# generated using pymatgen
data_Ba6Ca2Ta(RuO6)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.00582708
_cell_length_b   6.00592100
_cell_length_c   14.91165701
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00363034
_cell_angle_gamma   59.99948823
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba6Ca2Ta(RuO6)3
_chemical_formula_sum   'Ba6 Ca2 Ta1 Ru3 O18'
_cell_volume   465.80777802
_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  0.33335400  0.33332300  0.60296300  1.0
  Ba  Ba1  1  0.66667400  0.66666300  0.40394100  1.0
  Ba  Ba2  1  0.66666300  0.66666800  0.10070100  1.0
  Ba  Ba3  1  0.33332900  0.33333600  0.90173100  1.0
  Ba  Ba4  1  0.99999900  0.00000000  0.75032000  1.0
  Ba  Ba5  1  0.00001100  0.99999500  0.24803900  1.0
  Ca  Ca6  1  0.00001500  0.99999300  0.50153100  1.0
  Ca  Ca7  1  0.99999100  0.00000500  0.00010300  1.0
  Ta  Ta8  1  0.33334400  0.33332800  0.34529000  1.0
  Ru  Ru9  1  0.66667900  0.66666000  0.65794100  1.0
  Ru  Ru10  1  0.66664000  0.66668000  0.84352900  1.0
  Ru  Ru11  1  0.33336300  0.33331900  0.15603000  1.0
  O  O12  1  0.17354700  0.65292800  0.40887100  1.0
  O  O13  1  0.65295100  0.17352500  0.40886800  1.0
  O  O14  1  0.17354700  0.17352500  0.40887100  1.0
  O  O15  1  0.82271600  0.35454300  0.59024400  1.0
  O  O16  1  0.35454900  0.82272600  0.59024100  1.0
  O  O17  1  0.82271600  0.82274100  0.59024400  1.0
  O  O18  1  0.82329500  0.35336400  0.90989700  1.0
  O  O19  1  0.35336200  0.82331900  0.90989000  1.0
  O  O20  1  0.82329500  0.82334100  0.90989700  1.0
  O  O21  1  0.17709900  0.64577800  0.08874000  1.0
  O  O22  1  0.64580900  0.17709500  0.08876900  1.0
  O  O23  1  0.17709900  0.17712400  0.08874000  1.0
  O  O24  1  0.51665700  0.96668100  0.75004800  1.0
  O  O25  1  0.96666800  0.51666600  0.75005100  1.0
  O  O26  1  0.51665700  0.51666200  0.75004800  1.0
  O  O27  1  0.48345300  0.03308100  0.24815400  1.0
  O  O28  1  0.03306700  0.48346700  0.24815400  1.0
  O  O29  1  0.48345300  0.48346600  0.24815400  1.0