# generated using pymatgen
data_Mg2TaNiO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.10962817
_cell_length_b   5.39557530
_cell_length_c   7.51286800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   87.78236724
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2TaNiO6
_chemical_formula_sum   'Mg4 Ta2 Ni2 O12'
_cell_volume   206.97001413
_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
  Mg  Mg0  1  0.02662600  0.94833100  0.25000000  1.0
  Mg  Mg1  1  0.48707700  0.42681200  0.25000000  1.0
  Mg  Mg2  1  0.51292300  0.57318800  0.75000000  1.0
  Mg  Mg3  1  0.97337400  0.05166900  0.75000000  1.0
  Ta  Ta4  1  0.00000000  0.50000000  0.00000000  1.0
  Ta  Ta5  1  0.00000000  0.50000000  0.50000000  1.0
  Ni  Ni6  1  0.50000000  0.00000000  0.00000000  1.0
  Ni  Ni7  1  0.50000000  0.00000000  0.50000000  1.0
  O  O8  1  0.81425900  0.81355900  0.56697500  1.0
  O  O9  1  0.30833300  0.68214500  0.43031400  1.0
  O  O10  1  0.18574100  0.18644100  0.43302500  1.0
  O  O11  1  0.69166700  0.31785500  0.93031400  1.0
  O  O12  1  0.13488200  0.44610900  0.75000000  1.0
  O  O13  1  0.69166700  0.31785500  0.56968600  1.0
  O  O14  1  0.30833300  0.68214500  0.06968600  1.0
  O  O15  1  0.81425900  0.81355900  0.93302500  1.0
  O  O16  1  0.63464300  0.06523500  0.25000000  1.0
  O  O17  1  0.18574100  0.18644100  0.06697500  1.0
  O  O18  1  0.36535700  0.93476500  0.75000000  1.0
  O  O19  1  0.86511700  0.55389100  0.25000000  1.0