data_global
_chemical_name_mineral 'Rosickyite'
loop_
_publ_author_name
'Steudel R'
'Steidel J'
'Reinhardt R'
_journal_name_full 'Zeitschrift fur Naturforschung'
_journal_volume B38 
_journal_year 1983
_journal_page_first 1548
_journal_page_last 1556
_publ_section_title
;
 X-ray structural analyses of cyclodecasulfur (S10) and of a
 cyclohexasulfur-cyclodecasulfur molecular addition compound (S6*S10)
 Sample: at T = 163 K
;
_database_code_amcsd 0015841
_chemical_compound_source 'Synthetic'
_chemical_formula_sum 'S5'
_cell_length_a 12.533
_cell_length_b 10.275
_cell_length_c 12.776
_cell_angle_alpha 90
_cell_angle_beta 37.98
_cell_angle_gamma 90
_cell_volume 1012.464
_exptl_crystal_density_diffrn      2.104
_symmetry_space_group_name_H-M 'C 1 2/c 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,z'
  'x,-y,1/2+z'
  '1/2+x,1/2-y,1/2+z'
  '-x,y,1/2-z'
  '1/2-x,1/2+y,1/2-z'
  '-x,-y,-z'
  '1/2-x,1/2-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
S1   0.59590   0.28780   0.73080
S2   0.76090   0.44010   0.56400
S3   0.76570   0.55170   0.69310
S4   0.54570   0.66270   0.87260
S5   0.59470   0.81440   0.73210
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
S1 0.02540 0.01940 0.03260 -0.00070 -0.02360 0.00360
S2 0.02180 0.02010 0.02890 -0.00010 -0.01820 -0.00060
S3 0.02640 0.02530 0.04370 0.00340 -0.02970 -0.00440
S4 0.02630 0.03140 0.02670 0.00460 -0.02160 -0.00310
S5 0.02630 0.02090 0.03550 -0.00300 -0.02510 0.00030