# generated using pymatgen
data_Ca2TaMnO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.52133002
_cell_length_b   11.48296424
_cell_length_c   7.70880400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   86.11370277
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2TaMnO6
_chemical_formula_sum   'Ca8 Ta4 Mn4 O24'
_cell_volume   487.62382799
_cell_formula_units_Z   4
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  0.01795300  0.47629800  0.25000000  1.0
  Ca  Ca1  1  0.01795300  0.97629800  0.25000000  1.0
  Ca  Ca2  1  0.98204700  0.02370200  0.75000000  1.0
  Ca  Ca3  1  0.98204700  0.52370200  0.75000000  1.0
  Ca  Ca4  1  0.49402700  0.21684600  0.25000000  1.0
  Ca  Ca5  1  0.49402700  0.71684600  0.25000000  1.0
  Ca  Ca6  1  0.50597300  0.28315400  0.75000000  1.0
  Ca  Ca7  1  0.50597300  0.78315400  0.75000000  1.0
  Ta  Ta8  1  0.00000000  0.25000000  0.00000000  1.0
  Ta  Ta9  1  0.00000000  0.75000000  0.00000000  1.0
  Ta  Ta10  1  0.00000000  0.25000000  0.50000000  1.0
  Ta  Ta11  1  0.00000000  0.75000000  0.50000000  1.0
  Mn  Mn12  1  0.50000000  0.50000000  0.00000000  1.0
  Mn  Mn13  1  0.50000000  0.50000000  0.50000000  1.0
  Mn  Mn14  1  0.50000000  0.00000000  0.00000000  1.0
  Mn  Mn15  1  0.50000000  0.00000000  0.50000000  1.0
  O  O16  1  0.09771500  0.23600100  0.75000000  1.0
  O  O17  1  0.09771500  0.73600100  0.75000000  1.0
  O  O18  1  0.90228500  0.26399900  0.25000000  1.0
  O  O19  1  0.90228500  0.76399900  0.25000000  1.0
  O  O20  1  0.59510800  0.01396200  0.25000000  1.0
  O  O21  1  0.59510800  0.51396200  0.25000000  1.0
  O  O22  1  0.40489200  0.48603800  0.75000000  1.0
  O  O23  1  0.40489200  0.98603800  0.75000000  1.0
  O  O24  1  0.79809400  0.39858100  0.54835000  1.0
  O  O25  1  0.79809400  0.89858100  0.54835000  1.0
  O  O26  1  0.20190600  0.10141900  0.45165000  1.0
  O  O27  1  0.20190600  0.60141900  0.45165000  1.0
  O  O28  1  0.79809400  0.39858100  0.95165000  1.0
  O  O29  1  0.79809400  0.89858100  0.95165000  1.0
  O  O30  1  0.20190600  0.10141900  0.04835000  1.0
  O  O31  1  0.20190600  0.60141900  0.04835000  1.0
  O  O32  1  0.28083400  0.34257700  0.45147000  1.0
  O  O33  1  0.28083400  0.84257700  0.45147000  1.0
  O  O34  1  0.71916600  0.15742300  0.95147000  1.0
  O  O35  1  0.71916600  0.65742300  0.95147000  1.0
  O  O36  1  0.71916600  0.15742300  0.54853000  1.0
  O  O37  1  0.71916600  0.65742300  0.54853000  1.0
  O  O38  1  0.28083400  0.34257700  0.04853000  1.0
  O  O39  1  0.28083400  0.84257700  0.04853000  1.0