Subject: Too large Isotropic Fermi Contact Couplings

From: Arvydas Tamulis <tamulis$at$mserv.itpa.lt>
Date: Thu, 19 Aug 2004 15:57:48 +0300 (EEST)

Dear Colleagues,

Would you please to comment why we received too large large Isotropic Fermi 
Contact Couplings (71.9 MHz and 70.4 MHz) for H atoms in simple
neutral radical molecule (Oxygen atom is attached to benzene ring).
Calculations were performed by Gaussian03 in the framework of B3LYP EPR-II.

Thanking your in advance.
With best regards, Arvydas Tamulis