1  0.250046  0.874932  0.503077  1
  W  W8  1  -0.000005  0.249964  0.498790  1
  W  W9  1  0.083333  0.375033  0.499168  1
  W  W10  1  0.166793  0.500148  0.500141  1
  W  W11  1  0.249711  0.625348  0.500850  1
  W  W12  1  0.332980  0.750063  0.500798  1
  W  W13  1  0.416702  0.874868  0.500327  1
  W  W14  1  0.000052  -0.000364  0.500805  1
  W  W15  1  0.083333  0.124775  0.499183  1
  W  W16  1  0.166671  0.249964  0.498789  1
  W  W17  1  0.250010  0.375061  0.499066  1
  W  W18  1  0.333271  0.500123  0.499238  1
  W  W19  1  0.416559  0.625071  0.499183  1
  W  W20  1  0.499924  0.749958  0.499052  1
  W  W21  1  0.583333  0.874886  0.499398  1
  W  W22  1  0.166615  -0.000364  0.500805  1
  W  W23  1  0.249940  0.124877  0.499240  1
  W  W24  1  0.333318  0.249967  0.499027  1
  W  W25  1  0.416660  0.375063  0.499029  1
  W  W26  1  0.499974  0.500075  0.498781  1
  W  W27  1  0.583333  0.625000  0.498605  1
  W  W28  1  0.666742  0.749958  0.499052  1
  W  W29  1  0.749965  0.874868  0.500327  1
  W  W30  1  0.333281  -0.000023  0.500408  1
  W  W31  1  0.416652  0.124980  0.499488  1
  W  W32  1  0.499986  0.250026  0.499328  1
  W  W33  1  0.583333  0.375027  0.499061  1
  W  W34  1  0.666693  0.500075  0.498781  1
  W  W35  1  0.750107  0.625071  0.499183  1
  W  W36  1  0.833687  0.750063  0.500798  1
  W  W37  1  0.916620  0.874932  0.503077  1
  W  W38  1  0.499988  -0.000050  0.499777  1
  W  W39  1  0.583333  0.124987  0.499582  1
  W  W40  1  0.666681  0.250026  0.499328  1
  W  W41  1  0.750007  0.375063  0.499029  1
  W  W42  1  0.833395  0.500123  0.499238  1
  W  W43  1  0.916956  0.625348  0.500850  1
  W  W44  1  0.666679  -0.000050  0.499777  1
  W  W45  1  0.750014  0.124980  0.499488  1
  W  W46  1  0.833349  0.249967  0.499027  1
  W  W47  1  0.916656  0.375061  0.499066  1
  W  W48  1  0.833386  -0.000023  0.500408  1
  W  W49  1  0.916727  0.124877  0.499240  1
  S  S50  1  0.165800  0.913963  0.392702  1
  S  S51  1  0.083333  0.542521  0.390556  1
  S  S52  1  0.164761  0.668967  0.392483  1
  S  S53  1  0.247127  0.792207  0.392309  1
  S  S54  1  0.332709  0.916293  0.390644  1
  S  S55  1  0.083333  0.291757  0.388103  1
  S  S56  1  0.166634  0.417074  0.388695  1
  S  S57  1  0.249578  0.542384  0.389293  1
  S  S58  1  0.332630  0.667080  0.389386  1
  S  S59  1  0.415857  0.791730  0.389185  1
  S  S60  1  0.499746  0.916575  0.389030  1
  S  S61  1  0.083334  0.040772  0.389317  1
  S  S62  1  0.166654  0.166388  0.388251  1
  S  S63  1  0.250066  0.291714  0.388175  1
  S  S64  1  0.333291  0.416832  0.388340  1
  S  S65  1  0.416426  0.541815  0.388242  1
  S  S66  1  0.499757  0.666733  0.388063  1
  S  S67  1  0.583333  0.791701  0.388276  1
  S  S68  1  0.666921  0.916575  0.389030  1
  S  S69  1  0.249727  0.040950  0.389311  1
  S  S70  1  0.333341  0.166464  0.388473  1
  S  S71  1  0.416723  0.291633  0.388400  1
  S  S72  1  0.499999  0.416646  0.388217  1
  S  S73  1  0.583333  0.541664  0.387887  1
  S  S74  1  0.666910  0.666733  0.388063  1
  S  S75  1  0.750810  0.791730  0.389186  1
  S  S76  1  0.833958  0.916293  0.390644  1
  S  S77  1  0.416478  0.041441  0.389114  1
  S  S78  1  0.500016  0.166576  0.388742  1
  S  S79  1  0.583333  0.291580  0.388519  1
  S  S80  1  0.666667  0.416646  0.388217  1
  S  S81  1  0.750241  0.541815  0.388242  1
  S  S82  1  0.834036  0.667081  0.389387  1
  S  S83  1  0.919540  0.792207  0.392309  1
  S  S84  1  0.000867  0.913963  0.392702  1
  S  S85  1  0.583333  0.041568  0.388972  1
  S  S86  1  0.666650  0.166576  0.388742  1
  S  S87  1  0.749944  0.291633  0.388400  1
  S  S88  1  0.833376  0.416832  0.388339  1
  S  S89  1  0.917089  0.542384  0.389293  1
  S  S90  1  0.001906  0.668967  0.392483  1
  S  S91  1  0.750189  0.041441  0.389114  1
  S  S92  1  0.833325  0.166464  0.388473  1
  S  S93  1  0.916601  0.291714  0.388175  1
  S  S94  1  0.000032  0.417074  0.388695  1
  S  S95  1  0.916940  0.040950  0.389312  1
  S  S96  1  0.000013  0.166387  0.388251  1
  S  S97  1  0.083333  0.791541  0.616747  1
  S  S98  1  0.167051  0.917429  0.613729  1
  S  S99  1  0.083333  0.540785  0.611698  1
  S  S100  1  0.167217  0.666057  0.613933  1
  S  S101  1  0.251021  0.791533  0.614265  1
  S  S102  1  0.334338  0.917069  0.612092  1
  S  S103  1  0.083333  0.291535  0.609572  1
  S  S104  1  0.166745  0.416374  0.610166  1
  S  S105  1  0.250372  0.541498  0.610760  1
  S  S106  1  0.333715  0.666494  0.610844  1
  S  S107  1  0.417140  0.791369  0.610716  1
  S  S108  1  0.500348  0.916596  0.610558  1
  S  S109  1  0.083334  0.041925  0.610762  1
  S  S110  1  0.166616  0.166740  0.609713  1
  S  S111  1  0.249953  0.291627  0.609638  1
  S  S112  1  0.333389  0.416670  0.609840  1
  S  S113  1  0.416805  0.541649  0.609789  1
  S  S114  1  0.500166  0.666558  0.609600  1
  S  S115  1  0.583333  0.791426  0.609850  1
  S  S116  1  0.666319  0.916596  0.610558  1
  S  S117  1  0.249993  0.042043  0.610781  1
  S  S118  1  0.333219  0.166746  0.609969  1
  S  S119  1  0.416563  0.291750  0.609875  1
  S  S120  1  0.500017  0.416799  0.609693  1
  S  S121  1  0.583333  0.541732  0.609426  1
  S  S122  1  0.666501  0.666558  0.609600  1
  S  S123  1  0.749527  0.791369  0.610716  1
  S  S124  1  0.832328  0.917069  0.612092  1
  S  S125  1  0.416869  0.041865  0.610660  1
  S  S126  1  0.499956  0.166765  0.610233  1
  S  S127  1  0.583333  0.291785  0.610034  1
  S  S128  1  0.666649  0.416799  0.609693  1
  S  S129  1  0.749861  0.541650  0.609789  1
  S  S130  1  0.832951  0.666494  0.610843  1
  S  S131  1  0.915645  0.791533  0.614264  1
  S  S132  1  -0.000384  0.917429  0.613730  1
  S  S133  1  0.583333  0.041709  0.610447  1
  S  S134  1  0.666711  0.166765  0.610233  1
  S  S135  1  0.750104  0.291750  0.609875  1
  S  S136  1  0.833277  0.416670  0.609840  1
  S  S137  1  0.916294  0.541499  0.610760  1
  S  S138  1  -0.000550  0.666057  0.613932  1
  S  S139  1  0.749798  0.041865  0.610660  1
  S  S140  1  0.833448  0.166746  0.609969  1
  S  S141  1  0.916714  0.291627  0.609638  1
  S  S142  1  -0.000078  0.416374  0.610166  1
  S  S143  1  0.916674  0.042043  0.610781  1
  S  S144  1  0.000050  0.166740  0.609713  1
