# generated using pymatgen
data_Th3Fe2(CuSi2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.11667542
_cell_length_b   4.07828408
_cell_length_c   12.09107005
_cell_angle_alpha   99.70924394
_cell_angle_beta   99.80154577
_cell_angle_gamma   90.00000760
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th3Fe2(CuSi2)2
_chemical_formula_sum   'Th3 Fe2 Cu2 Si4'
_cell_volume   197.08217429
_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
  Th  Th0  1  0.84342802  0.34342802  0.68685804  1.0
  Th  Th1  1  0.15657198  0.65657198  0.31314196  1.0
  Th  Th2  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe3  1  0.24866260  0.24866260  0.49732320  1.0
  Fe  Fe4  1  0.75133740  0.75133740  0.50267680  1.0
  Cu  Cu5  1  0.59887713  0.09887713  0.19775526  1.0
  Cu  Cu6  1  0.40112287  0.90112287  0.80224474  1.0
  Si  Si7  1  0.44882192  0.44882192  0.89764484  1.0
  Si  Si8  1  0.55117808  0.55117808  0.10235516  1.0
  Si  Si9  1  0.70289602  0.20289602  0.40579204  1.0
  Si  Si10  1  0.29710398  0.79710398  0.59420796  1.0