# generated using pymatgen
data_Be(B6C)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24178117
_cell_length_b   5.24178117
_cell_length_c   5.24178135
_cell_angle_alpha   64.60019878
_cell_angle_beta   64.60019878
_cell_angle_gamma   64.60020474
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Be(B6C)2
_chemical_formula_sum   'Be1 B12 C2'
_cell_volume   112.10667598
_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
  Be  Be0  1  0.50000000  0.50000000  0.50000000  1.0
  B  B1  1  0.67949300  0.19671100  0.19671100  1.0
  B  B2  1  0.19671100  0.19671100  0.67949300  1.0
  B  B3  1  0.19671100  0.67949300  0.19671100  1.0
  B  B4  1  0.32050700  0.80328900  0.80328900  1.0
  B  B5  1  0.80328900  0.80328900  0.32050700  1.0
  B  B6  1  0.80328900  0.32050700  0.80328900  1.0
  B  B7  1  0.33268700  0.00265600  0.00265600  1.0
  B  B8  1  0.00265600  0.00265600  0.33268700  1.0
  B  B9  1  0.00265600  0.33268700  0.00265600  1.0
  B  B10  1  0.66731300  0.99734400  0.99734400  1.0
  B  B11  1  0.99734400  0.99734400  0.66731300  1.0
  B  B12  1  0.99734400  0.66731300  0.99734400  1.0
  C  C13  1  0.63482700  0.63482700  0.63482700  1.0
  C  C14  1  0.36517300  0.36517300  0.36517300  1.0