# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17576984
_cell_length_b   22.38893696
_cell_length_c   46.21582183
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   85.92090758
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg64
_cell_volume   3277.71830004
_cell_formula_units_Z   64
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
  Mg  Mg1  1  0.848208  0.246031  0.308673  1
  Mg  Mg2  1  0.587721  0.766895  0.282176  1
  Mg  Mg3  1  0.655547  0.631105  0.297032  1
  Mg  Mg4  1  0.916392  0.109371  0.324577  1
  Mg  Mg5  1  0.217743  0.506821  0.295190  1
  Mg  Mg6  1  0.478685  0.984811  0.322728  1
  Mg  Mg7  1  0.780083  0.382326  0.293187  1
  Mg  Mg8  1  0.040700  0.860867  0.320775  1
  Mg  Mg9  1  0.370663  0.200982  0.364690  1
  Mg  Mg10  1  0.109555  0.723175  0.337211  1
  Mg  Mg11  1  0.178575  0.585090  0.352151  1
  Mg  Mg12  1  0.439748  0.062697  0.379863  1
  Mg  Mg13  1  0.740460  0.461407  0.350149  1
  Mg  Mg14  1  1.001466  0.939298  0.377877  1
  Mg  Mg15  1  0.302007  0.338425  0.348932  1
  Mg  Mg16  1  0.563154  0.815978  0.375927  1
  Mg  Mg17  1  0.893786  0.154719  0.419841  1
  Mg  Mg18  1  0.632445  0.677404  0.392067  1
  Mg  Mg19  1  0.701441  0.539371  0.407795  1
  Mg  Mg20  1  0.962737  0.016740  0.435547  1
  Mg  Mg21  1  0.263002  0.416314  0.405980  1
  Mg  Mg22  1  0.524382  0.893495  0.433516  1
  Mg  Mg23  1  0.824691  0.292995  0.404133  1
  Mg  Mg24  1  0.086116  0.770085  0.431475  1
  Mg  Mg25  1  0.416670  0.108945  0.475458  1
  Mg  Mg26  1  0.155306  0.631684  0.447648  1
  Mg  Mg27  1  0.224249  0.493758  0.463688  1
  Mg  Mg28  1  0.485636  0.970948  0.491337  1
  Mg  Mg29  1  0.785903  0.370503  0.461707  1
  Mg  Mg30  1  0.047326  0.847618  0.489220  1
  Mg  Mg31  1  0.347633  0.247093  0.459606  1
  Mg  Mg32  1  0.609038  0.724252  0.487158  1
  Mg  Mg33  1  0.939476  0.063330  0.531158  1
  Mg  Mg34  1  0.678129  0.586043  0.503394  1
  Mg  Mg35  1  0.747120  0.448020  0.519423  1
  Mg  Mg36  1  0.008529  0.925159  0.546993  1
  Mg  Mg37  1  0.308837  0.324633  0.517373  1
  Mg  Mg38  1  0.570275  0.801725  0.544896  1
  Mg  Mg39  1  0.870536  0.201279  0.515250  1
  Mg  Mg40  1  0.131941  0.678453  0.542915  1
  Mg  Mg41  1  0.462357  0.017560  0.586762  1
  Mg  Mg42  1  0.200987  0.540338  0.559195  1
  Mg  Mg43  1  0.269992  0.402281  0.575012  1
  Mg  Mg44  1  0.531480  0.879245  0.602464  1
  Mg  Mg45  1  0.831813  0.278684  0.573011  1
  Mg  Mg46  1  0.093206  0.755863  0.600626  1
  Mg  Mg47  1  0.393376  0.155598  0.571099  1
  Mg  Mg48  1  0.654785  0.632776  0.598776  1
  Mg  Mg49  1  0.985464  0.971330  0.641898  1
  Mg  Mg50  1  0.723951  0.494436  0.614931  1
  Mg  Mg51  1  0.793019  0.356233  0.630102  1
  Mg  Mg52  1  0.054180  0.833795  0.657651  1
  Mg  Mg53  1  0.354514  0.233286  0.628826  1
  Mg  Mg54  1  0.615778  0.710722  0.656450  1
  Mg  Mg55  1  0.916325  0.109710  0.626722  1
  Mg  Mg56  1  0.177593  0.587183  0.654208  1
  Mg  Mg57  1  0.507941  0.926250  0.697899  1
  Mg  Mg58  1  0.247009  0.448376  0.670306  1
  Mg  Mg59  1  0.315029  0.312105  0.685880  1
  Mg  Mg60  1  0.576088  0.789936  0.713390  1
  Mg  Mg61  1  0.877437  0.187442  0.683757  1
  Mg  Mg62  1  0.138401  0.665508  0.711366  1
  Mg  Mg63  1  0.439709  0.062965  0.682003  1
  Mg  Mg64  1  0.700029  0.542381  0.708970  1
