# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.44898838
_cell_length_b   13.99958401
_cell_length_c   43.83117111
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.91452717
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P128
_cell_volume   9479.76930532
_cell_formula_units_Z   128
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  0.423711  1.014650  0.450235  1
  P  P2  1  0.497988  0.577819  0.427074  1
  P  P3  1  0.915600  0.945418  0.499903  1
  P  P4  1  0.819325  0.529673  0.451031  1
  P  P5  1  0.343606  0.976479  0.384230  1
  P  P6  1  0.353998  0.420716  0.446360  1
  P  P7  1  0.850504  0.913792  0.428688  1
  P  P8  1  0.834718  0.345538  0.496423  1
  P  P9  1  0.370051  0.640493  0.478875  1
  P  P10  1  0.344513  0.199862  0.413445  1
  P  P11  1  0.821084  0.702561  0.400339  1
  P  P12  1  0.853985  0.128310  0.459328  1
  P  P13  1  0.056726  0.861067  0.455816  1
  P  P14  1  0.952065  0.442695  0.402452  1
  P  P15  1  0.280703  0.854400  0.473181  1
  P  P16  1  0.143791  0.453432  0.431322  1
  P  P17  1  -0.001530  0.649717  0.429423  1
  P  P18  1  0.925023  0.222143  0.384851  1
  P  P19  1  0.169636  0.663495  0.464173  1
  P  P20  1  0.134055  0.236787  0.399652  1
  P  P21  1  -0.002889  0.833634  0.384759  1
  P  P22  1  -0.001683  0.285180  0.453550  1
  P  P23  1  0.201216  0.815723  0.405185  1
  P  P24  1  0.211980  0.260527  0.467975  1
  P  P25  1  0.852811  0.740623  0.474866  1
  P  P26  1  0.784884  0.318846  0.426021  1
  P  P27  1  0.415011  0.792262  0.421649  1
  P  P28  1  0.279191  0.390633  0.378766  1
  P  P29  1  0.210061  1.036669  0.435914  1
  P  P30  1  0.295523  0.606505  0.407611  1
  P  P31  1  0.012885  1.050317  0.417678  1
  P  P32  1  0.005120  0.494995  0.486465  1
  P  P33  1  0.528513  0.884446  0.566906  1
  P  P34  1  0.440241  0.454165  0.513778  1
  P  P35  1  0.718621  0.888694  0.593041  1
  P  P36  1  0.915047  0.390385  0.561208  1
  P  P37  1  0.485899  0.832918  0.492414  1
  P  P38  1  0.517359  0.270208  0.550400  1
  P  P39  1  0.862035  0.792318  0.551469  1
  P  P40  1  0.739753  0.258950  0.562760  1
  P  P41  1  0.528161  0.492066  0.581426  1
  P  P42  1  0.498880  1.052998  0.518760  1
  P  P43  1  0.837562  0.570283  0.525199  1
  P  P44  1  -0.005684  0.977744  0.566951  1
  P  P45  1  0.085661  0.749206  0.585324  1
  P  P46  1  0.079508  0.309106  0.524522  1
  P  P47  1  0.312791  0.732550  0.601468  1
  P  P48  1  0.299780  0.292239  0.536772  1
  P  P49  1  0.089601  0.525521  0.557180  1
  P  P50  1  0.070967  1.094338  0.488668  1
  P  P51  1  0.308822  0.510838  0.569312  1
  P  P52  1  0.287494  1.074523  0.503809  1
  P  P53  1  0.021282  0.708073  0.514971  1
  P  P54  1  0.157358  0.125021  0.558201  1
  P  P55  1  0.230879  0.695465  0.533991  1
  P  P56  1  0.372556  1.109836  0.573710  1
  P  P57  1  0.920039  0.612068  0.591209  1
  P  P58  1  0.911788  0.162383  0.531292  1
  P  P59  1  0.444921  0.676398  0.547012  1
  P  P60  1  0.428467  0.235393  0.481505  1
  P  P61  1  0.340748  0.891544  0.543823  1
  P  P62  1  0.221461  0.475713  0.501692  1
  P  P63  1  0.136392  0.902462  0.522804  1
  P  P64  1  0.172632  0.340484  0.593956  1
  P  P65  1  0.628740  0.748516  0.683170  1
  P  P66  1  0.607351  0.312071  0.617693  1
  P  P67  1  0.845116  0.728613  0.698333  1
  P  P68  1  0.826583  0.297419  0.629790  1
  P  P69  1  0.543618  0.713018  0.613303  1
  P  P70  1  0.685249  0.127415  0.653011  1
  P  P71  1  0.758897  0.698003  0.628802  1
  P  P72  1  0.894860  0.114858  0.671994  1
  P  P73  1  0.694692  0.347143  0.685312  1
  P  P74  1  0.575473  0.931414  0.643179  1
  P  P75  1  0.743597  0.482344  0.593039  1
  P  P76  1  0.779757  0.920404  0.664188  1
  P  P77  1  0.004438  0.660570  0.655699  1
  P  P78  1  -0.003827  0.210844  0.595809  1
  P  P79  1  0.487719  0.587386  0.705514  1
  P  P80  1  0.471337  0.146430  0.639982  1
  P  P81  1  0.001073  0.432504  0.625783  1
  P  P82  1  0.197556  0.934127  0.593957  1
  P  P83  1  0.475997  0.368817  0.673227  1
  P  P84  1  0.387729  0.938606  0.620094  1
  P  P85  1  0.176480  0.564044  0.624252  1
  P  P86  1  0.054104  1.030647  0.635544  1
  P  P87  1  0.398858  0.552685  0.636597  1
  P  P88  1  0.430270  0.990024  0.694575  1
  P  P89  1  0.836599  0.513901  0.662458  1
  P  P90  1  0.830551  1.073788  0.601698  1
  P  P91  1  0.616335  0.530574  0.650239  1
  P  P92  1  0.603320  1.090328  0.585550  1
  P  P93  1  0.417288  0.769941  0.668239  1
  P  P94  1  0.387993  0.330904  0.605574  1
  P  P95  1  0.921867  0.845113  0.620055  1
  P  P96  1  0.078618  0.252634  0.661785  1
  P  P97  1  0.782127  0.586143  0.787364  1
  P  P98  1  0.746531  0.159507  0.722809  1
  P  P99  1  -0.008898  0.600827  0.802152  1
  P  P100  1  0.917691  0.173254  0.757559  1
  P  P101  1  0.704222  0.562425  0.719003  1
  P  P102  1  0.714893  1.007152  0.781818  1
  P  P103  1  0.917933  0.537734  0.733469  1
  P  P104  1  0.919081  0.989275  0.802264  1
  P  P105  1  0.620648  0.216470  0.779392  1
  P  P106  1  0.706193  0.786235  0.751101  1
  P  P107  1  0.911130  0.327790  0.700548  1
  P  P108  1  0.903280  0.772552  0.769320  1
  P  P109  1  0.131369  0.503990  0.760979  1
  P  P110  1  0.063446  1.082297  0.712180  1
  P  P111  1  0.637028  0.432269  0.808211  1
  P  P112  1  0.501218  1.030639  0.765355  1
  P  P113  1  0.096847  0.293209  0.735974  1
  P  P114  1  0.000618  0.877410  0.687083  1
  P  P115  1  0.418249  0.245106  0.759922  1
  P  P116  1  0.492454  0.808263  0.736782  1
  P  P117  1  0.081482  0.477405  0.690583  1
  P  P118  1  0.065714  0.909131  0.758298  1
  P  P119  1  0.562140  0.402193  0.740643  1
  P  P120  1  0.572599  0.846474  0.802756  1
  P  P121  1  -0.035873  0.380254  0.784550  1
  P  P122  1  0.859452  0.961831  0.731192  1
  P  P123  1  0.772313  0.369437  0.755701  1
  P  P124  1  0.635471  0.968571  0.713824  1
  P  P125  1  0.571662  0.623061  0.773555  1
  P  P126  1  0.546140  0.182444  0.708118  1
  P  P127  1  0.062180  0.694733  0.727663  1
  P  P128  1  0.095122  0.120363  0.786656  1
