# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17576281
_cell_length_b   7.98467653
_cell_length_c   53.45140175
_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   Mg28
_cell_volume   1355.39064838
_cell_formula_units_Z   28
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  1.060719  0.634376  0.244022  1
  Mg  Mg2  1  1.060719  0.267532  0.222517  1
  Mg  Mg3  1  0.560719  0.346440  0.271564  1
  Mg  Mg4  1  0.560719  0.978025  0.249451  1
  Mg  Mg5  1  1.060719  0.425974  0.321458  1
  Mg  Mg6  1  1.060719  0.056973  0.299032  1
  Mg  Mg7  1  0.560719  0.136603  0.349251  1
  Mg  Mg8  1  0.560719  0.714783  0.293453  1
  Mg  Mg9  1  1.060719  0.215760  0.399517  1
  Mg  Mg10  1  1.060719  0.794402  0.343617  1
  Mg  Mg11  1  0.560719  0.873549  0.393876  1
  Mg  Mg12  1  0.560719  0.505211  0.371627  1
  Mg  Mg13  1  1.060719  0.952573  0.444140  1
  Mg  Mg14  1  1.060719  0.584199  0.421847  1
  Mg  Mg15  1  0.560719  0.663159  0.472076  1
  Mg  Mg16  1  0.560719  0.294784  0.449784  1
  Mg  Mg17  1  1.060719  0.742146  0.522297  1
  Mg  Mg18  1  1.060719  0.373809  0.500048  1
  Mg  Mg19  1  0.560719  0.452956  0.550306  1
  Mg  Mg20  1  0.560719  0.031598  0.494407  1
  Mg  Mg21  1  1.060719  0.532575  0.600471  1
  Mg  Mg22  1  1.060719  0.110755  0.544673  1
  Mg  Mg23  1  0.560719  0.190384  0.594891  1
  Mg  Mg24  1  0.560719  0.821383  0.572466  1
  Mg  Mg25  1  1.060719  0.269332  0.644473  1
  Mg  Mg26  1  1.060719  0.900918  0.622360  1
  Mg  Mg27  1  0.560719  0.979825  0.671406  1
  Mg  Mg28  1  0.560719  0.612982  0.649902  1
