# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.74464716
_cell_length_b   16.48965425
_cell_length_c   16.73554696
_cell_angle_alpha   94.11353515
_cell_angle_beta   98.72841968
_cell_angle_gamma   100.18562517
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P47
_cell_volume   4472.27746093
_cell_formula_units_Z   47
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  0.787513  0.502683  0.684414  1
  P  P2  1  0.214547  0.499209  0.315819  1
  P  P3  1  0.714547  0.499209  0.315819  1
  P  P4  1  0.176060  0.453968  0.813087  1
  P  P5  1  0.673957  0.452078  0.812694  1
  P  P6  1  0.328103  0.549814  0.187539  1
  P  P7  1  0.828103  0.549814  0.187539  1
  P  P8  1  0.254310  0.636251  0.809986  1
  P  P9  1  0.754058  0.638688  0.809546  1
  P  P10  1  0.248003  0.363204  0.190687  1
  P  P11  1  0.748003  0.363204  0.190687  1
  P  P12  1  0.361927  0.512524  0.867947  1
  P  P13  1  0.864239  0.512012  0.868803  1
  P  P14  1  0.137821  0.489880  0.131430  1
  P  P15  1  0.637821  0.489880  0.131430  1
  P  P16  1  0.135297  0.871158  0.557570  1
  P  P17  1  0.635297  0.871158  0.557570  1
  P  P18  1  0.366764  0.130734  0.442663  1
  P  P19  1  0.866764  0.130734  0.442663  1
  P  P20  1  0.047610  0.684306  0.534463  1
  P  P21  1  0.547610  0.684306  0.534463  1
  P  P22  1  0.454450  0.317586  0.465771  1
  P  P23  1  0.954450  0.317586  0.465771  1
  P  P24  1  0.007314  0.806720  0.668530  1
  P  P25  1  0.507314  0.806720  0.668530  1
  P  P26  1  0.494746  0.195172  0.331704  1
  P  P27  1  0.994746  0.195172  0.331704  1
  P  P28  1  0.447350  0.821740  0.484077  1
  P  P29  1  0.947350  0.821740  0.484077  1
  P  P30  1  0.054710  0.180152  0.516156  1
  P  P31  1  0.554710  0.180152  0.516156  1
  P  P32  1  0.401062  0.185253  0.965855  1
  P  P33  1  0.901062  0.185253  0.965855  1
  P  P34  1  0.100998  0.816639  0.034379  1
  P  P35  1  0.600998  0.816639  0.034379  1
  P  P36  1  0.221942  0.128174  0.867942  1
  P  P37  1  0.721942  0.128174  0.867942  1
  P  P38  1  0.280118  0.873718  0.132291  1
  P  P39  1  0.780118  0.873718  0.132291  1
  P  P40  1  0.352109  0.013489  0.859900  1
  P  P41  1  0.852109  0.013489  0.859900  1
  P  P42  1  0.149951  0.988403  0.140334  1
  P  P43  1  0.649951  0.988403  0.140334  1
  P  P44  1  0.370126  0.178229  0.775499  1
  P  P45  1  0.870126  0.178229  0.775499  1
  P  P46  1  0.131934  0.823663  0.224734  1
  P  P47  1  0.631934  0.823663  0.224734  1
