# generated using pymatgen
data_MnBe4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.33824773
_cell_length_b   4.33824670
_cell_length_c   7.07735691
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000010
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnBe4Ir
_chemical_formula_sum   'Mn2 Be8 Ir2'
_cell_volume   115.35337944
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.66666700  0.33333300  0.93673722  1.0
  Mn  Mn1  1  0.33333300  0.66666700  0.43673722  1.0
  Be  Be2  1  0.00000000  0.00000000  0.00234813  1.0
  Be  Be3  1  0.00000000  0.00000000  0.50234813  1.0
  Be  Be4  1  0.83086380  0.66172760  0.24950879  1.0
  Be  Be5  1  0.16913620  0.83086380  0.74950879  1.0
  Be  Be6  1  0.66172760  0.83086380  0.74950879  1.0
  Be  Be7  1  0.33827240  0.16913620  0.24950879  1.0
  Be  Be8  1  0.83086380  0.16913620  0.24950879  1.0
  Be  Be9  1  0.16913620  0.33827240  0.74950879  1.0
  Ir  Ir10  1  0.33333300  0.66666700  0.06238728  1.0
  Ir  Ir11  1  0.66666700  0.33333300  0.56238728  1.0