# generated using pymatgen
data_PrTiP7Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35521978
_cell_length_b   9.35521929
_cell_length_c   3.89865685
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999738
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrTiP7Ru12
_chemical_formula_sum   'Pr1 Ti1 P7 Ru12'
_cell_volume   295.49737097
_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
  Pr  Pr0  1  0.33333300  0.66666700  0.00000000  1.0
  Ti  Ti1  1  0.66666700  0.33333300  0.50000000  1.0
  P  P2  1  0.60507330  0.71935061  0.50000000  1.0
  P  P3  1  0.00000000  0.00000000  0.00000000  1.0
  P  P4  1  0.28064939  0.88572268  0.50000000  1.0
  P  P5  1  0.11427732  0.39492670  0.50000000  1.0
  P  P6  1  0.88510038  0.56910536  0.00000000  1.0
  P  P7  1  0.43089464  0.31599502  0.00000000  1.0
  P  P8  1  0.68400498  0.11489962  0.00000000  1.0
  Ru  Ru9  1  0.56150296  0.96197659  0.50000000  1.0
  Ru  Ru10  1  0.40047263  0.43849704  0.50000000  1.0
  Ru  Ru11  1  0.91466163  0.11966720  0.50000000  1.0
  Ru  Ru12  1  0.20500657  0.08533837  0.50000000  1.0
  Ru  Ru13  1  0.88033280  0.79499343  0.50000000  1.0
  Ru  Ru14  1  0.72702232  0.89041112  0.00000000  1.0
  Ru  Ru15  1  0.10958888  0.83660920  0.00000000  1.0
  Ru  Ru16  1  0.16339080  0.27297768  0.00000000  1.0
  Ru  Ru17  1  0.42734041  0.07787989  0.00000000  1.0
  Ru  Ru18  1  0.92212011  0.34946252  0.00000000  1.0
  Ru  Ru19  1  0.65053748  0.57265959  0.00000000  1.0
  Ru  Ru20  1  0.03802341  0.59952737  0.50000000  1.0