# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.50372750
_cell_length_b   10.82496465
_cell_length_c   45.32213148
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   75.29164064
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg52
_cell_volume   2611.70317941
_cell_formula_units_Z   52
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  0.026029  0.820863  0.285036  1
  Mg  Mg2  1  0.001894  0.548519  0.309551  1
  Mg  Mg3  1  0.792225  0.299415  0.301683  1
  Mg  Mg4  1  0.573896  0.058257  0.293293  1
  Mg  Mg5  1  0.542499  0.791381  0.317521  1
  Mg  Mg6  1  0.512604  0.524750  0.342699  1
  Mg  Mg7  1  0.299828  0.280158  0.334784  1
  Mg  Mg8  1  0.085932  0.035822  0.326576  1
  Mg  Mg9  1  0.052733  0.768991  0.351829  1
  Mg  Mg10  1  0.022141  0.501583  0.377134  1
  Mg  Mg11  1  0.810059  0.257549  0.368872  1
  Mg  Mg12  1  0.598387  0.012460  0.360150  1
  Mg  Mg13  1  0.564968  0.745717  0.385737  1
  Mg  Mg14  1  0.532964  0.478777  0.411619  1
  Mg  Mg15  1  0.321617  0.234229  0.403135  1
  Mg  Mg16  1  0.109697  0.990112  0.394630  1
  Mg  Mg17  1  0.076657  0.722617  0.420642  1
  Mg  Mg18  1  0.044486  0.455388  0.446499  1
  Mg  Mg19  1  0.832703  0.211209  0.437982  1
  Mg  Mg20  1  0.620984  0.966831  0.429277  1
  Mg  Mg21  1  0.588137  0.699596  0.455260  1
  Mg  Mg22  1  0.555692  0.432544  0.481251  1
  Mg  Mg23  1  0.344193  0.188181  0.472646  1
  Mg  Mg24  1  0.132388  0.943919  0.464040  1
  Mg  Mg25  1  0.099570  0.676679  0.490074  1
  Mg  Mg26  1  0.067106  0.409606  0.515992  1
  Mg  Mg27  1  0.855518  0.165301  0.507423  1
  Mg  Mg28  1  0.643793  0.920918  0.498710  1
  Mg  Mg29  1  0.610908  0.653702  0.524817  1
  Mg  Mg30  1  0.578520  0.386673  0.550809  1
  Mg  Mg31  1  0.367108  0.142317  0.542115  1
  Mg  Mg32  1  0.155150  0.898076  0.533490  1
  Mg  Mg33  1  0.122222  0.630911  0.559565  1
  Mg  Mg34  1  0.090009  0.363676  0.585397  1
  Mg  Mg35  1  0.878553  0.119392  0.576890  1
  Mg  Mg36  1  0.666581  0.874968  0.568128  1
  Mg  Mg37  1  0.633378  0.607662  0.594458  1
  Mg  Mg38  1  0.601405  0.340668  0.620310  1
  Mg  Mg39  1  0.390624  0.096024  0.611570  1
  Mg  Mg40  1  0.177914  0.852105  0.603017  1
  Mg  Mg41  1  0.144348  0.584714  0.628896  1
  Mg  Mg42  1  0.114062  0.317260  0.654168  1
  Mg  Mg43  1  0.901472  0.073865  0.646072  1
  Mg  Mg44  1  0.689466  0.828991  0.637278  1
  Mg  Mg45  1  0.655917  0.561385  0.663268  1
  Mg  Mg46  1  0.625109  0.294456  0.688469  1
  Mg  Mg47  1  0.412997  0.050875  0.679852  1
  Mg  Mg48  1  0.199007  0.806341  0.671398  1
  Mg  Mg49  1  0.163504  0.538786  0.696438  1
  Mg  Mg50  1  0.137364  0.268487  0.720918  1
  Mg  Mg51  1  0.923779  0.027210  0.713074  1
  Mg  Mg52  1  0.711083  0.785911  0.704282  1
