# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   33.43664741
_cell_length_b   91.51676642
_cell_length_c   48.57473880
_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   P336
_cell_volume   148639.373528
_cell_formula_units_Z   336
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  1.005397  0.992082  0.309793  1
  P  P2  1  0.505397  0.992082  0.309793  1
  P  P3  1  0.088730  1.003048  0.278434  1
  P  P4  1  0.588730  1.003048  0.278434  1
  P  P5  1  1.005397  0.503048  0.278434  1
  P  P6  1  0.505397  0.503048  0.278434  1
  P  P7  1  0.172064  0.992082  0.309793  1
  P  P8  1  0.672064  0.992082  0.309793  1
  P  P9  1  0.255397  1.003048  0.278434  1
  P  P10  1  0.755397  1.003048  0.278434  1
  P  P11  1  0.088730  0.492082  0.309793  1
  P  P12  1  0.588730  0.492082  0.309793  1
  P  P13  1  0.172064  0.503048  0.278434  1
  P  P14  1  0.672064  0.503048  0.278434  1
  P  P15  1  0.338730  0.992082  0.309793  1
  P  P16  1  0.838730  0.992082  0.309793  1
  P  P17  1  0.422064  1.003048  0.278434  1
  P  P18  1  0.922064  1.003048  0.278434  1
  P  P19  1  0.255397  0.492082  0.309793  1
  P  P20  1  0.755397  0.492082  0.309793  1
  P  P21  1  0.338730  0.503048  0.278434  1
  P  P22  1  0.838730  0.503048  0.278434  1
  P  P23  1  0.422064  0.492082  0.309793  1
  P  P24  1  0.922064  0.492082  0.309793  1
  P  P25  1  1.005397  0.531478  0.315008  1
  P  P26  1  0.505397  0.531478  0.315008  1
  P  P27  1  0.088730  0.522947  0.281068  1
  P  P28  1  0.588730  0.522947  0.281068  1
  P  P29  1  1.005397  1.022947  0.281068  1
  P  P30  1  0.505397  1.022947  0.281068  1
  P  P31  1  0.172064  0.531478  0.315008  1
  P  P32  1  0.672064  0.531478  0.315008  1
  P  P33  1  0.255397  0.522947  0.281068  1
  P  P34  1  0.755397  0.522947  0.281068  1
  P  P35  1  0.088730  0.031478  0.315008  1
  P  P36  1  0.588730  0.031478  0.315008  1
  P  P37  1  0.172064  1.022947  0.281068  1
  P  P38  1  0.672064  1.022947  0.281068  1
  P  P39  1  0.338730  0.531478  0.315008  1
  P  P40  1  0.838730  0.531478  0.315008  1
  P  P41  1  0.422064  0.522947  0.281068  1
  P  P42  1  0.922064  0.522947  0.281068  1
  P  P43  1  0.255397  0.031478  0.315008  1
  P  P44  1  0.755397  0.031478  0.315008  1
  P  P45  1  0.338730  1.022947  0.281068  1
  P  P46  1  0.838730  1.022947  0.281068  1
  P  P47  1  0.422064  0.031478  0.315008  1
  P  P48  1  0.922064  0.031478  0.315008  1
  P  P49  1  1.005397  0.990142  0.377491  1
  P  P50  1  0.505397  0.990142  0.377491  1
  P  P51  1  0.088730  0.999646  0.344163  1
  P  P52  1  0.588730  0.999646  0.344163  1
  P  P53  1  1.005397  0.499646  0.344163  1
  P  P54  1  0.505397  0.499646  0.344163  1
  P  P55  1  0.172064  0.990142  0.377491  1
  P  P56  1  0.672064  0.990142  0.377491  1
  P  P57  1  0.255397  0.999646  0.344163  1
  P  P58  1  0.755397  0.999646  0.344163  1
  P  P59  1  0.088730  0.490142  0.377491  1
  P  P60  1  0.588730  0.490142  0.377491  1
  P  P61  1  0.172064  0.499646  0.344163  1
  P  P62  1  0.672064  0.499646  0.344163  1
  P  P63  1  0.338730  0.990142  0.377491  1
  P  P64  1  0.838730  0.990142  0.377491  1
  P  P65  1  0.422064  0.999646  0.344163  1
  P  P66  1  0.922064  0.999646  0.344163  1
  P  P67  1  0.255397  0.490142  0.377491  1
  P  P68  1  0.755397  0.490142  0.377491  1
  P  P69  1  0.338730  0.499646  0.344163  1
  P  P70  1  0.838730  0.499646  0.344163  1
  P  P71  1  0.422064  0.490142  0.377491  1
  P  P72  1  0.922064  0.490142  0.377491  1
  P  P73  1  1.005397  0.528373  0.382552  1
  P  P74  1  0.505397  0.528373  0.382552  1
  P  P75  1  0.088730  0.521437  0.347048  1
  P  P76  1  0.588730  0.521437  0.347048  1
  P  P77  1  1.005397  1.021437  0.347048  1
  P  P78  1  0.505397  1.021437  0.347048  1
  P  P79  1  0.172064  0.528373  0.382552  1
  P  P80  1  0.672064  0.528373  0.382552  1
  P  P81  1  0.255397  0.521437  0.347048  1
  P  P82  1  0.755397  0.521437  0.347048  1
  P  P83  1  0.088730  1.028373  0.382552  1
  P  P84  1  0.588730  1.028373  0.382552  1
  P  P85  1  0.172064  1.021437  0.347048  1
  P  P86  1  0.672064  1.021437  0.347048  1
  P  P87  1  0.338730  0.528373  0.382552  1
  P  P88  1  0.838730  0.528373  0.382552  1
  P  P89  1  0.422064  0.521437  0.347048  1
  P  P90  1  0.922064  0.521437  0.347048  1
  P  P91  1  0.255397  1.028373  0.382552  1
  P  P92  1  0.755397  1.028373  0.382552  1
  P  P93  1  0.338730  1.021437  0.347048  1
  P  P94  1  0.838730  1.021437  0.347048  1
  P  P95  1  0.422064  1.028373  0.382552  1
  P  P96  1  0.922064  1.028373  0.382552  1
  P  P97  1  1.005397  0.989408  0.446261  1
  P  P98  1  0.505397  0.989408  0.446261  1
  P  P99  1  0.088730  0.996385  0.411413  1
  P  P100  1  0.588730  0.996385  0.411413  1
  P  P101  1  1.005397  0.496385  0.411413  1
  P  P102  1  0.505397  0.496385  0.411413  1
  P  P103  1  0.172064  0.989408  0.446261  1
  P  P104  1  0.672064  0.989408  0.446261  1
  P  P105  1  0.255397  0.996385  0.411413  1
  P  P106  1  0.755397  0.996385  0.411413  1
  P  P107  1  0.088730  0.489408  0.446261  1
  P  P108  1  0.588730  0.489408  0.446261  1
  P  P109  1  0.172064  0.496385  0.411413  1
  P  P110  1  0.672064  0.496385  0.411413  1
  P  P111  1  0.338730  0.989408  0.446261  1
  P  P112  1  0.838730  0.989408  0.446261  1
  P  P113  1  0.422064  0.996385  0.411413  1
  P  P114  1  0.922064  0.996385  0.411413  1
  P  P115  1  0.255397  0.489408  0.446261  1
  P  P116  1  0.755397  0.489408  0.446261  1
  P  P117  1  0.338730  0.496385  0.411413  1
  P  P118  1  0.838730  0.496385  0.411413  1
  P  P119  1  0.422064  0.489408  0.446261  1
  P  P120  1  0.922064  0.489408  0.446261  1
  P  P121  1  1.005397  0.523996  0.450841  1
  P  P122  1  0.505397  0.523996  0.450841  1
  P  P123  1  0.088730  0.519674  0.414496  1
  P  P124  1  0.588730  0.519674  0.414496  1
  P  P125  1  1.005397  1.019674  0.414496  1
  P  P126  1  0.505397  1.019674  0.414496  1
  P  P127  1  0.172064  0.523996  0.450841  1
  P  P128  1  0.672064  0.523996  0.450841  1
  P  P129  1  0.255397  0.519674  0.414496  1
  P  P130  1  0.755397  0.519674  0.414496  1
  P  P131  1  0.088730  1.023996  0.450841  1
  P  P132  1  0.588730  1.023996  0.450841  1
  P  P133  1  0.172064  1.019674  0.414496  1
  P  P134  1  0.672064  1.019674  0.414496  1
  P  P135  1  0.338730  0.523996  0.450841  1
  P  P136  1  0.838730  0.523996  0.450841  1
  P  P137  1  0.422064  0.519674  0.414496  1
  P  P138  1  0.922064  0.519674  0.414496  1
  P  P139  1  0.255397  1.023996  0.450841  1
  P  P140  1  0.755397  1.023996  0.450841  1
  P  P141  1  0.338730  1.019674  0.414496  1
  P  P142  1  0.838730  1.019674  0.414496  1
  P  P143  1  0.422064  1.023996  0.450841  1
  P  P144  1  0.922064  1.023996  0.450841  1
  P  P145  1  1.005397  0.990284  0.516184  1
  P  P146  1  0.505397  0.990284  0.516184  1
  P  P147  1  0.088730  0.991658  0.479342  1
  P  P148  1  0.588730  0.991658  0.479342  1
  P  P149  1  1.005397  0.491658  0.479342  1
  P  P150  1  0.505397  0.491658  0.479342  1
  P  P151  1  0.172064  0.990284  0.516184  1
  P  P152  1  0.672064  0.990284  0.516184  1
  P  P153  1  0.255397  0.991658  0.479342  1
  P  P154  1  0.755397  0.991658  0.479342  1
  P  P155  1  0.088730  0.490284  0.516184  1
  P  P156  1  0.588730  0.490284  0.516184  1
  P  P157  1  0.172064  0.491658  0.479342  1
  P  P158  1  0.672064  0.491658  0.479342  1
  P  P159  1  0.338730  0.990284  0.516184  1
  P  P160  1  0.838730  0.990284  0.516184  1
  P  P161  1  0.422064  0.991658  0.479342  1
  P  P162  1  0.922064  0.991658  0.479342  1
  P  P163  1  0.255397  0.490284  0.516184  1
  P  P164  1  0.755397  0.490284  0.516184  1
  P  P165  1  0.338730  0.491658  0.479342  1
  P  P166  1  0.838730  0.491658  0.479342  1
  P  P167  1  0.422064  0.490284  0.516184  1
  P  P168  1  0.922064  0.490284  0.516184  1
  P  P169  1  1.005397  0.517938  0.519845  1
  P  P170  1  0.505397  0.517938  0.519845  1
  P  P171  1  0.088730  0.519312  0.483003  1
  P  P172  1  0.588730  0.519312  0.483003  1
  P  P173  1  1.005397  1.019312  0.483003  1
  P  P174  1  0.505397  1.019312  0.483003  1
  P  P175  1  0.172064  0.517938  0.519845  1
  P  P176  1  0.672064  0.517938  0.519845  1
  P  P177  1  0.255397  0.519312  0.483003  1
  P  P178  1  0.755397  0.519312  0.483003  1
  P  P179  1  0.088730  1.017938  0.519845  1
  P  P180  1  0.588730  1.017938  0.519845  1
  P  P181  1  0.172064  1.019312  0.483003  1
  P  P182  1  0.672064  1.019312  0.483003  1
  P  P183  1  0.338730  0.517938  0.519845  1
  P  P184  1  0.838730  0.517938  0.519845  1
  P  P185  1  0.422064  0.519312  0.483003  1
  P  P186  1  0.922064  0.519312  0.483003  1
  P  P187  1  0.255397  1.017938  0.519845  1
  P  P188  1  0.755397  1.017938  0.519845  1
  P  P189  1  0.338730  1.019312  0.483003  1
  P  P190  1  0.838730  1.019312  0.483003  1
  P  P191  1  0.422064  1.017938  0.519845  1
  P  P192  1  0.922064  1.017938  0.519845  1
  P  P193  1  1.005397  0.989922  0.584692  1
  P  P194  1  0.505397  0.989922  0.584692  1
  P  P195  1  0.088730  0.985600  0.548347  1
  P  P196  1  0.588730  0.985600  0.548347  1
  P  P197  1  1.005397  0.485600  0.548347  1
  P  P198  1  0.505397  0.485600  0.548347  1
  P  P199  1  0.172064  0.989922  0.584692  1
  P  P200  1  0.672064  0.989922  0.584692  1
  P  P201  1  0.255397  0.985600  0.548347  1
  P  P202  1  0.755397  0.985600  0.548347  1
  P  P203  1  0.088730  0.489922  0.584692  1
  P  P204  1  0.588730  0.489922  0.584692  1
  P  P205  1  0.172064  0.485600  0.548347  1
  P  P206  1  0.672064  0.485600  0.548347  1
  P  P207  1  0.338730  0.989922  0.584692  1
  P  P208  1  0.838730  0.989922  0.584692  1
  P  P209  1  0.422064  0.985600  0.548347  1
  P  P210  1  0.922064  0.985600  0.548347  1
  P  P211  1  0.255397  0.489922  0.584692  1
  P  P212  1  0.755397  0.489922  0.584692  1
  P  P213  1  0.338730  0.485600  0.548347  1
  P  P214  1  0.838730  0.485600  0.548347  1
  P  P215  1  0.422064  0.489922  0.584692  1
  P  P216  1  0.922064  0.489922  0.584692  1
  P  P217  1  1.005397  0.513211  0.587775  1
  P  P218  1  0.505397  0.513211  0.587775  1
  P  P219  1  0.088730  0.520189  0.552926  1
  P  P220  1  0.588730  0.520189  0.552926  1
  P  P221  1  1.005397  1.020189  0.552926  1
  P  P222  1  0.505397  1.020189  0.552926  1
  P  P223  1  0.172064  0.513211  0.587775  1
  P  P224  1  0.672064  0.513211  0.587775  1
  P  P225  1  0.255397  0.520189  0.552926  1
  P  P226  1  0.755397  0.520189  0.552926  1
  P  P227  1  0.088730  1.013211  0.587775  1
  P  P228  1  0.588730  1.013211  0.587775  1
  P  P229  1  0.172064  1.020189  0.552926  1
  P  P230  1  0.672064  1.020189  0.552926  1
  P  P231  1  0.338730  0.513211  0.587775  1
  P  P232  1  0.838730  0.513211  0.587775  1
  P  P233  1  0.422064  0.520189  0.552926  1
  P  P234  1  0.922064  0.520189  0.552926  1
  P  P235  1  0.255397  1.013211  0.587775  1
  P  P236  1  0.755397  1.013211  0.587775  1
  P  P237  1  0.338730  1.020189  0.552926  1
  P  P238  1  0.838730  1.020189  0.552926  1
  P  P239  1  0.422064  1.013211  0.587775  1
  P  P240  1  0.922064  1.013211  0.587775  1
  P  P241  1  1.005397  0.988159  0.652140  1
  P  P242  1  0.505397  0.988159  0.652140  1
  P  P243  1  0.088730  0.981223  0.616636  1
  P  P244  1  0.588730  0.981223  0.616636  1
  P  P245  1  1.005397  0.481223  0.616636  1
  P  P246  1  0.505397  0.481223  0.616636  1
  P  P247  1  0.172064  0.988159  0.652140  1
  P  P248  1  0.672064  0.988159  0.652140  1
  P  P249  1  0.255397  0.981223  0.616636  1
  P  P250  1  0.755397  0.981223  0.616636  1
  P  P251  1  0.088730  0.488159  0.652140  1
  P  P252  1  0.588730  0.488159  0.652140  1
  P  P253  1  0.172064  0.481223  0.616636  1
  P  P254  1  0.672064  0.481223  0.616636  1
  P  P255  1  0.338730  0.988159  0.652140  1
  P  P256  1  0.838730  0.988159  0.652140  1
  P  P257  1  0.422064  0.981223  0.616636  1
  P  P258  1  0.922064  0.981223  0.616636  1
  P  P259  1  0.255397  0.488159  0.652140  1
  P  P260  1  0.755397  0.488159  0.652140  1
  P  P261  1  0.338730  0.481223  0.616636  1
  P  P262  1  0.838730  0.481223  0.616636  1
  P  P263  1  0.422064  0.488159  0.652140  1
  P  P264  1  0.922064  0.488159  0.652140  1
  P  P265  1  1.005397  0.509951  0.655025  1
  P  P266  1  0.505397  0.509951  0.655025  1
  P  P267  1  0.088730  0.519454  0.621697  1
  P  P268  1  0.588730  0.519454  0.621697  1
  P  P269  1  1.005397  1.019454  0.621697  1
  P  P270  1  0.505397  1.019454  0.621697  1
  P  P271  1  0.172064  0.509951  0.655025  1
  P  P272  1  0.672064  0.509951  0.655025  1
  P  P273  1  0.255397  0.519454  0.621697  1
  P  P274  1  0.755397  0.519454  0.621697  1
  P  P275  1  0.088730  1.009951  0.655025  1
  P  P276  1  0.588730  1.009951  0.655025  1
  P  P277  1  0.172064  1.019454  0.621697  1
  P  P278  1  0.672064  1.019454  0.621697  1
  P  P279  1  0.338730  0.509951  0.655025  1
  P  P280  1  0.838730  0.509951  0.655025  1
  P  P281  1  0.422064  0.519454  0.621697  1
  P  P282  1  0.922064  0.519454  0.621697  1
  P  P283  1  0.255397  1.009951  0.655025  1
  P  P284  1  0.755397  1.009951  0.655025  1
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