# generated using pymatgen
data_La3FeNiS7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.20763009
_cell_length_b   10.20763009
_cell_length_c   5.89927900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000060
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La3FeNiS7
_chemical_formula_sum   'La6 Fe2 Ni2 S14'
_cell_volume   532.32812510
_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
  La  La0  1  0.62790100  0.85922300  0.24937300  1.0
  La  La1  1  0.14077700  0.76867800  0.24937300  1.0
  La  La2  1  0.23132200  0.37209900  0.24937300  1.0
  La  La3  1  0.37209900  0.14077700  0.74937300  1.0
  La  La4  1  0.85922300  0.23132200  0.74937300  1.0
  La  La5  1  0.76867800  0.62790100  0.74937300  1.0
  Fe  Fe6  1  0.33333300  0.66666700  0.83357100  1.0
  Fe  Fe7  1  0.66666700  0.33333300  0.33357100  1.0
  Ni  Ni8  1  0.00000000  0.00000000  0.47161600  1.0
  Ni  Ni9  1  0.00000000  0.00000000  0.97161600  1.0
  S  S10  1  0.77844700  0.91623300  0.72103200  1.0
  S  S11  1  0.08376700  0.86221500  0.72103200  1.0
  S  S12  1  0.13778500  0.22155300  0.72103200  1.0
  S  S13  1  0.22155300  0.08376700  0.22103200  1.0
  S  S14  1  0.91623300  0.13778500  0.22103200  1.0
  S  S15  1  0.86221500  0.77844700  0.22103200  1.0
  S  S16  1  0.48375500  0.58175400  0.97066900  1.0
  S  S17  1  0.41824600  0.90200100  0.97066900  1.0
  S  S18  1  0.09799900  0.51624500  0.97066900  1.0
  S  S19  1  0.51624500  0.41824600  0.47066900  1.0
  S  S20  1  0.58175400  0.09799900  0.47066900  1.0
  S  S21  1  0.90200100  0.48375500  0.47066900  1.0
  S  S22  1  0.33333300  0.66666700  0.46055200  1.0
  S  S23  1  0.66666700  0.33333300  0.96055200  1.0