# generated using pymatgen
data_Tm2Th(MgIr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.19999593
_cell_length_b   7.19999526
_cell_length_c   4.04990843
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   118.70135044
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm2Th(MgIr)3
_chemical_formula_sum   'Tm2 Th1 Mg3 Ir3'
_cell_volume   184.15182574
_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  0.40733085  0.99996960  0.50000000  1.0
  Tm  Tm1  1  0.99996960  0.40733085  0.50000000  1.0
  Th  Th2  1  0.58268782  0.58268782  0.50000000  1.0
  Mg  Mg3  1  0.75709572  0.00905647  0.00000000  1.0
  Mg  Mg4  1  0.00905647  0.75709572  0.00000000  1.0
  Mg  Mg5  1  0.23320965  0.23320965  0.00000000  1.0
  Ir  Ir6  1  0.34143575  0.66967726  0.00000000  1.0
  Ir  Ir7  1  0.66967726  0.34143575  0.00000000  1.0
  Ir  Ir8  1  0.99953788  0.99953788  0.50000000  1.0