# generated using pymatgen
data_Mg3Zn(Ni3B)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95887188
_cell_length_b   4.95887302
_cell_length_c   7.30883235
_cell_angle_alpha   110.12355242
_cell_angle_beta   110.12355551
_cell_angle_gamma   59.96688647
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg3Zn(Ni3B)2
_chemical_formula_sum   'Mg3 Zn1 Ni6 B2'
_cell_volume   142.79555381
_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
  Mg  Mg0  1  0.35690213  0.35690213  0.07119152  1.0
  Mg  Mg1  1  0.50000000  0.50000000  0.50000100  1.0
  Mg  Mg2  1  0.64309787  0.64309787  0.92880848  1.0
  Zn  Zn3  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni4  1  0.93064954  0.93064954  0.29658197  1.0
  Ni  Ni5  1  0.93145343  0.43363251  0.29786635  1.0
  Ni  Ni6  1  0.43363251  0.93145343  0.29786635  1.0
  Ni  Ni7  1  0.56636649  0.06854557  0.70213365  1.0
  Ni  Ni8  1  0.06854557  0.56636649  0.70213365  1.0
  Ni  Ni9  1  0.06934946  0.06934946  0.70341803  1.0
  B  B10  1  0.83443306  0.83443306  0.50106830  1.0
  B  B11  1  0.16556594  0.16556594  0.49893170  1.0