# generated using pymatgen
data_Th10ZnSn2Sb5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.59623740
_cell_length_b   9.60030851
_cell_length_c   6.56645280
_cell_angle_alpha   89.97390098
_cell_angle_beta   90.05222019
_cell_angle_gamma   119.98597320
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th10ZnSn2Sb5
_chemical_formula_sum   'Th10 Zn1 Sn2 Sb5'
_cell_volume   523.97289144
_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  0.00028750  0.72749893  0.76045979  1.0
  Th  Th1  1  0.27278856  0.27250107  0.76045979  1.0
  Th  Th2  1  0.33308559  0.66690162  0.49863854  1.0
  Th  Th3  1  0.66618498  0.33309838  0.49863854  1.0
  Th  Th4  1  0.72568672  0.72606306  0.23829885  1.0
  Th  Th5  1  0.72756289  0.00000000  0.76067485  1.0
  Th  Th6  1  0.99962366  0.27393694  0.23829885  1.0
  Th  Th7  1  0.27508164  0.00000000  0.24001956  1.0
  Th  Th8  1  0.33342232  0.66694830  0.00131330  1.0
  Th  Th9  1  0.66647502  0.33305170  0.00131330  1.0
  Zn  Zn10  1  0.00062821  0.00000000  0.00257187  1.0
  Sn  Sn11  1  0.38199408  0.38219792  0.25107784  1.0
  Sn  Sn12  1  0.99979616  0.61780208  0.25107784  1.0
  Sb  Sb13  1  0.61561868  0.61479816  0.74908818  1.0
  Sb  Sb14  1  0.00082152  0.38520184  0.74908818  1.0
  Sb  Sb15  1  0.38384088  0.00000000  0.74993987  1.0
  Sb  Sb16  1  0.61720086  0.00000000  0.25072391  1.0
  Sb  Sb17  1  0.99990271  0.00000000  0.49831594  1.0