# generated using pymatgen
data_Tm2Be(B3Ir)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.60346922
_cell_length_b   5.80881427
_cell_length_c   5.80881536
_cell_angle_alpha   100.11482690
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm2Be(B3Ir)2
_chemical_formula_sum   'Tm2 Be1 B6 Ir2'
_cell_volume   119.69967433
_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  0.00000000  0.28654713  0.71345287  1.0
  Tm  Tm1  1  0.00000000  0.71345287  0.28654713  1.0
  Be  Be2  1  0.50000000  0.00000000  0.00000000  1.0
  B  B3  1  0.50000000  0.92234439  0.60996514  1.0
  B  B4  1  0.50000000  0.07765561  0.39003486  1.0
  B  B5  1  0.50000000  0.60996514  0.92234439  1.0
  B  B6  1  0.50000000  0.39003486  0.07765561  1.0
  B  B7  1  0.50000000  0.61707544  0.61707544  1.0
  B  B8  1  0.50000000  0.38292456  0.38292456  1.0
  Ir  Ir9  1  0.00000000  0.79795619  0.79795619  1.0
  Ir  Ir10  1  0.00000000  0.20204381  0.20204381  1.0