# generated using pymatgen
data_Sc4Al4Fe3Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.12008990
_cell_length_b   5.18016619
_cell_length_c   8.38790613
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.38846527
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc4Al4Fe3Ni
_chemical_formula_sum   'Sc4 Al4 Fe3 Ni1'
_cell_volume   191.90757254
_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
  Sc  Sc0  1  0.66754566  0.33377249  0.55304424  1.0
  Sc  Sc1  1  0.33576313  0.66788221  0.42567181  1.0
  Sc  Sc2  1  0.33576313  0.66788221  0.07432819  1.0
  Sc  Sc3  1  0.66754566  0.33377249  0.94695576  1.0
  Al  Al4  1  0.98546568  0.99273525  0.49316685  1.0
  Al  Al5  1  0.98546568  0.99273525  0.00683315  1.0
  Al  Al6  1  0.18028948  0.34573722  0.75000000  1.0
  Al  Al7  1  0.18028243  0.83454596  0.75000000  1.0
  Fe  Fe8  1  0.82388992  0.64879107  0.25000000  1.0
  Fe  Fe9  1  0.82388860  0.17509385  0.25000000  1.0
  Fe  Fe10  1  0.34280336  0.17139846  0.25000000  1.0
  Ni  Ni11  1  0.67129428  0.83565453  0.75000000  1.0