# generated using pymatgen
data_Lu5Nb3(Ni4P3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.12238882
_cell_length_b   12.12238785
_cell_length_c   3.70692585
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000266
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu5Nb3(Ni4P3)4
_chemical_formula_sum   'Lu5 Nb3 Ni16 P12'
_cell_volume   471.75977049
_cell_formula_units_Z   1
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
  Lu  Lu0  1  0.18385717  0.18385717  0.50000000  1.0
  Lu  Lu1  1  0.81614283  0.00000000  0.50000000  1.0
  Lu  Lu2  1  1.00000000  0.81614283  0.50000000  1.0
  Lu  Lu3  1  0.33333300  0.66666700  0.00000000  1.0
  Lu  Lu4  1  0.66666700  0.33333300  0.00000000  1.0
  Nb  Nb5  1  0.55940243  0.55940243  0.00000000  1.0
  Nb  Nb6  1  0.44059757  0.00000000  0.00000000  1.0
  Nb  Nb7  1  1.00000000  0.44059757  0.00000000  1.0
  Ni  Ni8  1  0.72401504  0.72401504  0.50000000  1.0
  Ni  Ni9  1  0.27598496  0.00000000  0.50000000  1.0
  Ni  Ni10  1  0.00000000  0.27598496  0.50000000  1.0
  Ni  Ni11  1  0.18321697  0.37382671  0.00000000  1.0
  Ni  Ni12  1  0.62617329  0.80939026  0.00000000  1.0
  Ni  Ni13  1  0.19060974  0.81678303  0.00000000  1.0
  Ni  Ni14  1  0.80939026  0.62617329  0.00000000  1.0
  Ni  Ni15  1  0.81678303  0.19060974  0.00000000  1.0
  Ni  Ni16  1  0.37382671  0.18321697  0.00000000  1.0
  Ni  Ni17  1  0.35798699  0.48525540  0.50000000  1.0
  Ni  Ni18  1  0.51474460  0.87273259  0.50000000  1.0
  Ni  Ni19  1  0.12726741  0.64201301  0.50000000  1.0
  Ni  Ni20  1  0.87273259  0.51474460  0.50000000  1.0
  Ni  Ni21  1  0.64201301  0.12726741  0.50000000  1.0
  Ni  Ni22  1  0.48525540  0.35798699  0.50000000  1.0
  Ni  Ni23  1  0.00000000  0.00000000  0.00000000  1.0
  P  P24  1  0.82339236  0.82339236  0.00000000  1.0
  P  P25  1  0.17660764  0.00000000  0.00000000  1.0
  P  P26  1  0.00000000  0.17660764  0.00000000  1.0
  P  P27  1  0.16840426  0.47900229  0.50000000  1.0
  P  P28  1  0.52099771  0.68940197  0.50000000  1.0
  P  P29  1  0.31059803  0.83159574  0.50000000  1.0
  P  P30  1  0.68940197  0.52099771  0.50000000  1.0
  P  P31  1  0.83159574  0.31059803  0.50000000  1.0
  P  P32  1  0.47900229  0.16840426  0.50000000  1.0
  P  P33  1  0.35874528  0.35874528  0.00000000  1.0
  P  P34  1  0.64125472  0.00000000  0.00000000  1.0
  P  P35  1  0.00000000  0.64125472  0.00000000  1.0