# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.28969648
_cell_length_b   33.49514796
_cell_length_c   51.45922626
_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   5670.23400964
_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  0.993769  0.729671  0.323625  1
  P  P2  1  0.993769  0.394807  0.287242  1
  P  P3  1  0.993769  1.062681  0.359378  1
  P  P4  1  0.993769  0.479870  0.321510  1
  P  P5  1  0.993769  1.147269  0.286643  1
  P  P6  1  0.993769  0.813133  0.359414  1
  P  P7  1  0.993769  0.562681  0.359378  1
  P  P8  1  0.993769  0.229671  0.323625  1
  P  P9  1  0.993769  0.894807  0.287242  1
  P  P10  1  0.993769  0.647269  0.286643  1
  P  P11  1  0.993769  0.313133  0.359414  1
  P  P12  1  0.993769  0.979870  0.321510  1
  P  P13  1  0.493769  0.564370  0.304518  1
  P  P14  1  0.493769  0.228700  0.269206  1
  P  P15  1  0.493769  0.896450  0.341335  1
  P  P16  1  0.493769  0.646312  0.341622  1
  P  P17  1  0.493769  0.312345  0.303836  1
  P  P18  1  0.493769  0.979506  0.377265  1
  P  P19  1  0.493769  0.728700  0.269206  1
  P  P20  1  0.493769  0.396450  0.341335  1
  P  P21  1  0.493769  1.064370  0.304518  1
  P  P22  1  0.493769  0.479506  0.377265  1
  P  P23  1  0.493769  1.146312  0.341622  1
  P  P24  1  0.493769  0.812345  0.303836  1
  P  P25  1  0.993769  0.729304  0.434352  1
  P  P26  1  0.993769  0.396165  0.396759  1
  P  P27  1  0.993769  1.062377  0.470550  1
  P  P28  1  0.993769  0.479280  0.433122  1
  P  P29  1  0.993769  1.146095  0.397077  1
  P  P30  1  0.993769  0.812431  0.470848  1
  P  P31  1  0.993769  0.562377  0.470550  1
  P  P32  1  0.993769  0.229304  0.434352  1
  P  P33  1  0.993769  0.896165  0.396759  1
  P  P34  1  0.993769  0.646095  0.397077  1
  P  P35  1  0.993769  0.312431  0.470848  1
  P  P36  1  0.993769  0.979280  0.433122  1
  P  P37  1  0.493769  0.562622  0.414972  1
  P  P38  1  0.493769  0.229681  0.378935  1
  P  P39  1  0.493769  0.895857  0.452258  1
  P  P40  1  0.493769  0.645823  0.452576  1
  P  P41  1  0.493769  0.312774  0.415205  1
  P  P42  1  0.493769  0.978963  0.488788  1
  P  P43  1  0.493769  0.729681  0.378935  1
  P  P44  1  0.493769  0.395857  0.452258  1
  P  P45  1  0.493769  1.062622  0.414972  1
  P  P46  1  0.493769  0.478963  0.488788  1
  P  P47  1  0.493769  1.145823  0.452576  1
  P  P48  1  0.493769  0.812774  0.415205  1
  P  P49  1  0.993769  0.728663  0.545559  1
  P  P50  1  0.993769  0.395513  0.507833  1
  P  P51  1  0.993769  1.061849  0.581603  1
  P  P52  1  0.993769  0.478639  0.544328  1
  P  P53  1  0.993769  1.145566  0.508131  1
  P  P54  1  0.993769  0.811778  0.581921  1
  P  P55  1  0.993769  0.561849  0.581603  1
  P  P56  1  0.993769  0.228663  0.545559  1
  P  P57  1  0.993769  0.895513  0.507833  1
  P  P58  1  0.993769  0.645566  0.508131  1
  P  P59  1  0.993769  0.311778  0.581921  1
  P  P60  1  0.993769  0.978639  0.544328  1
  P  P61  1  0.493769  0.562121  0.526105  1
  P  P62  1  0.493769  0.228981  0.489892  1
  P  P63  1  0.493769  0.895170  0.563475  1
  P  P64  1  0.493769  0.645322  0.563708  1
  P  P65  1  0.493769  0.312086  0.526422  1
  P  P66  1  0.493769  0.978263  0.599745  1
  P  P67  1  0.493769  0.728981  0.489892  1
  P  P68  1  0.493769  0.395170  0.563475  1
  P  P69  1  0.493769  1.062121  0.526105  1
  P  P70  1  0.493769  0.478263  0.599745  1
  P  P71  1  0.493769  1.145322  0.563708  1
  P  P72  1  0.493769  0.812086  0.526422  1
  P  P73  1  0.993769  0.728073  0.657170  1
  P  P74  1  0.993769  0.394810  0.619266  1
  P  P75  1  0.993769  1.060675  0.692038  1
  P  P76  1  0.993769  0.478273  0.655056  1
  P  P77  1  0.993769  1.145262  0.619302  1
  P  P78  1  0.993769  0.813136  0.691439  1
  P  P79  1  0.993769  0.560675  0.692038  1
  P  P80  1  0.993769  0.228073  0.657170  1
  P  P81  1  0.993769  0.894810  0.619266  1
  P  P82  1  0.993769  0.645262  0.619302  1
  P  P83  1  0.993769  0.313136  0.691439  1
  P  P84  1  0.993769  0.978273  0.655056  1
  P  P85  1  0.493769  0.561631  0.637058  1
  P  P86  1  0.493769  0.228437  0.601416  1
  P  P87  1  0.493769  0.895598  0.674844  1
  P  P88  1  0.493769  0.643573  0.674163  1
  P  P89  1  0.493769  0.311493  0.637345  1
  P  P90  1  0.493769  0.979243  0.709474  1
  P  P91  1  0.493769  0.728437  0.601416  1
  P  P92  1  0.493769  0.395598  0.674844  1
  P  P93  1  0.493769  1.061631  0.637058  1
  P  P94  1  0.493769  0.479243  0.709474  1
  P  P95  1  0.493769  1.143573  0.674163  1
  P  P96  1  0.493769  0.811493  0.637345  1
