# generated using pymatgen
data_BaSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.19828157
_cell_length_b   5.02903951
_cell_length_c   6.57141651
_cell_angle_alpha   112.49801427
_cell_angle_beta   89.14894188
_cell_angle_gamma   89.97380764
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaSi
_chemical_formula_sum   'Ba2 Si2'
_cell_volume   128.16802072
_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  0.74076200  0.63720400  0.27443600  1.0
  Ba  Ba1  1  0.25923500  0.36279100  0.72555200  1.0
  Si  Si2  1  0.75267500  0.94337500  0.88697500  1.0
  Si  Si3  1  0.24732800  0.05663000  0.11303800  1.0