# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.18453290
_cell_length_b   11.72420142
_cell_length_c   51.41398329
_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   1919.59788348
_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  1.064402  0.154889  0.317086  1
  Mg  Mg2  1  1.064402  0.812295  0.276847  1
  Mg  Mg3  1  1.064402  0.545525  0.269740  1
  Mg  Mg4  1  0.564402  0.045525  0.269740  1
  Mg  Mg5  1  0.564402  0.654889  0.317086  1
  Mg  Mg6  1  0.564402  0.312295  0.276847  1
  Mg  Mg7  1  1.064402  0.032472  0.372512  1
  Mg  Mg8  1  1.064402  0.764779  0.364750  1
  Mg  Mg9  1  1.064402  0.422477  0.324590  1
  Mg  Mg10  1  0.564402  0.922477  0.324590  1
  Mg  Mg11  1  0.564402  0.532472  0.372512  1
  Mg  Mg12  1  0.564402  0.264779  0.364750  1
  Mg  Mg13  1  1.064402  0.984176  0.460401  1
  Mg  Mg14  1  1.064402  0.642317  0.420357  1
  Mg  Mg15  1  1.064402  0.374432  0.412574  1
  Mg  Mg16  1  0.564402  0.874432  0.412574  1
  Mg  Mg17  1  0.564402  0.484176  0.460401  1
  Mg  Mg18  1  0.564402  0.142317  0.420357  1
  Mg  Mg19  1  1.064402  0.861808  0.516033  1
  Mg  Mg20  1  1.064402  0.593923  0.508250  1
  Mg  Mg21  1  1.064402  0.252064  0.468206  1
  Mg  Mg22  1  0.564402  0.752064  0.468206  1
  Mg  Mg23  1  0.564402  0.361808  0.516033  1
  Mg  Mg24  1  0.564402  0.093923  0.508250  1
  Mg  Mg25  1  1.064402  0.813763  0.604017  1
  Mg  Mg26  1  1.064402  0.471461  0.563857  1
  Mg  Mg27  1  1.064402  0.203768  0.556095  1
  Mg  Mg28  1  0.564402  0.703768  0.556095  1
  Mg  Mg29  1  0.564402  0.313763  0.604017  1
  Mg  Mg30  1  0.564402  0.971461  0.563857  1
  Mg  Mg31  1  1.064402  0.690715  0.658867  1
  Mg  Mg32  1  1.064402  0.423945  0.651760  1
  Mg  Mg33  1  1.064402  0.081351  0.611521  1
  Mg  Mg34  1  0.564402  0.581351  0.611521  1
  Mg  Mg35  1  0.564402  0.190715  0.658867  1
  Mg  Mg36  1  0.564402  0.923945  0.651760  1
