# generated using pymatgen
data_CdGa(Ni7B2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.37203212
_cell_length_b   7.37203211
_cell_length_c   7.37203199
_cell_angle_alpha   60.00000491
_cell_angle_beta   60.00000494
_cell_angle_gamma   60.00000578
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdGa(Ni7B2)3
_chemical_formula_sum   'Cd1 Ga1 Ni21 B6'
_cell_volume   283.30008273
_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
  Cd  Cd0  1  0.75000000  0.75000000  0.75000000  1.0
  Ga  Ga1  1  0.25000000  0.25000000  0.25000000  1.0
  Ni  Ni2  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni3  1  0.61068377  0.61068377  0.16794870  1.0
  Ni  Ni4  1  0.61068377  0.16794870  0.61068377  1.0
  Ni  Ni5  1  0.16794870  0.61068377  0.61068377  1.0
  Ni  Ni6  1  0.61068377  0.61068377  0.61068377  1.0
  Ni  Ni7  1  0.37983031  0.37983031  0.86051107  1.0
  Ni  Ni8  1  0.37983031  0.86051107  0.37983031  1.0
  Ni  Ni9  1  0.86051107  0.37983031  0.37983031  1.0
  Ni  Ni10  1  0.37983031  0.37983031  0.37983031  1.0
  Ni  Ni11  1  0.00043292  0.00043292  0.33613468  1.0
  Ni  Ni12  1  0.66299948  0.00043292  0.33613468  1.0
  Ni  Ni13  1  0.00043292  0.66299948  0.33613468  1.0
  Ni  Ni14  1  0.66299948  0.33613468  0.00043292  1.0
  Ni  Ni15  1  0.00043292  0.33613468  0.00043292  1.0
  Ni  Ni16  1  0.00043292  0.33613468  0.66299948  1.0
  Ni  Ni17  1  0.33613468  0.66299948  0.00043292  1.0
  Ni  Ni18  1  0.33613468  0.00043292  0.66299948  1.0
  Ni  Ni19  1  0.33613468  0.00043292  0.00043292  1.0
  Ni  Ni20  1  0.00043292  0.00043292  0.66299948  1.0
  Ni  Ni21  1  0.00043292  0.66299948  0.00043292  1.0
  Ni  Ni22  1  0.66299948  0.00043292  0.00043292  1.0
  B  B23  1  0.72712281  0.72712281  0.27287719  1.0
  B  B24  1  0.27287719  0.72712281  0.27287719  1.0
  B  B25  1  0.72712281  0.27287719  0.27287719  1.0
  B  B26  1  0.27287719  0.27287719  0.72712281  1.0
  B  B27  1  0.72712281  0.27287719  0.72712281  1.0
  B  B28  1  0.27287719  0.72712281  0.72712281  1.0