diff -Nru wxmacmolplt-7.2.1.orig/src/Frame.cpp wxmacmolplt-7.2.1/src/Frame.cpp --- wxmacmolplt-7.2.1.orig/src/Frame.cpp 2008-04-10 01:04:51.000000000 +0400 +++ wxmacmolplt-7.2.1/src/Frame.cpp 2009-03-09 10:59:11.000000000 +0300 @@ -1896,6 +1896,29 @@ } else tVib = icol; } } + if (Buffer->LocateKeyWord("RAMAN ACTIVITY:", 15, Buffer->GetFilePos()+132)) { + Buffer->GetLine(LineText); + LinePos = 16; + if ((imode == NumVibs)&&(lVibs->RamanIntensity.empty())) { + lVibs->RamanIntensity.reserve(NumModes); + } + LineLength = strlen(LineText); + long tVib = NumVibs; + float raman; + for (long icol=0; icol<tVib; icol++) { + if (LinePos<LineLength) { + test = sscanf(&(LineText[LinePos]), "%s%n", &token, &nchar); + LinePos += nchar; + if (test) { + if (token[0] != '*') { + test = sscanf(token, "%f", &raman); + if (test) + lVibs->RamanIntensity.push_back(raman); + } else lVibs->RamanIntensity.push_back(10000.0); + } else tVib = icol; + } else tVib = icol; + } + } if (Buffer->LocateKeyWord("DEPOLARIZATION:", 15, Buffer->GetFilePos()+132)) { Buffer->GetLine(LineText); LinePos = 16;