# generated using pymatgen
data_YNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.96799452
_cell_length_b   4.96799452
_cell_length_c   24.37536496
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YNi3
_chemical_formula_sum   'Y9 Ni27'
_cell_volume   521.00749967
_cell_formula_units_Z   9
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  0.00000000  0.86132900  1
  Y  Y1  1  0.33333300  0.66666700  0.80533800  1
  Y  Y2  1  0.00000000  0.00000000  0.00000000  1
  Y  Y3  1  0.66666700  0.33333300  0.19466200  1
  Y  Y4  1  0.00000000  0.00000000  0.13867100  1
  Y  Y5  1  0.66666700  0.33333300  0.33333300  1
  Y  Y6  1  0.33333300  0.66666700  0.52799500  1
  Y  Y7  1  0.66666700  0.33333300  0.47200500  1
  Y  Y8  1  0.33333300  0.66666700  0.66666700  1
  Ni  Ni9  1  0.49960900  0.99921800  0.91827300  1
  Ni  Ni10  1  0.49960900  0.50039100  0.91827300  1
  Ni  Ni11  1  0.66666700  0.33333300  0.83333300  1
  Ni  Ni12  1  0.33255200  0.16627600  0.74839300  1
  Ni  Ni13  1  0.83372400  0.66744800  0.74839300  1
  Ni  Ni14  1  0.33333300  0.66666700  0.99991000  1
  Ni  Ni15  1  0.00078200  0.50039100  0.91827300  1
  Ni  Ni16  1  0.00000000  0.00000000  0.66675700  1
  Ni  Ni17  1  0.83372400  0.16627600  0.74839300  1
  Ni  Ni18  1  0.16627600  0.33255200  0.25160700  1
  Ni  Ni19  1  0.16627600  0.83372400  0.25160700  1
  Ni  Ni20  1  0.33333300  0.66666700  0.16666700  1
  Ni  Ni21  1  0.99921800  0.49960900  0.08172700  1
  Ni  Ni22  1  0.50039100  0.00078200  0.08172700  1
  Ni  Ni23  1  0.00000000  0.00000000  0.33324300  1
  Ni  Ni24  1  0.66744800  0.83372400  0.25160700  1
  Ni  Ni25  1  0.66666700  0.33333300  0.00009000  1
  Ni  Ni26  1  0.50039100  0.49960900  0.08172700  1
  Ni  Ni27  1  0.83294300  0.66588500  0.58494000  1
  Ni  Ni28  1  0.83294300  0.16705700  0.58494000  1
  Ni  Ni29  1  0.00000000  0.00000000  0.50000000  1
  Ni  Ni30  1  0.66588500  0.83294300  0.41506000  1
  Ni  Ni31  1  0.16705700  0.33411500  0.41506000  1
  Ni  Ni32  1  0.66666700  0.33333300  0.66657700  1
  Ni  Ni33  1  0.33411500  0.16705700  0.58494000  1
  Ni  Ni34  1  0.33333300  0.66666700  0.33342300  1
  Ni  Ni35  1  0.16705700  0.83294300  0.41506000  1
