# generated using pymatgen
data_B4C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17552120
_cell_length_b   5.17552120
_cell_length_c   5.17552085
_cell_angle_alpha   65.94629340
_cell_angle_beta   65.94629340
_cell_angle_gamma   65.94628062
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B4C
_chemical_formula_sum   'B12 C3'
_cell_volume   110.64787235
_cell_formula_units_Z   3
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
  B  B0  1  0.30861965  0.80644137  0.80644137  1.0
  B  B1  1  0.80644137  0.80644137  0.30861965  1.0
  B  B2  1  0.80644137  0.30861965  0.80644137  1.0
  B  B3  1  0.69138035  0.19355863  0.19355863  1.0
  B  B4  1  0.19355863  0.19355863  0.69138035  1.0
  B  B5  1  0.19355863  0.69138035  0.19355863  1.0
  B  B6  1  0.67011697  0.99407128  0.99407128  1.0
  B  B7  1  0.99407128  0.99407128  0.67011697  1.0
  B  B8  1  0.99407128  0.67011697  0.99407128  1.0
  B  B9  1  0.32988303  0.00592872  0.00592872  1.0
  B  B10  1  0.00592872  0.00592872  0.32988303  1.0
  B  B11  1  0.00592872  0.32988303  0.00592872  1.0
  C  C12  1  0.60986435  0.60986435  0.60986435  1.0
  C  C13  1  0.39013565  0.39013565  0.39013565  1.0
  C  C14  1  0.50000000  0.50000000  0.50000000  1.0