# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17894176
_cell_length_b   11.74898118
_cell_length_c   51.11057100
_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   1908.94542692
_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  1.060806  0.146617  0.316292  1
  Mg  Mg2  1  1.060806  0.802429  0.275862  1
  Mg  Mg3  1  1.060806  0.537909  0.268300  1
  Mg  Mg4  1  0.560806  0.037909  0.268300  1
  Mg  Mg5  1  0.560806  0.646617  0.316292  1
  Mg  Mg6  1  0.560806  0.302429  0.275862  1
  Mg  Mg7  1  1.060806  0.025150  0.371368  1
  Mg  Mg8  1  1.060806  0.757839  0.363591  1
  Mg  Mg9  1  1.060806  0.414711  0.323250  1
  Mg  Mg10  1  0.560806  0.914711  0.323250  1
  Mg  Mg11  1  0.560806  0.525150  0.371368  1
  Mg  Mg12  1  0.560806  0.257839  0.363591  1
  Mg  Mg13  1  1.060806  0.979174  0.459350  1
  Mg  Mg14  1  1.060806  0.636346  0.419241  1
  Mg  Mg15  1  1.060806  0.368191  0.411501  1
  Mg  Mg16  1  0.560806  0.868191  0.411501  1
  Mg  Mg17  1  0.560806  0.479174  0.459350  1
  Mg  Mg18  1  0.560806  0.136346  0.419241  1
  Mg  Mg19  1  1.060806  0.858153  0.515039  1
  Mg  Mg20  1  1.060806  0.589999  0.507299  1
  Mg  Mg21  1  1.060806  0.247170  0.467190  1
  Mg  Mg22  1  0.560806  0.747170  0.467190  1
  Mg  Mg23  1  0.560806  0.358153  0.515039  1
  Mg  Mg24  1  0.560806  0.089999  0.507299  1
  Mg  Mg25  1  1.060806  0.811634  0.603290  1
  Mg  Mg26  1  1.060806  0.468505  0.562949  1
  Mg  Mg27  1  1.060806  0.201195  0.555172  1
  Mg  Mg28  1  0.560806  0.701195  0.555172  1
  Mg  Mg29  1  0.560806  0.311634  0.603290  1
  Mg  Mg30  1  0.560806  0.968505  0.562949  1
  Mg  Mg31  1  1.060806  0.688436  0.658240  1
  Mg  Mg32  1  1.060806  0.423916  0.650677  1
  Mg  Mg33  1  1.060806  0.079727  0.610248  1
  Mg  Mg34  1  0.560806  0.579727  0.610248  1
  Mg  Mg35  1  0.560806  0.188436  0.658240  1
  Mg  Mg36  1  0.560806  0.923916  0.650677  1
