# generated using pymatgen
data_SmTh3(ZnRu)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.94864087
_cell_length_b   7.04400036
_cell_length_c   8.44438941
_cell_angle_alpha   90.57516408
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmTh3(ZnRu)4
_chemical_formula_sum   'Sm1 Th3 Zn4 Ru4'
_cell_volume   234.86233547
_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
  Sm  Sm0  1  0.75000000  0.96000493  0.68657840  1.0
  Th  Th1  1  0.25000000  0.53506032  0.18466906  1.0
  Th  Th2  1  0.75000000  0.45972088  0.81061813  1.0
  Th  Th3  1  0.25000000  0.04024724  0.31797227  1.0
  Zn  Zn4  1  0.25000000  0.11764113  0.93949656  1.0
  Zn  Zn5  1  0.75000000  0.87433517  0.05002322  1.0
  Zn  Zn6  1  0.25000000  0.63770893  0.55333240  1.0
  Zn  Zn7  1  0.75000000  0.37558247  0.44623525  1.0
  Ru  Ru8  1  0.75000000  0.75916205  0.36140051  1.0
  Ru  Ru9  1  0.25000000  0.26236765  0.63703206  1.0
  Ru  Ru10  1  0.75000000  0.25100499  0.13632835  1.0
  Ru  Ru11  1  0.25000000  0.72716424  0.87631580  1.0