# generated using pymatgen
data_Sc2(NiP)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.64606884
_cell_length_b   9.97087674
_cell_length_c   12.19125135
_cell_angle_alpha   90.00543057
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2(NiP)3
_chemical_formula_sum   'Sc8 Ni12 P12'
_cell_volume   443.20688178
_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
  Sc  Sc0  1  0.25000000  0.07159741  0.21314562  1.0
  Sc  Sc1  1  0.75000000  0.92835003  0.78692305  1.0
  Sc  Sc2  1  0.75000000  0.57170233  0.28684275  1.0
  Sc  Sc3  1  0.25000000  0.42823583  0.71309112  1.0
  Sc  Sc4  1  0.25000000  0.15857589  0.49708057  1.0
  Sc  Sc5  1  0.75000000  0.84144906  0.50286207  1.0
  Sc  Sc6  1  0.75000000  0.65867002  0.00297677  1.0
  Sc  Sc7  1  0.25000000  0.34136243  0.99708424  1.0
  Ni  Ni8  1  0.25000000  0.72484021  0.66503347  1.0
  Ni  Ni9  1  0.75000000  0.27504741  0.33475684  1.0
  Ni  Ni10  1  0.75000000  0.22480950  0.83499343  1.0
  Ni  Ni11  1  0.25000000  0.77509059  0.16521660  1.0
  Ni  Ni12  1  0.25000000  0.36520775  0.21809202  1.0
  Ni  Ni13  1  0.75000000  0.63473364  0.78189473  1.0
  Ni  Ni14  1  0.75000000  0.86528407  0.28182691  1.0
  Ni  Ni15  1  0.25000000  0.13466017  0.71819341  1.0
  Ni  Ni16  1  0.25000000  0.59390443  0.48069820  1.0
  Ni  Ni17  1  0.75000000  0.40631325  0.51871197  1.0
  Ni  Ni18  1  0.75000000  0.09371873  0.01904047  1.0
  Ni  Ni19  1  0.25000000  0.90647132  0.98152291  1.0
  P  P20  1  0.25000000  0.94401622  0.62647551  1.0
  P  P21  1  0.75000000  0.05595581  0.37344895  1.0
  P  P22  1  0.75000000  0.44402364  0.87354409  1.0
  P  P23  1  0.25000000  0.55595310  0.12653702  1.0
  P  P24  1  0.25000000  0.39709540  0.39768269  1.0
  P  P25  1  0.75000000  0.60288040  0.60219326  1.0
  P  P26  1  0.75000000  0.89714245  0.10231916  1.0
  P  P27  1  0.25000000  0.10282673  0.89782364  1.0
  P  P28  1  0.25000000  0.76355489  0.35358080  1.0
  P  P29  1  0.75000000  0.23648444  0.64629548  1.0
  P  P30  1  0.75000000  0.26338423  0.14632472  1.0
  P  P31  1  0.25000000  0.73665562  0.85378654  1.0