# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   25.11001716
_cell_length_b   33.07024775
_cell_length_c   51.12461249
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   106.07484798
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P384
_cell_volume   40793.69472
_cell_formula_units_Z   384
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  0.551357  0.446877  0.357064  1
  P  P2  1  0.313855  0.379632  0.405852  1
  P  P3  1  0.933907  0.429725  0.386446  1
  P  P4  1  0.933907  0.929725  0.386446  1
  P  P5  1  0.551357  0.946877  0.357064  1
  P  P6  1  0.313855  0.879632  0.405852  1
  P  P7  1  0.516406  0.336362  0.409983  1
  P  P8  1  0.293919  0.283919  0.434863  1
  P  P9  1  0.923367  0.328204  0.401119  1
  P  P10  1  0.923367  0.828204  0.401119  1
  P  P11  1  0.516406  0.836362  0.409983  1
  P  P12  1  0.293919  0.783919  0.434863  1
  P  P13  1  0.460615  0.415033  0.403233  1
  P  P14  1  0.069893  0.436386  0.389546  1
  P  P15  1  0.696997  0.483862  0.366444  1
  P  P16  1  0.696997  0.983862  0.366444  1
  P  P17  1  0.460615  0.915033  0.403233  1
  P  P18  1  0.069893  0.936386  0.389546  1
  P  P19  1  0.800524  0.271312  0.413384  1
  P  P20  1  0.388840  0.316219  0.391477  1
  P  P21  1  0.969071  0.295107  0.351339  1
  P  P22  1  0.969071  0.795107  0.351339  1
  P  P23  1  0.800524  0.771312  0.413384  1
  P  P24  1  0.388840  0.816219  0.391477  1
  P  P25  1  0.745372  0.445820  0.416960  1
  P  P26  1  0.340544  0.470340  0.378181  1
  P  P27  1  0.028994  0.496749  0.352127  1
  P  P28  1  0.028994  -0.003251  0.352127  1
  P  P29  1  0.745372  0.945820  0.416960  1
  P  P30  1  0.340544  0.970340  0.378181  1
  P  P31  1  0.594585  0.168143  0.394317  1
  P  P32  1  0.161045  0.283957  0.417162  1
  P  P33  1  0.834769  0.277484  0.354257  1
  P  P34  1  0.834769  0.777484  0.354257  1
  P  P35  1  0.594585  0.668143  0.394317  1
  P  P36  1  0.161045  0.783957  0.417162  1
  P  P37  1  0.465055  0.766400  0.361078  1
  P  P38  1  0.319990  0.715929  0.390825  1
  P  P39  1  0.894151  0.722932  0.391076  1
  P  P40  1  0.894151  0.222932  0.391076  1
  P  P41  1  0.465055  0.266400  0.361078  1
  P  P42  1  0.319990  0.215929  0.390825  1
  P  P43  1  0.609008  0.538019  0.379549  1
  P  P44  1  0.274889  0.518995  0.340432  1
  P  P45  1  1.020599  0.505996  0.419108  1
  P  P46  1  1.020599  0.005996  0.419108  1
  P  P47  1  0.609008  0.038019  0.379549  1
  P  P48  1  0.274889  0.018995  0.340432  1
  P  P49  1  0.573592  0.712729  0.340710  1
  P  P50  1  0.363253  0.638077  0.409560  1
  P  P51  1  0.923303  0.626984  0.384066  1
  P  P52  1  0.923303  0.126984  0.384066  1
  P  P53  1  0.573592  0.212729  0.340710  1
  P  P54  1  0.363253  0.138077  0.409560  1
  P  P55  1  0.528775  0.601609  0.353303  1
  P  P56  1  0.282046  0.540863  0.400812  1
  P  P57  1  0.933751  0.532446  0.372657  1
  P  P58  1  0.933751  0.032446  0.372657  1
  P  P59  1  0.528775  0.101609  0.353303  1
  P  P60  1  0.282046  0.040863  0.400812  1
  P  P61  1  0.467202  0.672163  0.373685  1
  P  P62  1  0.996661  0.709305  0.356241  1
  P  P63  1  0.824021  0.636991  0.421548  1
  P  P64  1  0.824021  0.136991  0.421548  1
  P  P65  1  0.467202  0.172163  0.373685  1
  P  P66  1  0.996661  0.209305  0.356241  1
  P  P67  1  0.811155  0.543455  0.393129  1
  P  P68  1  0.396691  0.570956  0.367711  1
  P  P69  1  0.161734  0.504243  0.426582  1
  P  P70  1  0.161734  0.004243  0.426582  1
  P  P71  1  0.811155  0.043455  0.393129  1
  P  P72  1  0.396691  0.070956  0.367711  1
  P  P73  1  0.563080  0.254707  0.397268  1
  P  P74  1  0.436796  0.241974  0.422741  1
  P  P75  1  1.024638  0.270921  0.408855  1
  P  P76  1  1.024638  0.770921  0.408855  1
  P  P77  1  0.563080  0.754707  0.397268  1
  P  P78  1  0.436796  0.741974  0.422741  1
  P  P79  1  0.609138  0.434301  0.409007  1
  P  P80  1  0.203483  0.446098  0.380978  1
  P  P81  1  0.820815  0.457207  0.365772  1
  P  P82  1  0.820815  0.957207  0.365772  1
  P  P83  1  0.609138  0.934301  0.409007  1
  P  P84  1  0.203483  0.946098  0.380978  1
  P  P85  1  0.476055  0.508167  0.378098  1
  P  P86  1  0.159043  0.525876  0.366692  1
  P  P87  1  0.879082  0.485441  0.423231  1
  P  P88  1  0.879082  0.985441  0.423231  1
  P  P89  1  0.476055  0.008167  0.378098  1
  P  P90  1  0.159043  0.025876  0.366692  1
  P  P91  1  0.695842  0.744071  0.369418  1
  P  P92  1  0.256038  0.784300  0.375839  1
  P  P93  1  0.067939  0.685804  0.400911  1
  P  P94  1  0.067939  0.185804  0.400911  1
  P  P95  1  0.695842  0.244071  0.369418  1
  P  P96  1  0.256038  0.284300  0.375839  1
  P  P97  1  0.717943  0.359935  0.450988  1
  P  P98  1  0.478605  0.317293  0.483573  1
  P  P99  1  0.100541  0.314489  0.464811  1
  P  P100  1  0.100541  0.814489  0.464811  1
  P  P101  1  0.717943  0.859935  0.450988  1
  P  P102  1  0.478605  0.817293  0.483573  1
  P  P103  1  0.673407  0.257989  0.430072  1
  P  P104  1  0.436752  0.216086  0.485906  1
  P  P105  1  0.088362  0.215029  0.460331  1
  P  P106  1  0.088362  0.715029  0.460331  1
  P  P107  1  0.673407  0.757989  0.430072  1
  P  P108  1  0.436752  0.716086  0.485906  1
  P  P109  1  0.619162  0.348142  0.492266  1
  P  P110  1  0.239478  0.356622  0.458223  1
  P  P111  1  0.855563  0.384401  0.438203  1
  P  P112  1  0.855563  0.884401  0.438203  1
  P  P113  1  0.619162  0.848142  0.492266  1
  P  P114  1  0.239478  0.856622  0.458223  1
  P  P115  1  0.955917  0.122236  0.484776  1
  P  P116  1  0.557462  0.257855  0.460810  1
  P  P117  1  0.196343  0.197168  0.419928  1
  P  P118  1  0.196343  0.697168  0.419928  1
  P  P119  1  0.955917  0.622236  0.484776  1
  P  P120  1  0.557462  0.757855  0.460810  1
  P  P121  1  0.932315  0.375459  0.497360  1
  P  P122  1  0.528814  0.404604  0.457190  1
  P  P123  1  0.132560  0.403563  0.436526  1
  P  P124  1  0.132560  0.903563  0.436526  1
  P  P125  1  0.932315  0.875459  0.497360  1
  P  P126  1  0.528814  0.904604  0.457190  1
  P  P127  1  0.741878  0.160766  0.516755  1
  P  P128  1  0.319040  0.194782  0.453920  1
  P  P129  1  0.958815  0.182294  0.435592  1
  P  P130  1  0.958815  0.682294  0.435592  1
  P  P131  1  0.741878  0.660766  0.516755  1
  P  P132  1  0.319040  0.694782  0.453920  1
  P  P133  1  0.720294  0.674559  0.409514  1
  P  P134  1  0.384195  0.618481  0.468602  1
  P  P135  1  0.069697  0.619860  0.448452  1
  P  P136  1  0.069697  0.119860  0.448452  1
  P  P137  1  0.720294  0.174559  0.409514  1
  P  P138  1  0.384195  0.118481  0.468602  1
  P  P139  1  0.804766  0.447144  0.474572  1
  P  P140  1  0.406889  0.479436  0.433236  1
  P  P141  1  0.198625  0.423488  0.491543  1
  P  P142  1  0.198625  0.923488  0.491543  1
  P  P143  1  0.804766  0.947144  0.474572  1
  P  P144  1  0.406889  0.979436  0.433236  1
  P  P145  1  0.721785  0.614225  0.461476  1
  P  P146  1  0.487259  0.569055  0.467432  1
  P  P147  1  0.147475  0.568021  0.473785  1
  P  P148  1  0.147475  0.068021  0.473785  1
  P  P149  1  0.721785  0.114225  0.461476  1
  P  P150  1  0.487259  0.069055  0.467432  1
  P  P151  1  0.691804  0.525194  0.425779  1
  P  P152  1  0.474860  0.469606  0.486476  1
  P  P153  1  0.071703  0.474771  0.471286  1
  P  P154  1  0.071703  0.974771  0.471286  1
  P  P155  1  0.691804  0.025194  0.425779  1
  P  P156  1  0.474860  0.969606  0.486476  1
  P  P157  1  0.621601  0.668664  0.456128  1
  P  P158  1  0.237549  0.610872  0.432653  1
  P  P159  1  0.025649  0.551955  0.496302  1
  P  P160  1  0.025649  0.051955  0.496302  1
  P  P161  1  0.621601  0.168664  0.456128  1
  P  P162  1  0.237549  0.110872  0.432653  1
  P  P163  1  0.939036  0.466572  0.474263  1
  P  P164  1  0.545398  0.500375  0.432879  1
  P  P165  1  0.338960  0.442930  0.484969  1
  P  P166  1  0.338960  0.942930  0.484969  1
  P  P167  1  0.939036  0.966572  0.474263  1
  P  P168  1  0.545398  0.000375  0.432879  1
  P  P169  1  0.756540  0.217211  0.465318  1
  P  P170  1  0.519642  0.159955  0.497080  1
  P  P171  1  0.193397  0.168579  0.479215  1
  P  P172  1  0.193397  0.668579  0.479215  1
  P  P173  1  0.756540  0.717211  0.465318  1
  P  P174  1  0.519642  0.659955  0.497080  1
  P  P175  1  0.799987  0.349257  0.496082  1
  P  P176  1  0.390222  0.373969  0.454950  1
  P  P177  1  0.991794  0.401780  0.439363  1
  P  P178  1  0.991794  0.901780  0.439363  1
  P  P179  1  0.799987  0.849257  0.496082  1
  P  P180  1  0.390222  0.873969  0.454950  1
  P  P181  1  0.666177  0.440638  0.468182  1
  P  P182  1  0.267184  0.453813  0.434927  1
  P  P183  1  0.066219  0.388253  0.494485  1
  P  P184  1  0.066219  0.888253  0.494485  1
  P  P185  1  0.666177  0.940638  0.468182  1
  P  P186  1  0.267184  0.953813  0.434927  1
  P  P187  1  0.855959  0.675522  0.480169  1
  P  P188  1  0.493581  0.666574  0.435826  1
  P  P189  1  0.269802  0.609926  0.500934  1
  P  P190  1  0.269802  0.109926  0.500934  1
  P  P191  1  0.855959  0.175522  0.480169  1
  P  P192  1  0.493581  0.166574  0.435826  1
  P  P193  1  0.874668  0.287074  0.527761  1
  P  P194  1  0.657724  0.231487  0.588458  1
  P  P195  1  0.277825  0.281910  0.542951  1
  P  P196  1  0.277825  0.781910  0.542951  1
  P  P197  1  0.874668  0.787074  0.527761  1
  P  P198  1  0.657724  0.731487  0.588458  1
  P  P199  1  0.862269  0.187626  0.546805  1
  P  P200  1  0.627743  0.142456  0.552760  1
  P  P201  1  0.202053  0.188659  0.540452  1
  P  P202  1  0.202053  0.688659  0.540452  1
  P  P203  1  0.862269  0.687626  0.546805  1
  P  P204  1  0.627743  0.642456  0.552760  1
  P  P205  1  0.804130  0.256306  0.581357  1
  P  P206  1  0.410492  0.290109  0.539974  1
  P  P207  1  1.010568  0.313750  0.529268  1
  P  P208  1  1.010568  0.813750  0.529268  1
  P  P209  1  0.804130  0.756306  0.581357  1
  P  P210  1  0.410492  0.790109  0.539974  1
  P  P211  1  0.111979  0.145808  0.581583  1
  P  P212  1  0.727927  0.088017  0.558109  1
  P  P213  1  0.323879  0.204726  0.517935  1
  P  P214  1  0.323879  0.704726  0.517935  1
  P  P215  1  0.111979  0.645808  0.581583  1
  P  P216  1  0.727927  0.588017  0.558109  1
  P  P217  1  0.082344  0.302868  0.579310  1
  P  P218  1  0.683351  0.316043  0.546055  1
  P  P219  1  0.283309  0.368428  0.519752  1
  P  P220  1  0.283309  0.868428  0.519752  1
  P  P221  1  0.082344  0.802868  0.579310  1
  P  P222  1  0.683351  0.816043  0.546055  1
  P  P223  1  0.855947  0.090106  0.578411  1
  P  P224  1  0.493569  0.081158  0.534068  1
  P  P225  1  0.079726  0.146754  0.513303  1
  P  P226  1  0.079726  0.646754  0.513303  1
  P  P227  1  0.855947  0.590106  0.578411  1
  P  P228  1  0.493569  0.581158  0.534068  1
  P  P229  1  0.829886  0.596726  0.517156  1
  P  P230  1  0.592988  0.539470  0.548919  1
  P  P231  1  0.156130  0.588101  0.535022  1
  P  P232  1  0.156130  0.088101  0.535022  1
  P  P233  1  0.829886  0.096726  0.517156  1
  P  P234  1  0.592988  0.039470  0.548919  1
  P  P235  1  0.959306  0.382711  0.559287  1
  P  P236  1  0.549541  0.407423  0.518154  1
  P  P237  1  0.357733  0.354901  0.574874  1
  P  P238  1  0.357733  0.854901  0.574874  1
  P  P239  1  0.959306  0.882711  0.559287  1
  P  P240  1  0.549541  0.907423  0.518154  1
  P  P241  1  0.912776  0.540594  0.528331  1
  P  P242  1  0.676121  0.498691  0.584165  1
  P  P243  1  0.261166  0.541651  0.553906  1
  P  P244  1  0.261166  0.041651  0.553906  1
  P  P245  1  0.912776  0.040594  0.528331  1
  P  P246  1  0.676121  -0.001309  0.584165  1
  P  P247  1  0.870923  0.439387  0.530663  1
  P  P248  1  0.631584  0.396746  0.563248  1
  P  P249  1  0.248986  0.442192  0.549426  1
  P  P250  1  0.248986  0.942192  0.549426  1
  P  P251  1  0.870923  0.939387  0.530663  1
  P  P252  1  0.631584  0.896746  0.563248  1
  P  P253  1  0.792066  0.498825  0.553427  1
  P  P254  1  0.393610  0.634445  0.529461  1
  P  P255  1  0.153185  0.559512  0.594309  1
  P  P256  1  0.153185  0.059512  0.594309  1
  P  P257  1  0.792066  -0.001175  0.553427  1
  P  P258  1  0.393610  0.134445  0.529461  1
  P  P259  1  0.110050  0.400059  0.556014  1
  P  P260  1  0.730366  0.408538  0.521971  1
  P  P261  1  0.493965  0.372280  0.576033  1
  P  P262  1  0.493965  0.872280  0.576033  1
  P  P263  1  0.110050  0.900059  0.556014  1
  P  P264  1  0.730366  0.908538  0.521971  1
  P  P265  1  0.965333  0.138199  0.545635  1
  P  P266  1  0.629234  0.082122  0.604723  1
  P  P267  1  0.279831  0.136821  0.565785  1
  P  P268  1  0.279831  0.636821  0.565785  1
  P  P269  1  0.965333  0.638199  0.545635  1
  P  P270  1  0.629234  0.582122  0.604723  1
  P  P271  1  0.942639  0.277244  0.581001  1
  P  P272  1  0.544762  0.309536  0.539664  1
  P  P273  1  0.150902  0.333193  0.522694  1
  P  P274  1  0.150902  0.833193  0.522694  1
  P  P275  1  0.942639  0.777244  0.581001  1
  P  P276  1  0.544762  0.809536  0.539664  1
  P  P277  1  0.820714  0.352077  0.557047  1
  P  P278  1  0.417213  0.381222  0.516877  1
  P  P279  1  0.216968  0.353117  0.577711  1
  P  P280  1  0.216968  0.853117  0.577711  1
  P  P281  1  0.820714  0.852077  0.557047  1
  P  P282  1  0.417213  0.881222  0.516877  1
  P  P283  1  0.030487  0.561898  0.560317  1
  P  P284  1  0.607650  0.595914  0.497482  1
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