# generated using pymatgen
data_Lu3Mg3Hg2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.80061695
_cell_length_b   7.80061859
_cell_length_c   3.77370731
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999006
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu3Mg3Hg2Ir
_chemical_formula_sum   'Lu3 Mg3 Hg2 Ir1'
_cell_volume   198.86432682
_cell_formula_units_Z   1
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
  Lu  Lu0  1  0.61086496  0.04003482  0.00000000  1.0
  Lu  Lu1  1  0.95996518  0.57083014  0.00000000  1.0
  Lu  Lu2  1  0.42916986  0.38913504  0.00000000  1.0
  Mg  Mg3  1  0.26275593  0.99574384  0.50000000  1.0
  Mg  Mg4  1  0.00425616  0.26701110  0.50000000  1.0
  Mg  Mg5  1  0.73298890  0.73724407  0.50000000  1.0
  Hg  Hg6  1  0.33333300  0.66666700  0.50000000  1.0
  Hg  Hg7  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir8  1  0.66666700  0.33333300  0.50000000  1.0