# generated using pymatgen
data_CeTm2(ThIr6)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.30919711
_cell_length_b   5.30919544
_cell_length_c   17.58387120
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000436
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeTm2(ThIr6)3
_chemical_formula_sum   'Ce1 Tm2 Th3 Ir18'
_cell_volume   429.24245363
_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
  Ce  Ce0  1  0.33333300  0.66666700  0.54516528  1.0
  Tm  Tm1  1  0.33333300  0.66666700  0.96195001  1.0
  Tm  Tm2  1  0.66666700  0.33333300  0.03752432  1.0
  Th  Th3  1  0.66666700  0.33333300  0.45849988  1.0
  Th  Th4  1  0.33333300  0.66666700  0.75660111  1.0
  Th  Th5  1  0.66666700  0.33333300  0.24269109  1.0
  Ir  Ir6  1  0.16735190  0.83264810  0.37139837  1.0
  Ir  Ir7  1  0.16735190  0.33470380  0.37139837  1.0
  Ir  Ir8  1  0.66529620  0.83264810  0.37139837  1.0
  Ir  Ir9  1  0.83282772  0.16717228  0.62823142  1.0
  Ir  Ir10  1  0.83282772  0.66565245  0.62823142  1.0
  Ir  Ir11  1  0.33434755  0.16717228  0.62823142  1.0
  Ir  Ir12  1  0.83232386  0.16767614  0.87687618  1.0
  Ir  Ir13  1  0.83232386  0.66464571  0.87687618  1.0
  Ir  Ir14  1  0.33535429  0.16767614  0.87687618  1.0
  Ir  Ir15  1  0.16766102  0.83233898  0.12277494  1.0
  Ir  Ir16  1  0.16766102  0.33532304  0.12277494  1.0
  Ir  Ir17  1  0.66467696  0.83233898  0.12277494  1.0
  Ir  Ir18  1  0.33333300  0.66666700  0.24814948  1.0
  Ir  Ir19  1  0.66666700  0.33333300  0.75160696  1.0
  Ir  Ir20  1  0.00000000  0.00000000  0.24729248  1.0
  Ir  Ir21  1  0.00000000  0.00000000  0.75257020  1.0
  Ir  Ir22  1  0.00000000  0.00000000  0.50028659  1.0
  Ir  Ir23  1  0.00000000  0.00000000  0.99981488  1.0