# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.33133564
_cell_length_b   10.97805181
_cell_length_c   53.75124600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   86.62782575
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P112
_cell_volume   6674.86195972
_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  0.718653  0.972086  0.254728  1
  P  P2  1  0.171248  0.977998  0.285312  1
  P  P3  1  0.678000  0.722719  0.285788  1
  P  P4  1  0.226569  0.727585  0.255554  1
  P  P5  1  0.899582  0.424463  0.300297  1
  P  P6  1  0.444914  0.527197  0.269857  1
  P  P7  1  0.948514  1.172604  0.269265  1
  P  P8  1  0.504078  0.274668  0.240888  1
  P  P9  1  0.718653  0.472086  0.254728  1
  P  P10  1  0.171248  0.477998  0.285312  1
  P  P11  1  0.678000  0.222719  0.285788  1
  P  P12  1  0.226569  0.227585  0.255554  1
  P  P13  1  0.899582  0.924463  0.300297  1
  P  P14  1  0.444914  1.027197  0.269857  1
  P  P15  1  0.948514  0.672604  0.269265  1
  P  P16  1  0.504078  0.774668  0.240888  1
  P  P17  1  0.626627  0.975963  0.315809  1
  P  P18  1  0.081299  0.979933  0.346772  1
  P  P19  1  0.582782  0.727926  0.346978  1
  P  P20  1  0.127979  0.729082  0.315696  1
  P  P21  1  0.808423  0.427107  0.362027  1
  P  P22  1  0.353360  0.532644  0.331401  1
  P  P23  1  0.857223  1.175330  0.331329  1
  P  P24  1  0.402754  0.280278  0.300839  1
  P  P25  1  0.626627  0.475963  0.315809  1
  P  P26  1  0.081299  0.479933  0.346772  1
  P  P27  1  0.582782  0.227926  0.346978  1
  P  P28  1  0.127979  0.229082  0.315696  1
  P  P29  1  0.808423  0.927107  0.362027  1
  P  P30  1  0.353360  1.032644  0.331401  1
  P  P31  1  0.857223  0.675330  0.331329  1
  P  P32  1  0.402754  0.780278  0.300839  1
  P  P33  1  0.534852  0.980579  0.377606  1
  P  P34  1  0.988960  0.983545  0.408499  1
  P  P35  1  0.489337  0.732814  0.408525  1
  P  P36  1  0.035957  0.731978  0.377711  1
  P  P37  1  0.716097  0.430584  0.423770  1
  P  P38  1  0.261673  0.536322  0.393202  1
  P  P39  1  0.763226  1.178747  0.393022  1
  P  P40  1  0.308513  0.284419  0.362332  1
  P  P41  1  0.534852  0.480579  0.377606  1
  P  P42  1  0.988960  0.483545  0.408499  1
  P  P43  1  0.489337  0.232814  0.408525  1
  P  P44  1  0.035957  0.231978  0.377711  1
  P  P45  1  0.716097  0.930584  0.423770  1
  P  P46  1  0.261673  1.036322  0.393202  1
  P  P47  1  0.763226  0.678747  0.393022  1
  P  P48  1  0.308513  0.784419  0.362332  1
  P  P49  1  0.442622  0.985209  0.439354  1
  P  P50  1  0.896283  0.987162  0.470193  1
  P  P51  1  0.396717  0.737425  0.470250  1
  P  P52  1  0.943057  0.735472  0.439410  1
  P  P53  1  0.623472  0.434338  0.485501  1
  P  P54  1  0.169131  0.540181  0.454924  1
  P  P55  1  0.670209  1.182454  0.454679  1
  P  P56  1  0.215868  0.288297  0.424102  1
  P  P57  1  0.442622  0.485209  0.439354  1
  P  P58  1  0.896283  0.487162  0.470193  1
  P  P59  1  0.396717  0.237425  0.470250  1
  P  P60  1  0.943057  0.235472  0.439410  1
  P  P61  1  0.623472  0.934338  0.485501  1
  P  P62  1  0.169131  1.040181  0.454924  1
  P  P63  1  0.670209  0.682454  0.454679  1
  P  P64  1  0.215868  0.788297  0.424102  1
  P  P65  1  0.350003  0.989820  0.501079  1
  P  P66  1  0.803383  0.990657  0.531892  1
  P  P67  1  0.304488  0.742056  0.531998  1
  P  P68  1  0.850380  0.739090  0.501104  1
  P  P69  1  0.530827  0.438216  0.547272  1
  P  P70  1  0.076113  0.543888  0.516581  1
  P  P71  1  0.577666  1.186313  0.516402  1
  P  P72  1  0.123243  0.292051  0.485834  1
  P  P73  1  0.350003  0.489820  0.501079  1
  P  P74  1  0.803383  0.490657  0.531892  1
  P  P75  1  0.304488  0.242056  0.531998  1
  P  P76  1  0.850380  0.239090  0.501104  1
  P  P77  1  0.530827  0.938216  0.547272  1
  P  P78  1  0.076113  1.043888  0.516581  1
  P  P79  1  0.577666  0.686313  0.516402  1
  P  P80  1  0.123243  0.792051  0.485834  1
  P  P81  1  0.256558  0.994708  0.562625  1
  P  P82  1  0.711361  0.993552  0.593907  1
  P  P83  1  0.212713  0.746672  0.593795  1
  P  P84  1  0.758040  0.742701  0.562831  1
  P  P85  1  0.436585  0.442356  0.608764  1
  P  P86  1  0.982117  0.547305  0.578275  1
  P  P87  1  0.485980  1.189991  0.578202  1
  P  P88  1  0.030917  0.295528  0.547576  1
  P  P89  1  0.256558  0.494708  0.562625  1
  P  P90  1  0.711361  0.493552  0.593907  1
  P  P91  1  0.212713  0.246672  0.593795  1
  P  P92  1  0.758040  0.242701  0.562831  1
  P  P93  1  0.436585  0.942356  0.608764  1
  P  P94  1  0.982117  1.047305  0.578275  1
  P  P95  1  0.485980  0.689991  0.578202  1
  P  P96  1  0.030917  0.795528  0.547576  1
  P  P97  1  0.161340  0.999915  0.623816  1
  P  P98  1  0.612771  0.995049  0.654049  1
  P  P99  1  0.120687  0.750549  0.654876  1
  P  P100  1  0.668092  0.744636  0.624291  1
  P  P101  1  0.335261  0.447967  0.668715  1
  P  P102  1  0.890825  0.550031  0.640338  1
  P  P103  1  0.394425  1.195437  0.639747  1
  P  P104  1  0.939758  0.298171  0.609306  1
  P  P105  1  0.161340  0.499915  0.623816  1
  P  P106  1  0.612771  0.495049  0.654049  1
  P  P107  1  0.120687  0.250549  0.654876  1
  P  P108  1  0.668092  0.244636  0.624291  1
  P  P109  1  0.335261  0.947967  0.668715  1
  P  P110  1  0.890825  1.050031  0.640338  1
  P  P111  1  0.394425  0.695437  0.639747  1
  P  P112  1  0.939758  0.798171  0.609306  1
