# generated using pymatgen
data_Mg2Al3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44470100
_cell_length_b   6.44470100
_cell_length_c   10.63373425
_cell_angle_alpha   107.63973694
_cell_angle_beta   107.63973694
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2Al3
_chemical_formula_sum   'Mg8 Al12'
_cell_volume   399.05072038
_cell_formula_units_Z   4
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  0.29337200  0.51734500  0.58674400  1.0
  Mg  Mg1  1  0.29337200  0.06939900  0.58674400  1.0
  Mg  Mg2  1  0.31939900  0.04337200  0.08674400  1.0
  Mg  Mg3  1  0.95662800  0.68060100  0.91325600  1.0
  Mg  Mg4  1  0.95662800  0.23265500  0.91325600  1.0
  Mg  Mg5  1  0.76734500  0.04337200  0.08674400  1.0
  Mg  Mg6  1  0.93060100  0.70662800  0.41325600  1.0
  Mg  Mg7  1  0.48265500  0.70662800  0.41325600  1.0
  Al  Al8  1  0.80318700  0.09071200  0.60637400  1.0
  Al  Al9  1  0.80318700  0.51566300  0.60637400  1.0
  Al  Al10  1  0.76566300  0.55318700  0.10637400  1.0
  Al  Al11  1  0.44681300  0.23433700  0.89362600  1.0
  Al  Al12  1  0.44681300  0.65928800  0.89362600  1.0
  Al  Al13  1  0.34071200  0.55318700  0.10637400  1.0
  Al  Al14  1  0.48433700  0.19681300  0.39362600  1.0
  Al  Al15  1  0.90928800  0.19681300  0.39362600  1.0
  Al  Al16  1  0.12500000  0.37500000  0.25000000  1.0
  Al  Al17  1  0.12500000  0.87500000  0.25000000  1.0
  Al  Al18  1  0.12500000  0.87500000  0.75000000  1.0
  Al  Al19  1  0.62500000  0.87500000  0.75000000  1.0