# generated using pymatgen
data_SmTh2(AlNi)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.07310144
_cell_length_b   7.01376525
_cell_length_c   4.00090621
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.72287020
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmTh2(AlNi)3
_chemical_formula_sum   'Sm1 Th2 Al3 Ni3'
_cell_volume   172.36780076
_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  1.00000000  0.41945572  0.50000000  1.0
  Th  Th1  1  0.57537217  0.57625240  0.50000000  1.0
  Th  Th2  1  0.42462783  0.00088123  0.50000000  1.0
  Al  Al3  1  0.00000000  0.76845115  0.00000000  1.0
  Al  Al4  1  0.22219233  0.22533238  0.00000000  1.0
  Al  Al5  1  0.77780767  0.00314005  0.00000000  1.0
  Ni  Ni6  1  0.34907672  0.68145890  0.00000000  1.0
  Ni  Ni7  1  0.65092328  0.33238118  0.00000000  1.0
  Ni  Ni8  1  1.00000000  0.99264799  0.50000000  1.0