# generated using pymatgen
data_Mg3Co4Ni5B6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.81959967
_cell_length_b   4.85015834
_cell_length_c   8.67494744
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.20995399
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg3Co4Ni5B6
_chemical_formula_sum   'Mg3 Co4 Ni5 B6'
_cell_volume   175.24339736
_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  0.00000000  0.00000000  0.66792409  1.0
  Mg  Mg1  1  0.00000000  0.00000000  0.99874291  1.0
  Mg  Mg2  1  0.00000000  0.00000000  0.33333300  1.0
  Co  Co3  1  0.50000000  0.00000000  0.79523141  1.0
  Co  Co4  1  0.50000000  0.50000000  0.87143559  1.0
  Co  Co5  1  0.50000000  0.50000000  0.46187390  1.0
  Co  Co6  1  0.50000000  0.00000000  0.20479310  1.0
  Ni  Ni7  1  0.00000000  0.50000000  0.83333300  1.0
  Ni  Ni8  1  0.00000000  0.50000000  0.12755185  1.0
  Ni  Ni9  1  0.50000000  0.50000000  0.16715547  1.0
  Ni  Ni10  1  0.00000000  0.50000000  0.53911415  1.0
  Ni  Ni11  1  0.50000000  0.00000000  0.49951153  1.0
  B  B12  1  0.60220273  0.22077347  0.99946702  1.0
  B  B13  1  0.76382430  0.38191165  0.33333300  1.0
  B  B14  1  0.23617570  0.61808835  0.33333300  1.0
  B  B15  1  0.60220273  0.38142826  0.66719998  1.0
  B  B16  1  0.39779727  0.61857174  0.66719998  1.0
  B  B17  1  0.39779727  0.77922653  0.99946702  1.0