# generated using pymatgen
data_Nd3Sn2Hg3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.46484978
_cell_length_b   6.46485023
_cell_length_c   10.61872847
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   101.66592275
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3Sn2Hg3
_chemical_formula_sum   'Nd6 Sn4 Hg6'
_cell_volume   434.63465871
_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
  Nd  Nd0  1  0.63802767  0.63802767  0.25000000  1.0
  Nd  Nd1  1  0.36197233  0.36197233  0.75000000  1.0
  Nd  Nd2  1  0.20020677  0.79979323  0.50000000  1.0
  Nd  Nd3  1  0.20020677  0.79979323  0.00000000  1.0
  Nd  Nd4  1  0.79979323  0.20020677  0.50000000  1.0
  Nd  Nd5  1  0.79979323  0.20020677  0.00000000  1.0
  Sn  Sn6  1  0.31421724  0.31421724  0.04714805  1.0
  Sn  Sn7  1  0.68578276  0.68578276  0.95285195  1.0
  Sn  Sn8  1  0.31421724  0.31421724  0.45285195  1.0
  Sn  Sn9  1  0.68578276  0.68578276  0.54714805  1.0
  Hg  Hg10  1  0.01786510  0.01786510  0.25000000  1.0
  Hg  Hg11  1  0.98213490  0.98213490  0.75000000  1.0
  Hg  Hg12  1  0.50726120  0.08314540  0.25000000  1.0
  Hg  Hg13  1  0.91685460  0.49273880  0.75000000  1.0
  Hg  Hg14  1  0.49273880  0.91685460  0.75000000  1.0
  Hg  Hg15  1  0.08314540  0.50726120  0.25000000  1.0