# generated using pymatgen
data_Ni17(GeSe)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.60070270
_cell_length_b   3.60070270
_cell_length_c   25.42978404
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni17(GeSe)4
_chemical_formula_sum   'Ni17 Ge4 Se4'
_cell_volume   329.69867418
_cell_formula_units_Z   1
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
  Ni  Ni0  1  0.00000000  0.50000000  0.50038900  1
  Ni  Ni1  1  0.50000000  0.00000000  0.00004200  1
  Ni  Ni2  1  0.50000000  0.00000000  0.50038900  1
  Ni  Ni3  1  0.00000000  0.50000000  0.00004200  1
  Ni  Ni4  1  0.00000000  0.50000000  0.36250100  1
  Ni  Ni5  1  0.50000000  0.00000000  0.86086800  1
  Ni  Ni6  1  0.50000000  0.00000000  0.36250100  1
  Ni  Ni7  1  0.00000000  0.50000000  0.86086800  1
  Ni  Ni8  1  0.50000000  0.00000000  0.13917200  1
  Ni  Ni9  1  0.00000000  0.50000000  0.63918200  1
  Ni  Ni10  1  0.00000000  0.50000000  0.13917200  1
  Ni  Ni11  1  0.50000000  0.00000000  0.63918200  1
  Ni  Ni12  1  0.00000000  0.00000000  0.43233500  1
  Ni  Ni13  1  0.50000000  0.50000000  0.93123500  1
  Ni  Ni14  1  0.50000000  0.50000000  0.06873900  1
  Ni  Ni15  1  0.00000000  0.00000000  0.56907400  1
  Ni  Ni16  1  0.50000000  0.50000000  0.28635100  1
  Ge  Ge17  1  0.50000000  0.50000000  0.42971200  1
  Ge  Ge18  1  0.00000000  0.00000000  0.92923400  1
  Ge  Ge19  1  0.00000000  0.00000000  0.07048500  1
  Ge  Ge20  1  0.50000000  0.50000000  0.57006200  1
  Se  Se21  1  0.00000000  0.00000000  0.29843800  1
  Se  Se22  1  0.50000000  0.50000000  0.80278900  1
  Se  Se23  1  0.50000000  0.50000000  0.19665000  1
  Se  Se24  1  0.00000000  0.00000000  0.69718600  1
