# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.59683592
_cell_length_b   38.39770843
_cell_length_c   39.00601400
_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   P128
_cell_volume   9880.35526985
_cell_formula_units_Z   128
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  0.218666  0.300656  0.533353  1
  P  P2  1  0.209799  0.864205  0.492711  1
  P  P3  1  0.219578  0.211815  0.512163  1
  P  P4  1  0.215667  0.648514  0.553159  1
  P  P5  1  0.468611  0.364205  0.492711  1
  P  P6  1  0.459744  0.800656  0.533353  1
  P  P7  1  0.462743  0.148514  0.553159  1
  P  P8  1  0.458832  0.711815  0.512163  1
  P  P9  1  0.969989  0.364200  0.492703  1
  P  P10  1  0.959738  0.802654  0.534387  1
  P  P11  1  0.965389  0.148550  0.549971  1
  P  P12  1  0.959954  0.585363  0.593413  1
  P  P13  1  0.492660  0.581120  0.513658  1
  P  P14  1  0.389009  0.143566  0.473742  1
  P  P15  1  0.467337  0.367125  0.573674  1
  P  P16  1  0.459095  0.928978  0.530476  1
  P  P17  1  0.994089  0.584008  0.512493  1
  P  P18  1  0.947432  0.018139  0.553502  1
  P  P19  1  0.968981  0.367121  0.573661  1
  P  P20  1  0.959078  0.928665  0.530581  1
  P  P21  1  0.730979  0.518139  0.553502  1
  P  P22  1  0.684321  0.084008  0.512493  1
  P  P23  1  0.719332  0.428665  0.530581  1
  P  P24  1  0.709430  0.867121  0.573661  1
  P  P25  1  0.718456  0.085363  0.593413  1
  P  P26  1  0.713021  0.648550  0.549971  1
  P  P27  1  0.718672  0.302654  0.534387  1
  P  P28  1  0.708422  0.864200  0.492703  1
  P  P29  1  0.219315  0.428978  0.530476  1
  P  P30  1  0.211073  0.867125  0.573674  1
  P  P31  1  0.289401  0.643566  0.473742  1
  P  P32  1  0.185750  0.081120  0.513658  1
  P  P33  1  0.213776  0.176241  0.618299  1
  P  P34  1  0.208123  0.738815  0.576680  1
  P  P35  1  0.216143  0.085277  0.594125  1
  P  P36  1  0.210351  0.523143  0.636133  1
  P  P37  1  0.470287  0.238815  0.576680  1
  P  P38  1  0.464635  0.676241  0.618299  1
  P  P39  1  0.468060  0.023143  0.636133  1
  P  P40  1  0.462267  0.585277  0.594125  1
  P  P41  1  0.965363  0.238720  0.576543  1
  P  P42  1  0.960652  0.675745  0.619174  1
  P  P43  1  0.966860  0.023060  0.636193  1
  P  P44  1  0.960027  0.460966  0.679426  1
  P  P45  1  0.471014  0.456560  0.597214  1
  P  P46  1  0.450208  0.018494  0.553493  1
  P  P47  1  0.466353  0.242135  0.659003  1
  P  P48  1  0.461308  0.804516  0.616188  1
  P  P49  1  0.971291  0.456414  0.597237  1
  P  P50  1  0.960062  0.894346  0.640586  1
  P  P51  1  0.966459  0.242073  0.659320  1
  P  P52  1  0.960981  0.804736  0.616769  1
  P  P53  1  0.718349  0.394346  0.640586  1
  P  P54  1  0.707119  0.956414  0.597237  1
  P  P55  1  0.717429  0.304736  0.616769  1
  P  P56  1  0.711952  0.742073  0.659320  1
  P  P57  1  0.718383  0.960966  0.679426  1
  P  P58  1  0.711551  0.523060  0.636193  1
  P  P59  1  0.717758  0.175745  0.619174  1
  P  P60  1  0.713048  0.738720  0.576543  1
  P  P61  1  0.217102  0.304516  0.616188  1
  P  P62  1  0.212057  0.742135  0.659003  1
  P  P63  1  0.228202  0.518494  0.553493  1
  P  P64  1  0.207397  0.956560  0.597214  1
  P  P65  1  0.217429  0.050582  0.703281  1
  P  P66  1  0.211952  0.613245  0.660730  1
  P  P67  1  0.218349  0.960973  0.679465  1
  P  P68  1  0.207119  0.398905  0.722814  1
  P  P69  1  0.466459  0.113245  0.660730  1
  P  P70  1  0.460981  0.550582  0.703281  1
  P  P71  1  0.471291  0.898905  0.722814  1
  P  P72  1  0.460062  0.460973  0.679465  1
  P  P73  1  0.966353  0.113183  0.661047  1
  P  P74  1  0.961308  0.550802  0.703862  1
  P  P75  1  0.971014  0.898758  0.722836  1
  P  P76  1  0.950208  0.336824  0.766557  1
  P  P77  1  0.466860  0.332258  0.683858  1
  P  P78  1  0.460027  0.894352  0.640625  1
  P  P79  1  0.465363  0.116598  0.743507  1
  P  P80  1  0.460652  0.679573  0.700877  1
  P  P81  1  0.968060  0.332175  0.683917  1
  P  P82  1  0.962267  0.770042  0.725925  1
  P  P83  1  0.970287  0.116504  0.743371  1
  P  P84  1  0.964635  0.679077  0.701752  1
  P  P85  1  0.716143  0.270042  0.725925  1
  P  P86  1  0.710351  0.832175  0.683917  1
  P  P87  1  0.713776  0.179077  0.701752  1
  P  P88  1  0.708123  0.616504  0.743371  1
  P  P89  1  0.728202  0.836824  0.766557  1
  P  P90  1  0.707397  0.398758  0.722836  1
  P  P91  1  0.717102  0.050802  0.703862  1
  P  P92  1  0.712057  0.613183  0.661047  1
  P  P93  1  0.217758  0.179573  0.700877  1
  P  P94  1  0.213048  0.616598  0.743507  1
  P  P95  1  0.218383  0.394352  0.640625  1
  P  P96  1  0.211551  0.832258  0.683858  1
  P  P97  1  0.219332  0.926653  0.789470  1
  P  P98  1  0.209430  0.488197  0.746390  1
  P  P99  1  0.230979  0.837179  0.766549  1
  P  P100  1  0.184321  0.271311  0.807558  1
  P  P101  1  0.468981  -0.011803  0.746390  1
  P  P102  1  0.459078  0.426653  0.789470  1
  P  P103  1  0.494089  0.771311  0.807558  1
  P  P104  1  0.447432  0.337179  0.766549  1
  P  P105  1  0.967337  -0.011806  0.746377  1
  P  P106  1  0.959095  0.426341  0.789574  1
  P  P107  1  0.992660  0.774198  0.806393  1
  P  P108  1  0.889009  0.211752  0.846308  1
  P  P109  1  0.465389  0.206768  0.770079  1
  P  P110  1  0.459954  0.769955  0.726637  1
  P  P111  1  0.469989  -0.008882  0.827348  1
  P  P112  1  0.459738  0.552665  0.785664  1
  P  P113  1  0.962743  0.206804  0.766892  1
  P  P114  1  0.958832  0.643503  0.807888  1
  P  P115  1  0.968611  -0.008887  0.827339  1
  P  P116  1  0.959744  0.554662  0.786697  1
  P  P117  1  0.719578  0.143503  0.807888  1
  P  P118  1  0.715667  0.706804  0.766892  1
  P  P119  1  0.718666  0.054662  0.786697  1
  P  P120  1  0.709799  0.491113  0.827339  1
  P  P121  1  0.789401  0.711752  0.846308  1
  P  P122  1  0.685750  0.274198  0.806393  1
  P  P123  1  0.719315  0.926341  0.789574  1
  P  P124  1  0.711073  0.488194  0.746377  1
  P  P125  1  0.218672  0.052665  0.785664  1
  P  P126  1  0.208422  0.491118  0.827348  1
  P  P127  1  0.218456  0.269955  0.726637  1
  P  P128  1  0.213021  0.706768  0.770079  1
