# Comments starts with #
# Structure Title
Formulae: SbSI COL=28264
# Space group
# If ITA number is given the default setting is used:
#  - unique axis b for groups within the monoclinic system
#  - the hexagonal axes for the groups within the hexagonal system  
#  - for the groups for which there are two origin choices, the origin two is the default one.
# If Hermann-Mauguin symbol is given the structure will be transformed to the default setting if necessary 
33
# Cell parameters
8.523 10.124 4.111 90. 90. 90.
# Number of atoms in the asymmetric unit
3
# Atom type   ID  Wyckoff Position  X       Y       Z       Occ.  Uiso      Scattering Factor
Sb            1   4C                0.1195  0.1238  0.2544  1     0.019965    
S             1   4C                0.8448  0.0468  0.2478  1     0.020934   
I             1   4C                0.5088  0.8284  0.2463  1     0.017493  
# Notes:
#  - If Wyckoff Positions are not known put a - in its place.
#  - If Uiso are not known leave blank
#  - If scattering factors labels are not known, leave blank