# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.45820631
_cell_length_b   16.74201362
_cell_length_c   54.21934920
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.98022901
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P128
_cell_volume   12788.9506812
_cell_formula_units_Z   128
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  0.823888  0.836706  0.366529  1
  P  P2  1  0.418528  0.667132  0.394079  1
  P  P3  1  0.692864  0.647243  0.363142  1
  P  P4  1  0.420582  0.501345  0.428569  1
  P  P5  1  0.627274  0.779645  0.400852  1
  P  P6  1  1.009204  0.868781  0.406225  1
  P  P7  1  0.196457  0.404579  0.436168  1
  P  P8  1  0.650421  0.559165  0.414966  1
  P  P9  1  0.925448  0.029031  0.377412  1
  P  P10  1  0.458800  0.883503  0.384014  1
  P  P11  1  0.775891  0.404923  0.416281  1
  P  P12  1  0.248577  0.511363  0.385723  1
  P  P13  1  0.685151  0.445842  0.364054  1
  P  P14  1  0.328337  0.347796  0.391884  1
  P  P15  1  0.820375  0.926751  0.420510  1
  P  P16  1  0.330718  0.019363  0.376957  1
  P  P17  1  0.894146  0.382334  0.369028  1
  P  P18  1  0.379590  0.174541  0.412046  1
  P  P19  1  0.776814  0.113825  0.411657  1
  P  P20  1  0.379935  0.982212  0.434873  1
  P  P21  1  0.691491  0.253656  0.380643  1
  P  P22  1  0.060928  0.542474  0.356826  1
  P  P23  1  0.176535  0.019826  0.423207  1
  P  P24  1  0.549163  0.085114  0.399058  1
  P  P25  1  0.871630  0.571766  0.383903  1
  P  P26  1  0.542183  0.354532  0.407293  1
  P  P27  1  0.817236  0.721783  0.414894  1
  P  P28  1  0.225765  0.842977  0.395162  1
  P  P29  1  0.685780  0.964710  0.374505  1
  P  P30  1  0.376264  0.794492  0.433764  1
  P  P31  1  1.030337  0.486205  0.412357  1
  P  P32  1  0.487416  0.508750  0.372044  1
  P  P33  1  0.875910  0.560018  0.444753  1
  P  P34  1  0.644338  0.485035  0.514731  1
  P  P35  1  1.037995  0.458607  0.470544  1
  P  P36  1  0.622806  0.426905  0.459154  1
  P  P37  1  0.872120  0.557127  0.501863  1
  P  P38  1  0.237358  0.607907  0.438025  1
  P  P39  1  0.392264  0.254383  0.510388  1
  P  P40  1  0.820404  0.366929  0.474782  1
  P  P41  1  1.051921  0.684526  0.416579  1
  P  P42  1  0.708364  0.629234  0.472860  1
  P  P43  1  0.999006  0.088421  0.497779  1
  P  P44  1  0.377836  0.315653  0.452313  1
  P  P45  1  0.932551  0.294519  0.426716  1
  P  P46  1  0.463497  0.153129  0.464530  1
  P  P47  1  0.168683  0.832482  0.450789  1
  P  P48  1  0.598514  0.939196  0.431106  1
  P  P49  1  0.980599  0.098496  0.434867  1
  P  P50  1  0.624685  0.085156  0.495915  1
  P  P51  1  1.007238  0.937416  0.463355  1
  P  P52  1  0.498112  0.887347  0.481251  1
  P  P53  1  0.832067  0.171021  0.469689  1
  P  P54  1  0.176105  0.216542  0.422508  1
  P  P55  1  0.332352  0.719407  0.487017  1
  P  P56  1  0.713718  0.815837  0.461301  1
  P  P57  1  0.068442  0.262527  0.471982  1
  P  P58  1  0.619174  0.280479  0.499554  1
  P  P59  1  0.086287  0.651071  0.478866  1
  P  P60  1  0.517626  0.685043  0.449669  1
  P  P61  1  0.930853  0.748723  0.463585  1
  P  P62  1  0.579649  0.737768  0.506636  1
  P  P63  1  0.229150  0.136482  0.473741  1
  P  P64  1  0.661403  0.235483  0.440615  1
  P  P65  1  0.295548  0.418329  0.541878  1
  P  P66  1  0.786422  0.368260  0.559775  1
  P  P67  1  0.168974  0.220520  0.527214  1
  P  P68  1  0.813060  0.207180  0.588262  1
  P  P69  1  0.079941  0.489840  0.561828  1
  P  P70  1  0.461307  0.586269  0.536112  1
  P  P71  1  0.617554  0.089134  0.600621  1
  P  P72  1  0.961593  0.134655  0.553440  1
  P  P73  1  0.214010  0.567908  0.516493  1
  P  P74  1  0.862806  0.556953  0.559544  1
  P  P75  1  0.132256  0.070193  0.582514  1
  P  P76  1  0.564509  0.169195  0.549388  1
  P  P77  1  0.174486  0.025197  0.523575  1
  P  P78  1  0.725217  0.043149  0.551148  1
  P  P79  1  0.276033  0.620634  0.573460  1
  P  P80  1  0.707372  0.654605  0.544263  1
  P  P81  1  0.170854  0.878771  0.563975  1
  P  P82  1  0.755664  0.847069  0.552586  1
  P  P83  1  0.149321  0.820641  0.508399  1
  P  P84  1  0.917749  0.745658  0.578377  1
  P  P85  1  0.973255  0.938747  0.548347  1
  P  P86  1  0.401395  0.051293  0.512741  1
  P  P87  1  0.556301  0.697769  0.585104  1
  P  P88  1  0.921539  0.748549  0.521266  1
  P  P89  1  0.330162  0.152547  0.558599  1
  P  P90  1  0.861108  0.011157  0.596413  1
  P  P91  1  0.195145  0.366480  0.592023  1
  P  P92  1  0.624977  0.473194  0.572340  1
  P  P93  1  0.085295  0.676443  0.550269  1
  P  P94  1  0.741738  0.621150  0.606550  1
  P  P95  1  0.415823  -0.009977  0.570816  1
  P  P96  1  0.794653  0.217256  0.525350  1
  P  P97  1  0.413724  0.323464  0.588256  1
  P  P98  1  1.016845  0.191851  0.611472  1
  P  P99  1  0.414069  0.131135  0.611083  1
  P  P100  1  0.899513  0.923342  0.654101  1
  P  P101  1  0.244496  0.220562  0.624071  1
  P  P102  1  0.617124  0.285851  0.599922  1
  P  P103  1  0.732731  0.763203  0.666303  1
  P  P104  1  0.102168  0.052020  0.642486  1
  P  P105  1  0.417395  0.511185  0.589365  1
  P  P106  1  0.107880  0.340966  0.648625  1
  P  P107  1  0.306243  0.796926  0.651085  1
  P  P108  1  0.763322  0.819471  0.610773  1
  P  P109  1  0.251476  0.951144  0.615836  1
  P  P110  1  0.922029  0.733910  0.639226  1
  P  P111  1  0.567894  0.462699  0.627967  1
  P  P112  1  0.976424  0.583893  0.608235  1
  P  P113  1  0.373078  0.804331  0.594560  1
  P  P114  1  0.100795  0.658434  0.659987  1
  P  P115  1  0.375131  0.638544  0.629050  1
  P  P116  1  0.969771  0.468970  0.656600  1
  P  P117  1  0.143238  0.746511  0.608163  1
  P  P118  1  0.597202  0.901097  0.586961  1
  P  P119  1  0.784456  0.436895  0.616904  1
  P  P120  1  0.166385  0.526032  0.622277  1
  P  P121  1  0.465322  0.957880  0.631245  1
  P  P122  1  0.108509  0.859834  0.659075  1
  P  P123  1  0.462941  0.286313  0.646172  1
  P  P124  1  0.973285  0.378926  0.602620  1
  P  P125  1  0.334859  0.422173  0.639115  1
  P  P126  1  0.868211  0.276646  0.645717  1
  P  P127  1  0.545082  0.794313  0.637406  1
  P  P128  1  1.017768  0.900754  0.606848  1
