# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.87177598
_cell_length_b   17.67347978
_cell_length_c   44.01896492
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.42328257
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P192
_cell_volume   16095.8127575
_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  0.899877  0.746755  0.549745  1
  P  P2  1  0.284074  0.882806  0.496090  1
  P  P3  1  0.589341  0.836511  0.528460  1
  P  P4  1  0.867574  0.572634  0.525524  1
  P  P5  1  0.257366  0.708564  0.481505  1
  P  P6  1  0.530425  0.666409  0.517782  1
  P  P7  1  1.014081  0.836307  0.516719  1
  P  P8  1  0.329408  0.752395  0.543735  1
  P  P9  1  0.699404  0.934542  0.494218  1
  P  P10  1  0.984858  0.660749  0.495656  1
  P  P11  1  0.410258  0.580941  0.560012  1
  P  P12  1  0.597012  0.524149  0.554719  1
  P  P13  1  0.235254  0.012276  0.447957  1
  P  P14  1  0.543042  -0.021929  0.482719  1
  P  P15  1  0.857235  0.890388  0.504513  1
  P  P16  1  0.143917  0.610431  0.502625  1
  P  P17  1  0.482418  0.487270  0.507065  1
  P  P18  1  0.764437  0.472263  0.559060  1
  P  P19  1  1.013947  0.332970  0.509222  1
  P  P20  1  0.310772  0.544737  0.507628  1
  P  P21  1  0.683139  0.446741  0.499461  1
  P  P22  1  0.971871  -0.023338  0.472202  1
  P  P23  1  0.310860  0.055000  0.509320  1
  P  P24  1  0.612818  0.016896  0.547516  1
  P  P25  1  0.175928  0.277935  0.515751  1
  P  P26  1  0.480433  0.231070  0.552844  1
  P  P27  1  0.848557  0.390304  0.502229  1
  P  P28  1  0.151148  0.100960  0.499841  1
  P  P29  1  0.455835  0.049528  0.537330  1
  P  P30  1  0.833084  0.210415  0.482298  1
  P  P31  1  0.119991  0.434457  0.478674  1
  P  P32  1  0.447541  0.316104  0.486274  1
  P  P33  1  0.744074  0.291243  0.535036  1
  P  P34  1  1.039829  0.012292  0.535969  1
  P  P35  1  0.437440  0.137952  0.476450  1
  P  P36  1  0.727964  0.109289  0.513024  1
  P  P37  1  1.036361  0.512257  0.534693  1
  P  P38  1  0.374188  0.393263  0.542142  1
  P  P39  1  0.700175  0.623184  0.520922  1
  P  P40  1  0.128389  0.924454  0.482268  1
  P  P41  1  0.439455  0.869895  0.513255  1
  P  P42  1  0.744370  0.792535  0.538911  1
  P  P43  1  0.882902  0.062941  0.524496  1
  P  P44  1  0.195986  -0.031556  0.548704  1
  P  P45  1  0.503261  0.920666  0.585209  1
  P  P46  1  0.959980  0.486965  0.473713  1
  P  P47  1  0.283124  0.373813  0.483194  1
  P  P48  1  0.580339  0.342996  0.528514  1
  P  P49  1  0.844260  0.498376  0.621514  1
  P  P50  1  0.226993  0.634351  0.562853  1
  P  P51  1  0.516055  0.607122  0.611580  1
  P  P52  1  0.819710  0.321716  0.599703  1
  P  P53  1  0.201271  0.454392  0.539122  1
  P  P54  1  0.494106  0.424668  0.584310  1
  P  P55  1  0.949453  0.596642  0.588573  1
  P  P56  1  0.296804  0.480576  0.594894  1
  P  P57  1  0.623836  0.703112  0.577252  1
  P  P58  1  0.926731  0.417766  0.563833  1
  P  P59  1  0.254254  0.308929  0.580286  1
  P  P60  1  0.552577  0.272273  0.621576  1
  P  P61  1  0.169421  0.792848  0.532348  1
  P  P62  1  0.464427  0.755270  0.572755  1
  P  P63  1  0.786923  0.650308  0.583009  1
  P  P64  1  0.091972  0.359526  0.571969  1
  P  P65  1  0.395252  0.312415  0.609671  1
  P  P66  1  0.709624  0.226272  0.634661  1
  P  P67  1  0.952782  0.096576  0.591172  1
  P  P68  1  0.336844  0.225294  0.524367  1
  P  P69  1  0.639025  0.191005  0.567665  1
  P  P70  1  0.926349  0.922349  0.571179  1
  P  P71  1  0.240396  0.835799  0.597510  1
  P  P72  1  0.543195  0.785196  0.634810  1
  P  P73  1  0.109110  0.051621  0.603135  1
  P  P74  1  0.414251  0.006845  0.639761  1
  P  P75  1  0.795955  0.145311  0.579036  1
  P  P76  1  1.082062  0.876214  0.585086  1
  P  P77  1  0.379318  0.837082  0.626576  1
  P  P78  1  0.769549  -0.030957  0.559576  1
  P  P79  1  1.064326  0.187413  0.554053  1
  P  P80  1  0.369211  0.134122  0.588122  1
  P  P81  1  0.682973  0.051226  0.614946  1
  P  P82  1  0.974985  0.777182  0.614621  1
  P  P83  1  0.349991  0.939801  0.566115  1
  P  P84  1  0.657955  0.876042  0.595023  1
  P  P85  1  0.977759  0.271988  0.609442  1
  P  P86  1  0.285037  0.210180  0.642193  1
  P  P87  1  0.659448  0.371884  0.590854  1
  P  P88  1  1.060203  0.691757  0.559406  1
  P  P89  1  0.330514  0.666297  0.612933  1
  P  P90  1  0.681114  0.552713  0.615730  1
  P  P91  1  0.814941  0.827461  0.605511  1
  P  P92  1  0.140839  0.720457  0.620366  1
  P  P93  1  0.430554  0.691465  0.666522  1
  P  P94  1  0.906201  0.239607  0.544121  1
  P  P95  1  0.221287  0.141061  0.564861  1
  P  P96  1  0.526201  0.097663  0.603056  1
  P  P97  1  0.779810  0.261776  0.701702  1
  P  P98  1  0.170040  0.393737  0.634702  1
  P  P99  1  0.467296  0.354605  0.676191  1
  P  P100  1  0.753403  0.085507  0.682242  1
  P  P101  1  0.135108  0.223974  0.621517  1
  P  P102  1  0.440248  0.179197  0.658142  1
  P  P103  1  0.891404  0.354777  0.666254  1
  P  P104  1  0.199367  0.291018  0.695163  1
  P  P105  1  0.574373  0.453636  0.646657  1
  P  P106  1  0.866386  0.179592  0.646332  1
  P  P107  1  0.180147  0.096696  0.673156  1
  P  P108  1  0.485032  0.043406  0.707225  1
  P  P109  1  0.118804  0.539354  0.594756  1
  P  P110  1  0.408520  0.510361  0.640912  1
  P  P111  1  0.734417  0.403358  0.655766  1
  P  P112  1  1.023157  0.133156  0.658222  1
  P  P113  1  0.328072  0.089758  0.696417  1
  P  P114  1  0.643157  -0.008789  0.717157  1
  P  P115  1  0.889910  0.858935  0.670424  1
  P  P116  1  0.264322  0.020639  0.619085  1
  P  P117  1  0.571599  -0.041169  0.651836  1
  P  P118  1  0.868244  0.678106  0.645548  1
  P  P119  1  0.218844  0.564522  0.648345  1
  P  P120  1  0.489155  0.539062  0.701872  1
  P  P121  1  1.055253  0.806151  0.676968  1
  P  P122  1  0.348087  0.776426  0.722156  1
  P  P123  1  0.729648  0.909103  0.661575  1
  P  P124  1  1.033303  0.623697  0.649698  1
  P  P125  1  0.322366  0.596468  0.698425  1
  P  P126  1  0.705099  0.732442  0.639763  1
  P  P127  1  0.996781  -0.041455  0.639702  1
  P  P128  1  0.295104  0.921890  0.680992  1
  P  P129  1  0.622627  0.813052  0.697445  1
  P  P130  1  0.925522  0.527706  0.684026  1
  P  P131  1  0.252554  0.750242  0.666384  1
  P  P132  1  0.599906  0.634176  0.672704  1
  P  P133  1  0.910333  0.039814  0.693613  1
  P  P134  1  0.212514  0.005525  0.736911  1
  P  P135  1  0.596576  0.134243  0.670106  1
  P  P136  1  1.006163  0.445622  0.626468  1
  P  P137  1  0.308962  0.395020  0.663768  1
  P  P138  1  0.623009  0.308469  0.690099  1
  P  P139  1  0.762436  0.580511  0.678269  1
  P  P140  1  1.084931  0.475548  0.688523  1
  P  P141  1  0.379937  0.437970  0.728930  1
  P  P142  1  0.839734  0.004547  0.626617  1
  P  P143  1  0.154107  0.918404  0.651606  1
  P  P144  1  0.457386  0.871293  0.689308  1
  P  P145  1  0.716274  0.020403  0.778980  1
  P  P146  1  0.093523  0.181291  0.723948  1
  P  P147  1  0.398210  0.129859  0.761436  1
  P  P148  1  0.700801  0.840515  0.759049  1
  P  P149  1  1.068925  -0.000252  0.708434  1
  P  P150  1  0.373431  0.952884  0.745527  1
  P  P151  1  0.821394  0.121529  0.748254  1
  P  P152  1  0.111918  0.092867  0.784828  1
  P  P153  1  0.509529  0.218526  0.725309  1
  P  P154  1  0.805284  0.939576  0.726242  1
  P  P155  1  0.101817  0.914715  0.775004  1
  P  P156  1  0.429367  0.796362  0.782604  1
  P  P157  1  1.046097  0.310153  0.676069  1
  P  P158  1  0.353372  0.262375  0.712574  1
  P  P159  1  0.666456  0.167878  0.736782  1
  P  P160  1  0.969019  0.887823  0.732764  1
  P  P161  1  0.266234  0.857006  0.778084  1
  P  P162  1  0.589378  0.743854  0.787565  1
  P  P163  1  0.849184  0.607635  0.740356  1
  P  P164  1  0.175171  0.837555  0.719136  1
  P  P165  1  0.512997  0.718561  0.726585  1
  P  P166  1  0.804988  0.438284  0.722367  1
  P  P167  1  0.109903  0.360924  0.748023  1
  P  P168  1  0.420969  0.306365  0.779010  1
  P  P169  1  1.018934  0.564410  0.743496  1
  P  P170  1  0.291993  0.522254  0.779772  1
  P  P171  1  0.681784  0.658184  0.735754  1
  P  P172  1  0.960017  0.394307  0.732818  1
  P  P173  1  0.265284  0.348013  0.765188  1
  P  P174  1  0.649481  0.484064  0.711533  1
  P  P175  1  0.952346  0.706670  0.706559  1
  P  P176  1  0.139101  0.649878  0.701266  1
  P  P177  1  0.564501  0.570070  0.765622  1
  P  P178  1  0.849954  0.296276  0.767060  1
  P  P179  1  0.219951  0.478424  0.717543  1
  P  P180  1  0.535277  0.394511  0.744559  1
  P  P181  1  0.866219  0.784077  0.761817  1
  P  P182  1  0.238587  0.686082  0.753650  1
  P  P183  1  0.535411  0.897849  0.752056  1
  P  P184  1  0.936540  0.213923  0.713762  1
  P  P185  1  0.238499  0.175819  0.751958  1
  P  P186  1  0.577487  0.254156  0.789075  1
  P  P187  1  0.692124  0.340431  0.756765  1
  P  P188  1  1.006316  0.252748  0.778559  1
  P  P189  1  0.314105  0.218543  0.813321  1
  P  P190  1  0.784921  0.758555  0.702218  1
  P  P191  1  1.066941  0.743549  0.754213  1
  P  P192  1  0.405441  0.620388  0.758653  1
