# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.19927403
_cell_length_b   11.19825060
_cell_length_c   49.32268943
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.04273377
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P112
_cell_volume   6152.26558017
_cell_formula_units_Z   112
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  0.076433  0.080533  0.301129  1
  P  P2  1  0.576433  0.580533  0.301129  1
  P  P3  1  0.636112  0.140224  0.273631  1
  P  P4  1  0.136112  0.640224  0.273631  1
  P  P5  1  0.386112  0.390224  0.273631  1
  P  P6  1  0.886112  0.890224  0.273631  1
  P  P7  1  0.826433  0.330533  0.301129  1
  P  P8  1  0.326433  0.830533  0.301129  1
  P  P9  1  0.108437  0.362538  0.288592  1
  P  P10  1  0.608437  0.862538  0.288592  1
  P  P11  1  0.556039  0.310145  0.323409  1
  P  P12  1  0.056039  0.810145  0.323409  1
  P  P13  1  0.358437  0.112538  0.288592  1
  P  P14  1  0.858437  0.612538  0.288592  1
  P  P15  1  0.806039  0.060145  0.323409  1
  P  P16  1  0.306039  0.560145  0.323409  1
  P  P17  1  0.982398  0.986503  0.372980  1
  P  P18  1  0.482398  0.486503  0.372980  1
  P  P19  1  0.530447  0.034550  0.338684  1
  P  P20  1  0.030447  0.534550  0.338684  1
  P  P21  1  0.280447  0.284550  0.338684  1
  P  P22  1  0.780447  0.784550  0.338684  1
  P  P23  1  0.732398  0.236503  0.372980  1
  P  P24  1  0.232398  0.736503  0.372980  1
  P  P25  1  0.002611  0.256713  0.351719  1
  P  P26  1  0.502611  0.756713  0.351719  1
  P  P27  1  0.456956  0.211060  0.389285  1
  P  P28  1  0.956956  0.711060  0.389285  1
  P  P29  1  0.252611  0.006713  0.351719  1
  P  P30  1  0.752611  0.506713  0.351719  1
  P  P31  1  0.706956  0.961060  0.389285  1
  P  P32  1  0.206956  0.461060  0.389285  1
  P  P33  1  0.883141  0.887245  0.439854  1
  P  P34  1  0.383141  0.387245  0.439854  1
  P  P35  1  0.429232  0.933335  0.402842  1
  P  P36  1  0.929232  0.433335  0.402842  1
  P  P37  1  0.179232  0.183335  0.402842  1
  P  P38  1  0.679232  0.683335  0.402842  1
  P  P39  1  0.633141  0.137245  0.439854  1
  P  P40  1  0.133141  0.637245  0.439854  1
  P  P41  1  0.907631  0.161736  0.422755  1
  P  P42  1  0.407631  0.661736  0.422755  1
  P  P43  1  0.355688  0.109792  0.453700  1
  P  P44  1  0.855688  0.609792  0.453700  1
  P  P45  1  0.157631  0.911736  0.422755  1
  P  P46  1  0.657631  0.411736  0.422755  1
  P  P47  1  0.605688  0.859792  0.453700  1
  P  P48  1  0.105688  0.359792  0.453700  1
  P  P49  1  0.782021  0.786125  0.504423  1
  P  P50  1  0.282021  0.286125  0.504423  1
  P  P51  1  0.333014  0.837118  0.472549  1
  P  P52  1  0.833014  0.337118  0.472549  1
  P  P53  1  0.083014  0.087118  0.472549  1
  P  P54  1  0.583014  0.587118  0.472549  1
  P  P55  1  0.532021  0.036125  0.504423  1
  P  P56  1  0.032021  0.536125  0.504423  1
  P  P57  1  0.809393  0.063498  0.490483  1
  P  P58  1  0.309393  0.563498  0.490483  1
  P  P59  1  0.258400  0.012505  0.522357  1
  P  P60  1  0.758400  0.512505  0.522357  1
  P  P61  1  0.059393  0.813498  0.490483  1
  P  P62  1  0.559393  0.313498  0.490483  1
  P  P63  1  0.508400  0.762505  0.522357  1
  P  P64  1  0.008400  0.262505  0.522357  1
  P  P65  1  0.683783  0.687887  0.572151  1
  P  P66  1  0.183783  0.187887  0.572151  1
  P  P67  1  0.235726  0.739831  0.541206  1
  P  P68  1  0.735726  0.239831  0.541206  1
  P  P69  1  0.985726  0.989831  0.541206  1
  P  P70  1  0.485726  0.489831  0.541206  1
  P  P71  1  0.433783  0.937887  0.572151  1
  P  P72  1  0.933783  0.437887  0.572151  1
  P  P73  1  0.708274  0.962378  0.555052  1
  P  P74  1  0.208274  0.462378  0.555052  1
  P  P75  1  0.162182  0.916288  0.592064  1
  P  P76  1  0.662182  0.416288  0.592064  1
  P  P77  1  0.958274  0.712378  0.555052  1
  P  P78  1  0.458274  0.212378  0.555052  1
  P  P79  1  0.412182  0.666288  0.592064  1
  P  P80  1  0.912182  0.166288  0.592064  1
  P  P81  1  0.588803  0.592910  0.643187  1
  P  P82  1  0.088803  0.092910  0.643187  1
  P  P83  1  0.134458  0.638563  0.605621  1
  P  P84  1  0.634458  0.138563  0.605621  1
  P  P85  1  0.884458  0.888563  0.605621  1
  P  P86  1  0.384458  0.388563  0.605621  1
  P  P87  1  0.338803  0.842910  0.643187  1
  P  P88  1  0.838803  0.342910  0.643187  1
  P  P89  1  0.609016  0.863120  0.621926  1
  P  P90  1  0.109016  0.363120  0.621926  1
  P  P91  1  0.060967  0.815073  0.656222  1
  P  P92  1  0.560967  0.315073  0.656222  1
  P  P93  1  0.859016  0.613120  0.621926  1
  P  P94  1  0.359016  0.113120  0.621926  1
  P  P95  1  0.310967  0.565073  0.656222  1
  P  P96  1  0.810967  0.065073  0.656222  1
  P  P97  1  0.482977  0.487085  0.706314  1
  P  P98  1  0.982977  0.987085  0.706314  1
  P  P99  1  0.035376  0.539478  0.671497  1
  P  P100  1  0.535376  0.039478  0.671497  1
  P  P101  1  0.785376  0.789478  0.671497  1
  P  P102  1  0.285376  0.289478  0.671497  1
  P  P103  1  0.232977  0.737085  0.706314  1
  P  P104  1  0.732977  0.237085  0.706314  1
  P  P105  1  0.514982  0.769090  0.693778  1
  P  P106  1  0.014982  0.269090  0.693778  1
  P  P107  1  0.955303  0.709399  0.721275  1
  P  P108  1  0.455303  0.209399  0.721275  1
  P  P109  1  0.764982  0.519090  0.693778  1
  P  P110  1  0.264982  0.019090  0.693778  1
  P  P111  1  0.205303  0.459399  0.721275  1
  P  P112  1  0.705303  0.959399  0.721275  1
