# generated using pymatgen
data_ZrSc2(AlNi)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.91563769
_cell_length_b   6.92668133
_cell_length_c   3.41589110
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.94726819
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrSc2(AlNi)3
_chemical_formula_sum   'Zr1 Sc2 Al3 Ni3'
_cell_volume   141.78249374
_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
  Zr  Zr0  1  0.41365632  0.00000000  0.50000000  1.0
  Sc  Sc1  1  0.99955337  0.41145750  0.50000000  1.0
  Sc  Sc2  1  0.58809587  0.58854250  0.50000000  1.0
  Al  Al3  1  0.99795762  0.74814376  0.00000000  1.0
  Al  Al4  1  0.24981386  0.25185624  0.00000000  1.0
  Al  Al5  1  0.75299517  1.00000000  0.00000000  1.0
  Ni  Ni6  1  0.00290337  1.00000000  0.50000000  1.0
  Ni  Ni7  1  0.33292861  0.67083280  0.00000000  1.0
  Ni  Ni8  1  0.66209681  0.32916720  0.00000000  1.0