# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.42334276
_cell_length_b   22.67214502
_cell_length_c   51.78541748
_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   P112
_cell_volume   6367.47349163
_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
  P  P1  1  1.019970  1.049040  0.255529  1
  P  P2  1  1.019970  0.558193  0.287042  1
  P  P3  1  1.019970  0.424854  0.263467  1
  P  P4  1  1.019970  0.937825  0.294877  1
  P  P5  1  0.519970  0.338851  0.268742  1
  P  P6  1  0.519970  0.850998  0.300740  1
  P  P7  1  0.519970  0.205354  0.246132  1
  P  P8  1  0.519970  0.718994  0.276189  1
  P  P9  1  1.019970  0.314621  0.302932  1
  P  P10  1  1.019970  0.804595  0.270852  1
  P  P11  1  1.019970  0.182703  0.278669  1
  P  P12  1  1.019970  0.668877  0.247982  1
  P  P13  1  0.519970  1.094812  0.284947  1
  P  P14  1  0.519970  0.585398  0.253360  1
  P  P15  1  0.519970  0.471893  0.292558  1
  P  P16  1  0.519970  0.963170  0.261170  1
  P  P17  1  1.019970  1.070622  0.319152  1
  P  P18  1  1.019970  0.580999  0.351305  1
  P  P19  1  1.019970  0.447301  0.327227  1
  P  P20  1  1.019970  0.958693  0.359597  1
  P  P21  1  0.519970  0.360954  0.333034  1
  P  P22  1  0.519970  0.871876  0.365446  1
  P  P23  1  0.519970  0.227824  0.309178  1
  P  P24  1  0.519970  0.739115  0.340911  1
  P  P25  1  1.019970  0.335994  0.367707  1
  P  P26  1  1.019970  0.825810  0.335030  1
  P  P27  1  1.019970  0.203159  0.343524  1
  P  P28  1  1.019970  0.692714  0.310667  1
  P  P29  1  0.519970  1.116401  0.349629  1
  P  P30  1  0.519970  0.606270  0.316516  1
  P  P31  1  0.519970  0.494452  0.357147  1
  P  P32  1  0.519970  0.983564  0.325093  1
  P  P33  1  1.019970  1.091480  0.384032  1
  P  P34  1  1.019970  0.602493  0.416014  1
  P  P35  1  1.019970  0.469312  0.391811  1
  P  P36  1  1.019970  0.979876  0.424435  1
  P  P37  1  0.519970  0.382816  0.397797  1
  P  P38  1  0.519970  0.893137  0.430279  1
  P  P39  1  0.519970  0.249574  0.373809  1
  P  P40  1  0.519970  0.760276  0.405808  1
  P  P41  1  1.019970  0.357564  0.432354  1
  P  P42  1  1.019970  0.847045  0.399960  1
  P  P43  1  1.019970  0.224409  0.408274  1
  P  P44  1  1.019970  0.714158  0.375514  1
  P  P45  1  0.519970  1.137852  0.414290  1
  P  P46  1  0.519970  0.627450  0.381421  1
  P  P47  1  0.519970  0.515849  0.421955  1
  P  P48  1  0.519970  1.004745  0.389935  1
  P  P49  1  1.019970  1.112783  0.448784  1
  P  P50  1  1.019970  0.623869  0.480791  1
  P  P51  1  1.019970  0.490734  0.456506  1
  P  P52  1  1.019970  1.001228  0.489244  1
  P  P53  1  0.519970  0.404179  0.462533  1
  P  P54  1  0.519970  0.914509  0.495121  1
  P  P55  1  0.519970  0.271074  0.438447  1
  P  P56  1  0.519970  0.781629  0.470663  1
  P  P57  1  1.019970  0.378927  0.497045  1
  P  P58  1  1.019970  0.868372  0.464829  1
  P  P59  1  1.019970  0.245822  0.472959  1
  P  P60  1  1.019970  0.735492  0.440371  1
  P  P61  1  0.519970  1.159267  0.478985  1
  P  P62  1  0.519970  0.648773  0.446248  1
  P  P63  1  0.519970  0.537218  0.486708  1
  P  P64  1  0.519970  1.026132  0.454701  1
  P  P65  1  1.019970  1.134152  0.513536  1
  P  P66  1  1.019970  0.645256  0.545557  1
  P  P67  1  1.019970  0.512149  0.521202  1
  P  P68  1  1.019970  1.022551  0.554071  1
  P  P69  1  0.519970  0.425592  0.527218  1
  P  P70  1  0.519970  0.935843  0.559978  1
  P  P71  1  0.519970  0.292437  0.503138  1
  P  P72  1  0.519970  0.802956  0.535531  1
  P  P73  1  1.019970  0.400427  0.561683  1
  P  P74  1  1.019970  0.889725  0.529684  1
  P  P75  1  1.019970  0.267185  0.537695  1
  P  P76  1  1.019970  0.756864  0.505212  1
  P  P77  1  0.519970  0.180688  0.543681  1
  P  P78  1  0.519970  0.670125  0.511057  1
  P  P79  1  0.519970  0.558521  0.551460  1
  P  P80  1  0.519970  1.047508  0.519478  1
  P  P81  1  1.019970  1.155549  0.578345  1
  P  P82  1  1.019970  0.666437  0.610399  1
  P  P83  1  1.019970  0.533600  0.585862  1
  P  P84  1  1.019970  1.043731  0.618976  1
  P  P85  1  0.519970  0.446842  0.591968  1
  P  P86  1  0.519970  0.957287  0.624824  1
  P  P87  1  0.519970  0.314007  0.567785  1
  P  P88  1  0.519970  0.824191  0.600462  1
  P  P89  1  1.019970  0.422177  0.626313  1
  P  P90  1  1.019970  0.910886  0.594581  1
  P  P91  1  1.019970  0.289047  0.602458  1
  P  P92  1  1.019970  0.778125  0.570046  1
  P  P93  1  0.519970  0.202700  0.608265  1
  P  P94  1  0.519970  0.691308  0.575895  1
  P  P95  1  0.519970  0.579379  0.616340  1
  P  P96  1  0.519970  1.069002  0.584187  1
  P  P97  1  1.019970  0.178108  0.642934  1
  P  P98  1  1.019970  0.686831  0.674322  1
  P  P99  1  1.019970  0.555189  0.650545  1
  P  P100  1  1.019970  1.064603  0.682132  1
  P  P101  1  0.519970  0.467298  0.656823  1
  P  P102  1  0.519970  0.981124  0.687510  1
  P  P103  1  0.519970  0.335379  0.632560  1
  P  P104  1  0.519970  0.845406  0.664639  1
  P  P105  1  1.019970  0.444647  0.689360  1
  P  P106  1  1.019970  0.931007  0.659303  1
  P  P107  1  1.019970  0.311150  0.666750  1
  P  P108  1  1.019970  0.799003  0.634752  1
  P  P109  1  0.519970  0.225147  0.672025  1
  P  P110  1  0.519970  0.712176  0.640615  1
  P  P111  1  0.519970  0.600961  0.679963  1
  P  P112  1  0.519970  1.091808  0.648450  1
