# generated using pymatgen
data_Mg16Al12I
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.01832600
_cell_length_b   9.08109130
_cell_length_c   9.13385578
_cell_angle_alpha   108.56093383
_cell_angle_beta   107.78307662
_cell_angle_gamma   107.79002745
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg16Al12I
_chemical_formula_sum   'Mg16 Al12 I1'
_cell_volume   604.30573091
_cell_formula_units_Z   1
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  Mg0  1  0.32428600  0.31879100  0.32394800  1.0
  Mg  Mg1  1  0.00128400  0.99950500  0.00142900  1.0
  Mg  Mg2  1  0.00170400  0.65594200  0.00180000  1.0
  Mg  Mg3  1  0.31275600  0.70808200  0.31263000  1.0
  Mg  Mg4  1  0.67142600  0.98644100  0.38615100  1.0
  Mg  Mg5  1  0.59890100  0.59934400  0.29313000  1.0
  Mg  Mg6  1  0.00794100  0.40738100  0.69106000  1.0
  Mg  Mg7  1  0.00620700  0.01243200  0.65245000  1.0
  Mg  Mg8  1  0.71917400  0.32298300  0.32018700  1.0
  Mg  Mg9  1  0.40418500  0.68066300  0.99784100  1.0
  Mg  Mg10  1  0.99729900  0.68136100  0.40428400  1.0
  Mg  Mg11  1  0.32043200  0.32329200  0.71897700  1.0
  Mg  Mg12  1  0.65324000  0.01327200  0.00651300  1.0
  Mg  Mg13  1  0.69140100  0.40837000  0.00860400  1.0
  Mg  Mg14  1  0.29384400  0.59913300  0.59890500  1.0
  Mg  Mg15  1  0.38520100  0.98620200  0.67056000  1.0
  Al  Al16  1  0.84200700  0.18747000  0.84287700  1.0
  Al  Al17  1  0.63711700  0.84109800  0.63674500  1.0
  Al  Al18  1  0.34664300  0.97690300  0.15817400  1.0
  Al  Al19  1  0.19455700  0.37029200  0.00684000  1.0
  Al  Al20  1  0.83395100  0.66114100  0.64243600  1.0
  Al  Al21  1  0.17988100  0.81289100  0.81021900  1.0
  Al  Al22  1  0.37669700  0.18410400  0.99725900  1.0
  Al  Al23  1  0.99612100  0.18316500  0.37660300  1.0
  Al  Al24  1  0.81003500  0.81202700  0.17980900  1.0
  Al  Al25  1  0.64173900  0.65924400  0.83325100  1.0
  Al  Al26  1  0.00648500  0.36904900  0.19337700  1.0
  Al  Al27  1  0.15870500  0.97741100  0.34786900  1.0
  I  I28  1  0.58678500  0.26201600  0.58607600  1.0