# generated using pymatgen
data_Zr6C3O2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.71030857
_cell_length_b   5.71031035
_cell_length_c   5.68903316
_cell_angle_alpha   99.68922280
_cell_angle_beta   99.68922118
_cell_angle_gamma   119.83206226
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6C3O2
_chemical_formula_sum   'Zr6 C3 O2'
_cell_volume   151.58220687
_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
  Zr  Zr0  1  0.42796252  0.08652545  0.26058162  1.0
  Zr  Zr1  1  0.08652545  0.42796252  0.26058162  1.0
  Zr  Zr2  1  0.74851393  0.74851393  0.26801293  1.0
  Zr  Zr3  1  0.25148607  0.25148607  0.73198707  1.0
  Zr  Zr4  1  0.91347555  0.57203848  0.73941838  1.0
  Zr  Zr5  1  0.57203848  0.91347555  0.73941838  1.0
  C  C6  1  0.83346872  0.16653028  0.50000000  1.0
  C  C7  1  0.50000000  0.50000000  0.50000000  1.0
  C  C8  1  0.16653028  0.83346872  0.50000000  1.0
  O  O9  1  0.66521026  0.33478874  0.00000000  1.0
  O  O10  1  0.33478874  0.66521026  1.00000000  1.0