# generated using pymatgen
data_Ca2Nd2MnNiO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.47474150
_cell_length_b   5.47474150
_cell_length_c   11.93068600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.04808656
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2Nd2MnNiO8
_chemical_formula_sum   'Ca4 Nd4 Mn2 Ni2 O16'
_cell_volume   357.59587386
_cell_formula_units_Z   2
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  0.48649200  0.51350800  0.86376800  1.0
  Ca  Ca1  1  0.01350800  0.98649200  0.86376800  1.0
  Ca  Ca2  1  0.51350800  0.48649200  0.13623200  1.0
  Ca  Ca3  1  0.98649200  0.01350800  0.13623200  1.0
  Nd  Nd4  1  0.98431600  0.48431600  0.64535700  1.0
  Nd  Nd5  1  0.51568400  0.01568400  0.64535700  1.0
  Nd  Nd6  1  0.01568400  0.51568400  0.35464300  1.0
  Nd  Nd7  1  0.48431600  0.98431600  0.35464300  1.0
  Mn  Mn8  1  0.00000000  0.50000000  0.00000000  1.0
  Mn  Mn9  1  0.50000000  0.00000000  0.00000000  1.0
  Ni  Ni10  1  0.50000000  0.50000000  0.50000000  1.0
  Ni  Ni11  1  0.00000000  0.00000000  0.50000000  1.0
  O  O12  1  0.54535500  0.45464500  0.67767100  1.0
  O  O13  1  0.95464500  0.04535500  0.67767100  1.0
  O  O14  1  0.03662000  0.53662000  0.83555000  1.0
  O  O15  1  0.46338000  0.96338000  0.83555000  1.0
  O  O16  1  0.45464500  0.54535500  0.32232900  1.0
  O  O17  1  0.04535500  0.95464500  0.32232900  1.0
  O  O18  1  0.96338000  0.46338000  0.16445000  1.0
  O  O19  1  0.53662000  0.03662000  0.16445000  1.0
  O  O20  1  0.75000000  0.25000000  0.47352400  1.0
  O  O21  1  0.25000000  0.75000000  0.02249300  1.0
  O  O22  1  0.25000000  0.75000000  0.52647600  1.0
  O  O23  1  0.75000000  0.25000000  0.97750700  1.0
  O  O24  1  0.75000000  0.75000000  0.50000000  1.0
  O  O25  1  0.25000000  0.25000000  0.00000000  1.0
  O  O26  1  0.25000000  0.25000000  0.50000000  1.0
  O  O27  1  0.75000000  0.75000000  0.00000000  1.0