# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   51.21244458
_cell_length_b   27.88876698
_cell_length_c   57.17740691
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.43741097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P432
_cell_volume   80006.4852127
_cell_formula_units_Z   432
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  0.367959  0.155345  0.418302  1
  P  P2  1  0.421220  0.618715  0.251628  1
  P  P3  1  0.034626  0.155345  0.418302  1
  P  P4  1  0.394584  0.387078  0.334969  1
  P  P5  1  0.087887  0.618715  0.251628  1
  P  P6  1  0.701292  0.155345  0.418302  1
  P  P7  1  0.061250  0.387078  0.334969  1
  P  P8  1  0.754554  0.618715  0.251628  1
  P  P9  1  0.727917  0.387078  0.334969  1
  P  P10  1  0.343505  0.300470  0.498596  1
  P  P11  1  0.396755  0.763936  0.331929  1
  P  P12  1  0.010172  0.300470  0.498596  1
  P  P13  1  0.370130  0.532203  0.415263  1
  P  P14  1  0.063422  0.763936  0.331929  1
  P  P15  1  0.676839  0.300470  0.498596  1
  P  P16  1  0.036797  0.532203  0.415263  1
  P  P17  1  0.730088  0.763936  0.331929  1
  P  P18  1  0.703463  0.532203  0.415263  1
  P  P19  1  0.399883  0.157086  0.371542  1
  P  P20  1  0.373258  0.925353  0.454875  1
  P  P21  1  0.066550  0.157086  0.371542  1
  P  P22  1  0.426508  0.388819  0.288208  1
  P  P23  1  0.039925  0.925353  0.454875  1
  P  P24  1  0.733216  0.157086  0.371542  1
  P  P25  1  0.093175  0.388819  0.288208  1
  P  P26  1  0.706592  0.925353  0.454875  1
  P  P27  1  0.759841  0.388819  0.288208  1
  P  P28  1  0.392122  0.994559  0.295283  1
  P  P29  1  0.364831  0.762195  0.378690  1
  P  P30  1  0.058789  0.994559  0.295283  1
  P  P31  1  0.338206  0.530462  0.462023  1
  P  P32  1  0.031497  0.762195  0.378690  1
  P  P33  1  0.725456  0.994559  0.295283  1
  P  P34  1  0.004873  0.530462  0.462023  1
  P  P35  1  0.698164  0.762195  0.378690  1
  P  P36  1  0.671539  0.530462  0.462023  1
  P  P37  1  0.337945  0.164191  0.370138  1
  P  P38  1  0.311320  0.932458  0.453471  1
  P  P39  1  0.004611  0.164191  0.370138  1
  P  P40  1  0.364569  0.395924  0.286805  1
  P  P41  1  0.977986  0.932458  0.453471  1
  P  P42  1  0.671278  0.164191  0.370138  1
  P  P43  1  0.031236  0.395924  0.286805  1
  P  P44  1  0.644653  0.932458  0.453471  1
  P  P45  1  0.697903  0.395924  0.286805  1
  P  P46  1  0.452626  0.987622  0.296660  1
  P  P47  1  0.426769  0.755091  0.380093  1
  P  P48  1  0.119293  0.987622  0.296660  1
  P  P49  1  0.400144  0.523358  0.463427  1
  P  P50  1  0.093436  0.755091  0.380093  1
  P  P51  1  0.785959  0.987622  0.296660  1
  P  P52  1  0.066811  0.523358  0.463427  1
  P  P53  1  0.760102  0.755091  0.380093  1
  P  P54  1  0.733478  0.523358  0.463427  1
  P  P55  1  0.375780  0.065373  0.384201  1
  P  P56  1  0.349156  0.833640  0.467535  1
  P  P57  1  0.042447  0.065373  0.384201  1
  P  P58  1  0.402405  0.297106  0.300868  1
  P  P59  1  0.015822  0.833640  0.467535  1
  P  P60  1  0.709114  0.065373  0.384201  1
  P  P61  1  0.069072  0.297106  0.300868  1
  P  P62  1  0.682489  0.833640  0.467535  1
  P  P63  1  0.735738  0.297106  0.300868  1
  P  P64  1  0.415671  0.084116  0.282863  1
  P  P65  1  0.388933  0.853909  0.366030  1
  P  P66  1  0.082338  0.084116  0.282863  1
  P  P67  1  0.362309  0.622176  0.449363  1
  P  P68  1  0.055600  0.853909  0.366030  1
  P  P69  1  0.749004  0.084116  0.282863  1
  P  P70  1  0.028975  0.622176  0.449363  1
  P  P71  1  0.722267  0.853909  0.366030  1
  P  P72  1  0.695642  0.622176  0.449363  1
  P  P73  1  0.252848  0.349740  0.393935  1
  P  P74  1  0.226224  0.118007  0.477268  1
  P  P75  1  0.919515  0.349740  0.393935  1
  P  P76  1  0.279473  0.581473  0.310601  1
  P  P77  1  0.892890  0.118007  0.477268  1
  P  P78  1  0.586182  0.349740  0.393935  1
  P  P79  1  0.946140  0.581473  0.310601  1
  P  P80  1  0.559557  0.118007  0.477268  1
  P  P81  1  0.612806  0.581473  0.310601  1
  P  P82  1  0.538490  0.801274  0.272963  1
  P  P83  1  0.511865  0.569541  0.356296  1
  P  P84  1  0.205157  0.801274  0.272963  1
  P  P85  1  0.485241  0.337808  0.439630  1
  P  P86  1  0.178532  0.569541  0.356296  1
  P  P87  1  0.871824  0.801274  0.272963  1
  P  P88  1  0.151907  0.337808  0.439630  1
  P  P89  1  0.845199  0.569541  0.356296  1
  P  P90  1  0.818574  0.337808  0.439630  1
  P  P91  1  0.313161  0.354147  0.400660  1
  P  P92  1  0.286536  0.122414  0.483993  1
  P  P93  1  0.979827  0.354147  0.400660  1
  P  P94  1  0.339786  0.585880  0.317326  1
  P  P95  1  0.953203  0.122414  0.483993  1
  P  P96  1  0.646494  0.354147  0.400660  1
  P  P97  1  0.006452  0.585880  0.317326  1
  P  P98  1  0.619869  0.122414  0.483993  1
  P  P99  1  0.673119  0.585880  0.317326  1
  P  P100  1  0.478178  0.796867  0.266238  1
  P  P101  1  0.451553  0.565135  0.349572  1
  P  P102  1  0.144844  0.796867  0.266238  1
  P  P103  1  0.424928  0.333402  0.432905  1
  P  P104  1  0.118220  0.565135  0.349572  1
  P  P105  1  0.811511  0.796867  0.266238  1
  P  P106  1  0.091595  0.333402  0.432905  1
  P  P107  1  0.784886  0.565135  0.349572  1
  P  P108  1  0.758262  0.333402  0.432905  1
  P  P109  1  0.288410  0.360277  0.350254  1
  P  P110  1  0.261785  0.128544  0.433587  1
  P  P111  1  0.955076  0.360277  0.350254  1
  P  P112  1  0.315035  0.592010  0.266920  1
  P  P113  1  0.928452  0.128544  0.433587  1
  P  P114  1  0.621743  0.360277  0.350254  1
  P  P115  1  0.981701  0.592010  0.266920  1
  P  P116  1  0.595118  0.128544  0.433587  1
  P  P117  1  0.648368  0.592010  0.266920  1
  P  P118  1  0.502929  0.790738  0.316644  1
  P  P119  1  0.476304  0.559005  0.399978  1
  P  P120  1  0.169596  0.790738  0.316644  1
  P  P121  1  0.449679  0.327272  0.483311  1
  P  P122  1  0.142971  0.559005  0.399978  1
  P  P123  1  0.836262  0.790738  0.316644  1
  P  P124  1  0.116346  0.327272  0.483311  1
  P  P125  1  0.809637  0.559005  0.399978  1
  P  P126  1  0.783013  0.327272  0.483311  1
  P  P127  1  0.245572  0.216404  0.468468  1
  P  P128  1  0.298822  0.679869  0.301801  1
  P  P129  1  0.912239  0.216404  0.468468  1
  P  P130  1  0.272197  0.448136  0.385135  1
  P  P131  1  0.965489  0.679869  0.301801  1
  P  P132  1  0.578906  0.216404  0.468468  1
  P  P133  1  0.938864  0.448136  0.385135  1
  P  P134  1  0.632155  0.679869  0.301801  1
  P  P135  1  0.605531  0.448136  0.385135  1
  P  P136  1  0.465892  0.239412  0.448430  1
  P  P137  1  0.519141  0.702878  0.281763  1
  P  P138  1  0.132558  0.239412  0.448430  1
  P  P139  1  0.492517  0.471145  0.365097  1
  P  P140  1  0.185808  0.702878  0.281763  1
  P  P141  1  0.799225  0.239412  0.448430  1
  P  P142  1  0.159183  0.471145  0.365097  1
  P  P143  1  0.852475  0.702878  0.281763  1
  P  P144  1  0.825850  0.471145  0.365097  1
  P  P145  1  0.481737  0.943065  0.393323  1
  P  P146  1  0.455112  0.711332  0.476656  1
  P  P147  1  0.148404  0.943065  0.393323  1
  P  P148  1  0.508362  0.174798  0.309990  1
  P  P149  1  0.121779  0.711332  0.476656  1
  P  P150  1  0.815070  0.943065  0.393323  1
  P  P151  1  0.175029  0.174798  0.309990  1
  P  P152  1  0.788446  0.711332  0.476656  1
  P  P153  1  0.841695  0.174798  0.309990  1
  P  P154  1  0.308927  0.204566  0.273589  1
  P  P155  1  0.282977  0.976217  0.356908  1
  P  P156  1  0.975593  0.204566  0.273589  1
  P  P157  1  0.256352  0.744484  0.440242  1
  P  P158  1  0.949643  0.976217  0.356908  1
  P  P159  1  0.642260  0.204566  0.273589  1
  P  P160  1  0.923019  0.744484  0.440242  1
  P  P161  1  0.616310  0.976217  0.356908  1
  P  P162  1  0.589685  0.744484  0.440242  1
  P  P163  1  0.501012  0.043056  0.392734  1
  P  P164  1  0.474387  0.811323  0.476067  1
  P  P165  1  0.167679  0.043056  0.392734  1
  P  P166  1  0.527637  0.274789  0.309401  1
  P  P167  1  0.141054  0.811323  0.476067  1
  P  P168  1  0.834345  0.043056  0.392734  1
  P  P169  1  0.194303  0.274789  0.309401  1
  P  P170  1  0.807720  0.811323  0.476067  1
  P  P171  1  0.860970  0.274789  0.309401  1
  P  P172  1  0.290962  0.111375  0.274141  1
  P  P173  1  0.263702  0.876226  0.357497  1
  P  P174  1  0.957629  0.111375  0.274141  1
  P  P175  1  0.237077  0.644493  0.440830  1
  P  P176  1  0.930368  0.876226  0.357497  1
  P  P177  1  0.624296  0.111375  0.274141  1
  P  P178  1  0.903744  0.644493  0.440830  1
  P  P179  1  0.597035  0.876226  0.357497  1
  P  P180  1  0.570410  0.644493  0.440830  1
  P  P181  1  0.528693  0.958345  0.425951  1
  P  P182  1  0.579932  0.423728  0.259612  1
  P  P183  1  0.195359  0.958345  0.425951  1
  P  P184  1  0.555318  0.190078  0.342618  1
  P  P185  1  0.246599  0.423728  0.259612  1
  P  P186  1  0.862026  0.958345  0.425951  1
  P  P187  1  0.221984  0.190078  0.342618  1
  P  P188  1  0.913266  0.423728  0.259612  1
  P  P189  1  0.888651  0.190078  0.342618  1
  P  P190  1  0.182771  0.497470  0.490947  1
  P  P191  1  0.236021  0.960936  0.324280  1
  P  P192  1  0.849438  0.497470  0.490947  1
  P  P193  1  0.209396  0.729203  0.407614  1
  P  P194  1  0.902688  0.960936  0.324280  1
  P  P195  1  0.516105  0.497470  0.490947  1
  P  P196  1  0.876063  0.729203  0.407614  1
  P  P197  1  0.569354  0.960936  0.324280  1
  P  P198  1  0.542730  0.729203  0.407614  1
  P  P199  1  0.470281  0.014113  0.436345  1
  P  P200  1  0.525502  0.475695  0.269342  1
  P  P201  1  0.136948  0.014113  0.436345  1
  P  P202  1  0.496906  0.245846  0.353012  1
  P  P203  1  0.192169  0.475695  0.269342  1
  P  P204  1  0.803615  0.014113  0.436345  1
  P  P205  1  0.163573  0.245846  0.353012  1
  P  P206  1  0.858835  0.475695  0.269342  1
  P  P207  1  0.830240  0.245846  0.353012  1
  P  P208  1  0.241183  0.441702  0.480553  1
  P  P209  1  0.294432  0.905168  0.313886  1
  P  P210  1  0.907849  0.441702  0.480553  1
  P  P211  1  0.267807  0.673435  0.397219  1
  P  P212  1  0.961099  0.905168  0.313886  1
  P  P213  1  0.574516  0.441702  0.480553  1
  P  P214  1  0.934474  0.673435  0.397219  1
  P  P215  1  0.627766  0.905168  0.313886  1
  P  P216  1  0.601141  0.673435  0.397219  1
  P  P217  1  0.288085  0.460147  0.668302  1
  P  P218  1  0.341334  0.923613  0.501635  1
  P  P219  1  0.954751  0.460147  0.668302  1
  P  P220  1  0.314709  0.691880  0.584969  1
  P  P221  1  0.008001  0.923613  0.501635  1
  P  P222  1  0.621418  0.460147  0.668302  1
  P  P223  1  0.981376  0.691880  0.584969  1
  P  P224  1  0.674667  0.923613  0.501635  1
  P  P225  1  0.648043  0.691880  0.584969  1
  P  P226  1  0.263619  0.605367  0.748603  1
  P  P227  1  0.316880  0.068737  0.581929  1
  P  P228  1  0.930286  0.605367  0.748603  1
  P  P229  1  0.290256  0.837004  0.665263  1
  P  P230  1  0.983547  0.068737  0.581929  1
  P  P231  1  0.596952  0.605367  0.748603  1
  P  P232  1  0.956922  0.837004  0.665263  1
  P  P233  1  0.650214  0.068737  0.581929  1
  P  P234  1  0.623589  0.837004  0.665263  1
  P  P235  1  0.320009  0.461887  0.621542  1
  P  P236  1  0.292717  0.229523  0.704949  1
  P  P237  1  0.986675  0.461887  0.621542  1
  P  P238  1  0.346633  0.693620  0.538208  1
  P  P239  1  0.959384  0.229523  0.704949  1
  P  P240  1  0.653342  0.461887  0.621542  1
  P  P241  1  0.013300  0.693620  0.538208  1
  P  P242  1  0.626050  0.229523  0.704949  1
  P  P243  1  0.679967  0.693620  0.538208  1
  P  P244  1  0.311581  0.298729  0.545356  1
  P  P245  1  0.284956  0.066996  0.628690  1
  P  P246  1  0.978248  0.298729  0.545356  1
  P  P247  1  0.258331  0.835263  0.712023  1
  P  P248  1  0.951623  0.066996  0.628690  1
  P  P249  1  0.644914  0.298729  0.545356  1
  P  P250  1  0.924998  0.835263  0.712023  1
  P  P251  1  0.618290  0.066996  0.628690  1
  P  P252  1  0.591665  0.835263  0.712023  1
  P  P253  1  0.258070  0.468992  0.620138  1
  P  P254  1  0.232213  0.236460  0.703572  1
  P  P255  1  0.924737  0.468992  0.620138  1
  P  P256  1  0.284695  0.700725  0.536805  1
  P  P257  1  0.898880  0.236460  0.703572  1
  P  P258  1  0.591404  0.468992  0.620138  1
  P  P259  1  0.951362  0.700725  0.536805  1
  P  P260  1  0.565547  0.236460  0.703572  1
  P  P261  1  0.618028  0.700725  0.536805  1
  P  P262  1  0.373520  0.291625  0.546760  1
  P  P263  1  0.346895  0.059892  0.630093  1
  P  P264  1  0.040186  0.291625  0.546760  1
  P  P265  1  0.320270  0.828159  0.713427  1
  P  P266  1  0.013561  0.059892  0.630093  1
  P  P267  1  0.706853  0.291625  0.546760  1
  P  P268  1  0.986937  0.828159  0.713427  1
  P  P269  1  0.680228  0.059892  0.630093  1
  P  P270  1  0.653603  0.828159  0.713427  1
  P  P271  1  0.295906  0.370174  0.634201  1
  P  P272  1  0.269168  0.139966  0.717368  1
  P  P273  1  0.962573  0.370174  0.634201  1
  P  P274  1  0.322531  0.601907  0.550868  1
  P  P275  1  0.935835  0.139966  0.717368  1
  P  P276  1  0.629239  0.370174  0.634201  1
  P  P277  1  0.989197  0.601907  0.550868  1
  P  P278  1  0.602502  0.139966  0.717368  1
  P  P279  1  0.655864  0.601907  0.550868  1
  P  P280  1  0.335684  0.390443  0.532697  1
  P  P281  1  0.309059  0.158710  0.616030  1
  P  P282  1  0.002350  0.390443  0.532697  1
  P  P283  1  0.282434  0.926977  0.699363  1
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