Hi all!
I have file1 which looks like this:
Code
Nº de átomos totales
157
Información atómica individual
NA RX(A) RY(A) RZ(A) EPSILON(eV) SIGMA(A) Q (e) FVX FVY FVZ MOL
79 12.4923970000 0.0000000000 0.0000000000 0.00150 3.217 0.0000 0 0 0 0
79 7.4954386000 0.0000000000 0.0000000000 0.00150 3.217 0.0000 0 0 0 0
79 9.9939184000 1.4424978000 0.0000000000 0.00150 3.217 0.0000 0 0 0 0
79 12.4923970000 2.8849957000 0.0000000000 0.00150 3.217 0.0000 0 0 0 0
79 2.4984796000 0.0000000000 0.0000000000 0.00150 3.217 0.0000 0 0 0 0
79 4.9969592000 1.4424978000 0.0000000000 0.00150 3.217 0.0000 0 0 0 0
7 9.9940004349 10.0970001221 10.0670000000 0.02250 3.660 0.0000 1 1 1 1
6 9.9687515010 10.9408269779 11.2463665363 0.00512 3.905 0.0000 1 1 1 1
6 9.9946844294 10.0741408239 12.4876889268 0.00512 3.905 0.0000 1 1 1 1
.
.
(the file is longer)
And file2 which look like:
Code
Au 12.90881 0.72125 87.57815
Au 7.91185 0.72125 87.57815
Au 10.41033 2.16375 87.57815
Au 12.90881 3.60625 87.57815
Au 2.91489 0.72125 87.57815
Au 5.41337 2.16375 87.57815
N 10.41104 10.81936 96.97897
C 11.10785 11.56856 98.02487
C 10.28173 11.54696 99.31489
.
.
What I want to do is replace columns $2 $3 and $4 from file2 into therespective columns of file1. So the final result would look like:
Code
Nº de átomos totales
157
Información atómica individual
NA RX(A) RY(A) RZ(A) EPSILON(eV) SIGMA(A) Q (e) FVX FVY FVZ MOL
79 12.90881 0.72125 87.57815 0.00150 3.217 0.0000 0 0 0 0
79 7.91185 0.72125 87.57815 0.00150 3.217 0.0000 0 0 0 0
79 10.41033 2.16375 87.57815 0.00150 3.217 0.0000 0 0 0 0
79 12.90881 3.60625 87.57815 0.00150 3.217 0.0000 0 0 0 0
79 2.91489 0.72125 87.57815 0.00150 3.217 0.0000 0 0 0 0
79 5.41337 2.16375 87.57815 0.00150 3.217 0.0000 0 0 0 0
7 10.41104 10.81936 96.97897 0.02250 3.660 0.0000 1 1 1 1
6 11.10785 11.56856 98.02487 0.00512 3.905 0.0000 1 1 1 1
6 10.28173 11.54696 99.31489 0.00512 3.905 0.0000 1 1 1 1
.
.(the file is longer)
I hope I made my point clear and solve my problem.
Thanks a lot!!
11-26-2010