From grzesb(+ at +)asp.biogeo.uw.edu.pl Tue Nov 23 04:38:12 1993
From: grzesb $#at#$ asp.biogeo.uw.edu.pl (Grzegorz Bakalarski)
To: rovshan "-at-" atlas.chemistry.uakron.edu

Dear dr Sadygov
Y should not use MOPAC 5 for any C.I. calculation. The code is wrong
( simply). Try to use MOPAC 93 ( or MOPAC7 or last version of MOPAC 6
[about 6.7]). In addition MOPAC 6 ( 6.0 or 6.1) has also bugs in C.I.
calculations.
Best regards
Grzegorz

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