# generated using pymatgen
data_AcNi11B6Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.05109708
_cell_length_b   6.14254118
_cell_length_c   6.14254396
_cell_angle_alpha   104.54911418
_cell_angle_beta   104.52720267
_cell_angle_gamma   104.52719548
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AcNi11B6Ir
_chemical_formula_sum   'Ac1 Ni11 B6 Ir1'
_cell_volume   201.56812738
_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
  Ac  Ac0  1  0.00000000  0.00260291  0.99739709  1.0
  Ni  Ni1  1  0.46271070  0.45898069  0.19330027  1.0
  Ni  Ni2  1  0.18379205  0.46263654  0.46190514  1.0
  Ni  Ni3  1  0.53728930  0.80669973  0.54101931  1.0
  Ni  Ni4  1  0.81620795  0.53809486  0.53736346  1.0
  Ni  Ni5  1  0.53499985  0.53237168  0.80549295  1.0
  Ni  Ni6  1  0.12930123  0.49053637  0.86362236  1.0
  Ni  Ni7  1  0.87069877  0.13637764  0.50946363  1.0
  Ni  Ni8  1  0.50000000  0.13743567  0.86256433  1.0
  Ni  Ni9  1  0.86408385  0.50257631  0.13203156  1.0
  Ni  Ni10  1  0.13591615  0.86796844  0.49742369  1.0
  Ni  Ni11  1  0.46500015  0.19450705  0.46762832  1.0
  B  B12  1  0.77424298  0.77090740  0.35649376  1.0
  B  B13  1  0.34564274  0.76768937  0.76195162  1.0
  B  B14  1  0.76905974  0.35154236  0.76910387  1.0
  B  B15  1  0.65435726  0.23804838  0.23231063  1.0
  B  B16  1  0.23094026  0.23089613  0.64845764  1.0
  B  B17  1  0.22575702  0.64350624  0.22909260  1.0
  Ir  Ir18  1  0.50000000  0.86662122  0.13337878  1.0