# generated using pymatgen
data_NbCoP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.14740308
_cell_length_b   3.60925582
_cell_length_c   6.97250456
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbCoP
_chemical_formula_sum   'Nb4 Co4 P4'
_cell_volume   154.70279595
_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  0.52598700  0.67268300  1
  Nb  Nb1  1  0.25000000  0.02598700  0.82731700  1
  Nb  Nb2  1  0.75000000  0.97401300  0.17268300  1
  Nb  Nb3  1  0.75000000  0.47401300  0.32731700  1
  Co  Co4  1  0.75000000  0.35441000  0.93864600  1
  Co  Co5  1  0.25000000  0.14559000  0.43864600  1
  Co  Co6  1  0.75000000  0.85441000  0.56135400  1
  Co  Co7  1  0.25000000  0.64559000  0.06135400  1
  P  P8  1  0.25000000  0.77806100  0.37992300  1
  P  P9  1  0.25000000  0.27806100  0.12007700  1
  P  P10  1  0.75000000  0.22193900  0.62007700  1
  P  P11  1  0.75000000  0.72193900  0.87992300  1
