# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   24.89831978
_cell_length_b   24.89831978
_cell_length_c   49.85319454
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.26082952
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P108
_cell_volume   30750.3930298
_cell_formula_units_Z   108
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  0.106061  0.439394  0.357143  1
  P  P2  1  0.439394  0.106061  0.357143  1
  P  P3  1  0.409091  0.409091  0.404762  1
  P  P4  1  0.772727  0.772727  0.357143  1
  P  P5  1  0.742424  0.075758  0.404762  1
  P  P6  1  0.803030  0.469697  0.309524  1
  P  P7  1  0.075758  0.742424  0.404762  1
  P  P8  1  0.136364  0.136364  0.309524  1
  P  P9  1  0.469697  0.803030  0.309524  1
  P  P10  1  0.242424  0.575758  0.404762  1
  P  P11  1  0.575758  0.242424  0.404762  1
  P  P12  1  0.636364  0.636364  0.309524  1
  P  P13  1  0.909091  0.909091  0.404762  1
  P  P14  1  0.969697  0.303030  0.309524  1
  P  P15  1  0.939394  0.606061  0.357143  1
  P  P16  1  0.303030  0.969697  0.309524  1
  P  P17  1  0.272727  0.272727  0.357143  1
  P  P18  1  0.606061  0.939394  0.357143  1
  P  P19  1  0.136364  0.636364  0.309524  1
  P  P20  1  0.469697  0.303030  0.309524  1
  P  P21  1  0.439394  0.606061  0.357143  1
  P  P22  1  0.803030  0.969697  0.309524  1
  P  P23  1  0.772727  0.272727  0.357143  1
  P  P24  1  0.742424  0.575758  0.404762  1
  P  P25  1  0.106061  0.939394  0.357143  1
  P  P26  1  0.075758  0.242424  0.404762  1
  P  P27  1  0.409091  0.909091  0.404762  1
  P  P28  1  0.303030  0.469697  0.309524  1
  P  P29  1  0.636364  0.136364  0.309524  1
  P  P30  1  0.606061  0.439394  0.357143  1
  P  P31  1  0.969697  0.803030  0.309524  1
  P  P32  1  0.939394  0.106061  0.357143  1
  P  P33  1  0.909091  0.409091  0.404762  1
  P  P34  1  0.272727  0.772727  0.357143  1
  P  P35  1  0.242424  0.075758  0.404762  1
  P  P36  1  0.575758  0.742424  0.404762  1
  P  P37  1  0.015152  0.348485  0.500000  1
  P  P38  1  0.348485  0.015152  0.500000  1
  P  P39  1  0.318182  0.318182  0.547619  1
  P  P40  1  0.681818  0.681818  0.500000  1
  P  P41  1  0.651515  0.984848  0.547619  1
  P  P42  1  0.712121  0.378788  0.452381  1
  P  P43  1  0.984848  0.651515  0.547619  1
  P  P44  1  0.045455  0.045455  0.452381  1
  P  P45  1  0.378788  0.712121  0.452381  1
  P  P46  1  0.151515  0.484848  0.547619  1
  P  P47  1  0.484848  0.151515  0.547619  1
  P  P48  1  0.545455  0.545455  0.452381  1
  P  P49  1  0.818182  0.818182  0.547619  1
  P  P50  1  0.878788  0.212121  0.452381  1
  P  P51  1  0.848485  0.515152  0.500000  1
  P  P52  1  0.212121  0.878788  0.452381  1
  P  P53  1  0.181818  0.181818  0.500000  1
  P  P54  1  0.515152  0.848485  0.500000  1
  P  P55  1  0.045455  0.545455  0.452381  1
  P  P56  1  0.378788  0.212121  0.452381  1
  P  P57  1  0.348485  0.515152  0.500000  1
  P  P58  1  0.712121  0.878788  0.452381  1
  P  P59  1  0.681818  0.181818  0.500000  1
  P  P60  1  0.651515  0.484848  0.547619  1
  P  P61  1  0.015152  0.848485  0.500000  1
  P  P62  1  0.984848  0.151515  0.547619  1
  P  P63  1  0.318182  0.818182  0.547619  1
  P  P64  1  0.212121  0.378788  0.452381  1
  P  P65  1  0.545455  0.045455  0.452381  1
  P  P66  1  0.515152  0.348485  0.500000  1
  P  P67  1  0.878788  0.712121  0.452381  1
  P  P68  1  0.848485  0.015152  0.500000  1
  P  P69  1  0.818182  0.318182  0.547619  1
  P  P70  1  0.181818  0.681818  0.500000  1
  P  P71  1  0.151515  0.984848  0.547619  1
  P  P72  1  0.484848  0.651515  0.547619  1
  P  P73  1  0.924242  0.257576  0.642857  1
  P  P74  1  0.257576  0.924242  0.642857  1
  P  P75  1  0.227273  0.227273  0.690476  1
  P  P76  1  0.590909  0.590909  0.642857  1
  P  P77  1  0.560606  0.893939  0.690476  1
  P  P78  1  0.621212  0.287879  0.595238  1
  P  P79  1  0.893939  0.560606  0.690476  1
  P  P80  1  0.954545  0.954545  0.595238  1
  P  P81  1  0.287879  0.621212  0.595238  1
  P  P82  1  0.060606  0.393939  0.690476  1
  P  P83  1  0.393939  0.060606  0.690476  1
  P  P84  1  0.454545  0.454545  0.595238  1
  P  P85  1  0.727273  0.727273  0.690476  1
  P  P86  1  0.787879  0.121212  0.595238  1
  P  P87  1  0.757576  0.424242  0.642857  1
  P  P88  1  0.121212  0.787879  0.595238  1
  P  P89  1  0.090909  0.090909  0.642857  1
  P  P90  1  0.424242  0.757576  0.642857  1
  P  P91  1  0.954545  0.454545  0.595238  1
  P  P92  1  0.287879  0.121212  0.595238  1
  P  P93  1  0.257576  0.424242  0.642857  1
  P  P94  1  0.621212  0.787879  0.595238  1
  P  P95  1  0.590909  0.090909  0.642857  1
  P  P96  1  0.560606  0.393939  0.690476  1
  P  P97  1  0.924242  0.757576  0.642857  1
  P  P98  1  0.893939  0.060606  0.690476  1
  P  P99  1  0.227273  0.727273  0.690476  1
  P  P100  1  0.121212  0.287879  0.595238  1
  P  P101  1  0.454545  0.954545  0.595238  1
  P  P102  1  0.424242  0.257576  0.642857  1
  P  P103  1  0.787879  0.621212  0.595238  1
  P  P104  1  0.757576  0.924242  0.642857  1
  P  P105  1  0.727273  0.227273  0.690476  1
  P  P106  1  0.090909  0.590909  0.642857  1
  P  P107  1  0.060606  0.893939  0.690476  1
  P  P108  1  0.393939  0.560606  0.690476  1
