#!/bin/sh

#!/bin/sh
xyz2pipe -in lp1/testlp%03d.ft3  -x -verb               \
| nmrPipe  -fn POLY -auto -x1  11.1ppm -xn 5.9ppm -ord 2 \
| nmrPipe  -fn POLY -auto -x1  5.9ppm -xn 4.9ppm -ord 2 \
| nmrPipe  -fn POLY -auto -x1 4.60ppm -xn -1.00ppm -ord 2 \
| pipe2xyz -out pipe_base/simnoesy%03d.ft4 -x
xyz2pipe -in pipe_base/simnoesy%03d.ft4  -y -verb               \
| nmrPipe  -fn POLY -auto -x1  11.1ppm -xn 4.79ppm -ord 3 \
| nmrPipe  -fn POLY -auto -x1 4.70ppm -xn -1.00ppm -ord 3 \
| pipe2xyz -out pipe_base/simnoesy%03d.ft5 -y
xyz2pipe -in pipe_base/simnoesy%03d.ft5  -z -verb               \
| nmrPipe  -fn POLY -auto -ord 1  \
| pipe2xyz -out pipe_base/simnoesy%03d.ft6 -z

xyz2pipe -in pipe_base/simnoesy%03d.ft6 -x -verb > simnoesyB.ft
showhdr -verb pipe_base/simnoesy%03d.ft6 > simnoesyB.header