# generated using pymatgen
data_NbNiP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.41323752
_cell_length_b   3.35780282
_cell_length_c   12.20697661
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbNiP2
_chemical_formula_sum   'Nb4 Ni4 P8'
_cell_volume   221.88113830
_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  0.75000000  0.48410600  0.32969200  1
  Nb  Nb1  1  0.25000000  0.51589400  0.67030800  1
  Nb  Nb2  1  0.75000000  0.98410600  0.17030800  1
  Nb  Nb3  1  0.25000000  0.01589400  0.82969200  1
  Ni  Ni4  1  0.25000000  0.01918500  0.58504200  1
  Ni  Ni5  1  0.25000000  0.51918500  0.91495800  1
  Ni  Ni6  1  0.75000000  0.98081500  0.41495800  1
  Ni  Ni7  1  0.75000000  0.48081500  0.08504200  1
  P  P8  1  0.25000000  0.19178800  0.03606900  1
  P  P9  1  0.75000000  0.80821200  0.96393100  1
  P  P10  1  0.25000000  0.69178800  0.46393100  1
  P  P11  1  0.75000000  0.30821200  0.53606900  1
  P  P12  1  0.25000000  0.13615400  0.30981700  1
  P  P13  1  0.75000000  0.36384600  0.80981700  1
  P  P14  1  0.25000000  0.63615400  0.19018300  1
  P  P15  1  0.75000000  0.86384600  0.69018300  1
