# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.75854557
_cell_length_b   16.50148482
_cell_length_c   16.70853107
_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   4471.97016919
_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  0.287426  0.503492  0.687451  1
  P  P2  1  0.787133  0.502409  0.685040  1
  P  P3  1  0.214245  0.498931  0.316811  1
  P  P4  1  0.714245  0.498931  0.316811  1
  P  P5  1  0.673703  0.451861  0.813559  1
  P  P6  1  0.327675  0.549479  0.188292  1
  P  P7  1  0.827675  0.549479  0.188292  1
  P  P8  1  0.254806  0.636274  0.809881  1
  P  P9  1  0.753733  0.638333  0.810374  1
  P  P10  1  0.247645  0.363007  0.191476  1
  P  P11  1  0.747645  0.363007  0.191476  1
  P  P12  1  0.362385  0.512648  0.867846  1
  P  P13  1  0.863832  0.511753  0.869719  1
  P  P14  1  0.137546  0.489588  0.132131  1
  P  P15  1  0.637546  0.489588  0.132131  1
  P  P16  1  0.134867  0.870824  0.558347  1
  P  P17  1  0.634867  0.870824  0.558347  1
  P  P18  1  0.366511  0.130516  0.443504  1
  P  P19  1  0.866511  0.130516  0.443504  1
  P  P20  1  0.047253  0.684107  0.535234  1
  P  P21  1  0.547253  0.684107  0.535234  1
  P  P22  1  0.454125  0.317233  0.466617  1
  P  P23  1  0.954125  0.317233  0.466617  1
  P  P24  1  0.007019  0.806451  0.669521  1
  P  P25  1  0.507019  0.806451  0.669521  1
  P  P26  1  0.494359  0.194890  0.332330  1
  P  P27  1  0.994359  0.194890  0.332330  1
  P  P28  1  0.447067  0.821438  0.484773  1
  P  P29  1  0.947067  0.821438  0.484773  1
  P  P30  1  0.054311  0.179902  0.517078  1
  P  P31  1  0.554311  0.179902  0.517078  1
  P  P32  1  0.400686  0.184945  0.966809  1
  P  P33  1  0.900686  0.184945  0.966809  1
  P  P34  1  0.100692  0.816396  0.035041  1
  P  P35  1  0.600692  0.816396  0.035041  1
  P  P36  1  0.221700  0.127901  0.868774  1
  P  P37  1  0.721700  0.127901  0.868774  1
  P  P38  1  0.279678  0.873440  0.133077  1
  P  P39  1  0.779678  0.873440  0.133077  1
  P  P40  1  0.351754  0.013293  0.860703  1
  P  P41  1  0.851754  0.013293  0.860703  1
  P  P42  1  0.149624  0.988047  0.141148  1
  P  P43  1  0.649624  0.988047  0.141148  1
  P  P44  1  0.369736  0.177902  0.776145  1
  P  P45  1  0.869736  0.177902  0.776145  1
  P  P46  1  0.131642  0.823438  0.225706  1
  P  P47  1  0.631642  0.823438  0.225706  1
