# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   54.86229890
_cell_length_b   98.74617384
_cell_length_c   51.83544891
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.43887354
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P1296
_cell_volume   279493.850806
_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  0.714231  0.714590  0.428144  1
  P  P2  1  1.000175  0.716269  0.332906  1
  P  P3  1  0.023869  0.548763  0.380525  1
  P  P4  1  0.047564  0.381257  0.428144  1
  P  P5  1  0.357203  0.715429  0.380525  1
  P  P6  1  0.380897  0.547924  0.428144  1
  P  P7  1  0.666841  0.549602  0.332906  1
  P  P8  1  0.690536  0.382096  0.380525  1
  P  P9  1  0.714231  0.214590  0.428144  1
  P  P10  1  1.000175  0.216269  0.332906  1
  P  P11  1  0.023869  0.048763  0.380525  1
  P  P12  1  0.047564  0.881257  0.428144  1
  P  P13  1  0.333508  0.382935  0.332906  1
  P  P14  1  0.357203  0.215429  0.380525  1
  P  P15  1  0.380897  0.047924  0.428144  1
  P  P16  1  0.666841  0.049602  0.332906  1
  P  P17  1  0.690536  0.882096  0.380525  1
  P  P18  1  0.333508  0.882935  0.332906  1
  P  P19  1  0.643927  0.779345  0.289356  1
  P  P20  1  1.000879  0.777445  0.336556  1
  P  P21  1  0.024574  0.609939  0.384175  1
  P  P22  1  0.977260  0.446012  0.289356  1
  P  P23  1  0.357907  0.776606  0.384175  1
  P  P24  1  0.310594  0.612678  0.289356  1
  P  P25  1  0.667546  0.610778  0.336556  1
  P  P26  1  0.691240  0.443273  0.384175  1
  P  P27  1  0.643927  0.279345  0.289356  1
  P  P28  1  1.000879  0.277445  0.336556  1
  P  P29  1  0.024574  0.109939  0.384175  1
  P  P30  1  0.977260  0.946012  0.289356  1
  P  P31  1  0.334212  0.444112  0.336556  1
  P  P32  1  0.357907  0.276606  0.384175  1
  P  P33  1  0.310594  0.112678  0.289356  1
  P  P34  1  0.667546  0.110778  0.336556  1
  P  P35  1  0.691240  0.943273  0.384175  1
  P  P36  1  0.334212  0.944112  0.336556  1
  P  P37  1  0.649264  0.694907  0.327288  1
  P  P38  1  0.004909  0.694007  0.376329  1
  P  P39  1  0.028603  0.526501  0.423948  1
  P  P40  1  0.982598  0.361574  0.327288  1
  P  P41  1  0.361937  0.693167  0.423948  1
  P  P42  1  0.315931  0.528240  0.327288  1
  P  P43  1  0.671575  0.527340  0.376329  1
  P  P44  1  0.695270  0.359834  0.423948  1
  P  P45  1  0.649264  0.194907  0.327288  1
  P  P46  1  0.004909  0.194007  0.376329  1
  P  P47  1  0.028603  0.026501  0.423948  1
  P  P48  1  0.982598  0.861574  0.327288  1
  P  P49  1  0.338242  0.360673  0.376329  1
  P  P50  1  0.361937  0.193167  0.423948  1
  P  P51  1  0.315931  0.028240  0.327288  1
  P  P52  1  0.671575  0.027340  0.376329  1
  P  P53  1  0.695270  0.859834  0.423948  1
  P  P54  1  0.338242  0.860673  0.376329  1
  P  P55  1  0.710201  0.798029  0.388372  1
  P  P56  1  0.996145  0.799707  0.293134  1
  P  P57  1  0.019840  0.632201  0.340753  1
  P  P58  1  0.043535  0.464696  0.388372  1
  P  P59  1  0.353173  0.798868  0.340753  1
  P  P60  1  0.376868  0.631362  0.388372  1
  P  P61  1  0.662812  0.633040  0.293134  1
  P  P62  1  0.686507  0.465535  0.340753  1
  P  P63  1  0.710201  0.298029  0.388372  1
  P  P64  1  0.996145  0.299707  0.293134  1
  P  P65  1  0.019840  0.132201  0.340753  1
  P  P66  1  0.043535  0.964696  0.388372  1
  P  P67  1  0.329479  0.466374  0.293134  1
  P  P68  1  0.353173  0.298868  0.340753  1
  P  P69  1  0.376868  0.131362  0.388372  1
  P  P70  1  0.662812  0.133040  0.293134  1
  P  P71  1  0.686507  0.965535  0.340753  1
  P  P72  1  0.329479  0.966374  0.293134  1
  P  P73  1  0.688364  0.696072  0.289199  1
  P  P74  1  0.046877  0.695261  0.335480  1
  P  P75  1  0.070571  0.527756  0.383099  1
  P  P76  1  0.021698  0.362738  0.289199  1
  P  P77  1  0.403905  0.694422  0.383099  1
  P  P78  1  0.355031  0.529405  0.289199  1
  P  P79  1  0.713543  0.528595  0.335480  1
  P  P80  1  0.737238  0.361089  0.383099  1
  P  P81  1  0.688364  0.196072  0.289199  1
  P  P82  1  0.046877  0.195261  0.335480  1
  P  P83  1  0.070571  0.027756  0.383099  1
  P  P84  1  0.021698  0.862738  0.289199  1
  P  P85  1  0.380210  0.361928  0.335480  1
  P  P86  1  0.403905  0.194422  0.383099  1
  P  P87  1  0.355031  0.029405  0.289199  1
  P  P88  1  0.713543  0.028595  0.335480  1
  P  P89  1  0.737238  0.861089  0.383099  1
  P  P90  1  0.380210  0.861928  0.335480  1
  P  P91  1  0.668233  0.796774  0.429221  1
  P  P92  1  0.954177  0.798452  0.333983  1
  P  P93  1  0.977872  0.630947  0.381602  1
  P  P94  1  0.001567  0.463441  0.429221  1
  P  P95  1  0.311205  0.797613  0.381602  1
  P  P96  1  0.334900  0.630108  0.429221  1
  P  P97  1  0.620844  0.631786  0.333983  1
  P  P98  1  0.644539  0.464280  0.381602  1
  P  P99  1  0.668233  0.296774  0.429221  1
  P  P100  1  0.954177  0.298452  0.333983  1
  P  P101  1  0.977872  0.130947  0.381602  1
  P  P102  1  0.001567  0.963441  0.429221  1
  P  P103  1  0.287511  0.465119  0.333983  1
  P  P104  1  0.311205  0.297613  0.381602  1
  P  P105  1  0.334900  0.130108  0.429221  1
  P  P106  1  0.620844  0.131786  0.333983  1
  P  P107  1  0.644539  0.964280  0.381602  1
  P  P108  1  0.287511  0.965119  0.333983  1
  P  P109  1  0.710364  0.683947  0.414104  1
  P  P110  1  0.996308  0.685625  0.318866  1
  P  P111  1  0.020003  0.518119  0.366485  1
  P  P112  1  0.043697  0.350613  0.414104  1
  P  P113  1  0.353336  0.684786  0.366485  1
  P  P114  1  0.377031  0.517280  0.414104  1
  P  P115  1  0.662975  0.518958  0.318866  1
  P  P116  1  0.686670  0.351452  0.366485  1
  P  P117  1  0.710364  0.183947  0.414104  1
  P  P118  1  0.996308  0.185625  0.318866  1
  P  P119  1  0.020003  0.018119  0.366485  1
  P  P120  1  0.043697  0.850613  0.414104  1
  P  P121  1  0.329642  0.352291  0.318866  1
  P  P122  1  0.353336  0.184786  0.366485  1
  P  P123  1  0.377031  0.017280  0.414104  1
  P  P124  1  0.662975  0.018958  0.318866  1
  P  P125  1  0.686670  0.851452  0.366485  1
  P  P126  1  0.329642  0.852291  0.318866  1
  P  P127  1  0.647541  0.807900  0.302475  1
  P  P128  1  0.004746  0.808089  0.350597  1
  P  P129  1  0.028440  0.640583  0.398216  1
  P  P130  1  0.980875  0.474567  0.302475  1
  P  P131  1  0.361774  0.807250  0.398216  1
  P  P132  1  0.314208  0.641233  0.302475  1
  P  P133  1  0.671412  0.641422  0.350597  1
  P  P134  1  0.695107  0.473916  0.398216  1
  P  P135  1  0.647541  0.307900  0.302475  1
  P  P136  1  0.004746  0.308089  0.350597  1
  P  P137  1  0.028440  0.140583  0.398216  1
  P  P138  1  0.980875  0.974567  0.302475  1
  P  P139  1  0.338079  0.474756  0.350597  1
  P  P140  1  0.361774  0.307250  0.398216  1
  P  P141  1  0.314208  0.141233  0.302475  1
  P  P142  1  0.671412  0.141422  0.350597  1
  P  P143  1  0.695107  0.973916  0.398216  1
  P  P144  1  0.338079  0.974756  0.350597  1
  P  P145  1  0.767183  0.738119  0.287618  1
  P  P146  1  0.124211  0.737280  0.335237  1
  P  P147  1  0.147906  0.569775  0.382856  1
  P  P148  1  0.100517  0.404786  0.287618  1
  P  P149  1  0.481239  0.736441  0.382856  1
  P  P150  1  0.433850  0.571453  0.287618  1
  P  P151  1  0.790878  0.570614  0.335237  1
  P  P152  1  0.814573  0.403108  0.382856  1
  P  P153  1  0.767183  0.238119  0.287618  1
  P  P154  1  0.124211  0.237280  0.335237  1
  P  P155  1  0.147906  0.069775  0.382856  1
  P  P156  1  0.100517  0.904786  0.287618  1
  P  P157  1  0.457545  0.403947  0.335237  1
  P  P158  1  0.481239  0.236441  0.382856  1
  P  P159  1  0.433850  0.071453  0.287618  1
  P  P160  1  0.790878  0.070614  0.335237  1
  P  P161  1  0.814573  0.903108  0.382856  1
  P  P162  1  0.457545  0.903947  0.335237  1
  P  P163  1  0.590899  0.754755  0.429463  1
  P  P164  1  0.878214  0.756339  0.332770  1
  P  P165  1  0.900537  0.588928  0.381844  1
  P  P166  1  0.924232  0.421422  0.429463  1
  P  P167  1  0.233871  0.755594  0.381844  1
  P  P168  1  0.257565  0.588089  0.429463  1
  P  P169  1  0.544881  0.589673  0.332770  1
  P  P170  1  0.567204  0.422261  0.381844  1
  P  P171  1  0.590899  0.254755  0.429463  1
  P  P172  1  0.878214  0.256339  0.332770  1
  P  P173  1  0.900537  0.088928  0.381844  1
  P  P174  1  0.924232  0.921422  0.429463  1
  P  P175  1  0.211548  0.423006  0.332770  1
  P  P176  1  0.233871  0.255594  0.381844  1
  P  P177  1  0.257565  0.088089  0.429463  1
  P  P178  1  0.544881  0.089673  0.332770  1
  P  P179  1  0.567204  0.922261  0.381844  1
  P  P180  1  0.211548  0.923006  0.332770  1
  P  P181  1  0.725601  0.741247  0.329408  1
  P  P182  1  0.082629  0.740408  0.377027  1
  P  P183  1  0.106324  0.572902  0.424646  1
  P  P184  1  0.058935  0.407913  0.329408  1
  P  P185  1  0.439657  0.739569  0.424646  1
  P  P186  1  0.392268  0.574580  0.329408  1
  P  P187  1  0.749296  0.573741  0.377027  1
  P  P188  1  0.772990  0.406235  0.424646  1
  P  P189  1  0.725601  0.241247  0.329408  1
  P  P190  1  0.082629  0.240408  0.377027  1
  P  P191  1  0.106324  0.072902  0.424646  1
  P  P192  1  0.058935  0.907913  0.329408  1
  P  P193  1  0.415963  0.407074  0.377027  1
  P  P194  1  0.439657  0.239569  0.424646  1
  P  P195  1  0.392268  0.074580  0.329408  1
  P  P196  1  0.749296  0.073741  0.377027  1
  P  P197  1  0.772990  0.906235  0.424646  1
  P  P198  1  0.415963  0.907074  0.377027  1
  P  P199  1  0.632481  0.751628  0.387674  1
  P  P200  1  0.916953  0.753429  0.293805  1
  P  P201  1  0.942119  0.585800  0.340055  1
  P  P202  1  0.965814  0.418294  0.387674  1
  P  P203  1  0.275453  0.752467  0.340055  1
  P  P204  1  0.299147  0.584961  0.387674  1
  P  P205  1  0.583620  0.586762  0.293805  1
  P  P206  1  0.608786  0.419134  0.340055  1
  P  P207  1  0.632481  0.251628  0.387674  1
  P  P208  1  0.916953  0.253429  0.293805  1
  P  P209  1  0.942119  0.085800  0.340055  1
  P  P210  1  0.965814  0.918294  0.387674  1
  P  P211  1  0.250287  0.420096  0.293805  1
  P  P212  1  0.275453  0.252467  0.340055  1
  P  P213  1  0.299147  0.084961  0.387674  1
  P  P214  1  0.583620  0.086762  0.293805  1
  P  P215  1  0.608786  0.919134  0.340055  1
  P  P216  1  0.250287  0.920096  0.293805  1
  P  P217  1  0.769597  0.718677  0.335660  1
  P  P218  1  0.126625  0.717838  0.383279  1
  P  P219  1  0.079464  0.553912  0.288225  1
  P  P220  1  0.102931  0.385344  0.335660  1
  P  P221  1  0.412798  0.720579  0.288225  1
  P  P222  1  0.436264  0.552010  0.335660  1
  P  P223  1  0.793292  0.551171  0.383279  1
  P  P224  1  0.746131  0.387246  0.288225  1
  P  P225  1  0.769597  0.218677  0.335660  1
  P  P226  1  0.126625  0.217838  0.383279  1
  P  P227  1  0.079464  0.053912  0.288225  1
  P  P228  1  0.102931  0.885344  0.335660  1
  P  P229  1  0.459958  0.384505  0.383279  1
  P  P230  1  0.412798  0.220579  0.288225  1
  P  P231  1  0.436264  0.052010  0.335660  1
  P  P232  1  0.793292  0.051171  0.383279  1
  P  P233  1  0.746131  0.887246  0.288225  1
  P  P234  1  0.459958  0.884505  0.383279  1
  P  P235  1  0.588485  0.774198  0.381422  1
  P  P236  1  0.945513  0.773359  0.429041  1
  P  P237  1  0.898123  0.608370  0.333803  1
  P  P238  1  0.921818  0.440864  0.381422  1
  P  P239  1  0.231457  0.775037  0.333803  1
  P  P240  1  0.255151  0.607531  0.381422  1
  P  P241  1  0.612179  0.606692  0.429041  1
  P  P242  1  0.564790  0.441703  0.333803  1
  P  P243  1  0.588485  0.274198  0.381422  1
  P  P244  1  0.945513  0.273359  0.429041  1
  P  P245  1  0.898123  0.108370  0.333803  1
  P  P246  1  0.921818  0.940864  0.381422  1
  P  P247  1  0.278846  0.440025  0.429041  1
  P  P248  1  0.231457  0.275037  0.333803  1
  P  P249  1  0.255151  0.107531  0.381422  1
  P  P250  1  0.612179  0.106692  0.429041  1
  P  P251  1  0.564790  0.941703  0.333803  1
  P  P252  1  0.278846  0.940025  0.429041  1
  P  P253  1  0.778049  0.749458  0.342582  1
  P  P254  1  0.135077  0.748619  0.390201  1
  P  P255  1  0.087360  0.582597  0.294693  1
  P  P256  1  0.111383  0.416125  0.342582  1
  P  P257  1  0.420693  0.749263  0.294693  1
  P  P258  1  0.444716  0.582791  0.342582  1
  P  P259  1  0.801744  0.581952  0.390201  1
  P  P260  1  0.754027  0.415930  0.294693  1
  P  P261  1  0.778049  0.249458  0.342582  1
  P  P262  1  0.135077  0.248619  0.390201  1
  P  P263  1  0.087360  0.082597  0.294693  1
  P  P264  1  0.111383  0.916125  0.342582  1
  P  P265  1  0.468411  0.415286  0.390201  1
  P  P266  1  0.420693  0.249263  0.294693  1
  P  P267  1  0.444716  0.082791  0.342582  1
  P  P268  1  0.801744  0.081952  0.390201  1
  P  P269  1  0.754027  0.915930  0.294693  1
  P  P270  1  0.468411  0.915286  0.390201  1
  P  P271  1  0.580033  0.743417  0.374500  1
  P  P272  1  0.937061  0.742578  0.422119  1
  P  P273  1  0.889671  0.577589  0.326881  1
  P  P274  1  0.913366  0.410083  0.374500  1
  P  P275  1  0.223005  0.744256  0.326881  1
  P  P276  1  0.246699  0.576750  0.374500  1
  P  P277  1  0.603727  0.575911  0.422119  1
  P  P278  1  0.556338  0.410922  0.326881  1
  P  P279  1  0.580033  0.243417  0.374500  1
  P  P280  1  0.937061  0.242578  0.422119  1
  P  P281  1  0.889671  0.077589  0.326881  1
  P  P282  1  0.913366  0.910083  0.374500  1
  P  P283  1  0.270394  0.409244  0.422119  1
  P  P284  1  0.223005  0.244256  0.326881  1
  P  P285  1  0.246699  0.076750  0.374500  1
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  P  P1296  1  0.578708  0.954476  0.610647  1
