# generated using pymatgen
data_ScSi3Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.48199976
_cell_length_b   10.48199976
_cell_length_c   3.82633472
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   158.93871527
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScSi3Ni
_chemical_formula_sum   'Sc2 Si6 Ni2'
_cell_volume   151.08057286
_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  0.16914014  0.83085986  0.00000000  1.0
  Sc  Sc1  1  0.83085986  0.16914014  -0.00000000  1.0
  Si  Si2  1  0.71801002  0.28198998  0.50000000  1.0
  Si  Si3  1  0.44307161  0.55692839  -0.00000000  1.0
  Si  Si4  1  0.28198998  0.71801002  0.50000000  1.0
  Si  Si5  1  0.55692839  0.44307161  -0.00000000  1.0
  Si  Si6  1  0.94291248  0.05708752  0.50000000  1.0
  Si  Si7  1  0.05708752  0.94291248  0.50000000  1.0
  Ni  Ni8  1  0.61212406  0.38787594  0.50000000  1.0
  Ni  Ni9  1  0.38787594  0.61212406  0.50000000  1.0