# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   28.38845234
_cell_length_b   28.38845234
_cell_length_c   51.55957680
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.07978686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P144
_cell_volume   39536.2196119
_cell_formula_units_Z   144
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  0.977124  0.310458  0.336420  1
  P  P2  1  0.310458  0.977124  0.336420  1
  P  P3  1  0.349673  0.349673  0.299383  1
  P  P4  1  0.604575  0.271242  0.373457  1
  P  P5  1  0.937908  0.937908  0.373457  1
  P  P6  1  0.271242  0.604575  0.373457  1
  P  P7  1  0.643791  0.643791  0.336420  1
  P  P8  1  0.683007  0.016340  0.299383  1
  P  P9  1  0.016340  0.683007  0.299383  1
  P  P10  1  0.183007  0.516340  0.299383  1
  P  P11  1  0.516340  0.183007  0.299383  1
  P  P12  1  0.437908  0.437908  0.373457  1
  P  P13  1  0.810458  0.477124  0.336420  1
  P  P14  1  0.143791  0.143791  0.336420  1
  P  P15  1  0.477124  0.810458  0.336420  1
  P  P16  1  0.849673  0.849673  0.299383  1
  P  P17  1  0.771242  0.104575  0.373457  1
  P  P18  1  0.104575  0.771242  0.373457  1
  P  P19  1  0.996732  0.496732  0.317901  1
  P  P20  1  0.330065  0.163399  0.317901  1
  P  P21  1  0.251634  0.418301  0.391975  1
  P  P22  1  0.624183  0.457516  0.354938  1
  P  P23  1  0.957516  0.124183  0.354938  1
  P  P24  1  0.290850  0.790850  0.354938  1
  P  P25  1  0.663399  0.830065  0.317901  1
  P  P26  1  0.702614  0.202614  0.280864  1
  P  P27  1  0.035948  0.869281  0.280864  1
  P  P28  1  0.163399  0.330065  0.317901  1
  P  P29  1  0.496732  0.996732  0.317901  1
  P  P30  1  0.418301  0.251634  0.391975  1
  P  P31  1  0.790850  0.290850  0.354938  1
  P  P32  1  0.124183  0.957516  0.354938  1
  P  P33  1  0.457516  0.624183  0.354938  1
  P  P34  1  0.830065  0.663399  0.317901  1
  P  P35  1  0.869281  0.035948  0.280864  1
  P  P36  1  0.202614  0.702614  0.280864  1
  P  P37  1  0.859477  0.192810  0.447531  1
  P  P38  1  0.192810  0.859477  0.447531  1
  P  P39  1  0.232026  0.232026  0.410494  1
  P  P40  1  0.486928  0.153595  0.484568  1
  P  P41  1  0.820261  0.820261  0.484568  1
  P  P42  1  0.153595  0.486928  0.484568  1
  P  P43  1  0.526144  0.526144  0.447531  1
  P  P44  1  0.565359  0.898693  0.410494  1
  P  P45  1  0.898693  0.565359  0.410494  1
  P  P46  1  0.065359  0.398693  0.410494  1
  P  P47  1  0.398693  0.065359  0.410494  1
  P  P48  1  0.320261  0.320261  0.484568  1
  P  P49  1  0.692810  0.359477  0.447531  1
  P  P50  1  0.026144  0.026144  0.447531  1
  P  P51  1  0.359477  0.692810  0.447531  1
  P  P52  1  0.732026  0.732026  0.410494  1
  P  P53  1  0.653595  0.986928  0.484568  1
  P  P54  1  0.986928  0.653595  0.484568  1
  P  P55  1  0.879085  0.379085  0.429012  1
  P  P56  1  0.212418  0.045752  0.429012  1
  P  P57  1  0.133987  0.300654  0.503086  1
  P  P58  1  0.506536  0.339869  0.466049  1
  P  P59  1  0.839869  0.006536  0.466049  1
  P  P60  1  0.173203  0.673203  0.466049  1
  P  P61  1  0.545752  0.712418  0.429012  1
  P  P62  1  0.584967  0.084967  0.391975  1
  P  P63  1  0.918301  0.751634  0.391975  1
  P  P64  1  0.045752  0.212418  0.429012  1
  P  P65  1  0.379085  0.879085  0.429012  1
  P  P66  1  0.300654  0.133987  0.503086  1
  P  P67  1  0.673203  0.173203  0.466049  1
  P  P68  1  0.006536  0.839869  0.466049  1
  P  P69  1  0.339869  0.506536  0.466049  1
  P  P70  1  0.712418  0.545752  0.429012  1
  P  P71  1  0.751634  0.918301  0.391975  1
  P  P72  1  0.084967  0.584967  0.391975  1
  P  P73  1  0.741830  0.075163  0.558642  1
  P  P74  1  0.075163  0.741830  0.558642  1
  P  P75  1  0.114379  0.114379  0.521605  1
  P  P76  1  0.369281  0.035948  0.595679  1
  P  P77  1  0.702614  0.702614  0.595679  1
  P  P78  1  0.035948  0.369281  0.595679  1
  P  P79  1  0.408497  0.408497  0.558642  1
  P  P80  1  0.447712  0.781046  0.521605  1
  P  P81  1  0.781046  0.447712  0.521605  1
  P  P82  1  0.947712  0.281046  0.521605  1
  P  P83  1  0.281046  0.947712  0.521605  1
  P  P84  1  0.202614  0.202614  0.595679  1
  P  P85  1  0.575163  0.241830  0.558642  1
  P  P86  1  0.908497  0.908497  0.558642  1
  P  P87  1  0.241830  0.575163  0.558642  1
  P  P88  1  0.614379  0.614379  0.521605  1
  P  P89  1  0.535948  0.869281  0.595679  1
  P  P90  1  0.869281  0.535948  0.595679  1
  P  P91  1  0.761438  0.261438  0.540123  1
  P  P92  1  0.094771  0.928105  0.540123  1
  P  P93  1  0.016340  0.183007  0.614198  1
  P  P94  1  0.388889  0.222222  0.577160  1
  P  P95  1  0.722222  0.888889  0.577160  1
  P  P96  1  0.055556  0.555556  0.577160  1
  P  P97  1  0.428105  0.594771  0.540123  1
  P  P98  1  0.467320  0.967320  0.503086  1
  P  P99  1  0.800654  0.633987  0.503086  1
  P  P100  1  0.928105  0.094771  0.540123  1
  P  P101  1  0.261438  0.761438  0.540123  1
  P  P102  1  0.183007  0.016340  0.614198  1
  P  P103  1  0.555556  0.055556  0.577160  1
  P  P104  1  0.888889  0.722222  0.577160  1
  P  P105  1  0.222222  0.388889  0.577160  1
  P  P106  1  0.594771  0.428105  0.540123  1
  P  P107  1  0.633987  0.800654  0.503086  1
  P  P108  1  0.967320  0.467320  0.503086  1
  P  P109  1  0.624183  0.957516  0.669753  1
  P  P110  1  0.957516  0.624183  0.669753  1
  P  P111  1  0.996732  0.996732  0.632716  1
  P  P112  1  0.251634  0.918301  0.706790  1
  P  P113  1  0.584967  0.584967  0.706790  1
  P  P114  1  0.918301  0.251634  0.706790  1
  P  P115  1  0.290850  0.290850  0.669753  1
  P  P116  1  0.330065  0.663399  0.632716  1
  P  P117  1  0.663399  0.330065  0.632716  1
  P  P118  1  0.830065  0.163399  0.632716  1
  P  P119  1  0.163399  0.830065  0.632716  1
  P  P120  1  0.084967  0.084967  0.706790  1
  P  P121  1  0.457516  0.124183  0.669753  1
  P  P122  1  0.790850  0.790850  0.669753  1
  P  P123  1  0.124183  0.457516  0.669753  1
  P  P124  1  0.496732  0.496732  0.632716  1
  P  P125  1  0.418301  0.751634  0.706790  1
  P  P126  1  0.751634  0.418301  0.706790  1
  P  P127  1  0.643791  0.143791  0.651235  1
  P  P128  1  0.977124  0.810458  0.651235  1
  P  P129  1  0.898693  0.065359  0.725309  1
  P  P130  1  0.271242  0.104575  0.688272  1
  P  P131  1  0.604575  0.771242  0.688272  1
  P  P132  1  0.937908  0.437908  0.688272  1
  P  P133  1  0.310458  0.477124  0.651235  1
  P  P134  1  0.349673  0.849673  0.614198  1
  P  P135  1  0.683007  0.516340  0.614198  1
  P  P136  1  0.810458  0.977124  0.651235  1
  P  P137  1  0.143791  0.643791  0.651235  1
  P  P138  1  0.065359  0.898693  0.725309  1
  P  P139  1  0.437908  0.937908  0.688272  1
  P  P140  1  0.771242  0.604575  0.688272  1
  P  P141  1  0.104575  0.271242  0.688272  1
  P  P142  1  0.477124  0.310458  0.651235  1
  P  P143  1  0.516340  0.683007  0.614198  1
  P  P144  1  0.849673  0.349673  0.614198  1
