# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.34271598
_cell_length_b   37.89042778
_cell_length_c   56.34355406
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   85.02654366
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P96
_cell_volume   17743.651004
_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  0.010593  0.496270  0.266862  1
  P  P2  1  0.813835  0.110311  0.391902  1
  P  P3  1  0.011344  0.578834  0.359425  1
  P  P4  1  0.815020  0.192790  0.484425  1
  P  P5  1  0.886053  0.675275  0.491113  1
  P  P6  1  0.082377  0.061319  0.366113  1
  P  P7  1  0.742802  0.627826  0.385214  1
  P  P8  1  0.943046  0.013174  0.260495  1
  P  P9  1  0.760803  0.748294  0.468593  1
  P  P10  1  0.957127  0.134338  0.343593  1
  P  P11  1  0.868051  0.554807  0.407734  1
  P  P12  1  0.065204  0.941883  0.282564  1
  P  P13  1  0.538073  0.685646  0.469588  1
  P  P14  1  0.734397  0.071690  0.344588  1
  P  P15  1  0.090781  0.617455  0.406739  1
  P  P16  1  0.282790  0.003077  0.281587  1
  P  P17  1  0.340741  0.666922  0.252888  1
  P  P18  1  0.140462  0.281484  0.377534  1
  P  P19  1  0.684716  0.407661  0.373793  1
  P  P20  1  0.488392  0.021617  0.498793  1
  P  P21  1  0.467527  0.601433  0.281414  1
  P  P22  1  0.270534  0.214385  0.406656  1
  P  P23  1  0.554644  0.474760  0.344671  1
  P  P24  1  0.358321  0.088716  0.469671  1
  P  P25  1  0.232081  0.845056  0.482807  1
  P  P26  1  0.428405  0.231100  0.357807  1
  P  P27  1  0.396774  0.458045  0.393519  1
  P  P28  1  0.593614  0.843980  0.268482  1
  P  P29  1  0.671187  0.664706  0.276946  1
  P  P30  1  0.478971  0.279169  0.402096  1
  P  P31  1  0.346207  0.409976  0.349231  1
  P  P32  1  0.149884  0.023932  0.474231  1
  P  P33  1  0.438683  0.537457  0.486169  1
  P  P34  1  0.635007  0.923501  0.361169  1
  P  P35  1  0.190172  0.765644  0.390158  1
  P  P36  1  0.386080  0.151690  0.265116  1
  P  P37  1  0.136036  0.309841  0.268005  1
  P  P38  1  0.944660  0.923812  0.392800  1
  P  P39  1  0.880518  0.765334  0.358527  1
  P  P40  1  0.684194  0.379290  0.483527  1
  P  P41  1  0.855795  0.268241  0.284025  1
  P  P42  1  0.657636  0.881226  0.409143  1
  P  P43  1  0.167542  0.807920  0.342184  1
  P  P44  1  0.971219  0.421876  0.467184  1
  P  P45  1  0.819661  0.349472  0.284560  1
  P  P46  1  0.620641  0.964383  0.409689  1
  P  P47  1  0.204538  0.724763  0.341637  1
  P  P48  1  0.008214  0.338719  0.466637  1
  P  P49  1  0.617511  0.724267  0.516902  1
  P  P50  1  0.421187  0.338223  0.641902  1
  P  P51  1  0.618696  0.806746  0.609425  1
  P  P52  1  0.421938  0.420787  0.734465  1
  P  P53  1  0.489485  0.903883  0.740832  1
  P  P54  1  0.689729  0.289231  0.616113  1
  P  P55  1  0.350154  0.855738  0.635214  1
  P  P56  1  0.546478  0.241782  0.510214  1
  P  P57  1  0.367327  0.975174  0.718763  1
  P  P58  1  0.564480  0.362250  0.593593  1
  P  P59  1  0.475404  0.782719  0.657734  1
  P  P60  1  0.671728  0.168763  0.532734  1
  P  P61  1  0.149741  0.913980  0.719740  1
  P  P62  1  0.341750  0.299602  0.594588  1
  P  P63  1  0.698134  0.845366  0.656739  1
  P  P64  1  0.894458  0.231411  0.531739  1
  P  P65  1  0.944138  0.895440  0.502534  1
  P  P66  1  0.747815  0.509396  0.627534  1
  P  P67  1  0.292069  0.635572  0.623793  1
  P  P68  1  0.091790  0.250135  0.748439  1
  P  P69  1  0.074210  0.828341  0.531656  1
  P  P70  1  0.877887  0.442297  0.656656  1
  P  P71  1  0.161997  0.702672  0.594671  1
  P  P72  1  0.965004  0.315624  0.719913  1
  P  P73  1  0.838917  0.073077  0.732845  1
  P  P74  1  0.035757  0.459012  0.607807  1
  P  P75  1  0.004126  0.685957  0.643519  1
  P  P76  1  0.200450  0.072001  0.518519  1
  P  P77  1  0.282647  0.893125  0.527096  1
  P  P78  1  0.086324  0.507081  0.652096  1
  P  P79  1  0.953560  0.637888  0.599231  1
  P  P80  1  0.761344  0.252351  0.724381  1
  P  P81  1  0.046451  0.765367  0.736211  1
  P  P82  1  0.242359  0.151413  0.611169  1
  P  P83  1  0.797524  0.993556  0.640158  1
  P  P84  1  0.993848  0.379600  0.515158  1
  P  P85  1  0.748337  0.537767  0.517800  1
  P  P86  1  0.552013  0.151723  0.642800  1
  P  P87  1  0.487871  0.993245  0.608527  1
  P  P88  1  0.296495  0.607216  0.733321  1
  P  P89  1  0.461312  0.495181  0.534143  1
  P  P90  1  0.264989  0.109137  0.659143  1
  P  P91  1  0.774895  0.035831  0.592184  1
  P  P92  1  0.576736  0.648816  0.717302  1
  P  P93  1  0.424317  0.578338  0.534689  1
  P  P94  1  0.227993  0.192294  0.659689  1
  P  P95  1  0.811890  0.952674  0.591637  1
  P  P96  1  0.612870  0.567585  0.716767  1
