# generated using pymatgen
data_NbCoB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.16509088
_cell_length_b   5.92631588
_cell_length_c   8.15847511
_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   153.03119642
_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  0.63674836  0.36778608  1.0
  Nb  Nb1  1  0.75000000  0.36325164  0.63221392  1.0
  Nb  Nb2  1  0.25000000  0.13674836  0.13221392  1.0
  Nb  Nb3  1  0.75000000  0.86325164  0.86778608  1.0
  Co  Co4  1  0.75000000  0.00937141  0.38759769  1.0
  Co  Co5  1  0.75000000  0.50937141  0.11240231  1.0
  Co  Co6  1  0.25000000  0.99062859  0.61240231  1.0
  Co  Co7  1  0.25000000  0.49062859  0.88759769  1.0
  B  B8  1  0.25000000  0.66535096  0.67167259  1.0
  B  B9  1  0.75000000  0.33464904  0.32832741  1.0
  B  B10  1  0.25000000  0.16535096  0.82832741  1.0
  B  B11  1  0.75000000  0.83464904  0.17167259  1.0
  B  B12  1  0.25000000  0.72926955  0.07675818  1.0
  B  B13  1  0.75000000  0.77073045  0.57675818  1.0
  B  B14  1  0.25000000  0.22926955  0.42324182  1.0
  B  B15  1  0.75000000  0.27073045  0.92324182  1.0