# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.31512355
_cell_length_b   33.24575063
_cell_length_c   50.93407877
_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   P96
_cell_volume   5613.63688088
_cell_formula_units_Z   96
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  0.989982  0.400496  0.312601  1
  P  P2  1  0.989982  1.056731  0.348834  1
  P  P3  1  0.989982  0.742450  0.276425  1
  P  P4  1  0.989982  1.157909  0.284859  1
  P  P5  1  0.989982  0.814517  0.320459  1
  P  P6  1  0.989982  0.470948  0.358051  1
  P  P7  1  0.989982  0.228532  0.330846  1
  P  P8  1  0.989982  0.916113  0.259044  1
  P  P9  1  0.989982  0.572516  0.293919  1
  P  P10  1  0.989982  0.299121  0.376275  1
  P  P11  1  0.989982  0.986567  0.302517  1
  P  P12  1  0.989982  0.642646  0.339800  1
  P  P13  1  0.489982  0.242450  0.276425  1
  P  P14  1  0.489982  0.900496  0.312601  1
  P  P15  1  0.489982  0.556731  0.348834  1
  P  P16  1  0.489982  0.314517  0.320459  1
  P  P17  1  0.489982  0.970948  0.358051  1
  P  P18  1  0.489982  0.657909  0.284859  1
  P  P19  1  0.489982  0.416113  0.259044  1
  P  P20  1  0.489982  1.072516  0.293919  1
  P  P21  1  0.489982  0.728532  0.330846  1
  P  P22  1  0.489982  1.142646  0.339800  1
  P  P23  1  0.489982  0.799121  0.376275  1
  P  P24  1  0.489982  0.486567  0.302517  1
  P  P25  1  0.989982  0.369284  0.423061  1
  P  P26  1  0.989982  1.025649  0.460007  1
  P  P27  1  0.989982  0.713054  0.386263  1
  P  P28  1  0.989982  1.127103  0.395342  1
  P  P29  1  0.989982  0.783511  0.432108  1
  P  P30  1  0.989982  0.439724  0.469197  1
  P  P31  1  0.989982  0.197495  0.441714  1
  P  P32  1  0.989982  0.884708  0.367588  1
  P  P33  1  0.989982  0.541208  0.404453  1
  P  P34  1  0.989982  0.267920  0.487781  1
  P  P35  1  0.989982  0.955286  0.413651  1
  P  P36  1  0.989982  0.611558  0.450869  1
  P  P37  1  0.489982  0.213054  0.386263  1
  P  P38  1  0.489982  0.869284  0.423061  1
  P  P39  1  0.489982  0.525649  0.460007  1
  P  P40  1  0.489982  0.283511  0.432108  1
  P  P41  1  0.489982  0.939724  0.469197  1
  P  P42  1  0.489982  0.627103  0.395342  1
  P  P43  1  0.489982  0.384708  0.367588  1
  P  P44  1  0.489982  1.041208  0.404453  1
  P  P45  1  0.489982  0.697495  0.441714  1
  P  P46  1  0.489982  1.111558  0.450869  1
  P  P47  1  0.489982  0.767920  0.487781  1
  P  P48  1  0.489982  0.455286  0.413651  1
  P  P49  1  0.989982  0.338147  0.534313  1
  P  P50  1  0.989982  0.994554  0.571079  1
  P  P51  1  0.989982  0.681934  0.497224  1
  P  P52  1  0.989982  1.096009  0.506415  1
  P  P53  1  0.989982  0.752374  0.543360  1
  P  P54  1  0.989982  0.408603  0.580158  1
  P  P55  1  0.989982  1.166372  0.552771  1
  P  P56  1  0.989982  0.853738  0.478640  1
  P  P57  1  0.989982  0.510100  0.515553  1
  P  P58  1  0.989982  0.236950  0.598833  1
  P  P59  1  0.989982  0.924163  0.524707  1
  P  P60  1  0.989982  0.580449  0.561969  1
  P  P61  1  0.489982  1.181934  0.497224  1
  P  P62  1  0.489982  0.838147  0.534313  1
  P  P63  1  0.489982  0.494554  0.571079  1
  P  P64  1  0.489982  0.252374  0.543360  1
  P  P65  1  0.489982  0.908603  0.580158  1
  P  P66  1  0.489982  0.596009  0.506415  1
  P  P67  1  0.489982  0.353738  0.478640  1
  P  P68  1  0.489982  1.010100  0.515553  1
  P  P69  1  0.489982  0.666372  0.552771  1
  P  P70  1  0.489982  1.080449  0.561969  1
  P  P71  1  0.489982  0.736950  0.598833  1
  P  P72  1  0.489982  0.424163  0.524707  1
  P  P73  1  0.989982  0.307141  0.645962  1
  P  P74  1  0.989982  0.963749  0.681563  1
  P  P75  1  0.989982  0.650710  0.608370  1
  P  P76  1  0.989982  1.064927  0.617587  1
  P  P77  1  0.989982  0.721162  0.653821  1
  P  P78  1  0.989982  0.379208  0.689996  1
  P  P79  1  0.989982  1.135091  0.663905  1
  P  P80  1  0.989982  0.822537  0.590147  1
  P  P81  1  0.989982  0.479012  0.626621  1
  P  P82  1  0.989982  0.205545  0.707378  1
  P  P83  1  0.989982  0.893125  0.635576  1
  P  P84  1  0.989982  0.549141  0.672502  1
  P  P85  1  0.489982  1.150710  0.608370  1
  P  P86  1  0.489982  0.807141  0.645962  1
  P  P87  1  0.489982  0.463749  0.681563  1
  P  P88  1  0.489982  0.221162  0.653821  1
  P  P89  1  0.489982  0.879208  0.689996  1
  P  P90  1  0.489982  0.564927  0.617587  1
  P  P91  1  0.489982  0.322537  0.590147  1
  P  P92  1  0.489982  0.979012  0.626621  1
  P  P93  1  0.489982  0.635091  0.663905  1
  P  P94  1  0.489982  1.049141  0.672502  1
  P  P95  1  0.489982  0.705545  0.707378  1
  P  P96  1  0.489982  0.393125  0.635576  1
