# generated using pymatgen
data_NbCo3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68936079
_cell_length_b   5.68936079
_cell_length_c   9.22778414
_cell_angle_alpha   89.91450500
_cell_angle_beta   89.91450500
_cell_angle_gamma   120.03884500
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbCo3O8
_chemical_formula_sum   'Nb2 Co6 O16'
_cell_volume   258.57286338
_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
  Nb  Nb0  1  0.66583300  0.33222400  0.50092300  1.0
  Nb  Nb1  1  0.33222400  0.66583300  0.00092300  1.0
  Co  Co2  1  0.33775500  0.16892800  0.78430800  1.0
  Co  Co3  1  0.83111800  0.66233400  0.78436300  1.0
  Co  Co4  1  0.83140400  0.16891400  0.78432100  1.0
  Co  Co5  1  0.16891400  0.83140400  0.28432100  1.0
  Co  Co6  1  0.16892800  0.33775500  0.28430800  1.0
  Co  Co7  1  0.66233400  0.83111800  0.28436300  1.0
  O  O8  1  0.32572500  0.16305700  0.39864000  1.0
  O  O9  1  0.51884300  0.48286900  0.67108700  1.0
  O  O10  1  0.66599000  0.33248900  0.88758600  1.0
  O  O11  1  0.00058100  0.00066500  0.69249200  1.0
  O  O12  1  0.00066500  0.00058100  0.19249200  1.0
  O  O13  1  0.83654200  0.67359200  0.39851100  1.0
  O  O14  1  0.51867200  0.03625900  0.67079600  1.0
  O  O15  1  0.96394500  0.48246900  0.67094900  1.0
  O  O16  1  0.16314200  0.83644700  0.89816600  1.0
  O  O17  1  0.83644700  0.16314200  0.39816600  1.0
  O  O18  1  0.03625900  0.51867200  0.17079600  1.0
  O  O19  1  0.48246900  0.96394500  0.17094900  1.0
  O  O20  1  0.33248900  0.66599000  0.38758600  1.0
  O  O21  1  0.16305700  0.32572500  0.89864000  1.0
  O  O22  1  0.48286900  0.51884300  0.17108700  1.0
  O  O23  1  0.67359200  0.83654200  0.89851100  1.0