# generated using pymatgen
data_Ni3(SnS)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39101079
_cell_length_b   5.39101048
_cell_length_c   5.39101115
_cell_angle_alpha   61.36681984
_cell_angle_beta   61.36683524
_cell_angle_gamma   61.36682010
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni3(SnS)2
_chemical_formula_sum   'Ni3 Sn2 S2'
_cell_volume   114.19108456
_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
  Ni  Ni0  1  0.50000000  0.50000000  0.00000000  1.0
  Ni  Ni1  1  -0.00000000  0.50000000  0.50000000  1.0
  Ni  Ni2  1  0.50000000  0.00000000  0.50000000  1.0
  Sn  Sn3  1  -0.00000000  0.00000000  0.00000000  1.0
  Sn  Sn4  1  0.50000000  0.50000000  0.50000000  1.0
  S  S5  1  0.22070633  0.22070633  0.22070633  1.0
  S  S6  1  0.77929367  0.77929367  0.77929367  1.0