# generated using pymatgen
data_Zr3CoSn3Ir2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.29786320
_cell_length_b   7.29786363
_cell_length_c   7.23216335
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999804
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3CoSn3Ir2
_chemical_formula_sum   'Zr6 Co2 Sn6 Ir4'
_cell_volume   333.57256833
_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
  Zr  Zr0  1  0.40649881  0.02011652  0.25000000  1.0
  Zr  Zr1  1  0.59350119  0.61361871  0.75000000  1.0
  Zr  Zr2  1  0.61361871  0.59350119  0.25000000  1.0
  Zr  Zr3  1  0.97988348  0.38638129  0.25000000  1.0
  Zr  Zr4  1  0.02011652  0.40649881  0.75000000  1.0
  Zr  Zr5  1  0.38638129  0.97988348  0.75000000  1.0
  Co  Co6  1  0.00000000  0.00000000  0.75000000  1.0
  Co  Co7  1  0.00000000  0.00000000  0.25000000  1.0
  Sn  Sn8  1  0.25912219  0.25912219  0.50000000  1.0
  Sn  Sn9  1  0.25912219  0.25912219  0.00000000  1.0
  Sn  Sn10  1  0.74087781  0.00000000  0.00000000  1.0
  Sn  Sn11  1  1.00000000  0.74087781  0.50000000  1.0
  Sn  Sn12  1  0.74087781  0.00000000  0.50000000  1.0
  Sn  Sn13  1  1.00000000  0.74087781  0.00000000  1.0
  Ir  Ir14  1  0.66666700  0.33333300  0.53552954  1.0
  Ir  Ir15  1  0.66666700  0.33333300  0.96447046  1.0
  Ir  Ir16  1  0.33333300  0.66666700  0.03552954  1.0
  Ir  Ir17  1  0.33333300  0.66666700  0.46447046  1.0