# generated using pymatgen
data_TmThP7Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.39227907
_cell_length_b   9.39227909
_cell_length_c   3.93492002
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999648
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmThP7Ru12
_chemical_formula_sum   'Tm1 Th1 P7 Ru12'
_cell_volume   300.61353745
_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
  Tm  Tm0  1  0.66666700  0.33333300  0.50000000  1.0
  Th  Th1  1  0.33333300  0.66666700  0.00000000  1.0
  P  P2  1  0.60666114  0.71719998  0.50000000  1.0
  P  P3  1  0.00000000  0.00000000  0.00000000  1.0
  P  P4  1  0.28280002  0.88946117  0.50000000  1.0
  P  P5  1  0.11053883  0.39333886  0.50000000  1.0
  P  P6  1  0.88561880  0.57158839  0.00000000  1.0
  P  P7  1  0.42841161  0.31403041  0.00000000  1.0
  P  P8  1  0.68596959  0.11438120  0.00000000  1.0
  Ru  Ru9  1  0.55695554  0.95030568  0.50000000  1.0
  Ru  Ru10  1  0.39335114  0.44304446  0.50000000  1.0
  Ru  Ru11  1  0.91411930  0.11948578  0.50000000  1.0
  Ru  Ru12  1  0.20536648  0.08588070  0.50000000  1.0
  Ru  Ru13  1  0.88051422  0.79463352  0.50000000  1.0
  Ru  Ru14  1  0.72800280  0.89245478  0.00000000  1.0
  Ru  Ru15  1  0.10754522  0.83554603  0.00000000  1.0
  Ru  Ru16  1  0.16445397  0.27199720  0.00000000  1.0
  Ru  Ru17  1  0.42463065  0.07079766  0.00000000  1.0
  Ru  Ru18  1  0.92920234  0.35383299  0.00000000  1.0
  Ru  Ru19  1  0.64616701  0.57536935  0.00000000  1.0
  Ru  Ru20  1  0.04969432  0.60664886  0.50000000  1.0