# generated using pymatgen
data_YBC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.39593800
_cell_length_b   3.52498600
_cell_length_c   9.65590432
_cell_angle_alpha   90.00000000
_cell_angle_beta   100.12799539
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YBC
_chemical_formula_sum   'Y2 B2 C2'
_cell_volume   113.78614236
_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
  Y  Y0  1  0.15499200  0.00000000  0.30998400  1.0
  Y  Y1  1  0.84500800  0.00000000  0.69001600  1.0
  B  B2  1  0.72324700  0.50000000  0.44649400  1.0
  B  B3  1  0.27675300  0.50000000  0.55350600  1.0
  C  C4  1  0.35517200  0.50000000  0.71034400  1.0
  C  C5  1  0.64482800  0.50000000  0.28965600  1.0