# generated using pymatgen
data_Ti2MoRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.35237389
_cell_length_b   10.35237389
_cell_length_c   10.35237389
_cell_angle_alpha   129.99328568
_cell_angle_beta   117.88469476
_cell_angle_gamma   83.66211253
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2MoRu
_chemical_formula_sum   'Ti2 Mo1 Ru1'
_cell_volume   721.06022175
_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
  Ti  Ti0  1  0.00000000  0.25659300  0.25659300  1.0
  Ti  Ti1  1  0.00000000  0.74340700  0.74340700  1.0
  Mo  Mo2  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru3  1  0.00000000  0.50000000  0.50000000  1.0