# generated using pymatgen
data_SnCNCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.42552900
_cell_length_b   7.19000236
_cell_length_c   7.31201877
_cell_angle_alpha   90.04649613
_cell_angle_beta   90.65892213
_cell_angle_gamma   92.45875069
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnCNCl3
_chemical_formula_sum   'Sn2 C2 N2 Cl6'
_cell_volume   337.47850569
_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
  Sn  Sn0  1  0.59423300  0.49352800  0.99464900  1.0
  Sn  Sn1  1  0.48096700  0.98432600  0.49471000  1.0
  C  C2  1  0.06225800  0.95801300  0.05756500  1.0
  C  C3  1  0.95593700  0.38400400  0.51083700  1.0
  N  N4  1  0.89731900  0.01770500  0.02628200  1.0
  N  N5  1  0.95895400  0.54682200  0.50808200  1.0
  Cl  Cl6  1  0.45670800  0.24943000  0.20665700  1.0
  Cl  Cl7  1  0.95449400  0.15829300  0.51386800  1.0
  Cl  Cl8  1  0.95854800  0.49079800  0.98681600  1.0
  Cl  Cl9  1  0.49072300  0.72644200  0.24075600  1.0
  Cl  Cl10  1  0.45082300  0.29391700  0.73704500  1.0
  Cl  Cl11  1  0.49803700  0.77372100  0.78373400  1.0