# generated using pymatgen
data_Lu12Fe(TcHg)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.14042677
_cell_length_b   8.14042794
_cell_length_c   8.14042713
_cell_angle_alpha   108.98183523
_cell_angle_beta   108.98184259
_cell_angle_gamma   110.45447846
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu12Fe(TcHg)2
_chemical_formula_sum   'Lu12 Fe1 Tc2 Hg2'
_cell_volume   415.16774100
_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  0.30737913  0.30737913  0.61597120  1.0
  Lu  Lu1  1  0.69140694  0.69140694  0.38402880  1.0
  Lu  Lu2  1  0.69140694  0.30737913  1.00000000  1.0
  Lu  Lu3  1  0.30737913  0.69140694  0.00000000  1.0
  Lu  Lu4  1  0.18769409  0.43207165  0.24437756  1.0
  Lu  Lu5  1  0.81177532  0.56907997  0.75730465  1.0
  Lu  Lu6  1  0.18769409  0.94331553  0.75562244  1.0
  Lu  Lu7  1  0.94331553  0.18769409  0.75562244  1.0
  Lu  Lu8  1  0.81177532  0.05447168  0.24269535  1.0
  Lu  Lu9  1  0.05447168  0.81177532  0.24269535  1.0
  Lu  Lu10  1  0.43207165  0.18769409  0.24437756  1.0
  Lu  Lu11  1  0.56907997  0.81177532  0.75730465  1.0
  Fe  Fe12  1  0.63213112  0.63213112  0.00000000  1.0
  Tc  Tc13  1  0.37506630  0.37506630  1.00000000  1.0
  Tc  Tc14  1  0.99978108  0.99978108  1.00000000  1.0
  Hg  Hg15  1  0.99878535  0.49878535  0.50000000  1.0
  Hg  Hg16  1  0.49878535  0.99878535  0.50000000  1.0