# generated using pymatgen
data_Ni3Sn5Ir3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.72720439
_cell_length_b   6.72720482
_cell_length_c   9.73984818
_cell_angle_alpha   78.97177311
_cell_angle_beta   78.97177270
_cell_angle_gamma   63.58771425
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni3Sn5Ir3
_chemical_formula_sum   'Ni6 Sn10 Ir6'
_cell_volume   384.64124494
_cell_formula_units_Z   2
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
  Ni  Ni0  1  0.19812191  0.19096111  0.10135982  1.0
  Ni  Ni1  1  0.80903889  0.80187809  0.39864018  1.0
  Ni  Ni2  1  0.80187809  0.80903889  0.89864018  1.0
  Ni  Ni3  1  0.19096111  0.19812191  0.60135982  1.0
  Ni  Ni4  1  0.15816203  0.84183797  0.75000000  1.0
  Ni  Ni5  1  0.84183797  0.15816203  0.25000000  1.0
  Sn  Sn6  1  0.77368017  0.44815209  0.03294641  1.0
  Sn  Sn7  1  0.55184791  0.22631983  0.46705359  1.0
  Sn  Sn8  1  0.22631983  0.55184791  0.96705359  1.0
  Sn  Sn9  1  0.44815209  0.77368017  0.53294641  1.0
  Sn  Sn10  1  0.36717776  0.04266570  0.85443107  1.0
  Sn  Sn11  1  0.95733430  0.63282224  0.64556893  1.0
  Sn  Sn12  1  0.63282224  0.95733430  0.14556893  1.0
  Sn  Sn13  1  0.04266570  0.36717776  0.35443107  1.0
  Sn  Sn14  1  0.80713184  0.19286816  0.75000000  1.0
  Sn  Sn15  1  0.19286816  0.80713184  0.25000000  1.0
  Ir  Ir16  1  0.38040767  0.41076981  0.70225320  1.0
  Ir  Ir17  1  0.58923019  0.61959233  0.79774680  1.0
  Ir  Ir18  1  0.61959233  0.58923019  0.29774680  1.0
  Ir  Ir19  1  0.41076981  0.38040767  0.20225320  1.0
  Ir  Ir20  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir21  1  0.00000000  0.00000000  0.00000000  1.0