# generated using pymatgen
data_MgCu3(NiO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.26329591
_cell_length_b   6.26576809
_cell_length_c   6.28975529
_cell_angle_alpha   109.38395163
_cell_angle_beta   109.46384194
_cell_angle_gamma   109.43134537
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCu3(NiO3)4
_chemical_formula_sum   'Mg1 Cu3 Ni4 O12'
_cell_volume   190.33027226
_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
  Mg  Mg0  1  0.94805800  0.98140500  0.92305100  1.0
  Cu  Cu1  1  0.48531300  0.49235700  0.97886100  1.0
  Cu  Cu2  1  0.98574000  0.49590700  0.48146800  1.0
  Cu  Cu3  1  0.49284900  0.99302100  0.48593900  1.0
  Ni  Ni4  1  0.98832500  0.99506800  0.47472500  1.0
  Ni  Ni5  1  0.98834900  0.49690500  0.98159200  1.0
  Ni  Ni6  1  0.48040400  0.48716500  0.47575500  1.0
  Ni  Ni7  1  0.48489900  0.99290200  0.98150300  1.0
  O  O8  1  0.83587300  0.28393300  0.12023900  1.0
  O  O9  1  0.13387800  0.70798900  0.84170600  1.0
  O  O10  1  0.79461000  0.66471400  0.45986600  1.0
  O  O11  1  0.28721400  0.46641000  0.14254200  1.0
  O  O12  1  0.47159300  0.16324200  0.29522300  1.0
  O  O13  1  0.13202100  0.82134800  0.29662300  1.0
  O  O14  1  0.67394200  0.85411100  0.14307600  1.0
  O  O15  1  0.51939400  0.82514200  0.67898500  1.0
  O  O16  1  0.18128000  0.33366400  0.51426000  1.0
  O  O17  1  0.68427100  0.51788700  0.81535500  1.0
  O  O18  1  0.85397000  0.16142600  0.67779400  1.0
  O  O19  1  0.29676100  0.12998500  0.81477000  1.0