# generated using pymatgen
data_CaMnCu3(RuO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.49901122
_cell_length_b   6.49901122
_cell_length_c   6.53665929
_cell_angle_alpha   70.41138947
_cell_angle_beta   70.41138947
_cell_angle_gamma   109.35357607
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaMnCu3(RuO4)3
_chemical_formula_sum   'Ca1 Mn1 Cu3 Ru3 O12'
_cell_volume   212.22536809
_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
  Mn  Mn1  1  0.00000000  0.00000000  0.50000000  1.0
  Cu  Cu2  1  0.50000000  0.00000000  0.50000000  1.0
  Cu  Cu3  1  0.50000000  0.50000000  0.00000000  1.0
  Cu  Cu4  1  0.00000000  0.50000000  0.50000000  1.0
  Ru  Ru5  1  0.00000000  0.50000000  0.00000000  1.0
  Ru  Ru6  1  0.50000000  0.50000000  0.50000000  1.0
  Ru  Ru7  1  0.50000000  0.00000000  0.00000000  1.0
  O  O8  1  0.13809400  0.81983900  0.70284300  1.0
  O  O9  1  0.47826100  0.16974600  0.69229600  1.0
  O  O10  1  0.52173900  0.83025400  0.30770400  1.0
  O  O11  1  0.86190600  0.18016100  0.29715700  1.0
  O  O12  1  0.68174500  0.86190600  0.84093700  1.0
  O  O13  1  0.69148500  0.52173900  0.17055700  1.0
  O  O14  1  0.30851500  0.47826100  0.82944300  1.0
  O  O15  1  0.31825500  0.13809400  0.15906300  1.0
  O  O16  1  0.18016100  0.31825500  0.52268200  1.0
  O  O17  1  0.83025400  0.30851500  0.86204200  1.0
  O  O18  1  0.16974600  0.69148500  0.13795800  1.0
  O  O19  1  0.81983900  0.68174500  0.47731800  1.0