# generated using pymatgen
data_Sc3Si3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.96632596
_cell_length_b   5.21378536
_cell_length_c   13.09204399
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   112.35654902
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Si3Ni2
_chemical_formula_sum   'Sc6 Si6 Ni4'
_cell_volume   250.38779169
_cell_formula_units_Z   2
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  0.08377580  0.16755260  0.88884854  1.0
  Sc  Sc1  1  0.91622420  0.83244740  0.11115146  1.0
  Sc  Sc2  1  0.91622420  0.83244740  0.38884854  1.0
  Sc  Sc3  1  0.36201199  0.72402498  0.75000000  1.0
  Sc  Sc4  1  0.08377580  0.16755260  0.61115146  1.0
  Sc  Sc5  1  0.63798801  0.27597502  0.25000000  1.0
  Si  Si6  1  0.33889526  0.67779152  0.25000000  1.0
  Si  Si7  1  0.66110474  0.32220848  0.75000000  1.0
  Si  Si8  1  0.38277667  0.76555235  0.53883757  1.0
  Si  Si9  1  0.61722333  0.23444765  0.46116243  1.0
  Si  Si10  1  0.61722333  0.23444765  0.03883757  1.0
  Si  Si11  1  0.38277667  0.76555235  0.96116243  1.0
  Ni  Ni12  1  0.20791605  0.41583311  0.40368339  1.0
  Ni  Ni13  1  0.79208395  0.58416689  0.59631661  1.0
  Ni  Ni14  1  0.20791605  0.41583311  0.09631661  1.0
  Ni  Ni15  1  0.79208395  0.58416689  0.90368339  1.0