# generated using pymatgen
data_NiP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84769018
_cell_length_b   5.84769018
_cell_length_c   4.93297343
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.52684713
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiP
_chemical_formula_sum   'Ni6 P6'
_cell_volume   146.77735799
_cell_formula_units_Z   6
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  0.59032268  0.29739683  0.88669289  1.0
  Ni  Ni1  1  0.29739683  0.59032268  0.88669289  1.0
  Ni  Ni2  1  0.40967732  0.70260317  0.38669289  1.0
  Ni  Ni3  1  0.70260317  0.40967732  0.38669289  1.0
  Ni  Ni4  1  0.94689668  0.94689668  0.35690680  1.0
  Ni  Ni5  1  0.05310332  0.05310332  0.85690680  1.0
  P  P6  1  0.34738565  0.02729409  0.54966276  1.0
  P  P7  1  0.02729409  0.34738565  0.54966276  1.0
  P  P8  1  0.65261435  0.97270591  0.04966276  1.0
  P  P9  1  0.97270591  0.65261435  0.04966276  1.0
  P  P10  1  0.68822255  0.68822255  0.69908192  1.0
  P  P11  1  0.31177745  0.31177745  0.19908192  1.0