# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   35.35078592
_cell_length_b   19.75235497
_cell_length_c   51.47248040
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   81.75255072
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P192
_cell_volume   35569.5272039
_cell_formula_units_Z   192
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  0.058080  0.151291  0.314339  1
  P  P2  1  0.597131  0.259618  0.252258  1
  P  P3  1  0.018794  0.680219  0.374854  1
  P  P4  1  0.557608  0.786794  0.312354  1
  P  P5  1  0.042368  0.306512  0.298854  1
  P  P6  1  0.503553  0.199937  0.361354  1
  P  P7  1  0.112049  0.738391  0.265295  1
  P  P8  1  0.573320  0.631573  0.327839  1
  P  P9  1  0.116404  0.249863  0.330142  1
  P  P10  1  0.654115  0.355876  0.267708  1
  P  P11  1  0.960469  0.581646  0.359051  1
  P  P12  1  0.499283  0.688221  0.296551  1
  P  P13  1  0.036087  0.263111  0.357192  1
  P  P14  1  0.575682  0.368739  0.294163  1
  P  P15  1  0.040787  0.568399  0.332002  1
  P  P16  1  0.579601  0.674974  0.269502  1
  P  P17  1  0.260863  0.082303  0.282714  1
  P  P18  1  0.722724  0.970715  0.345979  1
  P  P19  1  0.892964  0.967370  0.280715  1
  P  P20  1  0.354149  0.860795  0.343215  1
  P  P21  1  0.112987  0.903324  0.371992  1
  P  P22  1  0.651801  0.009898  0.309492  1
  P  P23  1  0.963887  0.928186  0.317202  1
  P  P24  1  0.499822  0.035080  0.255423  1
  P  P25  1  0.243618  0.221307  0.262056  1
  P  P26  1  0.704212  0.119902  0.323854  1
  P  P27  1  0.911476  0.818183  0.302839  1
  P  P28  1  0.372662  0.711608  0.365339  1
  P  P29  1  0.196042  0.891694  0.349205  1
  P  P30  1  0.734857  0.998268  0.286705  1
  P  P31  1  0.880831  0.939816  0.339988  1
  P  P32  1  0.422441  0.045915  0.276705  1
  P  P33  1  0.872220  0.358678  0.358111  1
  P  P34  1  0.410678  0.463870  0.295096  1
  P  P35  1  0.204653  0.472832  0.331083  1
  P  P36  1  0.743468  0.579407  0.268583  1
  P  P37  1  0.881341  0.363995  0.297507  1
  P  P38  1  0.342527  0.257421  0.360007  1
  P  P39  1  0.273239  0.680851  0.266639  1
  P  P40  1  0.734347  0.574089  0.329187  1
  P  P41  1  0.808698  0.314279  0.321874  1
  P  P42  1  0.348658  0.420582  0.259652  1
  P  P43  1  0.268176  0.517230  0.367319  1
  P  P44  1  0.806990  0.623805  0.304819  1
  P  P45  1  0.888618  0.222335  0.326101  1
  P  P46  1  0.426720  0.330750  0.263790  1
  P  P47  1  0.188256  0.609175  0.363092  1
  P  P48  1  0.727070  0.715750  0.300592  1
  P  P49  1  0.980452  0.938141  0.439339  1
  P  P50  1  0.519266  0.044716  0.376839  1
  P  P51  1  0.941166  0.467070  0.499854  1
  P  P52  1  0.479980  0.573645  0.437354  1
  P  P53  1  0.964739  0.093363  0.423854  1
  P  P54  1  0.425925  0.986788  0.486354  1
  P  P55  1  0.034506  0.524998  0.390339  1
  P  P56  1  0.495692  0.418423  0.452839  1
  P  P57  1  0.038776  0.036714  0.455142  1
  P  P58  1  0.577590  0.143289  0.392642  1
  P  P59  1  0.882841  0.368497  0.484051  1
  P  P60  1  0.421655  0.475072  0.421551  1
  P  P61  1  0.958458  0.049961  0.482192  1
  P  P62  1  0.497272  0.156536  0.419692  1
  P  P63  1  0.963159  0.355250  0.457002  1
  P  P64  1  0.501973  0.461824  0.394502  1
  P  P65  1  0.183910  0.864140  0.408479  1
  P  P66  1  0.645096  0.757565  0.470979  1
  P  P67  1  0.815335  0.754220  0.405715  1
  P  P68  1  0.276521  0.647646  0.468215  1
  P  P69  1  0.035359  0.690174  0.496992  1
  P  P70  1  0.574173  0.796749  0.434492  1
  P  P71  1  0.886258  0.715037  0.442202  1
  P  P72  1  0.425073  0.821612  0.379702  1
  P  P73  1  0.165398  0.013327  0.386354  1
  P  P74  1  0.626584  0.906753  0.448854  1
  P  P75  1  0.833848  0.605033  0.427839  1
  P  P76  1  0.295033  0.498459  0.490339  1
  P  P77  1  0.118414  0.678544  0.474205  1
  P  P78  1  0.657228  0.785119  0.411705  1
  P  P79  1  0.803203  0.726667  0.464988  1
  P  P80  1  0.342017  0.833241  0.402488  1
  P  P81  1  0.794592  0.145528  0.483111  1
  P  P82  1  0.333406  0.252103  0.420611  1
  P  P83  1  0.127025  0.259683  0.456083  1
  P  P84  1  0.665839  0.366258  0.393583  1
  P  P85  1  0.803712  0.150846  0.422507  1
  P  P86  1  0.264898  0.044271  0.485007  1
  P  P87  1  0.195533  0.467515  0.391687  1
  P  P88  1  0.656719  0.360940  0.454187  1
  P  P89  1  0.731070  0.101130  0.446874  1
  P  P90  1  0.269884  0.207705  0.384374  1
  P  P91  1  0.190547  0.304081  0.492319  1
  P  P92  1  0.729362  0.410656  0.429819  1
  P  P93  1  0.810989  0.009185  0.451101  1
  P  P94  1  0.349803  0.115760  0.388601  1
  P  P95  1  0.110628  0.396026  0.488092  1
  P  P96  1  0.649442  0.502601  0.425592  1
  P  P97  1  0.902823  0.724992  0.564339  1
  P  P98  1  0.441637  0.831567  0.501839  1
  P  P99  1  0.863537  0.253921  0.624854  1
  P  P100  1  0.402351  0.360495  0.562354  1
  P  P101  1  0.887111  0.880213  0.548854  1
  P  P102  1  0.348297  0.773639  0.611354  1
  P  P103  1  0.956878  0.311849  0.515339  1
  P  P104  1  0.418064  0.205274  0.577839  1
  P  P105  1  0.961148  0.823565  0.580142  1
  P  P106  1  0.499962  0.930140  0.517642  1
  P  P107  1  0.805213  0.155348  0.609051  1
  P  P108  1  0.344027  0.261923  0.546551  1
  P  P109  1  0.880830  0.836812  0.607192  1
  P  P110  1  0.419644  0.943387  0.544692  1
  P  P111  1  0.885530  0.142101  0.582002  1
  P  P112  1  0.424345  0.248675  0.519502  1
  P  P113  1  0.106282  0.650991  0.533479  1
  P  P114  1  0.567468  0.544416  0.595979  1
  P  P115  1  0.737707  0.541071  0.530715  1
  P  P116  1  0.198893  0.434497  0.593215  1
  P  P117  1  0.957730  0.477025  0.621992  1
  P  P118  1  0.496544  0.583600  0.559492  1
  P  P119  1  0.808630  0.501888  0.567202  1
  P  P120  1  0.347444  0.608462  0.504702  1
  P  P121  1  0.087770  0.800178  0.511354  1
  P  P122  1  0.548955  0.693603  0.573854  1
  P  P123  1  0.756219  0.391884  0.552839  1
  P  P124  1  0.217405  0.285309  0.615339  1
  P  P125  1  0.040786  0.465395  0.599205  1
  P  P126  1  0.579600  0.571970  0.536705  1
  P  P127  1  0.725575  0.513518  0.589988  1
  P  P128  1  0.264389  0.620092  0.527488  1
  P  P129  1  0.716964  0.932379  0.608111  1
  P  P130  1  0.255778  0.038954  0.545611  1
  P  P131  1  0.049397  0.046534  0.581083  1
  P  P132  1  0.588211  0.153108  0.518583  1
  P  P133  1  0.726084  0.937697  0.547507  1
  P  P134  1  0.187270  0.831122  0.610007  1
  P  P135  1  0.117905  0.254365  0.516687  1
  P  P136  1  0.579091  0.147791  0.579187  1
  P  P137  1  0.653441  0.887981  0.571874  1
  P  P138  1  0.192256  0.994555  0.509374  1
  P  P139  1  0.112919  0.090932  0.617319  1
  P  P140  1  0.651733  0.197507  0.554819  1
  P  P141  1  0.733361  0.796036  0.576101  1
  P  P142  1  0.272175  0.902611  0.513601  1
  P  P143  1  0.032999  0.182877  0.613092  1
  P  P144  1  0.571814  0.289451  0.550592  1
  P  P145  1  0.825195  0.511843  0.689339  1
  P  P146  1  0.364009  0.618418  0.626839  1
  P  P147  1  0.785672  0.039019  0.749436  1
  P  P148  1  0.324723  0.147346  0.687354  1
  P  P149  1  0.809483  0.667064  0.673854  1
  P  P150  1  0.270754  0.560245  0.736399  1
  P  P151  1  0.879249  0.098699  0.640339  1
  P  P152  1  0.340435  0.992125  0.702839  1
  P  P153  1  0.883519  0.610416  0.705142  1
  P  P154  1  0.422334  0.716990  0.642642  1
  P  P155  1  0.728688  0.942761  0.733986  1
  P  P156  1  0.266398  0.048773  0.671551  1
  P  P157  1  0.803202  0.623663  0.732192  1
  P  P158  1  0.342016  0.730238  0.669692  1
  P  P159  1  0.807121  0.929897  0.707531  1
  P  P160  1  0.346716  0.035526  0.644502  1
  P  P161  1  0.028653  0.437842  0.658479  1
  P  P162  1  0.489839  0.331267  0.720979  1
  P  P163  1  0.660079  0.327922  0.655715  1
  P  P164  1  0.121940  0.216334  0.718979  1
  P  P165  1  0.882981  0.263557  0.746270  1
  P  P166  1  0.418916  0.370450  0.684492  1
  P  P167  1  0.731002  0.288739  0.692202  1
  P  P168  1  0.269816  0.395313  0.629702  1
  P  P169  1  0.010141  0.587029  0.636354  1
  P  P170  1  0.471327  0.480454  0.698854  1
  P  P171  1  0.678591  0.178735  0.677839  1
  P  P172  1  0.139185  0.077330  0.739637  1
  P  P173  1  0.960362  0.252721  0.724989  1
  P  P174  1  0.501972  0.358821  0.661705  1
  P  P175  1  0.647946  0.300368  0.714988  1
  P  P176  1  0.186761  0.406943  0.652488  1
  P  P177  1  0.639335  0.719230  0.733111  1
  P  P178  1  0.178150  0.825805  0.670611  1
  P  P179  1  0.972125  0.834766  0.706597  1
  P  P180  1  0.510583  0.939959  0.643583  1
  P  P181  1  0.648456  0.724547  0.672507  1
  P  P182  1  0.109564  0.617786  0.735055  1
  P  P183  1  0.040276  0.041216  0.641687  1
  P  P184  1  0.501462  0.934642  0.704187  1
  P  P185  1  0.575813  0.674832  0.696874  1
  P  P186  1  0.114627  0.781406  0.634374  1
  P  P187  1  0.034145  0.878055  0.742042  1
  P  P188  1  0.574105  0.984357  0.679819  1
  P  P189  1  0.655733  0.582887  0.701101  1
  P  P190  1  0.194547  0.689461  0.638601  1
  P  P191  1  0.956083  0.967887  0.737903  1
  P  P192  1  0.494185  0.076302  0.675592  1
