# generated using pymatgen
data_Mn2Be8CoIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.27345354
_cell_length_b   4.27345348
_cell_length_c   6.98032586
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999272
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2Be8CoIr
_chemical_formula_sum   'Mn2 Be8 Co1 Ir1'
_cell_volume   110.39879381
_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
  Mn  Mn0  1  0.66666700  0.33333300  0.94486504  1.0
  Mn  Mn1  1  0.33333300  0.66666700  0.42868129  1.0
  Be  Be2  1  0.00000000  0.00000000  0.00243082  1.0
  Be  Be3  1  0.00000000  0.00000000  0.49868154  1.0
  Be  Be4  1  0.83032306  0.66064613  0.24741017  1.0
  Be  Be5  1  0.16946885  0.83053115  0.75189133  1.0
  Be  Be6  1  0.66106330  0.83053115  0.75189133  1.0
  Be  Be7  1  0.33935387  0.16967694  0.24741017  1.0
  Be  Be8  1  0.83032306  0.16967694  0.24741017  1.0
  Be  Be9  1  0.16946885  0.33893670  0.75189133  1.0
  Co  Co10  1  0.33333300  0.66666700  0.06198414  1.0
  Ir  Ir11  1  0.66666700  0.33333300  0.56545065  1.0