# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.15023941
_cell_length_b   16.79831836
_cell_length_c   50.37487745
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   97.97447657
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P180
_cell_volume   10182.2690143
_cell_formula_units_Z   180
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  0.802436  0.393321  0.317441  1
  P  P2  1  0.469103  0.059988  0.317441  1
  P  P3  1  0.514210  0.352608  0.350165  1
  P  P4  1  0.063045  0.405317  0.290716  1
  P  P5  1  0.135769  0.726655  0.317441  1
  P  P6  1  0.180876  0.019275  0.350165  1
  P  P7  1  0.729712  0.071984  0.290716  1
  P  P8  1  0.847543  0.685942  0.350165  1
  P  P9  1  0.396379  0.738650  0.290716  1
  P  P10  1  0.729712  0.571984  0.290716  1
  P  P11  1  0.396379  0.238650  0.290716  1
  P  P12  1  0.469103  0.559988  0.317441  1
  P  P13  1  0.180876  0.519275  0.350165  1
  P  P14  1  0.063045  0.905317  0.290716  1
  P  P15  1  0.135769  0.226655  0.317441  1
  P  P16  1  0.847543  0.185942  0.350165  1
  P  P17  1  0.802436  0.893321  0.317441  1
  P  P18  1  0.514210  0.852608  0.350165  1
  P  P19  1  0.969103  0.559988  0.317441  1
  P  P20  1  0.635769  0.226655  0.317441  1
  P  P21  1  0.680876  0.519275  0.350165  1
  P  P22  1  0.229712  0.571984  0.290716  1
  P  P23  1  0.302436  0.893321  0.317441  1
  P  P24  1  0.347543  0.185942  0.350165  1
  P  P25  1  0.896379  0.238650  0.290716  1
  P  P26  1  0.014210  0.852608  0.350165  1
  P  P27  1  0.563045  0.905317  0.290716  1
  P  P28  1  0.014210  0.352608  0.350165  1
  P  P29  1  0.680876  0.019275  0.350165  1
  P  P30  1  0.563045  0.405317  0.290716  1
  P  P31  1  0.302436  0.393321  0.317441  1
  P  P32  1  0.347543  0.685942  0.350165  1
  P  P33  1  0.229712  0.071984  0.290716  1
  P  P34  1  0.969103  0.059988  0.317441  1
  P  P35  1  0.896379  0.738650  0.290716  1
  P  P36  1  0.635769  0.726655  0.317441  1
  P  P37  1  0.964623  0.298507  0.410293  1
  P  P38  1  0.631290  0.965173  0.410293  1
  P  P39  1  0.692750  0.274455  0.439605  1
  P  P40  1  0.245279  0.331724  0.378384  1
  P  P41  1  0.297956  0.631840  0.410293  1
  P  P42  1  0.359416  0.941122  0.439605  1
  P  P43  1  0.911946  0.998391  0.378384  1
  P  P44  1  0.026083  0.607789  0.439605  1
  P  P45  1  0.578612  0.665057  0.378384  1
  P  P46  1  0.911946  0.498391  0.378384  1
  P  P47  1  0.578612  0.165057  0.378384  1
  P  P48  1  0.631290  0.465173  0.410293  1
  P  P49  1  0.359416  0.441122  0.439605  1
  P  P50  1  0.245279  0.831724  0.378384  1
  P  P51  1  0.297956  0.131840  0.410293  1
  P  P52  1  0.026083  0.107789  0.439605  1
  P  P53  1  0.964623  0.798507  0.410293  1
  P  P54  1  0.692750  0.774455  0.439605  1
  P  P55  1  0.131290  0.465173  0.410293  1
  P  P56  1  0.797956  0.131840  0.410293  1
  P  P57  1  0.859416  0.441122  0.439605  1
  P  P58  1  0.411946  0.498391  0.378384  1
  P  P59  1  0.464623  0.798507  0.410293  1
  P  P60  1  0.526083  0.107789  0.439605  1
  P  P61  1  0.078612  0.165057  0.378384  1
  P  P62  1  0.192750  0.774455  0.439605  1
  P  P63  1  0.745279  0.831724  0.378384  1
  P  P64  1  0.192750  0.274455  0.439605  1
  P  P65  1  0.859416  0.941122  0.439605  1
  P  P66  1  0.745279  0.331724  0.378384  1
  P  P67  1  0.464623  0.298507  0.410293  1
  P  P68  1  0.526083  0.607789  0.439605  1
  P  P69  1  0.411946  0.998391  0.378384  1
  P  P70  1  0.131290  0.965173  0.410293  1
  P  P71  1  0.078612  0.665057  0.378384  1
  P  P72  1  0.797956  0.631840  0.410293  1
  P  P73  1  0.141378  0.218290  0.500751  1
  P  P74  1  0.808045  0.884957  0.500751  1
  P  P75  1  0.867020  0.191599  0.530925  1
  P  P76  1  0.415736  0.244981  0.470576  1
  P  P77  1  0.474711  0.551624  0.500751  1
  P  P78  1  0.533687  0.858266  0.530925  1
  P  P79  1  0.082403  0.911648  0.470576  1
  P  P80  1  0.200353  0.524933  0.530925  1
  P  P81  1  0.749069  0.578315  0.470576  1
  P  P82  1  0.082403  0.411648  0.470576  1
  P  P83  1  0.749069  0.078315  0.470576  1
  P  P84  1  0.808045  0.384957  0.500751  1
  P  P85  1  0.533687  0.358266  0.530925  1
  P  P86  1  0.415736  0.744981  0.470576  1
  P  P87  1  0.474711  0.051624  0.500751  1
  P  P88  1  0.200353  0.024933  0.530925  1
  P  P89  1  0.141378  0.718290  0.500751  1
  P  P90  1  0.867020  0.691599  0.530925  1
  P  P91  1  0.308045  0.384957  0.500751  1
  P  P92  1  0.974711  0.051624  0.500751  1
  P  P93  1  0.033687  0.358266  0.530925  1
  P  P94  1  0.582403  0.411648  0.470576  1
  P  P95  1  0.641378  0.718290  0.500751  1
  P  P96  1  0.700353  0.024933  0.530925  1
  P  P97  1  0.249069  0.078315  0.470576  1
  P  P98  1  0.367020  0.691599  0.530925  1
  P  P99  1  0.915736  0.744981  0.470576  1
  P  P100  1  0.367020  0.191599  0.530925  1
  P  P101  1  0.033687  0.858266  0.530925  1
  P  P102  1  0.915736  0.244981  0.470576  1
  P  P103  1  0.641378  0.218290  0.500751  1
  P  P104  1  0.700353  0.524933  0.530925  1
  P  P105  1  0.582403  0.911648  0.470576  1
  P  P106  1  0.308045  0.884957  0.500751  1
  P  P107  1  0.249069  0.578315  0.470576  1
  P  P108  1  0.974711  0.551624  0.500751  1
  P  P109  1  0.318133  0.138074  0.591209  1
  P  P110  1  0.984800  0.804741  0.591209  1
  P  P111  1  0.037477  0.104857  0.623117  1
  P  P112  1  0.590006  0.162125  0.561896  1
  P  P113  1  0.651466  0.471407  0.591209  1
  P  P114  1  0.704143  0.771523  0.623117  1
  P  P115  1  0.256673  0.828792  0.561896  1
  P  P116  1  0.370810  0.438190  0.623117  1
  P  P117  1  0.923340  0.495459  0.561896  1
  P  P118  1  0.256673  0.328792  0.561896  1
  P  P119  1  0.923340  0.995459  0.561896  1
  P  P120  1  0.984800  0.304741  0.591209  1
  P  P121  1  0.704143  0.271523  0.623117  1
  P  P122  1  0.590006  0.662125  0.561896  1
  P  P123  1  0.651466  0.971407  0.591209  1
  P  P124  1  0.370810  0.938190  0.623117  1
  P  P125  1  0.318133  0.638074  0.591209  1
  P  P126  1  0.037477  0.604857  0.623117  1
  P  P127  1  0.484800  0.304741  0.591209  1
  P  P128  1  0.151466  0.971407  0.591209  1
  P  P129  1  0.204143  0.271523  0.623117  1
  P  P130  1  0.756673  0.328792  0.561896  1
  P  P131  1  0.818133  0.638074  0.591209  1
  P  P132  1  0.870810  0.938190  0.623117  1
  P  P133  1  0.423340  0.995459  0.561896  1
  P  P134  1  0.537477  0.604857  0.623117  1
  P  P135  1  0.090006  0.662125  0.561896  1
  P  P136  1  0.537477  0.104857  0.623117  1
  P  P137  1  0.204143  0.771523  0.623117  1
  P  P138  1  0.090006  0.162125  0.561896  1
  P  P139  1  0.818133  0.138074  0.591209  1
  P  P140  1  0.870810  0.438190  0.623117  1
  P  P141  1  0.756673  0.828792  0.561896  1
  P  P142  1  0.484800  0.804741  0.591209  1
  P  P143  1  0.423340  0.495459  0.561896  1
  P  P144  1  0.151466  0.471407  0.591209  1
  P  P145  1  0.480320  0.043259  0.684060  1
  P  P146  1  0.146986  0.709926  0.684060  1
  P  P147  1  0.219711  0.031264  0.710785  1
  P  P148  1  0.768546  0.083972  0.651336  1
  P  P149  1  0.813653  0.376593  0.684060  1
  P  P150  1  0.886377  0.697930  0.710785  1
  P  P151  1  0.435213  0.750639  0.651336  1
  P  P152  1  0.553044  0.364597  0.710785  1
  P  P153  1  0.101880  0.417306  0.651336  1
  P  P154  1  0.435213  0.250639  0.651336  1
  P  P155  1  0.101880  0.917306  0.651336  1
  P  P156  1  0.146986  0.209926  0.684060  1
  P  P157  1  0.886377  0.197930  0.710785  1
  P  P158  1  0.768546  0.583972  0.651336  1
  P  P159  1  0.813653  0.876593  0.684060  1
  P  P160  1  0.553044  0.864597  0.710785  1
  P  P161  1  0.480320  0.543259  0.684060  1
  P  P162  1  0.219711  0.531264  0.710785  1
  P  P163  1  0.646986  0.209926  0.684060  1
  P  P164  1  0.313653  0.876593  0.684060  1
  P  P165  1  0.386377  0.197930  0.710785  1
  P  P166  1  0.935213  0.250639  0.651336  1
  P  P167  1  0.980320  0.543259  0.684060  1
  P  P168  1  0.053044  0.864597  0.710785  1
  P  P169  1  0.601880  0.917306  0.651336  1
  P  P170  1  0.719711  0.531264  0.710785  1
  P  P171  1  0.268546  0.583972  0.651336  1
  P  P172  1  0.719711  0.031264  0.710785  1
  P  P173  1  0.386377  0.697930  0.710785  1
  P  P174  1  0.268546  0.083972  0.651336  1
  P  P175  1  0.980320  0.043259  0.684060  1
  P  P176  1  0.053044  0.364597  0.710785  1
  P  P177  1  0.935213  0.750639  0.651336  1
  P  P178  1  0.646986  0.709926  0.684060  1
  P  P179  1  0.601880  0.417306  0.651336  1
  P  P180  1  0.313653  0.376593  0.684060  1
