# generated using pymatgen
data_SnIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68603050
_cell_length_b   5.68603050
_cell_length_c   4.53793800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000578
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnIr3
_chemical_formula_sum   'Sn2 Ir6'
_cell_volume   127.05961461
_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
  Sn  Sn0  1  0.33333300  0.66666700  0.75000000  1.0
  Sn  Sn1  1  0.66666700  0.33333300  0.25000000  1.0
  Ir  Ir2  1  0.16279100  0.32558300  0.25000000  1.0
  Ir  Ir3  1  0.67441700  0.83720900  0.25000000  1.0
  Ir  Ir4  1  0.16279100  0.83720900  0.25000000  1.0
  Ir  Ir5  1  0.83720900  0.67441700  0.75000000  1.0
  Ir  Ir6  1  0.32558300  0.16279100  0.75000000  1.0
  Ir  Ir7  1  0.83720900  0.16279100  0.75000000  1.0