# generated using pymatgen
data_NbNiP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.58880657
_cell_length_b   6.13078566
_cell_length_c   7.07341726
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbNiP
_chemical_formula_sum   'Nb4 Ni4 P4'
_cell_volume   155.63076851
_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  0.52063387  0.33314174  1.0
  Nb  Nb1  1  0.25000000  0.02063387  0.16685826  1.0
  Nb  Nb2  1  0.75000000  0.97936613  0.83314174  1.0
  Nb  Nb3  1  0.75000000  0.47936613  0.66685826  1.0
  Ni  Ni4  1  0.75000000  0.34928893  0.06847988  1.0
  Ni  Ni5  1  0.25000000  0.15071107  0.56847988  1.0
  Ni  Ni6  1  0.75000000  0.84928893  0.43152012  1.0
  Ni  Ni7  1  0.25000000  0.65071107  0.93152012  1.0
  P  P8  1  0.25000000  0.78507476  0.62024628  1.0
  P  P9  1  0.25000000  0.28507476  0.87975372  1.0
  P  P10  1  0.75000000  0.21492524  0.37975372  1.0
  P  P11  1  0.75000000  0.71492524  0.12024628  1.0