# generated using pymatgen
data_NaCa2(AsRu)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.41560301
_cell_length_b   8.41560457
_cell_length_c   5.97481084
_cell_angle_alpha   78.88221277
_cell_angle_beta   78.88220928
_cell_angle_gamma   41.06311569
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaCa2(AsRu)6
_chemical_formula_sum   'Na1 Ca2 As6 Ru6'
_cell_volume   272.00698933
_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
  Na  Na0  1  0.00000000  0.00000000  0.00000000  1.0
  Ca  Ca1  1  0.66538225  0.66538225  0.66988404  1.0
  Ca  Ca2  1  0.33461775  0.33461775  0.33011596  1.0
  As  As3  1  0.87857925  0.87857925  0.50877461  1.0
  As  As4  1  0.21063290  0.21063290  0.84742649  1.0
  As  As5  1  0.54565994  0.54565994  0.17953951  1.0
  As  As6  1  0.45434006  0.45434006  0.82046049  1.0
  As  As7  1  0.78936710  0.78936710  0.15257351  1.0
  As  As8  1  0.12142075  0.12142075  0.49122539  1.0
  Ru  Ru9  1  0.08235420  0.58221258  0.82913065  1.0
  Ru  Ru10  1  0.41778742  0.91764580  0.17086935  1.0
  Ru  Ru11  1  0.74985626  0.25014374  0.50000000  1.0
  Ru  Ru12  1  0.25014374  0.74985626  0.50000000  1.0
  Ru  Ru13  1  0.58221258  0.08235420  0.82913065  1.0
  Ru  Ru14  1  0.91764580  0.41778742  0.17086935  1.0