# generated using pymatgen
data_Lu4HgC2I
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.61800636
_cell_length_b   3.61800710
_cell_length_c   14.56212612
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999325
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu4HgC2I
_chemical_formula_sum   'Lu4 Hg1 C2 I1'
_cell_volume   165.07989732
_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  0.66666700  0.33333300  0.08251744  1.0
  Lu  Lu1  1  0.66666700  0.33333300  0.41748256  1.0
  Lu  Lu2  1  0.33333300  0.66666600  0.59109522  1.0
  Lu  Lu3  1  0.33333300  0.66666600  0.90890378  1.0
  Hg  Hg4  1  0.66666700  0.33333300  0.75000000  1.0
  C  C5  1  0.00000000  0.00000000  0.00957351  1.0
  C  C6  1  0.00000000  0.00000000  0.49042649  1.0
  I  I7  1  0.33333300  0.66666600  0.25000000  1.0