# generated using pymatgen
data_BaIn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29399022
_cell_length_b   6.65334712
_cell_length_c   6.65334625
_cell_angle_alpha   80.89071502
_cell_angle_beta   66.55652786
_cell_angle_gamma   66.55652659
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaIn2
_chemical_formula_sum   'Ba2 In4'
_cell_volume   197.25640713
_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  0.54827958  0.70172042  0.20172042  1.0
  Ba  Ba1  1  0.45172042  0.29827958  0.79827958  1.0
  In  In2  1  0.83948566  0.72896665  0.59206404  1.0
  In  In3  1  0.16051434  0.27103335  0.40793596  1.0
  In  In4  1  0.83948566  0.09206404  0.22896665  1.0
  In  In5  1  0.16051434  0.90793596  0.77103335  1.0