# generated using pymatgen
data_Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.67584029
_cell_length_b   8.67558318
_cell_length_c   48.38797862
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pt
_chemical_formula_sum   Pt112
_cell_volume   3568.48046317
_cell_formula_units_Z   112
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
  Pt  Pt1  1  0.913389  0.914452  0.333119  1
  Pt  Pt2  1  0.579264  0.580336  0.270690  1
  Pt  Pt3  1  0.499703  0.997462  0.299064  1
  Pt  Pt4  1  0.996399  0.500766  0.299064  1
  Pt  Pt5  1  0.746521  0.747583  0.298825  1
  Pt  Pt6  1  0.242532  0.243596  0.297948  1
  Pt  Pt7  1  0.331917  0.827288  0.271528  1
  Pt  Pt8  1  0.826216  0.332989  0.271528  1
  Pt  Pt9  1  0.038648  0.791985  0.284511  1
  Pt  Pt10  1  0.536341  0.288796  0.284123  1
  Pt  Pt11  1  0.455556  0.705513  0.317916  1
  Pt  Pt12  1  0.958284  0.203363  0.316197  1
  Pt  Pt13  1  0.790917  0.039714  0.284511  1
  Pt  Pt14  1  0.287730  0.537407  0.284123  1
  Pt  Pt15  1  0.202298  0.959348  0.316198  1
  Pt  Pt16  1  0.704448  0.456622  0.317916  1
  Pt  Pt17  1  0.745780  0.746839  0.399636  1
  Pt  Pt18  1  0.411736  0.412800  0.332523  1
  Pt  Pt19  1  0.328727  0.832647  0.366218  1
  Pt  Pt20  1  0.831586  0.329789  0.366217  1
  Pt  Pt21  1  0.579692  0.580753  0.366787  1
  Pt  Pt22  1  0.080153  0.081215  0.366365  1
  Pt  Pt23  1  0.163960  0.664915  0.332853  1
  Pt  Pt24  1  0.663852  0.165024  0.332853  1
  Pt  Pt25  1  0.872430  0.623425  0.348998  1
  Pt  Pt26  1  0.371747  0.123013  0.348634  1
  Pt  Pt27  1  0.287309  0.538535  0.382832  1
  Pt  Pt28  1  0.787585  0.038709  0.382968  1
  Pt  Pt29  1  0.622364  0.873491  0.348998  1
  Pt  Pt30  1  0.121951  0.372808  0.348634  1
  Pt  Pt31  1  0.037648  0.788645  0.382968  1
  Pt  Pt32  1  0.537474  0.288369  0.382832  1
  Pt  Pt33  1  0.577657  0.578712  0.466756  1
  Pt  Pt34  1  0.245755  0.246813  0.399404  1
  Pt  Pt35  1  0.161568  0.662578  0.433228  1
  Pt  Pt36  1  0.661521  0.162625  0.433228  1
  Pt  Pt37  1  0.411583  0.412640  0.433188  1
  Pt  Pt38  1  0.911615  0.912672  0.433276  1
  Pt  Pt39  1  0.995838  0.496544  0.399475  1
  Pt  Pt40  1  0.495485  0.996897  0.399476  1
  Pt  Pt41  1  0.703980  0.454335  0.416565  1
  Pt  Pt42  1  0.203628  0.954886  0.416578  1
  Pt  Pt43  1  0.119755  0.370676  0.449926  1
  Pt  Pt44  1  0.619566  0.870795  0.449963  1
  Pt  Pt45  1  0.453277  0.705038  0.416565  1
  Pt  Pt46  1  0.953828  0.204687  0.416578  1
  Pt  Pt47  1  0.869739  0.620622  0.449963  1
  Pt  Pt48  1  0.369620  0.120811  0.449926  1
  Pt  Pt49  1  0.409572  0.410623  0.533780  1
  Pt  Pt50  1  0.077672  0.078727  0.466816  1
  Pt  Pt51  1  0.993747  0.494652  0.500305  1
  Pt  Pt52  1  0.493599  0.994799  0.500305  1
  Pt  Pt53  1  0.243639  0.244692  0.500292  1
  Pt  Pt54  1  0.743668  0.744721  0.500300  1
  Pt  Pt55  1  0.827719  0.328658  0.466809  1
  Pt  Pt56  1  0.327603  0.828774  0.466809  1
  Pt  Pt57  1  0.535619  0.286667  0.483514  1
  Pt  Pt58  1  0.035614  0.786648  0.483559  1
  Pt  Pt59  1  0.951667  0.202659  0.517072  1
  Pt  Pt60  1  0.451637  0.702742  0.517028  1
  Pt  Pt61  1  0.285614  0.536673  0.483514  1
  Pt  Pt62  1  0.785594  0.036668  0.483559  1
  Pt  Pt63  1  0.701690  0.452689  0.517028  1
  Pt  Pt64  1  0.201607  0.952719  0.517072  1
  Pt  Pt65  1  0.241892  0.242939  0.601255  1
  Pt  Pt66  1  0.909635  0.910686  0.533892  1
  Pt  Pt67  1  0.825683  0.326645  0.567280  1
  Pt  Pt68  1  0.325597  0.826731  0.567280  1
  Pt  Pt69  1  0.075734  0.076782  0.567349  1
  Pt  Pt70  1  0.575667  0.576715  0.567211  1
  Pt  Pt71  1  0.659542  0.160708  0.533867  1
  Pt  Pt72  1  0.159657  0.660592  0.533867  1
  Pt  Pt73  1  0.367535  0.118802  0.550672  1
  Pt  Pt74  1  0.867810  0.618679  0.550630  1
  Pt  Pt75  1  0.783426  0.034872  0.584227  1
  Pt  Pt76  1  0.283931  0.534048  0.584177  1
  Pt  Pt77  1  0.117752  0.368585  0.550672  1
  Pt  Pt78  1  0.617629  0.868860  0.550630  1
  Pt  Pt79  1  0.533001  0.284979  0.584178  1
  Pt  Pt80  1  0.033824  0.784474  0.584227  1
  Pt  Pt81  1  0.073845  0.074886  0.667245  1
  Pt  Pt82  1  0.741781  0.742827  0.600944  1
  Pt  Pt83  1  0.655171  0.160332  0.634488  1
  Pt  Pt84  1  0.159288  0.656215  0.634488  1
  Pt  Pt85  1  0.907151  0.908196  0.634566  1
  Pt  Pt86  1  0.406789  0.407834  0.635295  1
  Pt  Pt87  1  0.491491  0.992895  0.601050  1
  Pt  Pt88  1  0.991848  0.492537  0.601050  1
  Pt  Pt89  1  0.199635  0.950712  0.617538  1
  Pt  Pt90  1  0.699159  0.450578  0.617358  1
  Pt  Pt91  1  0.615151  0.866244  0.651340  1
  Pt  Pt92  1  0.115887  0.366981  0.651734  1
  Pt  Pt93  1  0.949667  0.200680  0.617538  1
  Pt  Pt94  1  0.449533  0.700204  0.617358  1
  Pt  Pt95  1  0.365937  0.116931  0.651734  1
  Pt  Pt96  1  0.865200  0.616195  0.651340  1
  Pt  Pt97  1  0.909813  0.910846  0.727163  1
  Pt  Pt98  1  0.573037  0.574077  0.666750  1
  Pt  Pt99  1  0.494663  0.992930  0.701308  1
  Pt  Pt100  1  0.991889  0.495705  0.701308  1
  Pt  Pt101  1  0.739751  0.740792  0.700531  1
  Pt  Pt102  1  0.239509  0.240550  0.700825  1
  Pt  Pt103  1  0.325099  0.825720  0.666943  1
  Pt  Pt104  1  0.824679  0.326140  0.666943  1
  Pt  Pt105  1  0.036857  0.778793  0.683260  1
  Pt  Pt106  1  0.531575  0.283842  0.685928  1
  Pt  Pt107  1  0.448924  0.701371  0.714256  1
  Pt  Pt108  1  0.946483  0.200580  0.714806  1
  Pt  Pt109  1  0.777751  0.037899  0.683260  1
  Pt  Pt110  1  0.282799  0.532618  0.685928  1
  Pt  Pt111  1  0.199542  0.947518  0.714806  1
  Pt  Pt112  1  0.700335  0.449960  0.714256  1
