# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.18505969
_cell_length_b   11.66679899
_cell_length_c   48.72971671
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg36
_cell_volume   1810.76952879
_cell_formula_units_Z   36
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  0.125931  0.358393  0.288147  1
  Mg  Mg2  1  0.125931  0.093390  0.295946  1
  Mg  Mg3  1  0.625931  0.855113  0.289613  1
  Mg  Mg4  1  0.625931  0.527742  0.328262  1
  Mg  Mg5  1  0.625931  0.256274  0.337934  1
  Mg  Mg6  1  0.625931  0.988819  0.345996  1
  Mg  Mg7  1  0.125931  0.757024  0.339461  1
  Mg  Mg8  1  0.125931  0.416483  0.378714  1
  Mg  Mg9  1  0.125931  0.147460  0.387750  1
  Mg  Mg10  1  0.125931  0.879901  0.396466  1
  Mg  Mg11  1  0.625931  0.646276  0.388070  1
  Mg  Mg12  1  0.625931  0.306731  0.429290  1
  Mg  Mg13  1  0.625931  0.038371  0.438127  1
  Mg  Mg14  1  0.625931  0.769392  0.446432  1
  Mg  Mg15  1  0.125931  0.537277  0.438092  1
  Mg  Mg16  1  0.125931  0.197005  0.479713  1
  Mg  Mg17  1  0.125931  0.928244  0.488288  1
  Mg  Mg18  1  0.125931  0.659530  0.496655  1
  Mg  Mg19  1  0.625931  0.427558  0.488409  1
  Mg  Mg20  1  0.625931  0.087564  0.529918  1
  Mg  Mg21  1  0.625931  0.818286  0.538481  1
  Mg  Mg22  1  0.625931  0.549206  0.546883  1
  Mg  Mg23  1  0.125931  0.316915  0.538853  1
  Mg  Mg24  1  0.125931  0.979426  0.579598  1
  Mg  Mg25  1  0.125931  0.707883  0.588595  1
  Mg  Mg26  1  0.125931  0.437557  0.596937  1
  Mg  Mg27  1  0.625931  0.207114  0.589991  1
  Mg  Mg28  1  0.625931  0.872876  0.628239  1
  Mg  Mg29  1  0.625931  0.593693  0.637844  1
  Mg  Mg30  1  0.625931  0.332831  0.648339  1
  Mg  Mg31  1  0.125931  0.097667  0.640905  1
  Mg  Mg32  1  0.125931  0.758541  0.673475  1
  Mg  Mg33  1  0.125931  0.497691  0.691144  1
  Mg  Mg34  1  0.125931  0.221491  0.698121  1
  Mg  Mg35  1  0.625931  0.976763  0.691257  1
  Mg  Mg36  1  0.625931  0.710096  0.724288  1
