# generated using pymatgen
data_Sc3Si4Ni11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.93197330
_cell_length_b   7.93197330
_cell_length_c   8.32308293
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Si4Ni11
_chemical_formula_sum   'Sc6 Si8 Ni22'
_cell_volume   453.50005168
_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  0.80234100  0.60468300  0.75000000  1
  Sc  Sc1  1  0.19765900  0.80234100  0.25000000  1
  Sc  Sc2  1  0.60468300  0.80234100  0.25000000  1
  Sc  Sc3  1  0.39531700  0.19765900  0.75000000  1
  Sc  Sc4  1  0.80234100  0.19765900  0.75000000  1
  Sc  Sc5  1  0.19765900  0.39531700  0.25000000  1
  Si  Si6  1  0.00000000  0.00000000  0.75000000  1
  Si  Si7  1  0.50000000  0.00000000  0.00000000  1
  Si  Si8  1  0.50000000  0.50000000  0.50000000  1
  Si  Si9  1  0.00000000  0.50000000  0.50000000  1
  Si  Si10  1  0.00000000  0.50000000  0.00000000  1
  Si  Si11  1  0.50000000  0.50000000  0.00000000  1
  Si  Si12  1  0.50000000  0.00000000  0.50000000  1
  Si  Si13  1  0.00000000  0.00000000  0.25000000  1
  Ni  Ni14  1  0.84759700  0.69519500  0.09288200  1
  Ni  Ni15  1  0.69519500  0.84759700  0.90711800  1
  Ni  Ni16  1  0.15240300  0.30480500  0.90711800  1
  Ni  Ni17  1  0.15240300  0.84759700  0.90711800  1
  Ni  Ni18  1  0.30480500  0.15240300  0.40711800  1
  Ni  Ni19  1  0.43880100  0.56119900  0.75000000  1
  Ni  Ni20  1  0.12239800  0.56119900  0.75000000  1
  Ni  Ni21  1  0.87760200  0.43880100  0.25000000  1
  Ni  Ni22  1  0.56119900  0.43880100  0.25000000  1
  Ni  Ni23  1  0.43880100  0.87760200  0.75000000  1
  Ni  Ni24  1  0.33333300  0.66666700  0.00330900  1
  Ni  Ni25  1  0.66666700  0.33333300  0.50330900  1
  Ni  Ni26  1  0.66666700  0.33333300  0.99669100  1
  Ni  Ni27  1  0.33333300  0.66666700  0.49669100  1
  Ni  Ni28  1  0.84759700  0.15240300  0.40711800  1
  Ni  Ni29  1  0.84759700  0.69519500  0.40711800  1
  Ni  Ni30  1  0.15240300  0.84759700  0.59288200  1
  Ni  Ni31  1  0.69519500  0.84759700  0.59288200  1
  Ni  Ni32  1  0.30480500  0.15240300  0.09288200  1
  Ni  Ni33  1  0.84759700  0.15240300  0.09288200  1
  Ni  Ni34  1  0.15240300  0.30480500  0.59288200  1
  Ni  Ni35  1  0.56119900  0.12239800  0.25000000  1
