# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.01638585
_cell_length_b   16.81136527
_cell_length_c   45.48812435
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   70.89123162
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg156
_cell_volume   7960.22716327
_cell_formula_units_Z   156
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  0.544059  0.742684  0.303026  1
  Mg  Mg2  1  0.044059  0.742684  0.303026  1
  Mg  Mg3  1  0.626776  0.083029  0.292785  1
  Mg  Mg4  1  0.708545  0.424389  0.282810  1
  Mg  Mg5  1  0.126776  0.083029  0.292785  1
  Mg  Mg6  1  0.208545  0.424389  0.282810  1
  Mg  Mg7  1  0.795302  0.583051  0.292784  1
  Mg  Mg8  1  0.295302  0.583051  0.292784  1
  Mg  Mg9  1  0.872148  0.924362  0.282816  1
  Mg  Mg10  1  0.718353  0.242694  0.303029  1
  Mg  Mg11  1  0.372148  0.924362  0.282816  1
  Mg  Mg12  1  0.218353  0.242694  0.303029  1
  Mg  Mg13  1  0.305040  0.723657  0.337312  1
  Mg  Mg14  1  0.805040  0.723657  0.337312  1
  Mg  Mg15  1  0.386827  0.063396  0.326358  1
  Mg  Mg16  1  0.468066  0.401995  0.314386  1
  Mg  Mg17  1  0.886827  0.063396  0.326358  1
  Mg  Mg18  1  0.968066  0.401995  0.314386  1
  Mg  Mg19  1  0.554874  0.563394  0.326360  1
  Mg  Mg20  1  0.054874  0.563394  0.326360  1
  Mg  Mg21  1  0.635005  0.901997  0.314395  1
  Mg  Mg22  1  0.476409  0.223649  0.337313  1
  Mg  Mg23  1  0.135005  0.901997  0.314395  1
  Mg  Mg24  1  0.976409  0.223649  0.337313  1
  Mg  Mg25  1  0.066562  0.702955  0.372047  1
  Mg  Mg26  1  0.566562  0.702955  0.372047  1
  Mg  Mg27  1  0.147215  0.042604  0.360659  1
  Mg  Mg28  1  0.226964  0.382842  0.349676  1
  Mg  Mg29  1  0.647215  0.042604  0.360659  1
  Mg  Mg30  1  0.726964  0.382842  0.349676  1
  Mg  Mg31  1  0.315277  0.542605  0.360659  1
  Mg  Mg32  1  0.815277  0.542605  0.360659  1
  Mg  Mg33  1  0.395280  0.882841  0.349682  1
  Mg  Mg34  1  0.235581  0.202953  0.372050  1
  Mg  Mg35  1  0.895280  0.882841  0.349682  1
  Mg  Mg36  1  0.735581  0.202953  0.372050  1
  Mg  Mg37  1  0.826697  0.682961  0.406644  1
  Mg  Mg38  1  0.326697  0.682961  0.406644  1
  Mg  Mg39  1  0.907067  0.023039  0.395377  1
  Mg  Mg40  1  0.987202  0.362930  0.383783  1
  Mg  Mg41  1  0.407067  0.023039  0.395377  1
  Mg  Mg42  1  0.487202  0.362930  0.383783  1
  Mg  Mg43  1  0.074990  0.523039  0.395377  1
  Mg  Mg44  1  0.574990  0.523039  0.395377  1
  Mg  Mg45  1  0.154957  0.862928  0.383789  1
  Mg  Mg46  1  0.995438  0.182962  0.406647  1
  Mg  Mg47  1  0.654957  0.862928  0.383789  1
  Mg  Mg48  1  0.495438  0.182962  0.406647  1
  Mg  Mg49  1  0.586882  0.662949  0.441383  1
  Mg  Mg50  1  0.086882  0.662949  0.441383  1
  Mg  Mg51  1  0.667089  1.002910  0.429907  1
  Mg  Mg52  1  0.747184  0.342784  0.418496  1
  Mg  Mg53  1  0.167089  1.002910  0.429907  1
  Mg  Mg54  1  0.247184  0.342784  0.418496  1
  Mg  Mg55  1  0.835095  0.502909  0.429908  1
  Mg  Mg56  1  0.335095  0.502909  0.429908  1
  Mg  Mg57  1  0.915121  0.842784  0.418501  1
  Mg  Mg58  1  0.755263  0.162948  0.441387  1
  Mg  Mg59  1  0.415121  0.842784  0.418501  1
  Mg  Mg60  1  0.255263  0.162948  0.441387  1
  Mg  Mg61  1  0.346963  0.642945  0.476001  1
  Mg  Mg62  1  0.846963  0.642945  0.476001  1
  Mg  Mg63  1  0.427111  0.982900  0.464545  1
  Mg  Mg64  1  0.507092  0.322852  0.453014  1
  Mg  Mg65  1  0.927111  0.982900  0.464545  1
  Mg  Mg66  1  0.007092  0.322852  0.453014  1
  Mg  Mg67  1  0.595081  0.482900  0.464546  1
  Mg  Mg68  1  0.095081  0.482900  0.464546  1
  Mg  Mg69  1  0.675147  0.822851  0.453019  1
  Mg  Mg70  1  0.515185  0.142944  0.476005  1
  Mg  Mg71  1  0.175147  0.822851  0.453019  1
  Mg  Mg72  1  0.015185  0.142944  0.476005  1
  Mg  Mg73  1  0.107010  0.622949  0.510624  1
  Mg  Mg74  1  0.607010  0.622949  0.510624  1
  Mg  Mg75  1  0.187073  0.962911  0.499145  1
  Mg  Mg76  1  0.267047  0.302874  0.487663  1
  Mg  Mg77  1  0.687073  0.962911  0.499145  1
  Mg  Mg78  1  0.767047  0.302874  0.487663  1
  Mg  Mg79  1  0.355109  0.462911  0.499146  1
  Mg  Mg80  1  0.855109  0.462911  0.499146  1
  Mg  Mg81  1  0.435172  0.802873  0.487667  1
  Mg  Mg82  1  0.275135  0.122948  0.510627  1
  Mg  Mg83  1  0.935172  0.802873  0.487667  1
  Mg  Mg84  1  0.775135  0.122948  0.510627  1
  Mg  Mg85  1  0.867034  0.602971  0.545272  1
  Mg  Mg86  1  0.367034  0.602971  0.545272  1
  Mg  Mg87  1  0.947100  0.942922  0.533745  1
  Mg  Mg88  1  0.026996  0.282878  0.522286  1
  Mg  Mg89  1  0.447100  0.942922  0.533745  1
  Mg  Mg90  1  0.526996  0.282878  0.522286  1
  Mg  Mg91  1  0.115071  0.442922  0.533745  1
  Mg  Mg92  1  0.615071  0.442922  0.533745  1
  Mg  Mg93  1  0.195218  0.782877  0.522289  1
  Mg  Mg94  1  0.035090  0.102970  0.545276  1
  Mg  Mg95  1  0.695218  0.782877  0.522289  1
  Mg  Mg96  1  0.535090  0.102970  0.545276  1
  Mg  Mg97  1  0.627060  0.583039  0.579790  1
  Mg  Mg98  1  0.127060  0.583039  0.579790  1
  Mg  Mg99  1  0.707087  0.922913  0.568383  1
  Mg  Mg100  1  0.786918  0.262874  0.556904  1
  Mg  Mg101  1  0.207087  0.922913  0.568383  1
  Mg  Mg102  1  0.286918  0.262874  0.556904  1
  Mg  Mg103  1  0.875093  0.422912  0.568383  1
  Mg  Mg104  1  0.375093  0.422912  0.568383  1
  Mg  Mg105  1  0.955300  0.762873  0.556907  1
  Mg  Mg106  1  0.794998  0.083038  0.579794  1
  Mg  Mg107  1  0.455300  0.762873  0.556907  1
  Mg  Mg108  1  0.294998  0.083038  0.579794  1
  Mg  Mg109  1  0.387225  0.562894  0.614502  1
  Mg  Mg110  1  0.887225  0.562894  0.614502  1
  Mg  Mg111  1  0.467192  0.902784  0.602913  1
  Mg  Mg112  1  0.546744  0.242860  0.591644  1
  Mg  Mg113  1  0.967192  0.902784  0.602913  1
  Mg  Mg114  1  0.046744  0.242860  0.591644  1
  Mg  Mg115  1  0.635115  0.402783  0.602914  1
  Mg  Mg116  1  0.135115  0.402783  0.602914  1
  Mg  Mg117  1  0.715485  0.742861  0.591646  1
  Mg  Mg118  1  0.554980  0.062892  0.614508  1
  Mg  Mg119  1  0.215485  0.742861  0.591646  1
  Mg  Mg120  1  0.054980  0.062892  0.614508  1
  Mg  Mg121  1  0.146902  0.542981  0.648609  1
  Mg  Mg122  1  0.646902  0.542981  0.648609  1
  Mg  Mg123  1  0.226905  0.883217  0.637632  1
  Mg  Mg124  1  0.306601  0.222869  0.626241  1
  Mg  Mg125  1  0.726905  0.883217  0.637632  1
  Mg  Mg126  1  0.806601  0.222869  0.626241  1
  Mg  Mg127  1  0.394967  0.383218  0.637631  1
  Mg  Mg128  1  0.894967  0.383218  0.637631  1
  Mg  Mg129  1  0.475619  0.722867  0.626243  1
  Mg  Mg130  1  0.315218  0.042980  0.648615  1
  Mg  Mg131  1  0.975619  0.722867  0.626243  1
  Mg  Mg132  1  0.815218  0.042980  0.648615  1
  Mg  Mg133  1  0.907177  0.523826  0.683895  1
  Mg  Mg134  1  0.407177  0.523826  0.683895  1
  Mg  Mg135  1  0.987308  0.862428  0.671931  1
  Mg  Mg136  1  0.065773  0.202173  0.660978  1
  Mg  Mg137  1  0.487308  0.862428  0.671931  1
  Mg  Mg138  1  0.565773  0.202173  0.660978  1
  Mg  Mg139  1  0.155355  0.362426  0.671932  1
  Mg  Mg140  1  0.655355  0.362426  0.671932  1
  Mg  Mg141  1  0.237142  0.702165  0.660979  1
  Mg  Mg142  1  0.074116  0.023827  0.683905  1
  Mg  Mg143  1  0.737142  0.702165  0.660979  1
  Mg  Mg144  1  0.574116  0.023827  0.683905  1
  Mg  Mg145  1  0.670034  0.501460  0.715475  1
  Mg  Mg146  1  0.170034  0.501460  0.715475  1
  Mg  Mg147  1  0.746880  0.842772  0.705506  1
  Mg  Mg148  1  0.823829  0.183129  0.695261  1
  Mg  Mg149  1  0.246880  0.842772  0.705506  1
  Mg  Mg150  1  0.323829  0.183129  0.695261  1
  Mg  Mg151  1  0.915405  0.342793  0.705506  1
  Mg  Mg152  1  0.415405  0.342793  0.705506  1
  Mg  Mg153  1  0.998123  0.683138  0.695265  1
  Mg  Mg154  1  0.833637  1.001434  0.715481  1
  Mg  Mg155  1  0.498123  0.683138  0.695265  1
  Mg  Mg156  1  0.333637  1.001434  0.715481  1
