# generated using pymatgen
data_Ba(AlSi)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84614396
_cell_length_b   5.84614396
_cell_length_c   10.22208400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   136.27908954
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba(AlSi)2
_chemical_formula_sum   'Ba2 Al4 Si4'
_cell_volume   241.46177659
_cell_formula_units_Z   2
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
  Ba  Ba0  1  0.91421500  0.08578500  0.75000000  1.0
  Ba  Ba1  1  0.08578500  0.91421500  0.25000000  1.0
  Al  Al2  1  0.62113800  0.37886200  0.96548200  1.0
  Al  Al3  1  0.37886200  0.62113800  0.46548200  1.0
  Al  Al4  1  0.37886200  0.62113800  0.03451800  1.0
  Al  Al5  1  0.62113800  0.37886200  0.53451800  1.0
  Si  Si6  1  0.79858900  0.20141100  0.36759800  1.0
  Si  Si7  1  0.20141100  0.79858900  0.86759800  1.0
  Si  Si8  1  0.79858900  0.20141100  0.13240200  1.0
  Si  Si9  1  0.20141100  0.79858900  0.63240200  1.0