# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54196894
_cell_length_b   9.21132262
_cell_length_c   46.79064562
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   106.48528629
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P39
_cell_volume   2290.41987395
_cell_formula_units_Z   39
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  1.015336  0.213827  0.304356  1
  P  P2  1  0.268295  0.580898  0.293470  1
  P  P3  1  0.526013  0.941147  0.283296  1
  P  P4  1  0.473221  0.135061  0.338469  1
  P  P5  1  0.726492  0.489181  0.325400  1
  P  P6  1  0.983578  0.849444  0.314479  1
  P  P7  1  0.939461  0.058697  0.371243  1
  P  P8  1  0.196528  0.419535  0.359847  1
  P  P9  1  0.455487  0.778926  0.348918  1
  P  P10  1  0.404888  0.983209  0.405570  1
  P  P11  1  0.663690  0.343037  0.393993  1
  P  P12  1  0.920674  0.700047  0.382025  1
  P  P13  1  0.871424  0.906735  0.439123  1
  P  P14  1  0.129775  0.266004  0.427716  1
  P  P15  1  0.388078  0.625337  0.416388  1
  P  P16  1  0.338285  0.831269  0.473141  1
  P  P17  1  0.596972  0.190630  0.461722  1
  P  P18  1  0.855424  0.549778  0.450256  1
  P  P19  1  0.804909  0.755498  0.507027  1
  P  P20  1  0.063414  0.114454  0.495572  1
  P  P21  1  0.321920  0.473411  0.484117  1
  P  P22  1  0.271404  0.679130  0.540889  1
  P  P23  1  0.529857  0.038279  0.529423  1
  P  P24  1  0.788544  0.397639  0.518004  1
  P  P25  1  0.738751  0.603571  0.574757  1
  P  P26  1  0.997054  0.962904  0.563429  1
  P  P27  1  0.255405  0.322173  0.552022  1
  P  P28  1  0.206154  0.528862  0.609120  1
  P  P29  1  0.463139  0.885871  0.597151  1
  P  P30  1  0.721941  0.245700  0.585575  1
  P  P31  1  0.671341  0.449983  0.642227  1
  P  P32  1  0.930300  0.809374  0.631297  1
  P  P33  1  0.187367  0.170212  0.619902  1
  P  P34  1  0.143251  0.379464  0.676666  1
  P  P35  1  0.400337  0.739727  0.665745  1
  P  P36  1  0.653608  0.093848  0.652676  1
  P  P37  1  0.600815  0.287762  0.707848  1
  P  P38  1  0.858533  0.648010  0.697675  1
  P  P39  1  0.111492  1.015082  0.686789  1
