# generated using pymatgen
data_Zr4SnC2S
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.39647421
_cell_length_b   3.39647429
_cell_length_c   13.46521251
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000891
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr4SnC2S
_chemical_formula_sum   'Zr4 Sn1 C2 S1'
_cell_volume   134.52421223
_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
  Zr  Zr0  1  0.33333300  0.66666700  0.43011033  1.0
  Zr  Zr1  1  0.66666700  0.33333300  0.88569851  1.0
  Zr  Zr2  1  0.66666700  0.33333300  0.61430149  1.0
  Zr  Zr3  1  0.33333300  0.66666700  0.06988967  1.0
  Sn  Sn4  1  0.66666700  0.33333300  0.25000000  1.0
  C  C5  1  0.00000000  0.00000000  0.52158203  1.0
  C  C6  1  0.00000000  0.00000000  0.97841797  1.0
  S  S7  1  0.33333300  0.66666700  0.75000000  1.0