# generated using pymatgen
data_Zn5NiN4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92397513
_cell_length_b   8.49860416
_cell_length_c   5.35896723
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn5NiN4
_chemical_formula_sum   'Zn10 Ni2 N8'
_cell_volume   269.79999016
_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
  Zn  Zn0  1  0.71119600  0.26067600  0.32382100  1
  Zn  Zn1  1  0.71119600  0.26067600  0.67617900  1
  Zn  Zn2  1  0.71119600  0.73932400  0.32382100  1
  Zn  Zn3  1  0.71119600  0.73932400  0.67617900  1
  Zn  Zn4  1  0.28880400  0.23932400  0.17617900  1
  Zn  Zn5  1  0.28880400  0.23932400  0.82382100  1
  Zn  Zn6  1  0.28880400  0.76067600  0.17617900  1
  Zn  Zn7  1  0.28880400  0.76067600  0.82382100  1
  Zn  Zn8  1  0.22332200  0.50000000  0.50000000  1
  Zn  Zn9  1  0.77667800  0.00000000  0.00000000  1
  Ni  Ni10  1  0.12146400  0.00000000  0.50000000  1
  Ni  Ni11  1  0.87853600  0.50000000  0.00000000  1
  N  N12  1  0.94593600  0.74919300  0.50000000  1
  N  N13  1  0.94593600  0.25080700  0.50000000  1
  N  N14  1  0.05406400  0.75080700  0.00000000  1
  N  N15  1  0.05406400  0.24919300  0.00000000  1
  N  N16  1  0.43344400  0.50000000  0.29882400  1
  N  N17  1  0.43344400  0.50000000  0.70117600  1
  N  N18  1  0.56655600  0.00000000  0.20117600  1
  N  N19  1  0.56655600  0.00000000  0.79882400  1
