# generated using pymatgen
data_Mg3Ni6GeB2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97976877
_cell_length_b   4.97976942
_cell_length_c   13.25907710
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000217
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg3Ni6GeB2
_chemical_formula_sum   'Mg6 Ni12 Ge2 B4'
_cell_volume   284.74907988
_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
  Mg  Mg0  1  0.66666700  0.33333300  0.53390161  1.0
  Mg  Mg1  1  0.33333300  0.66666700  0.46609839  1.0
  Mg  Mg2  1  0.33333300  0.66666700  0.03390161  1.0
  Mg  Mg3  1  0.66666700  0.33333300  0.75000000  1.0
  Mg  Mg4  1  0.66666700  0.33333300  0.96609839  1.0
  Mg  Mg5  1  0.33333300  0.66666700  0.25000000  1.0
  Ni  Ni6  1  0.16674902  0.33349803  0.64755302  1.0
  Ni  Ni7  1  0.33349803  0.16674902  0.35244698  1.0
  Ni  Ni8  1  0.33349803  0.16674902  0.14755302  1.0
  Ni  Ni9  1  0.16674902  0.83325098  0.85244698  1.0
  Ni  Ni10  1  0.83325098  0.66650197  0.35244698  1.0
  Ni  Ni11  1  0.83325098  0.16674902  0.14755302  1.0
  Ni  Ni12  1  0.66650197  0.83325098  0.64755302  1.0
  Ni  Ni13  1  0.66650197  0.83325098  0.85244698  1.0
  Ni  Ni14  1  0.16674902  0.83325098  0.64755302  1.0
  Ni  Ni15  1  0.83325098  0.66650197  0.14755302  1.0
  Ni  Ni16  1  0.16674902  0.33349803  0.85244698  1.0
  Ni  Ni17  1  0.83325098  0.16674902  0.35244698  1.0
  Ge  Ge18  1  0.00000000  0.00000000  0.00000000  1.0
  Ge  Ge19  1  0.00000000  0.00000000  0.50000000  1.0
  B  B20  1  0.66666700  0.33333300  0.25000000  1.0
  B  B21  1  0.00000000  0.00000000  0.75000000  1.0
  B  B22  1  0.33333300  0.66666700  0.75000000  1.0
  B  B23  1  0.00000000  0.00000000  0.25000000  1.0