patterson

resolution 100 2.5

! list 100 ! uncomment this to get input FFT terms (fftkw.abcoeffs)

exclude SIG1 4 SIG2 4 DIFF 2800

! The correct fft spacegroup will be chosen automatically

! fftspacegroup 47   ! Orignal space group + no trans + center of sym

title  2.5A AU - NAT patterson - excluding 4 sig , and Diso > 180.

grid 88 144 80  ! this grid is finer than the default

xyzlim 0 44 0 72 0 40

labin F1=FAU20 SIG1=SIGFAU20 F2=FTOXD3  SIG2=SIGFTOXD3