# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17330804
_cell_length_b   31.57907755
_cell_length_c   48.69951411
_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   Mg96
_cell_volume   4880.18515486
_cell_formula_units_Z   96
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  0.001280  0.586406  0.298698  1
  Mg  Mg2  1  0.501280  0.924313  0.280131  1
  Mg  Mg3  1  0.501280  0.247485  0.315774  1
  Mg  Mg4  1  0.501280  0.833906  0.307177  1
  Mg  Mg5  1  0.001280  0.170950  0.289338  1
  Mg  Mg6  1  0.001280  0.495975  0.325719  1
  Mg  Mg7  1  0.001280  0.747982  0.316607  1
  Mg  Mg8  1  0.501280  0.085872  0.298092  1
  Mg  Mg9  1  0.501280  0.409137  0.334147  1
  Mg  Mg10  1  0.501280  0.661938  0.325601  1
  Mg  Mg11  1  0.001280  0.999891  0.307023  1
  Mg  Mg12  1  0.501280  0.337842  0.289258  1
  Mg  Mg13  1  0.501280  0.571145  0.353215  1
  Mg  Mg14  1  0.001280  0.909193  0.334665  1
  Mg  Mg15  1  0.001280  0.232453  0.371026  1
  Mg  Mg16  1  0.001280  0.818386  0.362082  1
  Mg  Mg17  1  0.501280  0.156582  0.343754  1
  Mg  Mg18  1  0.501280  0.479909  0.380403  1
  Mg  Mg19  1  0.501280  0.732582  0.371432  1
  Mg  Mg20  1  0.001280  0.070799  0.352852  1
  Mg  Mg21  1  0.001280  0.394129  0.389494  1
  Mg  Mg22  1  0.001280  0.646760  0.380650  1
  Mg  Mg23  1  0.501280  0.984973  0.362069  1
  Mg  Mg24  1  0.001280  0.323198  0.343865  1
  Mg  Mg25  1  0.001280  0.555550  0.408534  1
  Mg  Mg26  1  0.501280  0.893983  0.390078  1
  Mg  Mg27  1  0.501280  0.217269  0.426855  1
  Mg  Mg28  1  0.501280  0.803095  0.417746  1
  Mg  Mg29  1  0.001280  0.141474  0.399205  1
  Mg  Mg30  1  0.001280  0.464667  0.436117  1
  Mg  Mg31  1  0.001280  0.717202  0.427080  1
  Mg  Mg32  1  0.501280  0.055591  0.408476  1
  Mg  Mg33  1  0.501280  0.378848  0.445365  1
  Mg  Mg34  1  0.501280  0.631283  0.436341  1
  Mg  Mg35  1  0.001280  0.969721  0.417806  1
  Mg  Mg36  1  0.501280  0.308119  0.399243  1
  Mg  Mg37  1  0.501280  0.540328  0.464251  1
  Mg  Mg38  1  0.001280  0.878761  0.445788  1
  Mg  Mg39  1  0.001280  0.202056  0.482673  1
  Mg  Mg40  1  0.001280  0.787866  0.473499  1
  Mg  Mg41  1  0.501280  0.126293  0.454889  1
  Mg  Mg42  1  0.501280  0.449481  0.491911  1
  Mg  Mg43  1  0.501280  0.701964  0.482814  1
  Mg  Mg44  1  0.001280  0.040403  0.464222  1
  Mg  Mg45  1  0.001280  0.363638  0.501209  1
  Mg  Mg46  1  0.001280  0.616084  0.492117  1
  Mg  Mg47  1  0.501280  0.954518  0.473579  1
  Mg  Mg48  1  0.001280  0.292922  0.454970  1
  Mg  Mg49  1  0.001280  0.525150  0.520038  1
  Mg  Mg50  1  0.501280  0.863554  0.501562  1
  Mg  Mg51  1  0.501280  0.186852  0.538449  1
  Mg  Mg52  1  0.501280  0.772678  0.529252  1
  Mg  Mg53  1  0.001280  0.111103  0.510629  1
  Mg  Mg54  1  0.001280  0.434303  0.547697  1
  Mg  Mg55  1  0.001280  0.686803  0.538576  1
  Mg  Mg56  1  0.501280  0.025218  0.519977  1
  Mg  Mg57  1  0.501280  0.348438  0.557009  1
  Mg  Mg58  1  0.501280  0.600910  0.547869  1
  Mg  Mg59  1  0.001280  0.939320  0.529326  1
  Mg  Mg60  1  0.501280  0.277722  0.510762  1
  Mg  Mg61  1  0.501280  0.509951  0.575866  1
  Mg  Mg62  1  0.001280  0.848338  0.557383  1
  Mg  Mg63  1  0.001280  0.171656  0.594174  1
  Mg  Mg64  1  0.001280  0.757546  0.584997  1
  Mg  Mg65  1  0.501280  0.095904  0.566394  1
  Mg  Mg66  1  0.501280  0.419138  0.603455  1
  Mg  Mg67  1  0.501280  0.671622  0.594313  1
  Mg  Mg68  1  0.001280  0.010008  0.575716  1
  Mg  Mg69  1  0.001280  0.333197  0.612730  1
  Mg  Mg70  1  0.001280  0.585712  0.603567  1
  Mg  Mg71  1  0.501280  0.924094  0.585019  1
  Mg  Mg72  1  0.001280  0.262487  0.566592  1
  Mg  Mg73  1  0.001280  0.494743  0.631730  1
  Mg  Mg74  1  0.501280  0.833125  0.613261  1
  Mg  Mg75  1  0.501280  0.156380  0.649593  1
  Mg  Mg76  1  0.501280  0.742272  0.640541  1
  Mg  Mg77  1  0.001280  0.080616  0.622111  1
  Mg  Mg78  1  0.001280  0.403859  0.658976  1
  Mg  Mg79  1  0.001280  0.656393  0.649908  1
  Mg  Mg80  1  0.501280  0.994736  0.631320  1
  Mg  Mg81  1  0.501280  0.318165  0.668193  1
  Mg  Mg82  1  0.501280  0.570585  0.659055  1
  Mg  Mg83  1  0.001280  0.908970  0.640502  1
  Mg  Mg84  1  0.501280  0.247233  0.622473  1
  Mg  Mg85  1  0.501280  0.479614  0.687031  1
  Mg  Mg86  1  0.001280  0.818093  0.668612  1
  Mg  Mg87  1  0.001280  0.140910  0.704078  1
  Mg  Mg88  1  0.001280  0.726376  0.695243  1
  Mg  Mg89  1  0.501280  0.065554  0.677099  1
  Mg  Mg90  1  0.501280  0.388048  0.713664  1
  Mg  Mg91  1  0.501280  0.640970  0.704723  1
  Mg  Mg92  1  0.001280  0.979760  0.686099  1
  Mg  Mg93  1  0.001280  0.303361  0.722870  1
  Mg  Mg94  1  0.001280  0.556072  0.713502  1
  Mg  Mg95  1  0.501280  0.894816  0.694932  1
  Mg  Mg96  1  0.001280  0.232087  0.677853  1
