# generated using pymatgen
data_CaGa2Cu3(RuO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44540824
_cell_length_b   6.44540824
_cell_length_c   7.47204477
_cell_angle_alpha   54.78995921
_cell_angle_beta   54.78995921
_cell_angle_gamma   70.19718403
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaGa2Cu3(RuO6)2
_chemical_formula_sum   'Ca1 Ga2 Cu3 Ru2 O12'
_cell_volume   207.21035676
_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
  Ca  Ca0  1  0.00000000  0.00000000  0.00000000  1.0
  Ga  Ga1  1  0.50000000  0.00000000  0.50000000  1.0
  Ga  Ga2  1  0.00000000  0.50000000  0.50000000  1.0
  Cu  Cu3  1  0.50000000  0.50000000  0.00000000  1.0
  Cu  Cu4  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu5  1  0.00000000  0.00000000  0.50000000  1.0
  Ru  Ru6  1  0.00000000  0.50000000  0.00000000  1.0
  Ru  Ru7  1  0.50000000  0.00000000  0.00000000  1.0
  O  O8  1  0.82753500  0.82753500  0.47861100  1.0
  O  O9  1  0.17246500  0.17246500  0.52138900  1.0
  O  O10  1  0.82738000  0.82738000  0.86467000  1.0
  O  O11  1  0.17262000  0.17262000  0.13533000  1.0
  O  O12  1  0.30503900  0.68971600  0.83145700  1.0
  O  O13  1  0.69496100  0.31028400  0.16854300  1.0
  O  O14  1  0.68971600  0.30503900  0.83145700  1.0
  O  O15  1  0.31028400  0.69496100  0.16854300  1.0
  O  O16  1  0.13552200  0.48175700  0.69448300  1.0
  O  O17  1  0.86447800  0.51824300  0.30551700  1.0
  O  O18  1  0.51824300  0.86447800  0.30551700  1.0
  O  O19  1  0.48175700  0.13552200  0.69448300  1.0