# generated using pymatgen
data_Ba4Nd4Ti3Mn(Cu2O11)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.55719321
_cell_length_b   5.55719321
_cell_length_c   15.97814700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4Nd4Ti3Mn(Cu2O11)2
_chemical_formula_sum   'Ba4 Nd4 Ti3 Mn1 Cu4 O22'
_cell_volume   493.44346817
_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  0.50000000  0.00000000  0.76408400  1.0
  Ba  Ba1  1  0.00000000  0.50000000  0.76408400  1.0
  Ba  Ba2  1  0.50000000  0.00000000  0.23360400  1.0
  Ba  Ba3  1  0.00000000  0.50000000  0.23360400  1.0
  Nd  Nd4  1  0.50000000  0.00000000  0.99953800  1.0
  Nd  Nd5  1  0.00000000  0.50000000  0.99953800  1.0
  Nd  Nd6  1  0.50000000  0.00000000  0.50157700  1.0
  Nd  Nd7  1  0.00000000  0.50000000  0.50157700  1.0
  Ti  Ti8  1  0.50000000  0.50000000  0.62605800  1.0
  Ti  Ti9  1  0.00000000  0.00000000  0.37480400  1.0
  Ti  Ti10  1  0.50000000  0.50000000  0.37453700  1.0
  Mn  Mn11  1  0.00000000  0.00000000  0.62314300  1.0
  Cu  Cu12  1  0.00000000  0.00000000  0.89070800  1.0
  Cu  Cu13  1  0.50000000  0.50000000  0.89207100  1.0
  Cu  Cu14  1  0.00000000  0.00000000  0.10742800  1.0
  Cu  Cu15  1  0.50000000  0.50000000  0.10764900  1.0
  O  O16  1  0.24996600  0.24996600  0.90389800  1.0
  O  O17  1  0.75003400  0.75003400  0.90389800  1.0
  O  O18  1  0.24996600  0.75003400  0.90389800  1.0
  O  O19  1  0.75003400  0.24996600  0.90389800  1.0
  O  O20  1  0.24988600  0.24988600  0.09635300  1.0
  O  O21  1  0.75011400  0.75011400  0.09635300  1.0
  O  O22  1  0.24988600  0.75011400  0.09635300  1.0
  O  O23  1  0.75011400  0.24988600  0.09635300  1.0
  O  O24  1  0.00000000  0.00000000  0.74035200  1.0
  O  O25  1  0.50000000  0.50000000  0.74165400  1.0
  O  O26  1  0.00000000  0.00000000  0.25910000  1.0
  O  O27  1  0.50000000  0.50000000  0.25829500  1.0
  O  O28  1  0.24735800  0.24735800  0.61228800  1.0
  O  O29  1  0.75264200  0.75264200  0.61228800  1.0
  O  O30  1  0.24735800  0.75264200  0.61228800  1.0
  O  O31  1  0.75264200  0.24735800  0.61228800  1.0
  O  O32  1  0.25004400  0.25004400  0.38823000  1.0
  O  O33  1  0.74995600  0.74995600  0.38823000  1.0
  O  O34  1  0.25004400  0.74995600  0.38823000  1.0
  O  O35  1  0.74995600  0.25004400  0.38823000  1.0
  O  O36  1  0.00000000  0.00000000  0.50213800  1.0
  O  O37  1  0.50000000  0.50000000  0.50137700  1.0