# generated using pymatgen
data_SnS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.95685521
_cell_length_b   4.53281069
_cell_length_c   11.39201851
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnS
_chemical_formula_sum   'Sn4 S4'
_cell_volume   204.32354836
_cell_formula_units_Z   4
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
  Sn  Sn0  1  0.25000000  0.36953984  0.62163275  1.0
  Sn  Sn1  1  0.75000000  0.63046016  0.37836725  1.0
  Sn  Sn2  1  0.75000000  0.86953984  0.87836725  1.0
  Sn  Sn3  1  0.25000000  0.13046016  0.12163275  1.0
  S  S4  1  0.25000000  0.01059680  0.34749746  1.0
  S  S5  1  0.75000000  0.98940320  0.65250254  1.0
  S  S6  1  0.75000000  0.51059680  0.15250254  1.0
  S  S7  1  0.25000000  0.48940320  0.84749746  1.0