# generated using pymatgen
data_Y5Sc2Ni17P12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.17113798
_cell_length_b   12.13597698
_cell_length_c   3.77254095
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.90448203
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y5Sc2Ni17P12
_chemical_formula_sum   'Y5 Sc2 Ni17 P12'
_cell_volume   483.04515437
_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
  Y  Y0  1  0.66756428  0.33301980  0.00000000  1.0
  Y  Y1  1  0.33243572  0.66545552  0.00000000  1.0
  Y  Y2  1  0.18484495  0.18373516  0.50000000  1.0
  Y  Y3  1  0.81515505  0.99889021  0.50000000  1.0
  Y  Y4  1  0.00000000  0.80885738  0.50000000  1.0
  Sc  Sc5  1  0.56625309  0.56533236  0.00000000  1.0
  Sc  Sc6  1  0.43374691  0.99907927  0.00000000  1.0
  Ni  Ni7  1  1.00000000  0.44411770  0.00000000  1.0
  Ni  Ni8  1  0.82304955  0.20169944  0.00000000  1.0
  Ni  Ni9  1  0.81171758  0.61928625  0.00000000  1.0
  Ni  Ni10  1  0.37685774  0.18811739  0.00000000  1.0
  Ni  Ni11  1  0.18828242  0.80756767  0.00000000  1.0
  Ni  Ni12  1  0.62314226  0.81125965  0.00000000  1.0
  Ni  Ni13  1  0.17695045  0.37864989  0.00000000  1.0
  Ni  Ni14  1  0.64169409  0.12393676  0.50000000  1.0
  Ni  Ni15  1  0.87720607  0.50973855  0.50000000  1.0
  Ni  Ni16  1  0.48589497  0.36317993  0.50000000  1.0
  Ni  Ni17  1  0.12279393  0.63253148  0.50000000  1.0
  Ni  Ni18  1  0.51410503  0.87728496  0.50000000  1.0
  Ni  Ni19  1  0.35830591  0.48224267  0.50000000  1.0
  Ni  Ni20  1  0.72295873  0.72429071  0.50000000  1.0
  Ni  Ni21  1  0.27704127  0.00133199  0.50000000  1.0
  Ni  Ni22  1  1.00000000  0.28356678  0.50000000  1.0
  Ni  Ni23  1  1.00000000  0.99971298  0.00000000  1.0
  P  P24  1  0.35347882  0.36079222  0.00000000  1.0
  P  P25  1  0.64652118  0.00731340  0.00000000  1.0
  P  P26  1  0.00000000  0.62740206  0.00000000  1.0
  P  P27  1  0.83413080  0.31018840  0.50000000  1.0
  P  P28  1  0.69784420  0.52502031  0.50000000  1.0
  P  P29  1  0.47541174  0.17222401  0.50000000  1.0
  P  P30  1  0.30215580  0.82717711  0.50000000  1.0
  P  P31  1  0.52458826  0.69681326  0.50000000  1.0
  P  P32  1  0.16586920  0.47605760  0.50000000  1.0
  P  P33  1  0.82366142  0.81981061  0.00000000  1.0
  P  P34  1  0.17633858  0.99614919  0.00000000  1.0
  P  P35  1  1.00000000  0.17817233  0.00000000  1.0