# generated using pymatgen
data_Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.48806034
_cell_length_b   12.25669607
_cell_length_c   48.98072415
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pt
_chemical_formula_sum   Pt96
_cell_volume   3211.28831186
_cell_formula_units_Z   96
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  0.956806  0.903313  0.285918  1
  Pt  Pt2  1  0.113048  0.215804  0.300584  1
  Pt  Pt3  1  0.272750  0.535226  0.319304  1
  Pt  Pt4  1  0.113048  0.715804  0.300584  1
  Pt  Pt5  1  0.272750  0.035226  0.319304  1
  Pt  Pt6  1  0.956806  0.403313  0.285918  1
  Pt  Pt7  1  0.613048  0.715804  0.300584  1
  Pt  Pt8  1  0.772750  0.035226  0.319304  1
  Pt  Pt9  1  0.456806  0.403313  0.285918  1
  Pt  Pt10  1  0.456806  0.903313  0.285918  1
  Pt  Pt11  1  0.613048  0.215804  0.300584  1
  Pt  Pt12  1  0.772750  0.535226  0.319304  1
  Pt  Pt13  1  0.429081  0.847915  0.337960  1
  Pt  Pt14  1  0.587875  0.165498  0.356071  1
  Pt  Pt15  1  0.745573  0.480911  0.374392  1
  Pt  Pt16  1  0.587875  0.665498  0.356071  1
  Pt  Pt17  1  0.745573  0.980911  0.374392  1
  Pt  Pt18  1  0.429081  0.347915  0.337960  1
  Pt  Pt19  1  0.087875  0.665498  0.356071  1
  Pt  Pt20  1  0.245573  0.980911  0.374392  1
  Pt  Pt21  1  0.929081  0.347915  0.337960  1
  Pt  Pt22  1  0.929081  0.847915  0.337960  1
  Pt  Pt23  1  0.087875  0.165498  0.356071  1
  Pt  Pt24  1  0.245573  0.480911  0.374392  1
  Pt  Pt25  1  0.903294  0.796362  0.393421  1
  Pt  Pt26  1  0.060923  0.111631  0.411873  1
  Pt  Pt27  1  0.218866  0.427526  0.430540  1
  Pt  Pt28  1  0.060923  0.611631  0.411873  1
  Pt  Pt29  1  0.218866  0.927526  0.430540  1
  Pt  Pt30  1  0.903294  0.296362  0.393421  1
  Pt  Pt31  1  0.560923  0.611631  0.411873  1
  Pt  Pt32  1  0.718866  0.927526  0.430540  1
  Pt  Pt33  1  0.403294  0.296362  0.393421  1
  Pt  Pt34  1  0.403294  0.796362  0.393421  1
  Pt  Pt35  1  0.560923  0.111631  0.411873  1
  Pt  Pt36  1  0.718866  0.427526  0.430540  1
  Pt  Pt37  1  0.376558  0.742928  0.449200  1
  Pt  Pt38  1  0.534406  0.058631  0.467818  1
  Pt  Pt39  1  0.692187  0.374206  0.486412  1
  Pt  Pt40  1  0.534406  0.558631  0.467818  1
  Pt  Pt41  1  0.692187  0.874206  0.486412  1
  Pt  Pt42  1  0.376558  0.242928  0.449200  1
  Pt  Pt43  1  0.034406  0.558631  0.467818  1
  Pt  Pt44  1  0.192187  0.874206  0.486412  1
  Pt  Pt45  1  0.876558  0.242928  0.449200  1
  Pt  Pt46  1  0.876558  0.742928  0.449200  1
  Pt  Pt47  1  0.034406  0.058631  0.467818  1
  Pt  Pt48  1  0.192187  0.374206  0.486412  1
  Pt  Pt49  1  0.849995  0.689831  0.505083  1
  Pt  Pt50  1  1.007776  1.005406  0.523677  1
  Pt  Pt51  1  0.165625  0.321110  0.542295  1
  Pt  Pt52  1  1.007776  0.505406  0.523677  1
  Pt  Pt53  1  0.165625  0.821110  0.542295  1
  Pt  Pt54  1  0.849995  0.189831  0.505083  1
  Pt  Pt55  1  0.507776  0.505406  0.523677  1
  Pt  Pt56  1  0.665625  0.821110  0.542295  1
  Pt  Pt57  1  0.349995  0.189831  0.505083  1
  Pt  Pt58  1  0.349995  0.689831  0.505083  1
  Pt  Pt59  1  0.507776  1.005406  0.523677  1
  Pt  Pt60  1  0.665625  0.321110  0.542295  1
  Pt  Pt61  1  0.323317  0.636511  0.560955  1
  Pt  Pt62  1  0.481259  0.952406  0.579622  1
  Pt  Pt63  1  0.638889  0.267675  0.598074  1
  Pt  Pt64  1  0.481259  0.452406  0.579622  1
  Pt  Pt65  1  0.638889  0.767675  0.598074  1
  Pt  Pt66  1  0.323317  0.136511  0.560955  1
  Pt  Pt67  1  0.981259  0.452406  0.579622  1
  Pt  Pt68  1  0.138889  0.767675  0.598074  1
  Pt  Pt69  1  0.823317  0.136511  0.560955  1
  Pt  Pt70  1  0.823317  0.636511  0.560955  1
  Pt  Pt71  1  0.981259  0.952406  0.579622  1
  Pt  Pt72  1  0.138889  0.267675  0.598074  1
  Pt  Pt73  1  0.796609  0.583127  0.617103  1
  Pt  Pt74  1  0.954308  0.898539  0.635424  1
  Pt  Pt75  1  0.113102  0.216122  0.653535  1
  Pt  Pt76  1  0.954308  0.398539  0.635424  1
  Pt  Pt77  1  0.113102  0.716122  0.653535  1
  Pt  Pt78  1  0.796609  0.083127  0.617103  1
  Pt  Pt79  1  0.454308  0.398539  0.635424  1
  Pt  Pt80  1  0.613102  0.716122  0.653535  1
  Pt  Pt81  1  0.296609  0.083127  0.617103  1
  Pt  Pt82  1  0.296609  0.583127  0.617103  1
  Pt  Pt83  1  0.454308  0.898539  0.635424  1
  Pt  Pt84  1  0.613102  0.216122  0.653535  1
  Pt  Pt85  1  0.269432  0.528811  0.672191  1
  Pt  Pt86  1  0.429134  0.848233  0.690911  1
  Pt  Pt87  1  0.585376  0.160724  0.705577  1
  Pt  Pt88  1  0.429134  0.348233  0.690911  1
  Pt  Pt89  1  0.585376  0.660724  0.705577  1
  Pt  Pt90  1  0.269432  0.028811  0.672191  1
  Pt  Pt91  1  0.929134  0.348233  0.690911  1
  Pt  Pt92  1  0.085376  0.660724  0.705577  1
  Pt  Pt93  1  0.769432  0.028811  0.672191  1
  Pt  Pt94  1  0.769432  0.528811  0.672191  1
  Pt  Pt95  1  0.929134  0.848233  0.690911  1
  Pt  Pt96  1  0.085376  0.160724  0.705577  1
