# generated using pymatgen
data_BaSi6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.70181207
_cell_length_b   5.70181207
_cell_length_c   12.00789500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   133.47038753
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaSi6
_chemical_formula_sum   'Ba2 Si12'
_cell_volume   283.31383272
_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  0.27953100  0.72046900  0.25000000  1.0
  Ba  Ba1  1  0.72046900  0.27953100  0.75000000  1.0
  Si  Si2  1  0.97852700  0.02147300  0.09776900  1.0
  Si  Si3  1  0.02147300  0.97852700  0.90223100  1.0
  Si  Si4  1  0.75466000  0.24534000  0.46303600  1.0
  Si  Si5  1  0.24534000  0.75466000  0.53696400  1.0
  Si  Si6  1  0.24534000  0.75466000  0.96303600  1.0
  Si  Si7  1  0.75466000  0.24534000  0.03696400  1.0
  Si  Si8  1  0.43758100  0.56241900  0.64698500  1.0
  Si  Si9  1  0.56241900  0.43758100  0.35301500  1.0
  Si  Si10  1  0.56241900  0.43758100  0.14698500  1.0
  Si  Si11  1  0.43758100  0.56241900  0.85301500  1.0
  Si  Si12  1  0.97852700  0.02147300  0.40223100  1.0
  Si  Si13  1  0.02147300  0.97852700  0.59776900  1.0