# generated using pymatgen
data_Li4Nb2Fe3Cu3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.94720496
_cell_length_b   5.96472993
_cell_length_c   9.73557534
_cell_angle_alpha   89.86207199
_cell_angle_beta   89.71774202
_cell_angle_gamma   120.01021784
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Nb2Fe3Cu3O16
_chemical_formula_sum   'Li4 Nb2 Fe3 Cu3 O16'
_cell_volume   299.04674327
_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
  Li  Li0  1  0.32730300  0.66440200  0.90484000  1
  Li  Li1  1  0.01259000  0.00687600  0.99153200  1
  Li  Li2  1  0.01012900  0.00517400  0.48991900  1
  Li  Li3  1  0.65580200  0.32758300  0.40033900  1
  Nb  Nb4  1  0.33825300  0.66855900  0.49579100  1
  Nb  Nb5  1  0.66646600  0.33475000  0.99625200  1
  Fe  Fe6  1  0.65841400  0.82975000  0.21498000  1
  Fe  Fe7  1  0.83117600  0.65842100  0.71799900  1
  Fe  Fe8  1  0.83065900  0.17204800  0.71836800  1
  Cu  Cu9  1  0.16894200  0.82893100  0.21557800  1
  Cu  Cu10  1  0.16893600  0.34020400  0.21548100  1
  Cu  Cu11  1  0.34338700  0.17223800  0.71541800  1
  O  O12  1  0.15556700  0.81977200  0.58642000  1
  O  O13  1  0.03645700  0.51778400  0.34129000  1
  O  O14  1  0.32622000  0.66331500  0.11179500  1
  O  O15  1  0.00259400  0.00136500  0.30317400  1
  O  O16  1  0.00947300  0.00382600  0.80258600  1
  O  O17  1  0.15951400  0.33384600  0.58792400  1
  O  O18  1  0.48114000  0.96138200  0.34338900  1
  O  O19  1  0.48109200  0.51941200  0.34324000  1
  O  O20  1  0.33701300  0.16811000  0.09263100  1
  O  O21  1  0.66529400  0.83288400  0.59316200  1
  O  O22  1  0.52431900  0.48812800  0.84746900  1
  O  O23  1  0.52119400  0.03799600  0.84581700  1
  O  O24  1  0.66131500  0.33098700  0.61051000  1
  O  O25  1  0.83084000  0.66761600  0.09032100  1
  O  O26  1  0.96610100  0.48205600  0.84203100  1
  O  O27  1  0.82981300  0.16288700  0.08958700  1
