# generated using pymatgen
data_NbCo3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.73320848
_cell_length_b   4.73606500
_cell_length_c   15.46363451
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.02539212
_cell_angle_gamma   59.98004115
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbCo3
_chemical_formula_sum   'Nb6 Co18'
_cell_volume   300.14288955
_cell_formula_units_Z   6
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  0.00016800  0.99991600  0.09169300  1.0
  Nb  Nb1  1  0.99983200  0.00008400  0.90830700  1.0
  Nb  Nb2  1  0.33316800  0.33341600  0.35078400  1.0
  Nb  Nb3  1  0.66683200  0.66658400  0.64921600  1.0
  Nb  Nb4  1  0.66655500  0.66672200  0.83944800  1.0
  Nb  Nb5  1  0.33344500  0.33327800  0.16055200  1.0
  Co  Co6  1  0.16314600  0.67377700  0.74714700  1.0
  Co  Co7  1  0.67378800  0.16310600  0.74717900  1.0
  Co  Co8  1  0.16314600  0.16307700  0.74714700  1.0
  Co  Co9  1  0.83685400  0.32622300  0.25285300  1.0
  Co  Co10  1  0.32621200  0.83689400  0.25282100  1.0
  Co  Co11  1  0.83685400  0.83692300  0.25285300  1.0
  Co  Co12  1  0.50000000  0.00000000  0.50000000  1.0
  Co  Co13  1  0.00000000  0.50000000  0.50000000  1.0
  Co  Co14  1  0.50000000  0.50000000  0.50000000  1.0
  Co  Co15  1  0.50000000  0.00000000  0.00000000  1.0
  Co  Co16  1  0.00000000  0.50000000  0.00000000  1.0
  Co  Co17  1  0.50000000  0.50000000  0.00000000  1.0
  Co  Co18  1  0.33311900  0.33344100  0.62502100  1.0
  Co  Co19  1  0.66688100  0.66655900  0.37497900  1.0
  Co  Co20  1  0.66658400  0.66670800  0.12761600  1.0
  Co  Co21  1  0.33341600  0.33329200  0.87238400  1.0
  Co  Co22  1  0.00001300  0.99999300  0.58718400  1.0
  Co  Co23  1  0.99998700  0.00000700  0.41281600  1.0