# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   49.28755172
_cell_length_b   103.99142380
_cell_length_c   55.37709066
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   81.66964112
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P1296
_cell_volume   280839.628849
_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  0.123610  0.169255  0.315098  1
  P  P2  1  0.109853  0.987456  0.410074  1
  P  P3  1  0.116642  0.828549  0.362455  1
  P  P4  1  0.456943  0.835921  0.315098  1
  P  P5  1  0.123610  0.669255  0.315098  1
  P  P6  1  0.109853  0.487456  0.410074  1
  P  P7  1  0.116642  0.328549  0.362455  1
  P  P8  1  0.456943  0.335921  0.315098  1
  P  P9  1  0.443186  0.154123  0.410074  1
  P  P10  1  0.449976  0.995215  0.362455  1
  P  P11  1  0.790277  0.002588  0.315098  1
  P  P12  1  0.776519  0.820789  0.410074  1
  P  P13  1  0.443186  0.654123  0.410074  1
  P  P14  1  0.449976  0.495215  0.362455  1
  P  P15  1  0.790277  0.502588  0.315098  1
  P  P16  1  0.776519  0.320789  0.410074  1
  P  P17  1  0.783309  0.161882  0.362455  1
  P  P18  1  0.783309  0.661882  0.362455  1
  P  P19  1  0.116873  0.224770  0.352880  1
  P  P20  1  0.123305  0.066253  0.305353  1
  P  P21  1  0.110083  0.883677  0.400499  1
  P  P22  1  0.450206  0.891437  0.352880  1
  P  P23  1  0.116873  0.724770  0.352880  1
  P  P24  1  0.123305  0.566253  0.305353  1
  P  P25  1  0.110083  0.383677  0.400499  1
  P  P26  1  0.450206  0.391437  0.352880  1
  P  P27  1  0.456638  0.232919  0.305353  1
  P  P28  1  0.443416  0.050344  0.400499  1
  P  P29  1  0.783539  0.058103  0.352880  1
  P  P30  1  0.789971  0.899586  0.305353  1
  P  P31  1  0.456638  0.732919  0.305353  1
  P  P32  1  0.443416  0.550344  0.400499  1
  P  P33  1  0.783539  0.558103  0.352880  1
  P  P34  1  0.789971  0.399586  0.305353  1
  P  P35  1  0.776750  0.217011  0.400499  1
  P  P36  1  0.776750  0.717011  0.400499  1
  P  P37  1  0.104120  0.144888  0.336124  1
  P  P38  1  0.110351  0.985802  0.288686  1
  P  P39  1  0.096690  0.803597  0.383944  1
  P  P40  1  0.437453  0.811555  0.336124  1
  P  P41  1  0.104120  0.644888  0.336124  1
  P  P42  1  0.110351  0.485802  0.288686  1
  P  P43  1  0.096690  0.303597  0.383944  1
  P  P44  1  0.437453  0.311555  0.336124  1
  P  P45  1  0.443684  0.152468  0.288686  1
  P  P46  1  0.430023  0.970263  0.383944  1
  P  P47  1  0.770786  0.978222  0.336124  1
  P  P48  1  0.777017  0.819135  0.288686  1
  P  P49  1  0.443684  0.652468  0.288686  1
  P  P50  1  0.430023  0.470263  0.383944  1
  P  P51  1  0.770786  0.478222  0.336124  1
  P  P52  1  0.777017  0.319135  0.288686  1
  P  P53  1  0.763357  0.136930  0.383944  1
  P  P54  1  0.763357  0.636930  0.383944  1
  P  P55  1  0.136825  0.249722  0.331391  1
  P  P56  1  0.123245  0.067536  0.426629  1
  P  P57  1  0.130035  0.908629  0.379010  1
  P  P58  1  0.470158  0.916389  0.331391  1
  P  P59  1  0.136825  0.749722  0.331391  1
  P  P60  1  0.123245  0.567536  0.426629  1
  P  P61  1  0.130035  0.408629  0.379010  1
  P  P62  1  0.470158  0.416389  0.331391  1
  P  P63  1  0.456579  0.234203  0.426629  1
  P  P64  1  0.463369  0.075296  0.379010  1
  P  P65  1  0.803492  0.083055  0.331391  1
  P  P66  1  0.789912  0.900870  0.426629  1
  P  P67  1  0.456579  0.734203  0.426629  1
  P  P68  1  0.463369  0.575296  0.379010  1
  P  P69  1  0.803492  0.583055  0.331391  1
  P  P70  1  0.789912  0.400870  0.426629  1
  P  P71  1  0.796702  0.241962  0.379010  1
  P  P72  1  0.796702  0.741962  0.379010  1
  P  P73  1  0.165640  0.146195  0.331271  1
  P  P74  1  0.152879  0.963844  0.426603  1
  P  P75  1  0.159669  0.804937  0.378984  1
  P  P76  1  0.498974  0.812862  0.331271  1
  P  P77  1  0.165640  0.646195  0.331271  1
  P  P78  1  0.152879  0.463844  0.426603  1
  P  P79  1  0.159669  0.304937  0.378984  1
  P  P80  1  0.498974  0.312862  0.331271  1
  P  P81  1  0.486213  0.130510  0.426603  1
  P  P82  1  0.493002  0.971603  0.378984  1
  P  P83  1  0.832307  0.979529  0.331271  1
  P  P84  1  0.819546  0.797177  0.426603  1
  P  P85  1  0.486213  0.630510  0.426603  1
  P  P86  1  0.493002  0.471603  0.378984  1
  P  P87  1  0.832307  0.479529  0.331271  1
  P  P88  1  0.819546  0.297177  0.426603  1
  P  P89  1  0.826336  0.138270  0.378984  1
  P  P90  1  0.826336  0.638270  0.378984  1
  P  P91  1  0.073846  0.248382  0.336351  1
  P  P92  1  0.081287  0.089321  0.289199  1
  P  P93  1  0.067056  0.907289  0.383971  1
  P  P94  1  0.407179  0.915049  0.336351  1
  P  P95  1  0.073846  0.748382  0.336351  1
  P  P96  1  0.081287  0.589321  0.289199  1
  P  P97  1  0.067056  0.407289  0.383971  1
  P  P98  1  0.407179  0.415049  0.336351  1
  P  P99  1  0.414620  0.255988  0.289199  1
  P  P100  1  0.400390  0.073956  0.383971  1
  P  P101  1  0.740513  0.081715  0.336351  1
  P  P102  1  0.747954  0.922654  0.289199  1
  P  P103  1  0.414620  0.755988  0.289199  1
  P  P104  1  0.400390  0.573956  0.383971  1
  P  P105  1  0.740513  0.581715  0.336351  1
  P  P106  1  0.747954  0.422654  0.289199  1
  P  P107  1  0.733723  0.240623  0.383971  1
  P  P108  1  0.733723  0.740623  0.383971  1
  P  P109  1  0.110441  0.120414  0.427881  1
  P  P110  1  0.117230  0.961506  0.380262  1
  P  P111  1  0.124020  0.802599  0.332643  1
  P  P112  1  0.443774  0.787080  0.427881  1
  P  P113  1  0.110441  0.620414  0.427881  1
  P  P114  1  0.117230  0.461506  0.380262  1
  P  P115  1  0.124020  0.302599  0.332643  1
  P  P116  1  0.443774  0.287080  0.427881  1
  P  P117  1  0.450564  0.128173  0.380262  1
  P  P118  1  0.457353  0.969266  0.332643  1
  P  P119  1  0.777107  0.953747  0.427881  1
  P  P120  1  0.783897  0.794840  0.380262  1
  P  P121  1  0.450564  0.628173  0.380262  1
  P  P122  1  0.457353  0.469266  0.332643  1
  P  P123  1  0.777107  0.453747  0.427881  1
  P  P124  1  0.783897  0.294840  0.380262  1
  P  P125  1  0.790687  0.135932  0.332643  1
  P  P126  1  0.790687  0.635932  0.332643  1
  P  P127  1  0.109495  0.250720  0.382692  1
  P  P128  1  0.116072  0.091596  0.334493  1
  P  P129  1  0.123074  0.932883  0.287420  1
  P  P130  1  0.442828  0.917386  0.382692  1
  P  P131  1  0.109495  0.750720  0.382692  1
  P  P132  1  0.116072  0.591596  0.334493  1
  P  P133  1  0.123074  0.432883  0.287420  1
  P  P134  1  0.442828  0.417386  0.382692  1
  P  P135  1  0.449406  0.258262  0.334493  1
  P  P136  1  0.456407  0.099550  0.287420  1
  P  P137  1  0.776162  0.084053  0.382692  1
  P  P138  1  0.782739  0.924929  0.334493  1
  P  P139  1  0.449406  0.758262  0.334493  1
  P  P140  1  0.456407  0.599550  0.287420  1
  P  P141  1  0.776162  0.584053  0.382692  1
  P  P142  1  0.782739  0.424929  0.334493  1
  P  P143  1  0.789741  0.266216  0.287420  1
  P  P144  1  0.789741  0.766216  0.287420  1
  P  P145  1  0.234235  0.176952  0.399462  1
  P  P146  1  0.241025  0.018044  0.351843  1
  P  P147  1  0.247815  0.859137  0.304224  1
  P  P148  1  0.567568  0.843618  0.399462  1
  P  P149  1  0.234235  0.676952  0.399462  1
  P  P150  1  0.241025  0.518044  0.351843  1
  P  P151  1  0.247815  0.359137  0.304224  1
  P  P152  1  0.567568  0.343618  0.399462  1
  P  P153  1  0.574358  0.184711  0.351843  1
  P  P154  1  0.581148  0.025804  0.304224  1
  P  P155  1  0.900902  0.010285  0.399462  1
  P  P156  1  0.907692  0.851378  0.351843  1
  P  P157  1  0.574358  0.684711  0.351843  1
  P  P158  1  0.581148  0.525804  0.304224  1
  P  P159  1  0.900902  0.510285  0.399462  1
  P  P160  1  0.907692  0.351378  0.351843  1
  P  P161  1  0.914481  0.192471  0.304224  1
  P  P162  1  0.914481  0.692471  0.304224  1
  P  P163  1  0.985700  0.194182  0.411111  1
  P  P164  1  0.992490  0.035274  0.363492  1
  P  P165  1  0.999962  0.876519  0.315621  1
  P  P166  1  0.319034  0.860848  0.411111  1
  P  P167  1  0.985700  0.694182  0.411111  1
  P  P168  1  0.992490  0.535274  0.363492  1
  P  P169  1  0.999962  0.376519  0.315621  1
  P  P170  1  0.319034  0.360848  0.411111  1
  P  P171  1  0.325823  0.201941  0.363492  1
  P  P172  1  0.333296  0.043186  0.315621  1
  P  P173  1  0.652367  0.027515  0.411111  1
  P  P174  1  0.659157  0.868608  0.363492  1
  P  P175  1  0.325823  0.701941  0.363492  1
  P  P176  1  0.333296  0.543186  0.315621  1
  P  P177  1  0.652367  0.527515  0.411111  1
  P  P178  1  0.659157  0.368608  0.363492  1
  P  P179  1  0.666629  0.209852  0.315621  1
  P  P180  1  0.666629  0.709852  0.315621  1
  P  P181  1  0.170689  0.179446  0.407817  1
  P  P182  1  0.177479  0.020539  0.360198  1
  P  P183  1  0.184269  0.861631  0.312579  1
  P  P184  1  0.504023  0.846112  0.407817  1
  P  P185  1  0.170689  0.679446  0.407817  1
  P  P186  1  0.177479  0.520539  0.360198  1
  P  P187  1  0.184269  0.361631  0.312579  1
  P  P188  1  0.504023  0.346112  0.407817  1
  P  P189  1  0.510813  0.187205  0.360198  1
  P  P190  1  0.517602  0.028298  0.312579  1
  P  P191  1  0.837356  0.012779  0.407817  1
  P  P192  1  0.844146  0.853872  0.360198  1
  P  P193  1  0.510813  0.687205  0.360198  1
  P  P194  1  0.517602  0.528298  0.312579  1
  P  P195  1  0.837356  0.512779  0.407817  1
  P  P196  1  0.844146  0.353872  0.360198  1
  P  P197  1  0.850936  0.194965  0.312579  1
  P  P198  1  0.850936  0.694965  0.312579  1
  P  P199  1  0.049246  0.191687  0.402756  1
  P  P200  1  0.056036  0.032780  0.355137  1
  P  P201  1  0.062035  0.874080  0.307447  1
  P  P202  1  0.382579  0.858354  0.402756  1
  P  P203  1  0.049246  0.691687  0.402756  1
  P  P204  1  0.056036  0.532780  0.355137  1
  P  P205  1  0.062035  0.374080  0.307447  1
  P  P206  1  0.382579  0.358354  0.402756  1
  P  P207  1  0.389369  0.199447  0.355137  1
  P  P208  1  0.395368  0.040746  0.307447  1
  P  P209  1  0.715913  0.025021  0.402756  1
  P  P210  1  0.722702  0.866114  0.355137  1
  P  P211  1  0.389369  0.699447  0.355137  1
  P  P212  1  0.395368  0.540746  0.307447  1
  P  P213  1  0.715913  0.525021  0.402756  1
  P  P214  1  0.722702  0.366114  0.355137  1
  P  P215  1  0.728701  0.207413  0.307447  1
  P  P216  1  0.728701  0.707413  0.307447  1
  P  P217  1  0.209148  0.154302  0.424580  1
  P  P218  1  0.215937  0.995394  0.376961  1
  P  P219  1  0.222727  0.836487  0.329342  1
  P  P220  1  0.542481  0.820968  0.424580  1
  P  P221  1  0.209148  0.654302  0.424580  1
  P  P222  1  0.215937  0.495394  0.376961  1
  P  P223  1  0.222727  0.336487  0.329342  1
  P  P224  1  0.542481  0.320968  0.424580  1
  P  P225  1  0.549271  0.162061  0.376961  1
  P  P226  1  0.556060  0.003154  0.329342  1
  P  P227  1  0.875814  0.987635  0.424580  1
  P  P228  1  0.882604  0.828728  0.376961  1
  P  P229  1  0.549271  0.662061  0.376961  1
  P  P230  1  0.556060  0.503154  0.329342  1
  P  P231  1  0.875814  0.487635  0.424580  1
  P  P232  1  0.882604  0.328728  0.376961  1
  P  P233  1  0.889394  0.169821  0.329342  1
  P  P234  1  0.889394  0.669821  0.329342  1
  P  P235  1  0.010788  0.216831  0.385994  1
  P  P236  1  0.017578  0.057924  0.338375  1
  P  P237  1  0.024464  0.898635  0.291047  1
  P  P238  1  0.344121  0.883498  0.385994  1
  P  P239  1  0.010788  0.716831  0.385994  1
  P  P240  1  0.017578  0.557924  0.338375  1
  P  P241  1  0.024464  0.398635  0.291047  1
  P  P242  1  0.344121  0.383498  0.385994  1
  P  P243  1  0.350911  0.224591  0.338375  1
  P  P244  1  0.357797  0.065301  0.291047  1
  P  P245  1  0.677455  0.050165  0.385994  1
  P  P246  1  0.684244  0.891258  0.338375  1
  P  P247  1  0.350911  0.724591  0.338375  1
  P  P248  1  0.357797  0.565301  0.291047  1
  P  P249  1  0.677455  0.550165  0.385994  1
  P  P250  1  0.684244  0.391258  0.338375  1
  P  P251  1  0.691130  0.231968  0.291047  1
  P  P252  1  0.691130  0.731968  0.291047  1
  P  P253  1  0.230604  0.203920  0.309037  1
  P  P254  1  0.217037  0.021758  0.404307  1
  P  P255  1  0.223827  0.862851  0.356688  1
  P  P256  1  0.563938  0.870586  0.309037  1
  P  P257  1  0.230604  0.703920  0.309037  1
  P  P258  1  0.217037  0.521758  0.404307  1
  P  P259  1  0.223827  0.362851  0.356688  1
  P  P260  1  0.563938  0.370586  0.309037  1
  P  P261  1  0.550370  0.188424  0.404307  1
  P  P262  1  0.557160  0.029517  0.356688  1
  P  P263  1  0.897271  0.037253  0.309037  1
  P  P264  1  0.883704  0.855091  0.404307  1
  P  P265  1  0.550370  0.688424  0.404307  1
  P  P266  1  0.557160  0.529517  0.356688  1
  P  P267  1  0.897271  0.537253  0.309037  1
  P  P268  1  0.883704  0.355091  0.404307  1
  P  P269  1  0.890494  0.196184  0.356688  1
  P  P270  1  0.890494  0.696184  0.356688  1
  P  P271  1  0.009688  0.190468  0.358647  1
  P  P272  1  0.016478  0.031561  0.311028  1
  P  P273  1  0.002898  0.849375  0.406266  1
  P  P274  1  0.343021  0.857135  0.358647  1
  P  P275  1  0.009688  0.690468  0.358647  1
  P  P276  1  0.016478  0.531561  0.311028  1
  P  P277  1  0.002898  0.349375  0.406266  1
  P  P278  1  0.343021  0.357135  0.358647  1
  P  P279  1  0.349811  0.198228  0.311028  1
  P  P280  1  0.336232  0.016042  0.406266  1
  P  P281  1  0.676355  0.023801  0.358647  1
  P  P282  1  0.683144  0.864894  0.311028  1
  P  P283  1  0.349811  0.698228  0.311028  1
  P  P284  1  0.336232  0.516042  0.406266  1
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  P  P1296  1  0.856114  0.699332  0.602201  1
