# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17360067
_cell_length_b   8.40326674
_cell_length_c   47.10551255
_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   Mg42
_cell_volume   2047.91905888
_cell_formula_units_Z   42
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  0.251306  0.214863  0.319110  1
  Mg  Mg2  1  0.251306  0.937907  0.275149  1
  Mg  Mg3  1  0.251306  0.565350  0.294839  1
  Mg  Mg4  1  0.751306  0.158284  0.281654  1
  Mg  Mg5  1  0.751306  0.791535  0.303143  1
  Mg  Mg6  1  0.751306  0.437436  0.326233  1
  Mg  Mg7  1  0.251306  0.144421  0.384573  1
  Mg  Mg8  1  0.251306  0.857015  0.339850  1
  Mg  Mg9  1  0.251306  0.503185  0.362180  1
  Mg  Mg10  1  0.751306  0.076049  0.347463  1
  Mg  Mg11  1  0.751306  0.720273  0.369735  1
  Mg  Mg12  1  0.751306  0.361184  0.392125  1
  Mg  Mg13  1  0.251306  0.074054  0.451397  1
  Mg  Mg14  1  0.251306  0.788299  0.406724  1
  Mg  Mg15  1  0.251306  0.431089  0.428971  1
  Mg  Mg16  1  0.751306  0.004184  0.414309  1
  Mg  Mg17  1  0.751306  0.646720  0.436541  1
  Mg  Mg18  1  0.751306  0.289469  0.458926  1
  Mg  Mg19  1  0.251306  1.002627  0.518220  1
  Mg  Mg20  1  0.251306  0.716861  0.473593  1
  Mg  Mg21  1  0.251306  0.359791  0.495925  1
  Mg  Mg22  1  0.751306  0.932199  0.481156  1
  Mg  Mg23  1  0.751306  0.575035  0.503451  1
  Mg  Mg24  1  0.751306  0.217964  0.525784  1
  Mg  Mg25  1  0.251306  0.930642  0.585068  1
  Mg  Mg26  1  0.251306  0.645357  0.540451  1
  Mg  Mg27  1  0.251306  0.288106  0.562836  1
  Mg  Mg28  1  0.751306  0.860772  0.547980  1
  Mg  Mg29  1  0.751306  0.503737  0.570406  1
  Mg  Mg30  1  0.751306  0.146527  0.592652  1
  Mg  Mg31  1  0.251306  0.858777  0.651913  1
  Mg  Mg32  1  0.251306  0.573641  0.607252  1
  Mg  Mg33  1  0.251306  0.214552  0.629642  1
  Mg  Mg34  1  0.751306  0.790404  0.614804  1
  Mg  Mg35  1  0.751306  0.431640  0.637197  1
  Mg  Mg36  1  0.751306  0.077810  0.659526  1
  Mg  Mg37  1  0.251306  0.776541  0.717723  1
  Mg  Mg38  1  0.251306  0.497390  0.673144  1
  Mg  Mg39  1  0.251306  0.143291  0.696233  1
  Mg  Mg40  1  0.751306  0.719963  0.680267  1
  Mg  Mg41  1  0.751306  0.369475  0.704537  1
  Mg  Mg42  1  0.751306  0.996918  0.724227  1
