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From: Jiri Czernek <czernek |-at-| chemi.muni.cz>
Message-Id: <200004301153.NAA12225 ":at:" bilbo.chemi.muni.cz>
Subject: SUMMARY: MP2 paramagnetic shielding in g98
To: chemistry # - at - # ccl.net
Date: Sun, 30 Apr 2000 13:53:14 +0200 (MEST)
Cc: czernek%!at!%bilbo.chemi.muni.cz (Jiri Czernek)
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     Dear CCL-ers ,

Nearly one month ago I asked

~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
I run Gaussian 98:  SGI64-G98RevA.7 with NMR=GIAO IOP33(10=1) keywords and 
wanted to get the paramagnetic part of shielding tensors calculated at the
MP2 level. However, only  SCF GIAO Paramagnetic Magnetic shielding tensor (ppm)
^^^                       ^^^
is printed in the output. 
Can you tell me how this data can be obtained, please.
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~

Immediately I obtained a considerable number of wrong answers :-) Thanks anyway!
OK, the solution is to use IOP(11/33=2) NMR=PRINTEIGENVECTORS in the route 
section.


Cordially,
Jiri Czernek