# generated using pymatgen
data_Tm12Fe(TcHg)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.21581939
_cell_length_b   8.21581920
_cell_length_c   8.21582031
_cell_angle_alpha   108.97216215
_cell_angle_beta   108.97216025
_cell_angle_gamma   110.47402136
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm12Fe(TcHg)2
_chemical_formula_sum   'Tm12 Fe1 Tc2 Hg2'
_cell_volume   426.80626852
_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
  Tm  Tm0  1  0.18785424  0.43186907  0.24401383  1.0
  Tm  Tm1  1  0.81182189  0.56887697  0.75705609  1.0
  Tm  Tm2  1  0.18785424  0.94384141  0.75598617  1.0
  Tm  Tm3  1  0.94384141  0.18785424  0.75598617  1.0
  Tm  Tm4  1  0.81182189  0.05476380  0.24294391  1.0
  Tm  Tm5  1  0.05476380  0.81182189  0.24294391  1.0
  Tm  Tm6  1  0.43186907  0.18785424  0.24401383  1.0
  Tm  Tm7  1  0.56887697  0.81182189  0.75705609  1.0
  Tm  Tm8  1  0.30746985  0.30746985  0.61662490  1.0
  Tm  Tm9  1  0.69084595  0.69084595  0.38337510  1.0
  Tm  Tm10  1  0.69084595  0.30746985  0.00000000  1.0
  Tm  Tm11  1  0.30746985  0.69084595  1.00000000  1.0
  Fe  Fe12  1  0.63239347  0.63239347  1.00000000  1.0
  Tc  Tc13  1  0.37541342  0.37541342  0.00000000  1.0
  Tc  Tc14  1  0.99958894  0.99958894  0.00000000  1.0
  Hg  Hg15  1  0.99863553  0.49863553  0.50000000  1.0
  Hg  Hg16  1  0.49863553  0.99863553  0.50000000  1.0