# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.49084108
_cell_length_b   14.40765005
_cell_length_c   49.26571748
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   85.84241782
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P126
_cell_volume   7426.83689773
_cell_formula_units_Z   126
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  0.845863  0.428667  0.316537  1
  P  P2  1  0.179196  0.095333  0.316537  1
  P  P3  1  0.148929  0.414133  0.337228  1
  P  P4  1  0.512530  0.762000  0.316537  1
  P  P5  1  0.482262  0.080799  0.337228  1
  P  P6  1  0.544001  0.446302  0.297079  1
  P  P7  1  0.815596  0.747466  0.337228  1
  P  P8  1  0.877334  0.112968  0.297079  1
  P  P9  1  0.210668  0.779635  0.297079  1
  P  P10  1  0.027593  0.604622  0.306606  1
  P  P11  1  0.360926  0.271289  0.306606  1
  P  P12  1  0.330408  0.588106  0.326742  1
  P  P13  1  0.694259  0.937956  0.306606  1
  P  P14  1  0.663741  0.254772  0.326742  1
  P  P15  1  0.726506  0.618684  0.287322  1
  P  P16  1  0.997075  0.921439  0.326742  1
  P  P17  1  0.059840  0.285351  0.287322  1
  P  P18  1  0.393173  0.952018  0.287322  1
  P  P19  1  0.752029  0.380895  0.379095  1
  P  P20  1  0.085363  0.047562  0.379095  1
  P  P21  1  0.054511  0.365404  0.400029  1
  P  P22  1  0.418696  0.714228  0.379095  1
  P  P23  1  0.387844  0.032070  0.400029  1
  P  P24  1  0.450413  0.396916  0.358396  1
  P  P25  1  0.721177  0.698737  0.400029  1
  P  P26  1  0.783746  0.063582  0.358396  1
  P  P27  1  0.117079  0.730249  0.358396  1
  P  P28  1  0.934389  0.555819  0.368459  1
  P  P29  1  0.267722  0.222485  0.368459  1
  P  P30  1  0.236795  0.539685  0.389502  1
  P  P31  1  0.601056  0.889152  0.368459  1
  P  P32  1  0.570129  0.206352  0.389502  1
  P  P33  1  0.632643  0.572001  0.348241  1
  P  P34  1  0.903462  0.873019  0.389502  1
  P  P35  1  0.965976  0.238668  0.348241  1
  P  P36  1  0.299310  0.905334  0.348241  1
  P  P37  1  0.658271  0.332802  0.441871  1
  P  P38  1  0.991604  0.999468  0.441871  1
  P  P39  1  0.960467  0.316876  0.462747  1
  P  P40  1  0.324937  0.666135  0.441871  1
  P  P41  1  0.293800  0.983543  0.462747  1
  P  P42  1  0.356272  0.348724  0.420959  1
  P  P43  1  0.627133  0.650210  0.462747  1
  P  P44  1  0.689606  0.015391  0.420959  1
  P  P45  1  0.022939  0.682058  0.420959  1
  P  P46  1  0.840608  0.507590  0.431310  1
  P  P47  1  0.173941  0.174257  0.431310  1
  P  P48  1  0.142824  0.491467  0.452308  1
  P  P49  1  0.507274  0.840923  0.431310  1
  P  P50  1  0.476157  0.158133  0.452308  1
  P  P51  1  0.538533  0.523638  0.410673  1
  P  P52  1  0.809490  0.824800  0.452308  1
  P  P53  1  0.871866  0.190305  0.410673  1
  P  P54  1  0.205199  0.856972  0.410673  1
  P  P55  1  0.564474  0.284513  0.504609  1
  P  P56  1  0.897807  0.951180  0.504609  1
  P  P57  1  0.866581  0.268515  0.525422  1
  P  P58  1  0.231141  0.617846  0.504609  1
  P  P59  1  0.199914  0.935181  0.525422  1
  P  P60  1  0.262395  0.300573  0.483651  1
  P  P61  1  0.533248  0.601848  0.525422  1
  P  P62  1  0.595728  0.967239  0.483651  1
  P  P63  1  0.929061  0.633906  0.483651  1
  P  P64  1  0.746786  0.459295  0.494073  1
  P  P65  1  0.080119  0.125962  0.494073  1
  P  P66  1  0.048865  0.443235  0.515031  1
  P  P67  1  0.413453  0.792628  0.494073  1
  P  P68  1  0.382198  0.109902  0.515031  1
  P  P69  1  0.444679  0.475293  0.473260  1
  P  P70  1  0.715532  0.776569  0.515031  1
  P  P71  1  0.778012  0.141960  0.473260  1
  P  P72  1  0.111345  0.808626  0.473260  1
  P  P73  1  0.470652  0.236218  0.567372  1
  P  P74  1  0.803985  0.902885  0.567372  1
  P  P75  1  0.772727  0.220170  0.588009  1
  P  P76  1  0.137319  0.569551  0.567372  1
  P  P77  1  0.106061  0.886836  0.588009  1
  P  P78  1  0.168436  0.252341  0.546374  1
  P  P79  1  0.439394  0.553503  0.588009  1
  P  P80  1  0.501769  0.919008  0.546374  1
  P  P81  1  0.835103  0.585674  0.546374  1
  P  P82  1  0.652989  0.411006  0.556811  1
  P  P83  1  0.986322  0.077673  0.556811  1
  P  P84  1  0.954987  0.395083  0.577723  1
  P  P85  1  0.319656  0.744340  0.556811  1
  P  P86  1  0.288321  0.061750  0.577723  1
  P  P87  1  0.350793  0.426932  0.535935  1
  P  P88  1  0.621654  0.728417  0.577723  1
  P  P89  1  0.684126  0.093598  0.535935  1
  P  P90  1  0.017460  0.760265  0.535935  1
  P  P91  1  0.376871  0.187989  0.630223  1
  P  P92  1  0.710204  0.854656  0.630223  1
  P  P93  1  0.678617  0.171807  0.650441  1
  P  P94  1  0.043537  0.521322  0.630223  1
  P  P95  1  0.011950  0.838473  0.650441  1
  P  P96  1  0.074465  0.204122  0.609180  1
  P  P97  1  0.345284  0.505140  0.650441  1
  P  P98  1  0.407798  0.870789  0.609180  1
  P  P99  1  0.741131  0.537456  0.609180  1
  P  P100  1  0.559231  0.362913  0.619588  1
  P  P101  1  0.892564  0.029579  0.619588  1
  P  P102  1  0.860847  0.346892  0.640286  1
  P  P103  1  0.225897  0.696246  0.619588  1
  P  P104  1  0.194180  0.013559  0.640286  1
  P  P105  1  0.256749  0.378404  0.598653  1
  P  P106  1  0.527514  0.680226  0.640286  1
  P  P107  1  0.590083  0.045071  0.598653  1
  P  P108  1  0.923416  0.711738  0.598653  1
  P  P109  1  0.283667  0.139186  0.692077  1
  P  P110  1  0.617001  0.805852  0.692077  1
  P  P111  1  0.584753  0.125124  0.711360  1
  P  P112  1  0.950334  0.472519  0.692077  1
  P  P113  1  0.918087  0.791790  0.711360  1
  P  P114  1  0.980852  0.155702  0.671940  1
  P  P115  1  0.251420  0.458457  0.711360  1
  P  P116  1  0.314185  0.822369  0.671940  1
  P  P117  1  0.647519  0.489035  0.671940  1
  P  P118  1  0.465397  0.315141  0.682145  1
  P  P119  1  0.798730  0.981808  0.682145  1
  P  P120  1  0.767259  0.297506  0.701603  1
  P  P121  1  0.132063  0.648474  0.682145  1
  P  P122  1  0.100592  0.964173  0.701603  1
  P  P123  1  0.162331  0.329675  0.661454  1
  P  P124  1  0.433925  0.630840  0.701603  1
  P  P125  1  0.495664  0.996342  0.661454  1
  P  P126  1  0.828998  0.663009  0.661454  1
