# generated using pymatgen
data_Zr3Al12Os3Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.64164728
_cell_length_b   8.64164857
_cell_length_c   9.30299322
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999129
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3Al12Os3Ru
_chemical_formula_sum   'Zr6 Al24 Os6 Ru2'
_cell_volume   601.65358831
_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  0.19509616  0.39019132  0.25000000  1.0
  Zr  Zr1  1  0.80490384  0.60980868  0.75000000  1.0
  Zr  Zr2  1  0.60980868  0.80490384  0.25000000  1.0
  Zr  Zr3  1  0.39019132  0.19509616  0.75000000  1.0
  Zr  Zr4  1  0.19509616  0.80490384  0.25000000  1.0
  Zr  Zr5  1  0.80490384  0.19509616  0.75000000  1.0
  Al  Al6  1  0.33333300  0.66666700  0.03163768  1.0
  Al  Al7  1  0.66666700  0.33333300  0.96836232  1.0
  Al  Al8  1  0.66666700  0.33333300  0.53163768  1.0
  Al  Al9  1  0.33333300  0.66666700  0.46836232  1.0
  Al  Al10  1  0.16291773  0.32583346  0.57566400  1.0
  Al  Al11  1  0.83708227  0.67416654  0.42433600  1.0
  Al  Al12  1  0.67416654  0.83708227  0.57566400  1.0
  Al  Al13  1  0.83708227  0.67416654  0.07566400  1.0
  Al  Al14  1  0.32583346  0.16291773  0.42433600  1.0
  Al  Al15  1  0.16291773  0.32583346  0.92433600  1.0
  Al  Al16  1  0.16291773  0.83708227  0.57566400  1.0
  Al  Al17  1  0.32583346  0.16291773  0.07566400  1.0
  Al  Al18  1  0.83708227  0.16291773  0.42433600  1.0
  Al  Al19  1  0.67416654  0.83708227  0.92433600  1.0
  Al  Al20  1  0.83708227  0.16291773  0.07566400  1.0
  Al  Al21  1  0.16291773  0.83708227  0.92433600  1.0
  Al  Al22  1  0.55975116  0.11950232  0.25000000  1.0
  Al  Al23  1  0.44024884  0.88049768  0.75000000  1.0
  Al  Al24  1  0.88049768  0.44024884  0.25000000  1.0
  Al  Al25  1  0.11950232  0.55975116  0.75000000  1.0
  Al  Al26  1  0.55975116  0.44024884  0.25000000  1.0
  Al  Al27  1  0.44024884  0.55975116  0.75000000  1.0
  Al  Al28  1  0.00000000  0.00000000  0.25000000  1.0
  Al  Al29  1  0.00000000  0.00000000  0.75000000  1.0
  Os  Os30  1  0.50000000  0.00000000  0.00000000  1.0
  Os  Os31  1  0.00000000  0.50000000  0.00000000  1.0
  Os  Os32  1  0.50000000  0.00000000  0.50000000  1.0
  Os  Os33  1  0.50000000  0.50000000  0.00000000  1.0
  Os  Os34  1  0.00000000  0.50000000  0.50000000  1.0
  Os  Os35  1  0.50000000  0.50000000  0.50000000  1.0
  Ru  Ru36  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru37  1  0.00000000  0.00000000  0.50000000  1.0