# generated using pymatgen
data_Ba5Mg18Ge13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.66883682
_cell_length_b   14.66883495
_cell_length_c   4.51078019
_cell_angle_alpha   89.99962811
_cell_angle_beta   89.99962839
_cell_angle_gamma   120.00088578
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba5Mg18Ge13
_chemical_formula_sum   'Ba5 Mg18 Ge13'
_cell_volume   840.56193528
_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
  Ba  Ba0  1  0.33333253  0.66667006  0.99722818  1.0
  Ba  Ba1  1  0.66667002  0.33333225  0.99722821  1.0
  Ba  Ba2  1  0.82061583  -0.00000437  0.49622649  1.0
  Ba  Ba3  1  -0.00000459  0.82061555  0.49622616  1.0
  Ba  Ba4  1  0.17938395  0.17938427  0.49621823  1.0
  Mg  Mg5  1  0.44112833  0.00003095  0.00465304  1.0
  Mg  Mg6  1  0.00003102  0.44112826  0.00465312  1.0
  Mg  Mg7  1  0.55889337  0.55889335  0.00464623  1.0
  Mg  Mg8  1  0.51615934  0.87757127  0.49570869  1.0
  Mg  Mg9  1  0.12243619  0.63858586  0.49576412  1.0
  Mg  Mg10  1  0.36139577  0.48384497  0.49570976  1.0
  Mg  Mg11  1  0.63858595  0.12243592  0.49576480  1.0
  Mg  Mg12  1  0.48384484  0.36139561  0.49571009  1.0
  Mg  Mg13  1  0.87757136  0.51615940  0.49570909  1.0
  Mg  Mg14  1  0.82192578  0.19783170  0.99719337  1.0
  Mg  Mg15  1  0.80216841  0.62408774  0.99714999  1.0
  Mg  Mg16  1  0.37589936  0.17807567  0.99715823  1.0
  Mg  Mg17  1  0.62408798  0.80216840  0.99715079  1.0
  Mg  Mg18  1  0.17807584  0.37589942  0.99715834  1.0
  Mg  Mg19  1  0.19783166  0.82192560  0.99719343  1.0
  Mg  Mg20  1  0.28206912  -0.00000631  0.50048200  1.0
  Mg  Mg21  1  -0.00000599  0.28206938  0.50048220  1.0
  Mg  Mg22  1  0.71791775  0.71791776  0.50049016  1.0
  Ge  Ge23  1  0.62874103  -0.00000054  0.99645934  1.0
  Ge  Ge24  1  -0.00000032  0.62874087  0.99645941  1.0
  Ge  Ge25  1  0.37126529  0.37126532  0.99645056  1.0
  Ge  Ge26  1  0.52270300  0.69110491  0.49702270  1.0
  Ge  Ge27  1  0.30888736  0.83159229  0.49703313  1.0
  Ge  Ge28  1  0.16840144  0.47729297  0.49701962  1.0
  Ge  Ge29  1  0.83159255  0.30888732  0.49703293  1.0
  Ge  Ge30  1  0.47729280  0.16840092  0.49701932  1.0
  Ge  Ge31  1  0.69110493  0.52270293  0.49702209  1.0
  Ge  Ge32  1  0.17428892  0.00000416  0.00104278  1.0
  Ge  Ge33  1  0.00000439  0.17428913  0.00104270  1.0
  Ge  Ge34  1  0.82570647  0.82570662  0.00104796  1.0
  Ge  Ge35  1  -0.00000067  -0.00000063  0.97576174  1.0