# generated using pymatgen
data_Zr2Ti3Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.12422946
_cell_length_b   5.12422943
_cell_length_c   5.12422860
_cell_angle_alpha   67.02773827
_cell_angle_beta   67.02774148
_cell_angle_gamma   67.02774450
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Ti3Ru
_chemical_formula_sum   'Zr2 Ti3 Ru1'
_cell_volume   109.46917698
_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  0.24913511  0.24913511  0.24913511  1.0
  Zr  Zr1  1  0.00086489  0.00086489  0.00086489  1.0
  Ti  Ti2  1  0.62500000  0.62500000  0.12500000  1.0
  Ti  Ti3  1  0.62500000  0.12500000  0.62500000  1.0
  Ti  Ti4  1  0.12500000  0.62500000  0.62500000  1.0
  Ru  Ru5  1  0.62500000  0.62500000  0.62500000  1.0