# generated using pymatgen
data_NdMnO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.49970400
_cell_length_b   5.65781100
_cell_length_c   7.90017097
_cell_angle_alpha   89.42924992
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdMnO3
_chemical_formula_sum   'Nd4 Mn4 O12'
_cell_volume   245.81178103
_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
  Nd  Nd0  1  0.48436000  0.55262400  0.24849500  1.0
  Nd  Nd1  1  0.98436000  0.94737600  0.75150500  1.0
  Nd  Nd2  1  0.51564000  0.44737600  0.75150500  1.0
  Nd  Nd3  1  0.01564000  0.05262400  0.24849500  1.0
  Mn  Mn4  1  0.00000000  0.50000000  0.00000000  1.0
  Mn  Mn5  1  0.50000000  0.00000000  0.00000000  1.0
  Mn  Mn6  1  0.00000000  0.50000000  0.50000000  1.0
  Mn  Mn7  1  0.50000000  0.00000000  0.50000000  1.0
  O  O8  1  0.59448600  0.97299800  0.24001500  1.0
  O  O9  1  0.09448600  0.52700200  0.75998500  1.0
  O  O10  1  0.40551400  0.02700200  0.75998500  1.0
  O  O11  1  0.90551400  0.47299800  0.24001500  1.0
  O  O12  1  0.21315900  0.79520900  0.05341300  1.0
  O  O13  1  0.71315900  0.70479100  0.94658700  1.0
  O  O14  1  0.78684100  0.20479100  0.94658700  1.0
  O  O15  1  0.28684100  0.29520900  0.05341300  1.0
  O  O16  1  0.28765400  0.28968100  0.45092900  1.0
  O  O17  1  0.78765400  0.21031900  0.54907100  1.0
  O  O18  1  0.71234600  0.71031900  0.54907100  1.0
  O  O19  1  0.21234600  0.78968100  0.45092900  1.0