# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.68940464
_cell_length_b   49.25660679
_cell_length_c   57.28982608
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   97.08888298
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P216
_cell_volume   46735.8661189
_cell_formula_units_Z   216
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  0.155398  0.561167  0.347876  1
  P  P2  1  0.175511  0.219452  0.300614  1
  P  P3  1  0.133054  0.902728  0.395495  1
  P  P4  1  0.513749  0.565843  0.368390  1
  P  P5  1  0.536092  0.224281  0.320771  1
  P  P6  1  0.491405  0.907404  0.416009  1
  P  P7  1  0.013770  0.582844  0.375505  1
  P  P8  1  0.037206  0.240627  0.327623  1
  P  P9  1  0.991426  0.924405  0.423124  1
  P  P10  1  0.655376  0.544166  0.340761  1
  P  P11  1  0.677720  0.202604  0.293142  1
  P  P12  1  0.633033  0.885727  0.388380  1
  P  P13  1  0.019344  0.519649  0.370389  1
  P  P14  1  0.042641  0.178896  0.322621  1
  P  P15  1  0.997000  0.861210  0.418008  1
  P  P16  1  0.649803  0.607361  0.345877  1
  P  P17  1  0.672147  0.265800  0.298258  1
  P  P18  1  0.627459  0.948922  0.393496  1
  P  P19  1  0.980388  0.554407  0.326832  1
  P  P20  1  0.935700  0.237529  0.422070  1
  P  P21  1  0.958044  0.895968  0.374451  1
  P  P22  1  0.688758  0.572603  0.389434  1
  P  P23  1  0.711102  0.231042  0.341815  1
  P  P24  1  0.733261  0.889481  0.294140  1
  P  P25  1  0.245096  0.451856  0.426452  1
  P  P26  1  0.267440  0.110295  0.378833  1
  P  P27  1  0.289784  0.768734  0.331214  1
  P  P28  1  0.424088  0.675050  0.289772  1
  P  P29  1  0.379362  0.358276  0.385053  1
  P  P30  1  0.401706  0.016715  0.337434  1
  P  P31  1  0.331013  0.490183  0.291329  1
  P  P32  1  0.287187  0.173943  0.386095  1
  P  P33  1  0.309530  0.832382  0.338476  1
  P  P34  1  0.337272  0.636189  0.425410  1
  P  P35  1  0.359616  0.294628  0.377791  1
  P  P36  1  0.381960  0.953066  0.330172  1
  P  P37  1  0.189042  0.454194  0.313983  1
  P  P38  1  0.141861  0.137077  0.409268  1
  P  P39  1  0.164205  0.795516  0.361649  1
  P  P40  1  0.482598  0.673055  0.402237  1
  P  P41  1  0.504942  0.331494  0.354618  1
  P  P42  1  0.527286  0.989932  0.306999  1
  P  P43  1  0.361191  0.452450  0.332135  1
  P  P44  1  0.318097  0.135279  0.427841  1
  P  P45  1  0.340441  0.793718  0.380222  1
  P  P46  1  0.306361  0.674853  0.383663  1
  P  P47  1  0.328705  0.333292  0.336044  1
  P  P48  1  0.351049  0.991730  0.288425  1
  P  P49  1  0.835768  0.680778  0.428051  1
  P  P50  1  0.858112  0.339217  0.380432  1
  P  P51  1  0.880456  0.997655  0.332813  1
  P  P52  1  0.829632  0.444316  0.288266  1
  P  P53  1  0.788690  0.129354  0.383453  1
  P  P54  1  0.811034  0.787793  0.335834  1
  P  P55  1  0.983127  0.682297  0.329656  1
  P  P56  1  0.934785  0.366196  0.426189  1
  P  P57  1  0.957129  0.024635  0.378570  1
  P  P58  1  0.689674  0.443936  0.385316  1
  P  P59  1  0.712018  0.102375  0.337697  1
  P  P60  1  0.734362  0.760813  0.290078  1
  P  P61  1  0.943121  0.737723  0.425683  1
  P  P62  1  0.965464  0.396161  0.378064  1
  P  P63  1  0.987808  0.054600  0.330445  1
  P  P64  1  0.729541  0.391251  0.290477  1
  P  P65  1  0.681338  0.072410  0.385821  1
  P  P66  1  0.703682  0.730848  0.338202  1
  P  P67  1  0.085955  0.660682  0.294611  1
  P  P68  1  0.045153  0.342980  0.388610  1
  P  P69  1  0.067497  1.001419  0.340991  1
  P  P70  1  0.579305  0.467152  0.422895  1
  P  P71  1  0.601649  0.125591  0.375276  1
  P  P72  1  0.623993  0.784029  0.327657  1
  P  P73  1  0.088366  0.585851  0.490733  1
  P  P74  1  0.110710  0.244290  0.443114  1
  P  P75  1  0.066022  0.927413  0.538353  1
  P  P76  1  0.446717  0.590527  0.511247  1
  P  P77  1  0.469061  0.248966  0.463628  1
  P  P78  1  0.424373  0.932089  0.558866  1
  P  P79  1  0.946738  0.607528  0.518363  1
  P  P80  1  0.969082  0.265967  0.470744  1
  P  P81  1  0.924394  0.949090  0.565982  1
  P  P82  1  0.588345  0.568850  0.483618  1
  P  P83  1  0.610689  0.227289  0.435999  1
  P  P84  1  0.566001  0.910412  0.531237  1
  P  P85  1  0.952312  0.544333  0.513246  1
  P  P86  1  0.974656  0.202771  0.465627  1
  P  P87  1  0.929968  0.885894  0.560865  1
  P  P88  1  0.582771  0.632045  0.488734  1
  P  P89  1  0.605115  0.290484  0.441115  1
  P  P90  1  0.560427  0.973607  0.536353  1
  P  P91  1  0.913356  0.579091  0.469689  1
  P  P92  1  0.868668  0.262214  0.564927  1
  P  P93  1  0.891012  0.920652  0.517308  1
  P  P94  1  0.621726  0.597287  0.532291  1
  P  P95  1  0.644070  0.255726  0.484672  1
  P  P96  1  0.666414  0.914164  0.437053  1
  P  P97  1  0.178065  0.476541  0.569309  1
  P  P98  1  0.200409  0.134979  0.521690  1
  P  P99  1  0.222753  0.793418  0.474071  1
  P  P100  1  0.357018  0.699837  0.432672  1
  P  P101  1  0.312330  0.382960  0.527910  1
  P  P102  1  0.334674  0.041399  0.480291  1
  P  P103  1  0.264843  0.515505  0.433714  1
  P  P104  1  0.220155  0.198627  0.528952  1
  P  P105  1  0.242499  0.857066  0.481333  1
  P  P106  1  0.270240  0.660874  0.568267  1
  P  P107  1  0.292584  0.319312  0.520648  1
  P  P108  1  0.314928  0.977751  0.473029  1
  P  P109  1  0.119517  0.478639  0.456887  1
  P  P110  1  0.074829  0.161761  0.552125  1
  P  P111  1  0.097173  0.820200  0.504506  1
  P  P112  1  0.415566  0.697740  0.545094  1
  P  P113  1  0.437910  0.356178  0.497475  1
  P  P114  1  0.460254  0.014617  0.449856  1
  P  P115  1  0.295753  0.476841  0.475460  1
  P  P116  1  0.251065  0.159964  0.570698  1
  P  P117  1  0.273409  0.818402  0.523079  1
  P  P118  1  0.239329  0.699537  0.526521  1
  P  P119  1  0.261673  0.357976  0.478902  1
  P  P120  1  0.284017  0.016414  0.431282  1
  P  P121  1  0.768736  0.705462  0.570908  1
  P  P122  1  0.791080  0.363901  0.523289  1
  P  P123  1  0.813424  0.022340  0.475670  1
  P  P124  1  0.766346  0.470916  0.431072  1
  P  P125  1  0.721659  0.154039  0.526310  1
  P  P126  1  0.744002  0.812477  0.478691  1
  P  P127  1  0.912441  0.707758  0.473808  1
  P  P128  1  0.867753  0.390881  0.569046  1
  P  P129  1  0.890097  0.049319  0.521427  1
  P  P130  1  0.622642  0.468620  0.528173  1
  P  P131  1  0.644986  0.127059  0.480554  1
  P  P132  1  0.667330  0.785497  0.432935  1
  P  P133  1  0.876089  0.762407  0.568540  1
  P  P134  1  0.898433  0.420845  0.520921  1
  P  P135  1  0.920777  0.079284  0.473302  1
  P  P136  1  0.658994  0.413971  0.433440  1
  P  P137  1  0.614306  0.097094  0.528679  1
  P  P138  1  0.636650  0.755533  0.481059  1
  P  P139  1  0.022810  0.684542  0.436229  1
  P  P140  1  0.978122  0.367665  0.531467  1
  P  P141  1  1.000466  0.026103  0.483848  1
  P  P142  1  0.512273  0.491836  0.565752  1
  P  P143  1  0.534617  0.150275  0.518133  1
  P  P144  1  0.556961  0.808713  0.470514  1
  P  P145  1  0.021334  0.610535  0.633591  1
  P  P146  1  0.043678  0.268974  0.585972  1
  P  P147  1  0.998990  0.952097  0.681210  1
  P  P148  1  0.379685  0.615211  0.654104  1
  P  P149  1  0.402029  0.273650  0.606485  1
  P  P150  1  0.359571  0.956926  0.701367  1
  P  P151  1  0.879706  0.632212  0.661220  1
  P  P152  1  0.902050  0.290651  0.613601  1
  P  P153  1  0.857362  0.973774  0.708839  1
  P  P154  1  0.521313  0.593534  0.626475  1
  P  P155  1  0.543657  0.251973  0.578856  1
  P  P156  1  0.497877  0.935751  0.674358  1
  P  P157  1  0.885280  0.569017  0.656103  1
  P  P158  1  0.907624  0.227456  0.608484  1
  P  P159  1  0.862936  0.910579  0.703722  1
  P  P160  1  0.515739  0.656730  0.631592  1
  P  P161  1  0.538083  0.315168  0.583972  1
  P  P162  1  0.492442  0.997483  0.679360  1
  P  P163  1  0.846324  0.603775  0.612546  1
  P  P164  1  0.801821  0.286898  0.707840  1
  P  P165  1  0.823980  0.945337  0.660165  1
  P  P166  1  0.554695  0.621972  0.675149  1
  P  P167  1  0.577038  0.280410  0.627530  1
  P  P168  1  0.599382  0.938849  0.579910  1
  P  P169  1  0.110995  0.501329  0.712209  1
  P  P170  1  0.133377  0.159664  0.664547  1
  P  P171  1  0.155721  0.818102  0.616928  1
  P  P172  1  0.289986  0.724522  0.575529  1
  P  P173  1  0.245298  0.407645  0.670767  1
  P  P174  1  0.267642  0.066083  0.623148  1
  P  P175  1  0.197811  0.540189  0.576571  1
  P  P176  1  0.153123  0.223312  0.671809  1
  P  P177  1  0.175467  0.881750  0.624190  1
  P  P178  1  0.204069  0.686195  0.710652  1
  P  P179  1  0.225552  0.343997  0.663505  1
  P  P180  1  0.247896  0.002435  0.615886  1
  P  P181  1  0.052485  0.503323  0.599744  1
  P  P182  1  0.007797  0.186446  0.694982  1
  P  P183  1  0.030141  0.844884  0.647363  1
  P  P184  1  0.346041  0.722184  0.687998  1
  P  P185  1  0.370878  0.380863  0.640332  1
  P  P186  1  0.393222  0.039301  0.592713  1
  P  P187  1  0.228721  0.501525  0.618317  1
  P  P188  1  0.184033  0.184648  0.713555  1
  P  P189  1  0.206377  0.843087  0.665936  1
  P  P190  1  0.173891  0.723928  0.669846  1
  P  P191  1  0.194642  0.382660  0.621759  1
  P  P192  1  0.216986  0.041099  0.574140  1
  P  P193  1  0.705451  0.732063  0.713714  1
  P  P194  1  0.724048  0.388585  0.666146  1
  P  P195  1  0.746392  0.047024  0.618527  1
  P  P196  1  0.699315  0.495600  0.573929  1
  P  P197  1  0.654627  0.178723  0.669168  1
  P  P198  1  0.676971  0.837162  0.621549  1
  P  P199  1  0.845409  0.732442  0.616665  1
  P  P200  1  0.800721  0.415565  0.711903  1
  P  P201  1  0.823065  0.074004  0.664284  1
  P  P202  1  0.551956  0.494081  0.672324  1
  P  P203  1  0.577954  0.151743  0.623411  1
  P  P204  1  0.600298  0.810182  0.575792  1
  P  P205  1  0.805542  0.785127  0.711504  1
  P  P206  1  0.831401  0.445530  0.663778  1
  P  P207  1  0.853745  0.103968  0.616159  1
  P  P208  1  0.591962  0.438656  0.576298  1
  P  P209  1  0.547274  0.121779  0.671536  1
  P  P210  1  0.569618  0.780217  0.623917  1
  P  P211  1  0.955778  0.709226  0.579086  1
  P  P212  1  0.911090  0.392349  0.674324  1
  P  P213  1  0.933434  0.050788  0.626705  1
  P  P214  1  0.449128  0.515696  0.707370  1
  P  P215  1  0.467585  0.174959  0.660990  1
  P  P216  1  0.489929  0.833398  0.613371  1
