# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   97.19325800
_cell_length_b   55.10277490
_cell_length_c   52.54205937
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.97940248
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P1296
_cell_volume   280315.581778
_cell_formula_units_Z   1296
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  0.096687  0.917880  0.401401  1
  P  P2  1  0.094119  0.628799  0.306301  1
  P  P3  1  0.262015  0.607047  0.353782  1
  P  P4  1  0.430020  0.584547  0.401401  1
  P  P5  1  0.095348  0.273714  0.353782  1
  P  P6  1  0.263353  0.251214  0.401401  1
  P  P7  1  0.260786  0.962132  0.306301  1
  P  P8  1  0.428682  0.940380  0.353782  1
  P  P9  1  0.596687  0.917880  0.401401  1
  P  P10  1  0.594119  0.628799  0.306301  1
  P  P11  1  0.762015  0.607047  0.353782  1
  P  P12  1  0.930020  0.584547  0.401401  1
  P  P13  1  0.427453  0.295465  0.306301  1
  P  P14  1  0.595348  0.273714  0.353782  1
  P  P15  1  0.763353  0.251214  0.401401  1
  P  P16  1  0.760786  0.962132  0.306301  1
  P  P17  1  0.928682  0.940380  0.353782  1
  P  P18  1  0.927453  0.295465  0.306301  1
  P  P19  1  0.093678  0.081657  0.314294  1
  P  P20  1  0.095016  0.725824  0.361913  1
  P  P21  1  0.263020  0.703324  0.409532  1
  P  P22  1  0.427011  0.748324  0.314294  1
  P  P23  1  0.096354  0.369991  0.409532  1
  P  P24  1  0.260344  0.414991  0.314294  1
  P  P25  1  0.261682  0.059157  0.361913  1
  P  P26  1  0.429687  0.036657  0.409532  1
  P  P27  1  0.593678  0.081657  0.314294  1
  P  P28  1  0.595016  0.725824  0.361913  1
  P  P29  1  0.763020  0.703324  0.409532  1
  P  P30  1  0.927011  0.748324  0.314294  1
  P  P31  1  0.428349  0.392491  0.361913  1
  P  P32  1  0.596354  0.369991  0.409532  1
  P  P33  1  0.760344  0.414991  0.314294  1
  P  P34  1  0.761682  0.059157  0.361913  1
  P  P35  1  0.929687  0.036657  0.409532  1
  P  P36  1  0.928349  0.392491  0.361913  1
  P  P37  1  0.088739  0.866541  0.419189  1
  P  P38  1  0.086359  0.578658  0.323714  1
  P  P39  1  0.254067  0.555708  0.371570  1
  P  P40  1  0.422072  0.533208  0.419189  1
  P  P41  1  0.087401  0.222375  0.371570  1
  P  P42  1  0.255406  0.199875  0.419189  1
  P  P43  1  0.253026  0.911991  0.323714  1
  P  P44  1  0.420734  0.889042  0.371570  1
  P  P45  1  0.588739  0.866541  0.419189  1
  P  P46  1  0.586359  0.578658  0.323714  1
  P  P47  1  0.754067  0.555708  0.371570  1
  P  P48  1  0.922072  0.533208  0.419189  1
  P  P49  1  0.419693  0.245324  0.323714  1
  P  P50  1  0.587401  0.222375  0.371570  1
  P  P51  1  0.755406  0.199875  0.419189  1
  P  P52  1  0.753026  0.911991  0.323714  1
  P  P53  1  0.920734  0.889042  0.371570  1
  P  P54  1  0.919693  0.245324  0.323714  1
  P  P55  1  0.101625  0.132996  0.296506  1
  P  P56  1  0.102963  0.777163  0.344125  1
  P  P57  1  0.270968  0.754663  0.391744  1
  P  P58  1  0.434959  0.799663  0.296506  1
  P  P59  1  0.104301  0.421329  0.391744  1
  P  P60  1  0.268292  0.466330  0.296506  1
  P  P61  1  0.269630  0.110496  0.344125  1
  P  P62  1  0.437635  0.087996  0.391744  1
  P  P63  1  0.601625  0.132996  0.296506  1
  P  P64  1  0.602963  0.777163  0.344125  1
  P  P65  1  0.770968  0.754663  0.391744  1
  P  P66  1  0.934959  0.799663  0.296506  1
  P  P67  1  0.436297  0.443830  0.344125  1
  P  P68  1  0.604301  0.421329  0.391744  1
  P  P69  1  0.768292  0.466330  0.296506  1
  P  P70  1  0.769630  0.110496  0.344125  1
  P  P71  1  0.937635  0.087996  0.391744  1
  P  P72  1  0.936297  0.443830  0.344125  1
  P  P73  1  0.119515  0.874086  0.405496  1
  P  P74  1  0.116420  0.586020  0.310309  1
  P  P75  1  0.284843  0.563253  0.357877  1
  P  P76  1  0.452848  0.540753  0.405496  1
  P  P77  1  0.118177  0.229919  0.357877  1
  P  P78  1  0.286182  0.207419  0.405496  1
  P  P79  1  0.283087  0.919354  0.310309  1
  P  P80  1  0.451510  0.896586  0.357877  1
  P  P81  1  0.619515  0.874086  0.405496  1
  P  P82  1  0.616420  0.586020  0.310309  1
  P  P83  1  0.784843  0.563253  0.357877  1
  P  P84  1  0.952848  0.540753  0.405496  1
  P  P85  1  0.449753  0.252687  0.310309  1
  P  P86  1  0.618177  0.229919  0.357877  1
  P  P87  1  0.786182  0.207419  0.405496  1
  P  P88  1  0.783087  0.919354  0.310309  1
  P  P89  1  0.951510  0.896586  0.357877  1
  P  P90  1  0.949753  0.252687  0.310309  1
  P  P91  1  0.070849  0.125452  0.310199  1
  P  P92  1  0.072187  0.769618  0.357818  1
  P  P93  1  0.240192  0.747118  0.405437  1
  P  P94  1  0.404183  0.792118  0.310199  1
  P  P95  1  0.073526  0.413785  0.405437  1
  P  P96  1  0.237516  0.458785  0.310199  1
  P  P97  1  0.238854  0.102952  0.357818  1
  P  P98  1  0.406859  0.080451  0.405437  1
  P  P99  1  0.570849  0.125452  0.310199  1
  P  P100  1  0.572187  0.769618  0.357818  1
  P  P101  1  0.740192  0.747118  0.405437  1
  P  P102  1  0.904183  0.792118  0.310199  1
  P  P103  1  0.405521  0.436285  0.357818  1
  P  P104  1  0.573526  0.413785  0.405437  1
  P  P105  1  0.737516  0.458785  0.310199  1
  P  P106  1  0.738854  0.102952  0.357818  1
  P  P107  1  0.906859  0.080451  0.405437  1
  P  P108  1  0.905521  0.436285  0.357818  1
  P  P109  1  0.097147  0.874703  0.362343  1
  P  P110  1  0.098485  0.518869  0.409962  1
  P  P111  1  0.262475  0.563870  0.314724  1
  P  P112  1  0.430480  0.541369  0.362343  1
  P  P113  1  0.095809  0.230536  0.314724  1
  P  P114  1  0.263813  0.208036  0.362343  1
  P  P115  1  0.265152  0.852203  0.409962  1
  P  P116  1  0.429142  0.897203  0.314724  1
  P  P117  1  0.597147  0.874703  0.362343  1
  P  P118  1  0.598485  0.518869  0.409962  1
  P  P119  1  0.762475  0.563870  0.314724  1
  P  P120  1  0.930480  0.541369  0.362343  1
  P  P121  1  0.431818  0.185536  0.409962  1
  P  P122  1  0.595809  0.230536  0.314724  1
  P  P123  1  0.763813  0.208036  0.362343  1
  P  P124  1  0.765152  0.852203  0.409962  1
  P  P125  1  0.929142  0.897203  0.314724  1
  P  P126  1  0.931818  0.185536  0.409962  1
  P  P127  1  0.093217  0.124835  0.353352  1
  P  P128  1  0.094555  0.769001  0.400971  1
  P  P129  1  0.258533  0.813970  0.305684  1
  P  P130  1  0.426551  0.791502  0.353352  1
  P  P131  1  0.091866  0.480637  0.305684  1
  P  P132  1  0.259884  0.458168  0.353352  1
  P  P133  1  0.261222  0.102335  0.400971  1
  P  P134  1  0.425200  0.147303  0.305684  1
  P  P135  1  0.593217  0.124835  0.353352  1
  P  P136  1  0.594555  0.769001  0.400971  1
  P  P137  1  0.758533  0.813970  0.305684  1
  P  P138  1  0.926551  0.791502  0.353352  1
  P  P139  1  0.427889  0.435668  0.400971  1
  P  P140  1  0.591866  0.480637  0.305684  1
  P  P141  1  0.759884  0.458168  0.353352  1
  P  P142  1  0.761222  0.102335  0.400971  1
  P  P143  1  0.925200  0.147303  0.305684  1
  P  P144  1  0.927889  0.435668  0.400971  1
  P  P145  1  0.156171  0.993031  0.331653  1
  P  P146  1  0.157509  0.637198  0.379272  1
  P  P147  1  0.325513  0.614698  0.426891  1
  P  P148  1  0.489504  0.659698  0.331653  1
  P  P149  1  0.158847  0.281364  0.426891  1
  P  P150  1  0.322837  0.326365  0.331653  1
  P  P151  1  0.324175  0.970531  0.379272  1
  P  P152  1  0.492180  0.948031  0.426891  1
  P  P153  1  0.656171  0.993031  0.331653  1
  P  P154  1  0.657509  0.637198  0.379272  1
  P  P155  1  0.825513  0.614698  0.426891  1
  P  P156  1  0.989504  0.659698  0.331653  1
  P  P157  1  0.490842  0.303865  0.379272  1
  P  P158  1  0.658847  0.281364  0.426891  1
  P  P159  1  0.822837  0.326365  0.331653  1
  P  P160  1  0.824175  0.970531  0.379272  1
  P  P161  1  0.992180  0.948031  0.426891  1
  P  P162  1  0.990842  0.303865  0.379272  1
  P  P163  1  0.034194  0.006506  0.384043  1
  P  P164  1  0.031562  0.718221  0.288769  1
  P  P165  1  0.199835  0.696047  0.336116  1
  P  P166  1  0.367527  0.673173  0.384043  1
  P  P167  1  0.033168  0.362713  0.336116  1
  P  P168  1  0.200860  0.339840  0.384043  1
  P  P169  1  0.198229  0.051555  0.288769  1
  P  P170  1  0.366501  0.029380  0.336116  1
  P  P171  1  0.534194  0.006506  0.384043  1
  P  P172  1  0.531562  0.718221  0.288769  1
  P  P173  1  0.699835  0.696047  0.336116  1
  P  P174  1  0.867527  0.673173  0.384043  1
  P  P175  1  0.364896  0.384888  0.288769  1
  P  P176  1  0.533168  0.362713  0.336116  1
  P  P177  1  0.700860  0.339840  0.384043  1
  P  P178  1  0.698229  0.051555  0.288769  1
  P  P179  1  0.866501  0.029380  0.336116  1
  P  P180  1  0.864896  0.384888  0.288769  1
  P  P181  1  0.125485  0.992062  0.350006  1
  P  P182  1  0.126823  0.636229  0.397625  1
  P  P183  1  0.291181  0.680875  0.302702  1
  P  P184  1  0.458818  0.658729  0.350006  1
  P  P185  1  0.124514  0.347541  0.302702  1
  P  P186  1  0.292152  0.325395  0.350006  1
  P  P187  1  0.293490  0.969562  0.397625  1
  P  P188  1  0.457848  0.014208  0.302702  1
  P  P189  1  0.625485  0.992062  0.350006  1
  P  P190  1  0.626823  0.636229  0.397625  1
  P  P191  1  0.791181  0.680875  0.302702  1
  P  P192  1  0.958818  0.658729  0.350006  1
  P  P193  1  0.460156  0.302895  0.397625  1
  P  P194  1  0.624514  0.347541  0.302702  1
  P  P195  1  0.792152  0.325395  0.350006  1
  P  P196  1  0.793490  0.969562  0.397625  1
  P  P197  1  0.957848  0.014208  0.302702  1
  P  P198  1  0.960156  0.302895  0.397625  1
  P  P199  1  0.064879  0.007476  0.365690  1
  P  P200  1  0.066217  0.651642  0.413309  1
  P  P201  1  0.229804  0.696983  0.318152  1
  P  P202  1  0.398213  0.674142  0.365690  1
  P  P203  1  0.063137  0.363649  0.318152  1
  P  P204  1  0.231546  0.340809  0.365690  1
  P  P205  1  0.232884  0.984975  0.413309  1
  P  P206  1  0.396471  0.030316  0.318152  1
  P  P207  1  0.564879  0.007476  0.365690  1
  P  P208  1  0.566217  0.651642  0.413309  1
  P  P209  1  0.729804  0.696983  0.318152  1
  P  P210  1  0.898213  0.674142  0.365690  1
  P  P211  1  0.399551  0.318309  0.413309  1
  P  P212  1  0.563137  0.363649  0.318152  1
  P  P213  1  0.731546  0.340809  0.365690  1
  P  P214  1  0.732884  0.984975  0.413309  1
  P  P215  1  0.896471  0.030316  0.318152  1
  P  P216  1  0.899551  0.318309  0.413309  1
  P  P217  1  0.146057  0.945063  0.354555  1
  P  P218  1  0.147395  0.589230  0.402174  1
  P  P219  1  0.311273  0.634961  0.307153  1
  P  P220  1  0.479390  0.611730  0.354555  1
  P  P221  1  0.144607  0.301627  0.307153  1
  P  P222  1  0.312723  0.278396  0.354555  1
  P  P223  1  0.314061  0.922563  0.402174  1
  P  P224  1  0.477940  0.968294  0.307153  1
  P  P225  1  0.646057  0.945063  0.354555  1
  P  P226  1  0.647395  0.589230  0.402174  1
  P  P227  1  0.811273  0.634961  0.307153  1
  P  P228  1  0.979390  0.611730  0.354555  1
  P  P229  1  0.480728  0.255896  0.402174  1
  P  P230  1  0.644607  0.301627  0.307153  1
  P  P231  1  0.812723  0.278396  0.354555  1
  P  P232  1  0.814061  0.922563  0.402174  1
  P  P233  1  0.977940  0.968294  0.307153  1
  P  P234  1  0.980728  0.255896  0.402174  1
  P  P235  1  0.044308  0.054475  0.361140  1
  P  P236  1  0.045646  0.698641  0.408759  1
  P  P237  1  0.209707  0.742891  0.313701  1
  P  P238  1  0.377641  0.721141  0.361140  1
  P  P239  1  0.043041  0.409558  0.313701  1
  P  P240  1  0.210974  0.387808  0.361140  1
  P  P241  1  0.212312  0.031974  0.408759  1
  P  P242  1  0.376374  0.076224  0.313701  1
  P  P243  1  0.544308  0.054475  0.361140  1
  P  P244  1  0.545646  0.698641  0.408759  1
  P  P245  1  0.709707  0.742891  0.313701  1
  P  P246  1  0.877641  0.721141  0.361140  1
  P  P247  1  0.378979  0.365308  0.408759  1
  P  P248  1  0.543041  0.409558  0.313701  1
  P  P249  1  0.710974  0.387808  0.361140  1
  P  P250  1  0.712312  0.031974  0.408759  1
  P  P251  1  0.876374  0.076224  0.313701  1
  P  P252  1  0.878979  0.365308  0.408759  1
  P  P253  1  0.149560  0.989978  0.389991  1
  P  P254  1  0.146864  0.701609  0.294706  1
  P  P255  1  0.314678  0.678817  0.341805  1
  P  P256  1  0.482894  0.656645  0.389991  1
  P  P257  1  0.148012  0.345483  0.341805  1
  P  P258  1  0.316227  0.323312  0.389991  1
  P  P259  1  0.313531  0.034942  0.294706  1
  P  P260  1  0.481345  0.012150  0.341805  1
  P  P261  1  0.649560  0.989978  0.389991  1
  P  P262  1  0.646864  0.701609  0.294706  1
  P  P263  1  0.814678  0.678817  0.341805  1
  P  P264  1  0.982894  0.656645  0.389991  1
  P  P265  1  0.480197  0.368275  0.294706  1
  P  P266  1  0.648012  0.345483  0.341805  1
  P  P267  1  0.816227  0.323312  0.389991  1
  P  P268  1  0.813531  0.034942  0.294706  1
  P  P269  1  0.981345  0.012150  0.341805  1
  P  P270  1  0.980197  0.368275  0.294706  1
  P  P271  1  0.040804  0.009559  0.325704  1
  P  P272  1  0.042142  0.653726  0.373323  1
  P  P273  1  0.210147  0.631226  0.420942  1
  P  P274  1  0.374137  0.676226  0.325704  1
  P  P275  1  0.043480  0.297893  0.420942  1
  P  P276  1  0.207470  0.342893  0.325704  1
  P  P277  1  0.208809  0.987059  0.373323  1
  P  P278  1  0.376813  0.964559  0.420942  1
  P  P279  1  0.540804  0.009559  0.325704  1
  P  P280  1  0.542142  0.653726  0.373323  1
  P  P281  1  0.710147  0.631226  0.420942  1
  P  P282  1  0.874137  0.676226  0.325704  1
  P  P283  1  0.375475  0.320393  0.373323  1
  P  P284  1  0.543480  0.297893  0.420942  1
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