# generated using pymatgen
data_Ti3Tc(PRu)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.77042960
_cell_length_b   6.13663689
_cell_length_c   7.01549452
_cell_angle_alpha   89.71812307
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3Tc(PRu)4
_chemical_formula_sum   'Ti3 Tc1 P4 Ru4'
_cell_volume   162.32084594
_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  0.25000000  0.02708448  0.17902850  1.0
  Ti  Ti1  1  0.25000000  0.52409268  0.32929058  1.0
  Ti  Ti2  1  0.75000000  0.97186308  0.81532518  1.0
  Tc  Tc3  1  0.75000000  0.47612357  0.66983281  1.0
  P  P4  1  0.25000000  0.76145153  0.62451846  1.0
  P  P5  1  0.25000000  0.27651692  0.87028195  1.0
  P  P6  1  0.75000000  0.23787530  0.38629685  1.0
  P  P7  1  0.75000000  0.72960197  0.12395637  1.0
  Ru  Ru8  1  0.25000000  0.14423076  0.56581532  1.0
  Ru  Ru9  1  0.25000000  0.65160983  0.94122830  1.0
  Ru  Ru10  1  0.75000000  0.85218642  0.43479606  1.0
  Ru  Ru11  1  0.75000000  0.34736346  0.05962862  1.0