HKL file
The file name.hkl should contain all measured reflections in SHELX
format. For each reflection the direction cosines must be given, as
explained in the SHELX-76 manual. The file name.hkl is therefore
independent from the diffractometer that was used.
h k l Fsq Sig ib d(6)
format (3i4,2f8.0,i4,6f8.5)
Note for users of Denzo/Scalepack
Denzo should use the same orientation matrix for all scans (the Nonius program
Supergui provides this automatically). Scalepack should not scale the data,
write direction cosines, and use a Scale Restrain of 0.00001.