# generated using pymatgen
data_Be3Mo2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69859841
_cell_length_b   4.69859902
_cell_length_c   7.25273530
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000269
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be3Mo2Ir
_chemical_formula_sum   'Be6 Mo4 Ir2'
_cell_volume   138.66573547
_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
  Be  Be0  1  0.82571347  0.17428653  0.25000000  1.0
  Be  Be1  1  0.82571347  0.65142694  0.25000000  1.0
  Be  Be2  1  0.34857306  0.17428653  0.25000000  1.0
  Be  Be3  1  0.17428653  0.82571347  0.75000000  1.0
  Be  Be4  1  0.17428653  0.34857306  0.75000000  1.0
  Be  Be5  1  0.65142694  0.82571347  0.75000000  1.0
  Mo  Mo6  1  0.33333300  0.66666700  0.42514912  1.0
  Mo  Mo7  1  0.66666700  0.33333300  0.57485088  1.0
  Mo  Mo8  1  0.66666700  0.33333300  0.92514912  1.0
  Mo  Mo9  1  0.33333300  0.66666700  0.07485088  1.0
  Ir  Ir10  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir11  1  0.00000000  0.00000000  0.00000000  1.0