# generated using pymatgen
data_Hf16Nb3Ni4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.67796156
_cell_length_b   8.67796118
_cell_length_c   8.67796144
_cell_angle_alpha   60.26532227
_cell_angle_beta   60.26532842
_cell_angle_gamma   60.26532578
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf16Nb3Ni4Ir
_chemical_formula_sum   'Hf16 Nb3 Ni4 Ir1'
_cell_volume   464.87744522
_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
  Hf  Hf0  1  0.69857546  0.10081867  0.10081867  1.0
  Hf  Hf1  1  0.10081867  0.69857546  0.10081867  1.0
  Hf  Hf2  1  0.10081867  0.10081867  0.69857546  1.0
  Hf  Hf3  1  0.10101018  0.10101018  0.10101018  1.0
  Hf  Hf4  1  0.31416244  0.31416244  0.68344185  1.0
  Hf  Hf5  1  0.68546829  0.68546829  0.31452845  1.0
  Hf  Hf6  1  0.31416244  0.68344185  0.31416244  1.0
  Hf  Hf7  1  0.68546829  0.31452845  0.68546829  1.0
  Hf  Hf8  1  0.68344185  0.31416244  0.31416244  1.0
  Hf  Hf9  1  0.31452845  0.68546829  0.68546829  1.0
  Hf  Hf10  1  0.95002576  0.95002576  0.54950285  1.0
  Hf  Hf11  1  0.55016626  0.55016626  0.94941702  1.0
  Hf  Hf12  1  0.95002576  0.54950285  0.95002576  1.0
  Hf  Hf13  1  0.55016626  0.94941702  0.55016626  1.0
  Hf  Hf14  1  0.54950285  0.95002576  0.95002576  1.0
  Hf  Hf15  1  0.94941702  0.55016626  0.55016626  1.0
  Nb  Nb16  1  0.00052924  0.33360155  0.33360155  1.0
  Nb  Nb17  1  0.33360155  0.00052924  0.33360155  1.0
  Nb  Nb18  1  0.33360155  0.33360155  0.00052924  1.0
  Ni  Ni19  1  0.32589759  0.89017907  0.89017907  1.0
  Ni  Ni20  1  0.89017907  0.32589759  0.89017907  1.0
  Ni  Ni21  1  0.89017907  0.89017907  0.32589759  1.0
  Ni  Ni22  1  0.89157297  0.89157297  0.89157297  1.0
  Ir  Ir23  1  0.33667830  0.33667830  0.33667830  1.0