data_B5C3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.67
_cell_length_b   5.89
_cell_length_c   4.68
_cell_angle_alpha   90.0
_cell_angle_beta   119.02
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B5C3
_chemical_formula_sum   'B10 C6'
_cell_volume   112.66
_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
  B  B0  1  0.38  0.47  0.46  1.0
  B  B1  1  0.06  0.53  0.86  1.0
  B  B2  1  0.06  0.37  0.86  1.0
  B  B3  1  0.38  0.42  0.46  1.0
  B  B4  1  0.78  0.95  0.3  1.0
  B  B5  1  0.62  0.0  0.79  1.0
  B  B6  1  0.93  0.95  0.08  1.0
  B  B7  1  0.13  0.95  0.74  1.0
  B  B8  1  0.89  0.0  0.29  1.0
  B  B9  1  0.29  0.0  0.03  1.0
  C  C10  1  0.52  0.95  0.64  1.0
  C  C11  1  0.84  0.0  0.36  1.0
  C  C12  1  0.29  0.95  0.02  1.0
  C  C13  1  0.85  0.95  0.36  1.0
  C  C14  1  0.14  0.0  0.65  1.0
  C  C15  1  0.81  0.0  0.05  1.0

data_B5C3
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.67
_cell_length_b   4.68
_cell_length_c   5.89
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   119.02
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B5C3
_chemical_formula_sum   'B10 C6'
_cell_volume   112.66
_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
  B  B0  1  0.07  0.92  0.05  1.0
  B  B1  1  0.11  0.71  0.0  1.0
  B  B2  1  0.22  0.7  0.05  1.0
  B  B3  1  0.38  0.21  0.0  1.0
  B  B4  1  0.62  0.54  0.53  1.0
  B  B5  1  0.62  0.54  0.58  1.0
  B  B6  1  0.71  0.97  0.0  1.0
  B  B7  1  0.87  0.26  0.05  1.0
  B  B8  1  0.94  0.14  0.47  1.0
  B  B9  1  0.94  0.14  0.63  1.0
  C  C10  1  0.15  0.64  0.05  1.0
  C  C11  1  0.16  0.64  0.0  1.0
  C  C12  1  0.19  0.95  0.0  1.0
  C  C13  1  0.48  0.36  0.05  1.0
  C  C14  1  0.71  0.98  0.05  1.0
  C  C15  1  0.86  0.35  0.0  1.0

B B B B B B B B B B C C C C C C