# generated using pymatgen
data_NiP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45283493
_cell_length_b   5.45283493
_cell_length_c   5.45283493
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiP2
_chemical_formula_sum   'Ni4 P8'
_cell_volume   162.13136995
_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
  Ni  Ni0  1  0.00000000  0.50000000  0.50000000  1
  Ni  Ni1  1  0.50000000  0.50000000  0.00000000  1
  Ni  Ni2  1  0.50000000  0.00000000  0.50000000  1
  Ni  Ni3  1  0.00000000  0.00000000  0.00000000  1
  P  P4  1  0.38393600  0.11606400  0.88393600  1
  P  P5  1  0.11606400  0.88393600  0.38393600  1
  P  P6  1  0.88393600  0.38393600  0.11606400  1
  P  P7  1  0.61606400  0.61606400  0.61606400  1
  P  P8  1  0.38393600  0.38393600  0.38393600  1
  P  P9  1  0.11606400  0.61606400  0.88393600  1
  P  P10  1  0.88393600  0.11606400  0.61606400  1
  P  P11  1  0.61606400  0.88393600  0.11606400  1
