CRYSTALS string
A file containing peak coordinates is created in CRYSTALS format.
COMPLETE
To produce a complete QUICKSTART file for CRYSTALS.
SHELX string
A file containing peak coordinates is created in SHELXL-93 format.
MOLDRAW string
A file containing peak coordinates is created in MOLDRAW format.
SCHAKAL string
A file containing peak coordinates is created in SCHAKAL format.
MOLPLOT string
A file containing peak coordinates is created in MOLPLOT format.
XYZ string
A file containing peak coordinates is created in XYZ format (Cartesian coordinates).