X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-NEWSC-NEWCORR%2Fparmread.F;h=ba6ec3e7c323f460cc93bd5157fa907904ad22ba;hb=34d3ad3987785642be58fb2f26557d3314215577;hp=43a24b8a4e1f2420d1b8e74527b32a236af8d079;hpb=f690e8b70bab14132839afebf080d4a28363b226;p=unres.git diff --git a/source/wham/src-NEWSC-NEWCORR/parmread.F b/source/wham/src-NEWSC-NEWCORR/parmread.F index 43a24b8..ba6ec3e 100644 --- a/source/wham/src-NEWSC-NEWCORR/parmread.F +++ b/source/wham/src-NEWSC-NEWCORR/parmread.F @@ -694,10 +694,10 @@ C EEold(2,2,i)=-b(10,i)+b(11,i) EEold(2,1,i)= b(12,i)-b(13,i) EEold(1,2,i)= b(12,i)+b(13,i) -c EEold(1,1,-i)= b(10,i)+b(11,i) -c EEold(2,2,-i)=-b(10,i)+b(11,i) -c EEold(2,1,-i)=-b(12,i)+b(13,i) -c EEold(1,2,-i)=-b(12,i)-b(13,i) + EEold(1,1,-i)= b(10,i)+b(11,i) + EEold(2,2,-i)=-b(10,i)+b(11,i) + EEold(2,1,-i)=-b(12,i)+b(13,i) + EEold(1,2,-i)=-b(12,i)-b(13,i) #else EE(1,1,i)= b(10,i)+b(11,i) EE(2,2,i)=-b(10,i)+b(11,i)