# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.84330681
_cell_length_b   47.85659080
_cell_length_c   52.29626195
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P252
_cell_volume   19629.6071713
_cell_formula_units_Z   252
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  0.346851  0.755330  0.343168  1
  P  P2  1  0.493469  0.797151  0.297880  1
  P  P3  1  0.148946  0.112777  0.385841  1
  P  P4  1  0.885469  0.305248  0.361865  1
  P  P5  1  0.414968  0.363299  0.280155  1
  P  P6  1  0.611132  0.726681  0.385261  1
  P  P7  1  0.149386  0.354419  0.380966  1
  P  P8  1  0.679722  0.169478  0.303554  1
  P  P9  1  0.736261  0.368067  0.378075  1
  P  P10  1  0.001178  0.395407  0.335638  1
  P  P11  1  0.207403  0.289659  0.400629  1
  P  P12  1  0.086099  0.826124  0.422676  1
  P  P13  1  0.076147  0.582879  0.428291  1
  P  P14  1  0.014753  0.959609  0.321041  1
  P  P15  1  0.552608  0.640705  0.344791  1
  P  P16  1  0.005613  0.417846  0.393573  1
  P  P17  1  0.736652  0.346604  0.316739  1
  P  P18  1  0.090137  0.177127  0.367331  1
  P  P19  1  0.289468  0.711006  0.423122  1
  P  P20  1  0.552802  0.863299  0.280155  1
  P  P21  1  0.755504  0.747988  0.280761  1
  P  P22  1  0.878318  0.697923  0.427041  1
  P  P23  1  0.212266  0.247988  0.280761  1
  P  P24  1  0.414492  0.383195  0.340061  1
  P  P25  1  0.891623  0.082879  0.428291  1
  P  P26  1  0.414492  0.161190  0.404495  1
  P  P27  1  0.014048  0.941821  0.262075  1
  P  P28  1  0.415162  0.140705  0.344791  1
  P  P29  1  0.494568  0.818094  0.358649  1
  P  P30  1  0.231509  0.868067  0.378075  1
  P  P31  1  0.619072  0.276744  0.403971  1
  P  P32  1  0.089452  0.197923  0.427041  1
  P  P33  1  0.294851  0.932438  0.358472  1
  P  P34  1  0.553279  0.661190  0.404495  1
  P  P35  1  0.881671  0.326124  0.422676  1
  P  P36  1  0.469181  0.339954  0.419597  1
  P  P37  1  0.619046  0.234079  0.284108  1
  P  P38  1  0.005859  0.376725  0.276128  1
  P  P39  1  0.961912  0.876725  0.276128  1
  P  P40  1  0.143651  0.647482  0.408078  1
  P  P41  1  0.620919  0.255330  0.343168  1
  P  P42  1  0.758806  0.768283  0.339940  1
  P  P43  1  0.081129  0.154942  0.310218  1
  P  P44  1  0.824119  0.147482  0.408078  1
  P  P45  1  0.082302  0.805248  0.361865  1
  P  P46  1  0.498589  0.839954  0.419597  1
  P  P47  1  0.081280  0.784017  0.301458  1
  P  P48  1  0.474302  0.297151  0.297880  1
  P  P49  1  0.558653  0.904226  0.399705  1
  P  P50  1  0.348698  0.776744  0.403971  1
  P  P51  1  0.023518  0.718647  0.320822  1
  P  P52  1  0.944252  0.218647  0.320822  1
  P  P53  1  0.818824  0.612777  0.385841  1
  P  P54  1  0.409117  0.404226  0.399705  1
  P  P55  1  0.678303  0.211006  0.423122  1
  P  P56  1  0.886641  0.654942  0.310218  1
  P  P57  1  0.287224  0.689796  0.362590  1
  P  P58  1  0.818385  0.854419  0.380966  1
  P  P59  1  0.348724  0.734079  0.284108  1
  P  P60  1  0.286353  0.912595  0.298761  1
  P  P61  1  0.966592  0.895407  0.335638  1
  P  P62  1  0.681417  0.412595  0.298761  1
  P  P63  1  0.672919  0.432438  0.358472  1
  P  P64  1  0.942711  0.239953  0.381565  1
  P  P65  1  0.760367  0.789659  0.400629  1
  P  P66  1  0.962158  0.917846  0.393573  1
  P  P67  1  0.288048  0.669478  0.303554  1
  P  P68  1  0.612954  0.705012  0.324791  1
  P  P69  1  0.025059  0.739953  0.381565  1
  P  P70  1  0.886491  0.284017  0.301458  1
  P  P71  1  0.877633  0.677127  0.367331  1
  P  P72  1  0.271701  0.425215  0.296430  1
  P  P73  1  0.231119  0.846604  0.316739  1
  P  P74  1  0.553279  0.883195  0.340061  1
  P  P75  1  0.680546  0.189796  0.362590  1
  P  P76  1  0.152335  0.333354  0.319848  1
  P  P77  1  0.356638  0.226681  0.385261  1
  P  P78  1  0.696069  0.925215  0.296430  1
  P  P79  1  0.208964  0.268283  0.339940  1
  P  P80  1  0.815436  0.833354  0.319848  1
  P  P81  1  0.354817  0.205012  0.324791  1
  P  P82  1  0.953723  0.441821  0.262075  1
  P  P83  1  0.953017  0.459609  0.321041  1
  P  P84  1  0.473202  0.318094  0.358649  1
  P  P85  1  0.410207  0.640444  0.509915  1
  P  P86  1  0.555322  0.682190  0.464733  1
  P  P87  1  0.090976  0.997677  0.552963  1
  P  P88  1  0.821525  0.190518  0.528882  1
  P  P89  1  0.353371  0.248054  0.445826  1
  P  P90  1  0.675439  0.611811  0.551470  1
  P  P91  1  0.085835  0.240290  0.547582  1
  P  P92  1  0.621972  0.054229  0.469588  1
  P  P93  1  0.672773  0.253794  0.544285  1
  P  P94  1  0.940032  0.282552  0.502317  1
  P  P95  1  0.144524  0.175137  0.566916  1
  P  P96  1  0.148401  0.711880  0.589361  1
  P  P97  1  0.133862  0.468087  0.595388  1
  P  P98  1  0.090976  0.846566  0.482253  1
  P  P99  1  0.615304  0.525928  0.510893  1
  P  P100  1  0.937489  0.302597  0.561696  1
  P  P101  1  0.675439  0.232432  0.483746  1
  P  P102  1  0.027738  0.061691  0.532899  1
  P  P103  1  0.353371  0.596189  0.589390  1
  P  P104  1  0.614399  0.748054  0.445826  1
  P  P105  1  0.819370  0.632363  0.445855  1
  P  P106  1  0.941499  0.583080  0.593033  1
  P  P107  1  0.148401  0.132363  0.445855  1
  P  P108  1  0.350394  0.269401  0.506168  1
  P  P109  1  0.833908  0.968087  0.595388  1
  P  P110  1  0.351932  0.046491  0.570772  1
  P  P111  1  0.833908  0.876156  0.439828  1
  P  P112  1  0.352467  0.025928  0.510893  1
  P  P113  1  0.557563  0.703799  0.525302  1
  P  P114  1  0.294997  0.753794  0.544285  1
  P  P115  1  0.555322  0.162053  0.570483  1
  P  P116  1  0.026271  0.083080  0.593033  1
  P  P117  1  0.352467  0.818315  0.524324  1
  P  P118  1  0.615838  0.546491  0.570772  1
  P  P119  1  0.819370  0.211880  0.589361  1
  P  P120  1  0.407321  0.225523  0.585891  1
  P  P121  1  0.560450  0.118720  0.449325  1
  P  P122  1  0.941499  0.261163  0.442183  1
  P  P123  1  0.026271  0.761163  0.442183  1
  P  P124  1  0.204744  0.532549  0.574312  1
  P  P125  1  0.557563  0.140444  0.509915  1
  P  P126  1  0.821525  0.653725  0.506334  1
  P  P127  1  0.030281  0.041646  0.473521  1
  P  P128  1  0.763026  0.032549  0.574312  1
  P  P129  1  0.146246  0.690518  0.528882  1
  P  P130  1  0.560450  0.725523  0.585891  1
  P  P131  1  0.144524  0.669106  0.468300  1
  P  P132  1  0.412448  0.182190  0.464733  1
  P  P133  1  0.621972  0.790014  0.565629  1
  P  P134  1  0.412448  0.662053  0.570483  1
  P  P135  1  0.085835  0.603953  0.487634  1
  P  P136  1  0.881936  0.103953  0.487634  1
  P  P137  1  0.876794  0.497677  0.552963  1
  P  P138  1  0.345799  0.290014  0.565629  1
  P  P139  1  0.614399  0.096189  0.589390  1
  P  P140  1  0.937489  0.541646  0.473521  1
  P  P141  1  0.350394  0.574842  0.529048  1
  P  P142  1  0.881936  0.740290  0.547582  1
  P  P143  1  0.407321  0.618720  0.449325  1
  P  P144  1  0.351932  0.797752  0.464444  1
  P  P145  1  0.027738  0.782552  0.502317  1
  P  P146  1  0.615838  0.297752  0.464444  1
  P  P147  1  0.615304  0.318315  0.524324  1
  P  P148  1  0.880013  0.125024  0.547919  1
  P  P149  1  0.823246  0.675137  0.566916  1
  P  P150  1  0.030281  0.802597  0.561696  1
  P  P151  1  0.345799  0.554229  0.469588  1
  P  P152  1  0.672773  0.590449  0.490931  1
  P  P153  1  0.087757  0.625024  0.547919  1
  P  P154  1  0.823246  0.169106  0.468300  1
  P  P155  1  0.940032  0.561691  0.532899  1
  P  P156  1  0.204744  0.311694  0.460904  1
  P  P157  1  0.292332  0.732432  0.483746  1
  P  P158  1  0.617376  0.769401  0.506168  1
  P  P159  1  0.617376  0.074842  0.529048  1
  P  P160  1  0.087757  0.219219  0.487297  1
  P  P161  1  0.292332  0.111811  0.551470  1
  P  P162  1  0.763026  0.811694  0.460904  1
  P  P163  1  0.146246  0.153725  0.506334  1
  P  P164  1  0.880013  0.719219  0.487297  1
  P  P165  1  0.294997  0.090449  0.490931  1
  P  P166  1  0.133862  0.376156  0.439828  1
  P  P167  1  0.876794  0.346566  0.482253  1
  P  P168  1  0.410207  0.203799  0.525302  1
  P  P169  1  0.473202  0.526149  0.676567  1
  P  P170  1  0.619072  0.567499  0.631245  1
  P  P171  1  0.014753  0.884634  0.714175  1
  P  P172  1  0.758806  0.075960  0.695277  1
  P  P173  1  0.289468  0.133237  0.612094  1
  P  P174  1  0.736652  0.497639  0.718477  1
  P  P175  1  0.023518  0.125596  0.714395  1
  P  P176  1  0.558653  0.940017  0.635512  1
  P  P177  1  0.612954  0.139232  0.710425  1
  P  P178  1  0.877633  0.167116  0.667885  1
  P  P179  1  0.081280  0.060226  0.733758  1
  P  P180  1  0.212266  0.596255  0.754455  1
  P  P181  1  0.953723  0.402422  0.773141  1
  P  P182  1  0.148946  0.731466  0.649375  1
  P  P183  1  0.672919  0.411805  0.676744  1
  P  P184  1  0.886641  0.189302  0.724998  1
  P  P185  1  0.611132  0.117562  0.649956  1
  P  P186  1  0.966592  0.948837  0.699578  1
  P  P187  1  0.414968  0.480944  0.755061  1
  P  P188  1  0.678303  0.633237  0.612094  1
  P  P189  1  0.881671  0.518119  0.612540  1
  P  P190  1  0.005859  0.467518  0.759089  1
  P  P191  1  0.086099  0.018119  0.612540  1
  P  P192  1  0.287224  0.154447  0.672626  1
  P  P193  1  0.014048  0.902422  0.773141  1
  P  P194  1  0.286353  0.931648  0.736456  1
  P  P195  1  0.891623  0.761364  0.606925  1
  P  P196  1  0.294851  0.911805  0.676744  1
  P  P197  1  0.620919  0.588913  0.692048  1
  P  P198  1  0.354817  0.639232  0.710425  1
  P  P199  1  0.493469  0.047092  0.737336  1
  P  P200  1  0.961912  0.967518  0.759089  1
  P  P201  1  0.415162  0.703538  0.690426  1
  P  P202  1  0.681417  0.431648  0.736456  1
  P  P203  1  0.755504  0.096255  0.754455  1
  P  P204  1  0.348724  0.110164  0.751108  1
  P  P205  1  0.498589  1.004289  0.615619  1
  P  P206  1  0.878318  0.146321  0.608175  1
  P  P207  1  0.089452  0.646321  0.608175  1
  P  P208  1  0.271701  0.419028  0.738786  1
  P  P209  1  0.494568  0.026149  0.676567  1
  P  P210  1  0.885469  0.538995  0.673352  1
  P  P211  1  0.962158  0.926397  0.641643  1
  P  P212  1  0.696069  0.919028  0.738786  1
  P  P213  1  0.208964  0.575960  0.695277  1
  P  P214  1  0.619046  0.610164  0.751108  1
  P  P215  1  0.207403  0.554584  0.634588  1
  P  P216  1  0.348698  0.067499  0.631245  1
  P  P217  1  0.679722  0.674765  0.731662  1
  P  P218  1  0.474302  0.547092  0.737336  1
  P  P219  1  0.149386  0.489824  0.654250  1
  P  P220  1  0.818385  0.989824  0.654250  1
  P  P221  1  0.953017  0.384634  0.714175  1
  P  P222  1  0.288048  0.174765  0.731662  1
  P  P223  1  0.552802  0.980944  0.755061  1
  P  P224  1  0.005613  0.426397  0.641643  1
  P  P225  1  0.414492  0.461048  0.695156  1
  P  P226  1  0.944252  0.625596  0.714395  1
  P  P227  1  0.469181  0.504289  0.615619  1
  P  P228  1  0.414492  0.683053  0.630721  1
  P  P229  1  0.090137  0.667116  0.667885  1
  P  P230  1  0.553279  0.183053  0.630721  1
  P  P231  1  0.552608  0.203538  0.690426  1
  P  P232  1  0.815436  1.010889  0.715368  1
  P  P233  1  0.886491  0.560226  0.733758  1
  P  P234  1  0.081129  0.689302  0.724998  1
  P  P235  1  0.409117  0.440017  0.635512  1
  P  P236  1  0.736261  0.476176  0.657141  1
  P  P237  1  0.152335  0.510889  0.715368  1
  P  P238  1  0.760367  0.054584  0.634588  1
  P  P239  1  0.001178  0.448837  0.699578  1
  P  P240  1  0.143651  0.196761  0.627139  1
  P  P241  1  0.356638  0.617562  0.649956  1
  P  P242  1  0.680546  0.654447  0.672626  1
  P  P243  1  0.553279  0.961048  0.695156  1
  P  P244  1  0.025059  0.104290  0.653652  1
  P  P245  1  0.231119  0.997639  0.718477  1
  P  P246  1  0.824119  0.696761  0.627139  1
  P  P247  1  0.082302  0.038995  0.673352  1
  P  P248  1  0.942711  0.604290  0.653652  1
  P  P249  1  0.231509  0.976176  0.657141  1
  P  P250  1  0.076147  0.261364  0.606925  1
  P  P251  1  0.818824  0.231466  0.649375  1
  P  P252  1  0.346851  0.088913  0.692048  1
