# generated using pymatgen
data_Zr3Al3Cu2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.09627202
_cell_length_b   7.09627159
_cell_length_c   3.45362189
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000660
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3Al3Cu2Ru
_chemical_formula_sum   'Zr3 Al3 Cu2 Ru1'
_cell_volume   150.61418456
_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
  Zr  Zr0  1  0.39858072  0.99279921  0.50000000  1.0
  Zr  Zr1  1  0.00720079  0.40578250  0.50000000  1.0
  Zr  Zr2  1  0.59421750  0.60141928  0.50000000  1.0
  Al  Al3  1  0.75011303  0.00494760  0.00000000  1.0
  Al  Al4  1  0.99505240  0.74516443  0.00000000  1.0
  Al  Al5  1  0.25483557  0.24988697  0.00000000  1.0
  Cu  Cu6  1  0.66666700  0.33333300  0.00000000  1.0
  Cu  Cu7  1  0.00000000  0.00000000  0.50000000  1.0
  Ru  Ru8  1  0.33333300  0.66666700  0.00000000  1.0