# generated using pymatgen
data_Tm5Cu(P2Ru3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.38440752
_cell_length_b   12.38440774
_cell_length_c   3.94417711
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000465
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm5Cu(P2Ru3)6
_chemical_formula_sum   'Tm5 Cu1 P12 Ru18'
_cell_volume   523.88684824
_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  0.00000000  1.0
  Tm  Tm1  1  0.33333300  0.66666700  0.00000000  1.0
  Tm  Tm2  1  0.19096957  0.19096957  0.50000000  1.0
  Tm  Tm3  1  0.80903043  1.00000000  0.50000000  1.0
  Tm  Tm4  1  1.00000000  0.80903043  0.50000000  1.0
  Cu  Cu5  1  0.00000000  0.00000000  0.00000000  1.0
  P  P6  1  0.37349640  0.37349640  0.00000000  1.0
  P  P7  1  0.62650360  1.00000000  0.00000000  1.0
  P  P8  1  1.00000000  0.62650360  0.00000000  1.0
  P  P9  1  0.82932089  0.30597374  0.50000000  1.0
  P  P10  1  0.69402626  0.52334815  0.50000000  1.0
  P  P11  1  0.47665185  0.17067911  0.50000000  1.0
  P  P12  1  0.30597374  0.82932089  0.50000000  1.0
  P  P13  1  0.52334815  0.69402626  0.50000000  1.0
  P  P14  1  0.17067911  0.47665185  0.50000000  1.0
  P  P15  1  0.81922400  0.81922400  0.00000000  1.0
  P  P16  1  0.18077600  0.00000000  0.00000000  1.0
  P  P17  1  0.00000000  0.18077600  0.00000000  1.0
  Ru  Ru18  1  0.81529404  0.18935117  0.00000000  1.0
  Ru  Ru19  1  0.81064883  0.62594287  0.00000000  1.0
  Ru  Ru20  1  0.37405713  0.18470596  0.00000000  1.0
  Ru  Ru21  1  0.18935117  0.81529404  0.00000000  1.0
  Ru  Ru22  1  0.62594287  0.81064883  0.00000000  1.0
  Ru  Ru23  1  0.18470596  0.37405713  0.00000000  1.0
  Ru  Ru24  1  0.55632998  0.55632998  0.00000000  1.0
  Ru  Ru25  1  0.44367002  0.00000000  0.00000000  1.0
  Ru  Ru26  1  0.00000000  0.44367002  0.00000000  1.0
  Ru  Ru27  1  0.63396166  0.12706744  0.50000000  1.0
  Ru  Ru28  1  0.87293256  0.50689522  0.50000000  1.0
  Ru  Ru29  1  0.49310478  0.36603834  0.50000000  1.0
  Ru  Ru30  1  0.12706744  0.63396166  0.50000000  1.0
  Ru  Ru31  1  0.50689522  0.87293256  0.50000000  1.0
  Ru  Ru32  1  0.36603834  0.49310478  0.50000000  1.0
  Ru  Ru33  1  0.72073649  0.72073649  0.50000000  1.0
  Ru  Ru34  1  0.27926351  0.00000000  0.50000000  1.0
  Ru  Ru35  1  0.00000000  0.27926351  0.50000000  1.0