# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.46729100
_cell_length_b   2.46729152
_cell_length_c   7.80307300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000639
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C4
_cell_volume   41.13742607
_cell_formula_units_Z   4
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
  C  C0  1  0.00000000  0.00000000  0.25000000  1.0
  C  C1  1  0.00000000  0.00000000  0.75000000  1.0
  C  C2  1  0.33333300  0.66666700  0.25000000  1.0
  C  C3  1  0.66666700  0.33333300  0.75000000  1.0