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Revision 1 as of 2016-09-22 00:58:19

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location: Electronic states of IBr+ from IBr as reference

Input:

{{

$TRAINT orbi hforb $END

$CCSDSO MEMMEGA 40000 itriple 0 ifdebug 0 maxTcyc 100 threshT 10 $END

$EOMIPSO MEMMEGA 40000 nroots 8 0 0 0 0 0 0 0 ifdebug 0 $END

}}