# generated using pymatgen
data_BaInSnHg2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.94241660
_cell_length_b   4.94241660
_cell_length_c   12.09395473
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaInSnHg2
_chemical_formula_sum   'Ba2 In2 Sn2 Hg4'
_cell_volume   295.42485997
_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  0.00000000  0.50000000  0.76312335  1.0
  Ba  Ba1  1  0.50000000  0.00000000  0.23687665  1.0
  In  In2  1  0.50000000  0.50000000  0.50000000  1.0
  In  In3  1  0.00000000  0.00000000  0.50000000  1.0
  Sn  Sn4  1  0.50000000  0.00000000  0.86846521  1.0
  Sn  Sn5  1  0.00000000  0.50000000  0.13153479  1.0
  Hg  Hg6  1  0.00000000  0.50000000  0.36643316  1.0
  Hg  Hg7  1  0.50000000  0.00000000  0.63356684  1.0
  Hg  Hg8  1  0.50000000  0.50000000  0.00000000  1.0
  Hg  Hg9  1  0.00000000  0.00000000  0.00000000  1.0