diff --git a/src/moints/moints_full.F b/src/moints/moints_full.F index cf6abaddcf..71af480fa7 100644 --- a/src/moints/moints_full.F +++ b/src/moints/moints_full.F @@ -311,7 +311,8 @@ c $ nmixed) if (nmixed .ne. 0) then if (.not. ocontam) call errquit - $ ('moints: MOs are symmetry contaminated',0, INPUT_ERR) + $ ('moints: MOs are symmetry contaminated',nmixed, + I INPUT_ERR) c If forced to ignore contamination must orthog and c repeat projection to be sure if (oprint) then @@ -355,9 +356,11 @@ c call fcidump_symm(iunit,isym,norb,orbsym) end do else call ifill(nmo(1),0,int_mb(k_irs),1) - call fcidump_symm(moints_unit, + if (intfmt .eq. 'fcidump') then + call fcidump_symm(moints_unit, c hi-lo+1,1, c int_mb(k_irs+lo-1)) + endif end if c c Keep track of where the MOs will end up