# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.32257354
_cell_length_b   7.79072058
_cell_length_c   83.17945088
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P84
_cell_volume   6689.31524136
_cell_formula_units_Z   84
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
  P  P1  1  0.903098  0.406880  0.734844  1
  P  P2  1  0.607202  0.578488  0.738310  1
  P  P3  1  0.651427  0.112467  0.428286  1
  P  P4  1  0.080601  0.829515  0.515330  1
  P  P5  1  0.580843  0.329855  0.515569  1
  P  P6  1  0.153606  0.655629  0.734509  1
  P  P7  1  0.040466  0.096780  0.545737  1
  P  P8  1  0.154050  0.615335  0.428021  1
  P  P9  1  0.991118  0.675245  0.550373  1
  P  P10  1  0.740262  0.926999  0.550350  1
  P  P11  1  0.282424  0.160077  0.519721  1
  P  P12  1  0.506034  0.132769  0.296265  1
  P  P13  1  0.689898  0.099878  0.678180  1
  P  P14  1  0.720322  0.114999  0.325978  1
  P  P15  1  0.181965  0.612064  0.678141  1
  P  P16  1  0.949139  0.944245  0.579975  1
  P  P17  1  0.781167  0.658863  0.519778  1
  P  P18  1  0.412954  0.047304  0.453997  1
  P  P19  1  0.357230  0.328428  0.738274  1
  P  P20  1  0.795986  0.645875  0.266073  1
  P  P21  1  0.647182  0.841534  0.708082  1
  P  P22  1  0.403583  0.905596  0.734354  1
  P  P23  1  0.864219  0.130503  0.458038  1
  P  P24  1  0.789525  0.343845  0.546536  1
  P  P25  1  0.908608  0.872603  0.428099  1
  P  P26  1  0.613217  0.379714  0.457952  1
  P  P27  1  0.463318  0.874424  0.326167  1
  P  P28  1  0.400646  0.359436  0.427963  1
  P  P29  1  0.250118  0.567423  0.269503  1
  P  P30  1  0.209570  0.303621  0.299981  1
  P  P31  1  0.330817  0.579349  0.515611  1
  P  P32  1  0.621669  0.065082  0.484551  1
  P  P33  1  0.971251  0.362239  0.326206  1
  P  P34  1  0.395654  0.592427  0.707999  1
  P  P35  1  0.288996  0.843799  0.546310  1
  P  P36  1  0.240674  0.424747  0.550661  1
  P  P37  1  0.912542  0.549556  0.453686  1
  P  P38  1  0.531547  0.909221  0.519796  1
  P  P39  1  0.749633  0.068707  0.269993  1
  P  P40  1  0.446220  0.171685  0.703944  1
  P  P41  1  0.121748  0.563622  0.484643  1
  P  P42  1  0.857047  0.828632  0.738865  1
  P  P43  1  0.204077  0.030058  0.424372  1
  P  P44  1  0.664510  0.798731  0.453806  1
  P  P45  1  0.296169  0.145671  0.265482  1
  P  P46  1  0.458757  0.553954  0.300379  1
  P  P47  1  0.652479  0.155937  0.734634  1
  P  P48  1  0.822399  0.394954  0.488736  1
  P  P49  1  0.217024  0.618987  0.326131  1
  P  P50  1  0.546013  0.395815  0.266037  1
  P  P51  1  0.895125  0.094401  0.708846  1
  P  P52  1  0.112750  0.877523  0.458610  1
  P  P53  1  0.432894  0.859304  0.678369  1
  P  P54  1  0.999166  0.358967  0.576327  1
  P  P55  1  0.572373  0.644448  0.488779  1
  P  P56  1  0.983364  0.938791  0.674639  1
  P  P57  1  0.145855  0.341412  0.708044  1
  P  P58  1  0.258090  0.879902  0.295501  1
  P  P59  1  0.694459  0.420349  0.703968  1
  P  P60  1  0.757562  0.381876  0.296349  1
  P  P61  1  0.959121  0.050750  0.300148  1
  P  P62  1  0.539999  0.594588  0.546396  1
  P  P63  1  0.752569  0.614867  0.576384  1
  P  P64  1  0.323173  0.893919  0.488987  1
  P  P65  1  0.500736  0.818365  0.269714  1
  P  P66  1  0.169852  0.035512  0.329709  1
  P  P67  1  0.936192  0.355315  0.678217  1
  P  P68  1  0.943646  0.670682  0.704366  1
  P  P69  1  0.107766  0.078985  0.738771  1
  P  P70  1  0.870792  0.814226  0.484626  1
  P  P71  1  0.194095  0.923553  0.704199  1
  P  P72  1  0.488705  0.175571  0.550541  1
  P  P73  1  0.999610  0.318674  0.269839  1
  P  P74  1  1.007361  0.632891  0.296303  1
  P  P75  1  0.363691  0.630457  0.457811  1
  P  P76  1  0.830043  0.080384  0.515360  1
  P  P77  1  0.372049  0.315440  0.484569  1
  P  P78  1  0.706996  0.802618  0.300403  1
  P  P79  1  0.072615  0.144788  0.489018  1
  P  P80  1  0.045449  0.895317  0.265577  1
  P  P81  1  0.162098  0.299058  0.453974  1
  P  P82  1  0.244608  0.101700  0.576248  1
  P  P83  1  0.501789  0.861836  0.576061  1
  P  P84  1  0.031468  0.410681  0.519704  1
