# generated using pymatgen
data_YSi3Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.94042832
_cell_length_b   21.04579337
_cell_length_c   3.95879692
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YSi3Ni
_chemical_formula_sum   'Y4 Si12 Ni4'
_cell_volume   328.30081249
_cell_formula_units_Z   4
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
  Y  Y0  1  0.00000000  0.66895400  0.50000000  1
  Y  Y1  1  0.50000000  0.83104600  0.50000000  1
  Y  Y2  1  0.50000000  0.16895400  0.50000000  1
  Y  Y3  1  0.00000000  0.33104600  0.50000000  1
  Si  Si4  1  0.00000000  0.55599000  0.00000000  1
  Si  Si5  1  0.50000000  0.94401000  0.00000000  1
  Si  Si6  1  0.00000000  0.78219600  0.00000000  1
  Si  Si7  1  0.50000000  0.71780400  0.00000000  1
  Si  Si8  1  0.50000000  0.55597300  0.50000000  1
  Si  Si9  1  0.00000000  0.94402700  0.50000000  1
  Si  Si10  1  0.50000000  0.05599000  0.00000000  1
  Si  Si11  1  0.00000000  0.44401000  0.00000000  1
  Si  Si12  1  0.50000000  0.28219600  0.00000000  1
  Si  Si13  1  0.00000000  0.21780400  0.00000000  1
  Si  Si14  1  0.00000000  0.05597300  0.50000000  1
  Si  Si15  1  0.50000000  0.44402700  0.50000000  1
  Ni  Ni16  1  0.00000000  0.88999600  0.00000000  1
  Ni  Ni17  1  0.50000000  0.61000400  0.00000000  1
  Ni  Ni18  1  0.50000000  0.38999600  0.00000000  1
  Ni  Ni19  1  0.00000000  0.11000400  0.00000000  1
