# generated using pymatgen
data_Tm3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.34778195
_cell_length_b   7.12377753
_cell_length_c   8.94048040
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3Ir
_chemical_formula_sum   'Tm12 Ir4'
_cell_volume   404.29019038
_cell_formula_units_Z   4
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  0.32210513  0.67580405  0.06130267  1.0
  Tm  Tm1  1  0.17789487  0.17580405  0.43869733  1.0
  Tm  Tm2  1  0.67789487  0.32419595  0.56130267  1.0
  Tm  Tm3  1  0.82210513  0.82419595  0.93869733  1.0
  Tm  Tm4  1  0.67789487  0.32419595  0.93869733  1.0
  Tm  Tm5  1  0.82210513  0.82419595  0.56130267  1.0
  Tm  Tm6  1  0.32210513  0.67580405  0.43869733  1.0
  Tm  Tm7  1  0.17789487  0.17580405  0.06130267  1.0
  Tm  Tm8  1  0.87793685  0.53544875  0.25000000  1.0
  Tm  Tm9  1  0.62206315  0.03544875  0.25000000  1.0
  Tm  Tm10  1  0.12206315  0.46455125  0.75000000  1.0
  Tm  Tm11  1  0.37793685  0.96455125  0.75000000  1.0
  Ir  Ir12  1  0.03384520  0.88822022  0.25000000  1.0
  Ir  Ir13  1  0.46615480  0.38822022  0.25000000  1.0
  Ir  Ir14  1  0.96615480  0.11177978  0.75000000  1.0
  Ir  Ir15  1  0.53384520  0.61177978  0.75000000  1.0