# generated using pymatgen
data_La6Mg2Cd21As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.08857128
_cell_length_b   10.08857135
_cell_length_c   10.09752033
_cell_angle_alpha   59.97064939
_cell_angle_beta   59.97064916
_cell_angle_gamma   60.19491900
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La6Mg2Cd21As
_chemical_formula_sum   'La6 Mg2 Cd21 As1'
_cell_volume   727.44702257
_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
  La  La0  1  0.78907992  0.78907992  0.21092008  1.0
  La  La1  1  0.20907522  0.79092478  0.21100739  1.0
  La  La2  1  0.79092478  0.20907522  0.21100739  1.0
  La  La3  1  0.21092008  0.21092008  0.78907992  1.0
  La  La4  1  0.79092478  0.20907522  0.78899261  1.0
  La  La5  1  0.20907522  0.79092478  0.78899261  1.0
  Mg  Mg6  1  0.50000000  0.50000000  0.00000000  1.0
  Mg  Mg7  1  0.50000000  0.50000000  0.50000000  1.0
  Cd  Cd8  1  0.82956127  0.82956127  0.51032438  1.0
  Cd  Cd9  1  0.82882629  0.50887945  0.83114663  1.0
  Cd  Cd10  1  0.50887945  0.82882629  0.83114663  1.0
  Cd  Cd11  1  0.82956127  0.82956127  0.83055409  1.0
  Cd  Cd12  1  0.17043873  0.17043873  0.48967562  1.0
  Cd  Cd13  1  0.17117371  0.49112055  0.16885337  1.0
  Cd  Cd14  1  0.49112055  0.17117371  0.16885337  1.0
  Cd  Cd15  1  0.17043873  0.17043873  0.16944591  1.0
  Cd  Cd16  1  0.62101926  0.62101926  0.13208643  1.0
  Cd  Cd17  1  0.62144043  0.13218706  0.62318475  1.0
  Cd  Cd18  1  0.13218706  0.62144043  0.62318475  1.0
  Cd  Cd19  1  0.62101926  0.62101926  0.62587505  1.0
  Cd  Cd20  1  0.37898074  0.37898074  0.86791357  1.0
  Cd  Cd21  1  0.37855957  0.86781294  0.37681525  1.0
  Cd  Cd22  1  0.86781294  0.37855957  0.37681525  1.0
  Cd  Cd23  1  0.37898074  0.37898074  0.37412495  1.0
  Cd  Cd24  1  0.00000000  0.00000000  0.50000000  1.0
  Cd  Cd25  1  0.50000000  0.00000000  0.50000000  1.0
  Cd  Cd26  1  0.00000000  0.50000000  0.50000000  1.0
  Cd  Cd27  1  0.00000000  0.50000000  0.00000000  1.0
  Cd  Cd28  1  0.50000000  0.00000000  0.00000000  1.0
  As  As29  1  0.00000000  0.00000000  0.00000000  1.0