### principal axis system

AT_SETUP([Analysis - Principal Axis System])
AT_KEYWORDS([analysis,correlation])
AT_CHECK([/bin/cp -f ${abs_top_srcdir}/${AUTOTEST_PATH}/Analysis/PrincipalAxisSystem/pre/water.xyz .], 0)
AT_CHECK([../../molecuilder -i water.xyz -v 3 --select-all-molecules --principal-axis-system], 0, [stdout], [stderr])
AT_CHECK([egrep " with eigenvalues.*0.512674" stdout], 0, [ignore], [ignore])
AT_CHECK([egrep " with eigenvalues.*1.03033" stdout], 0, [ignore], [ignore])
AT_CHECK([egrep " with eigenvalues.*1.54301" stdout], 0, [ignore], [ignore])
AT_CLEANUP