# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.87433367
_cell_length_b   11.65296618
_cell_length_c   51.38478755
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.51529319
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P128
_cell_volume   7554.61065193
_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  0.947114  0.975538  0.263698  1
  P  P2  1  0.447114  0.975538  0.263698  1
  P  P3  1  0.890357  0.715984  0.273791  1
  P  P4  1  0.390357  0.715984  0.273791  1
  P  P5  1  0.080054  0.454276  0.283386  1
  P  P6  1  0.580054  0.454276  0.283386  1
  P  P7  1  0.253130  0.232705  0.254260  1
  P  P8  1  0.753130  0.232705  0.254260  1
  P  P9  1  0.830054  0.454276  0.283386  1
  P  P10  1  0.330054  0.454276  0.283386  1
  P  P11  1  0.003130  0.232705  0.254260  1
  P  P12  1  0.503130  0.232705  0.254260  1
  P  P13  1  0.197114  0.975538  0.263698  1
  P  P14  1  0.697114  0.975538  0.263698  1
  P  P15  1  0.140357  0.715984  0.273791  1
  P  P16  1  0.640357  0.715984  0.273791  1
  P  P17  1  0.824290  0.916983  0.318289  1
  P  P18  1  0.324290  0.916983  0.318289  1
  P  P19  1  0.768454  0.655972  0.328365  1
  P  P20  1  0.268454  0.655972  0.328365  1
  P  P21  1  0.960541  0.395720  0.338579  1
  P  P22  1  0.460541  0.395720  0.338579  1
  P  P23  1  0.129841  1.178113  0.308254  1
  P  P24  1  0.629841  1.178113  0.308254  1
  P  P25  1  0.710541  0.395720  0.338579  1
  P  P26  1  0.210541  0.395720  0.338579  1
  P  P27  1  0.879841  1.178113  0.308254  1
  P  P28  1  0.379841  1.178113  0.308254  1
  P  P29  1  0.074290  0.916983  0.318289  1
  P  P30  1  0.574290  0.916983  0.318289  1
  P  P31  1  0.018454  0.655972  0.328365  1
  P  P32  1  0.518454  0.655972  0.328365  1
  P  P33  1  0.701188  0.858026  0.373461  1
  P  P34  1  0.201188  0.858026  0.373461  1
  P  P35  1  0.645199  0.597207  0.383672  1
  P  P36  1  0.145199  0.597207  0.383672  1
  P  P37  1  0.838859  0.336294  0.393970  1
  P  P38  1  0.338859  0.336294  0.393970  1
  P  P39  1  0.006463  1.119387  0.363229  1
  P  P40  1  0.506463  1.119387  0.363229  1
  P  P41  1  0.588859  0.336294  0.393970  1
  P  P42  1  0.088859  0.336294  0.393970  1
  P  P43  1  0.756463  1.119387  0.363229  1
  P  P44  1  0.256463  1.119387  0.363229  1
  P  P45  1  0.951188  0.858026  0.373461  1
  P  P46  1  0.451188  0.858026  0.373461  1
  P  P47  1  0.895199  0.597207  0.383672  1
  P  P48  1  0.395199  0.597207  0.383672  1
  P  P49  1  0.577784  0.799068  0.428642  1
  P  P50  1  0.077784  0.799068  0.428642  1
  P  P51  1  0.521838  0.538090  0.438894  1
  P  P52  1  0.021838  0.538090  0.438894  1
  P  P53  1  0.716195  0.276917  0.449245  1
  P  P54  1  0.216195  0.276917  0.449245  1
  P  P55  1  0.883153  1.060331  0.418299  1
  P  P56  1  0.383153  1.060331  0.418299  1
  P  P57  1  0.466195  0.276917  0.449245  1
  P  P58  1  0.966195  0.276917  0.449245  1
  P  P59  1  0.633153  1.060331  0.418299  1
  P  P60  1  0.133153  1.060331  0.418299  1
  P  P61  1  0.827784  0.799068  0.428642  1
  P  P62  1  0.327784  0.799068  0.428642  1
  P  P63  1  0.771838  0.538090  0.438894  1
  P  P64  1  0.271838  0.538090  0.438894  1
  P  P65  1  0.454350  0.739949  0.483844  1
  P  P66  1  0.954350  0.739949  0.483844  1
  P  P67  1  0.398405  0.478970  0.494095  1
  P  P68  1  0.898405  0.478970  0.494095  1
  P  P69  1  0.593035  0.217707  0.504438  1
  P  P70  1  0.093035  0.217707  0.504438  1
  P  P71  1  0.759993  1.001121  0.473493  1
  P  P72  1  0.259993  1.001121  0.473493  1
  P  P73  1  0.343035  0.217707  0.504438  1
  P  P74  1  0.843035  0.217707  0.504438  1
  P  P75  1  0.509993  1.001121  0.473493  1
  P  P76  1  0.009993  1.001121  0.473493  1
  P  P77  1  0.704350  0.739949  0.483844  1
  P  P78  1  0.204350  0.739949  0.483844  1
  P  P79  1  0.648405  0.478970  0.494095  1
  P  P80  1  0.148405  0.478970  0.494095  1
  P  P81  1  0.330989  0.680832  0.539065  1
  P  P82  1  0.830989  0.680832  0.539065  1
  P  P83  1  0.275000  0.420012  0.549277  1
  P  P84  1  0.775000  0.420012  0.549277  1
  P  P85  1  0.469726  1.158652  0.559508  1
  P  P86  1  -0.030274  1.158652  0.559508  1
  P  P87  1  0.637330  0.941744  0.528768  1
  P  P88  1  0.137330  0.941744  0.528768  1
  P  P89  1  0.219726  1.158652  0.559508  1
  P  P90  1  0.719726  1.158652  0.559508  1
  P  P91  1  0.387330  0.941744  0.528768  1
  P  P92  1  0.887330  0.941744  0.528768  1
  P  P93  1  0.580989  0.680832  0.539065  1
  P  P94  1  0.080989  0.680832  0.539065  1
  P  P95  1  0.525000  0.420012  0.549277  1
  P  P96  1  0.025000  0.420012  0.549277  1
  P  P97  1  0.207734  0.622066  0.594373  1
  P  P98  1  0.707734  0.622066  0.594373  1
  P  P99  1  0.151898  0.361055  0.604449  1
  P  P100  1  0.651898  0.361055  0.604449  1
  P  P101  1  0.346347  1.099925  0.614484  1
  P  P102  1  0.846347  1.099925  0.614484  1
  P  P103  1  0.515647  0.882319  0.584159  1
  P  P104  1  0.015647  0.882319  0.584159  1
  P  P105  1  0.096347  1.099925  0.614484  1
  P  P106  1  0.596347  1.099925  0.614484  1
  P  P107  1  0.265647  0.882319  0.584159  1
  P  P108  1  0.765647  0.882319  0.584159  1
  P  P109  1  0.457734  0.622066  0.594373  1
  P  P110  1  0.957734  0.622066  0.594373  1
  P  P111  1  0.401898  0.361055  0.604449  1
  P  P112  1  0.901898  0.361055  0.604449  1
  P  P113  1  0.085831  0.562054  0.648947  1
  P  P114  1  0.585831  0.562054  0.648947  1
  P  P115  1  0.029074  0.302500  0.659040  1
  P  P116  1  0.529074  0.302500  0.659040  1
  P  P117  1  0.223058  1.045333  0.668478  1
  P  P118  1  0.723058  1.045333  0.668478  1
  P  P119  1  0.396135  0.823762  0.639352  1
  P  P120  1  0.896135  0.823762  0.639352  1
  P  P121  1  -0.026942  1.045333  0.668478  1
  P  P122  1  0.473058  1.045333  0.668478  1
  P  P123  1  0.146135  0.823762  0.639352  1
  P  P124  1  0.646135  0.823762  0.639352  1
  P  P125  1  0.335831  0.562054  0.648947  1
  P  P126  1  0.835831  0.562054  0.648947  1
  P  P127  1  0.279074  0.302500  0.659040  1
  P  P128  1  0.779074  0.302500  0.659040  1
