# generated using pymatgen
data_NbCoB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.97199770
_cell_length_b   3.16019189
_cell_length_c   8.20405346
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbCoB2
_chemical_formula_sum   'Nb4 Co4 B8'
_cell_volume   154.83230090
_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
  Nb  Nb0  1  0.25000000  0.13589100  0.86791800  1
  Nb  Nb1  1  0.75000000  0.86410900  0.13208200  1
  Nb  Nb2  1  0.25000000  0.63589100  0.63208200  1
  Nb  Nb3  1  0.75000000  0.36410900  0.36791800  1
  Co  Co4  1  0.75000000  0.50878800  0.88707000  1
  Co  Co5  1  0.75000000  0.00878800  0.61293000  1
  Co  Co6  1  0.25000000  0.49121200  0.11293000  1
  Co  Co7  1  0.25000000  0.99121200  0.38707000  1
  B  B8  1  0.25000000  0.16539200  0.17082600  1
  B  B9  1  0.75000000  0.83460800  0.82917400  1
  B  B10  1  0.25000000  0.66539200  0.32917400  1
  B  B11  1  0.75000000  0.33460800  0.67082600  1
  B  B12  1  0.25000000  0.23242200  0.57739200  1
  B  B13  1  0.75000000  0.26757800  0.07739200  1
  B  B14  1  0.25000000  0.73242200  0.92260800  1
  B  B15  1  0.75000000  0.76757800  0.42260800  1
