# generated using pymatgen
data_CaMn3Cu3RuO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.40376388
_cell_length_b   6.47964110
_cell_length_c   6.47856752
_cell_angle_alpha   70.38629723
_cell_angle_beta   109.29433555
_cell_angle_gamma   70.73450973
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMn3Cu3RuO12
_chemical_formula_sum   'Ca1 Mn3 Cu3 Ru1 O12'
_cell_volume   207.54872283
_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  0.00000400  0.99999600  1.0
  Mn  Mn1  1  0.49999300  0.49997600  0.50001000  1.0
  Mn  Mn2  1  0.00000500  0.99999500  0.49999900  1.0
  Mn  Mn3  1  0.99999600  0.50000700  0.00000500  1.0
  Cu  Cu4  1  0.99999600  0.49999700  0.50000200  1.0
  Cu  Cu5  1  0.50000700  0.99999600  0.50000200  1.0
  Cu  Cu6  1  0.50000000  0.50000300  0.99999800  1.0
  Ru  Ru7  1  0.49999600  0.00000400  0.00000300  1.0
  O  O8  1  0.82740600  0.69835500  0.13967100  1.0
  O  O9  1  0.17258900  0.30165700  0.86032700  1.0
  O  O10  1  0.52623400  0.16129000  0.69899500  1.0
  O  O11  1  0.47376400  0.83870400  0.30100600  1.0
  O  O12  1  0.31159300  0.86044700  0.83793000  1.0
  O  O13  1  0.68840800  0.13955600  0.16206800  1.0
  O  O14  1  0.18070000  0.68038900  0.48573400  1.0
  O  O15  1  0.81930900  0.31960800  0.51426200  1.0
  O  O16  1  0.86099800  0.83449700  0.67995900  1.0
  O  O17  1  0.13900700  0.16550600  0.32003700  1.0
  O  O18  1  0.30481500  0.51460400  0.16584900  1.0
  O  O19  1  0.69518300  0.48540300  0.83414800  1.0