data_image0
_chemical_formula_structural       SnBr2ClCs
_chemical_formula_sum              "Sn1 Br2 Cl1 Cs1"
_cell_length_a       5.77943541911733
_cell_length_b       5.77943541911733
_cell_length_c       5.481211990019082
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    90.0

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  '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  Sn1       1.0  2.2058460105057642e-30  0.0  8.633824351353811e-19  1.0000
  Br  Br1       1.0  0.5029822665561474  1.5087601397359715e-19  5.326052214412749e-20  1.0000
  Br  Br2       1.0  0.0  0.5029822665561474  2.5027867139360764e-20  1.0000
  Cl  Cl1       1.0  7.21260944850311e-20  1.1205303964717101e-20  0.49900605430580036  1.0000
  Cs  Cs1       1.0  0.5029822665561474  0.5029822665561474  0.49900605430580036  1.0000