%chk=000023435.chk %nprocshared=8 %mem=31GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000023435 0 1 O -2.287900 -5.9900001E-02 0.9189000 N 1.246000 5.2000000E-03 -0.2011000 C -0.2106000 2.6400000E-02 -0.3882000 C -0.8676000 -5.4499999E-02 1.001700 C -0.5982000 -1.177000 -1.258500 C -0.6066000 1.325600 -1.104900 C 1.652300 -1.232700 0.4585000 C 1.672500 1.167000 0.5737000 H -0.6241000 0.7852000 1.657100 H -0.6299000 -0.9761000 1.537100 H -1.626700 -1.069500 -1.625100 H -0.5788000 -2.129200 -0.7182000 H 4.2800002E-02 -1.261900 -2.144300 H 3.5100002E-02 1.519400 -1.972900 H -1.633600 1.262100 -1.485200 H -0.5838000 2.203800 -0.4510000 H 1.389100 -2.141100 -8.9100003E-02 H 1.341500 -1.329300 1.502900 H 2.750400 -1.255900 0.4847000 H 2.770200 1.163000 0.6164000 H 1.344800 1.179400 1.617100 H 1.434800 2.124800 0.1033000 H -2.569700 0.8087000 0.5860000 %chk=000023435-Freq.chk %nprocshared=4 %mem=3GB #p freq=noraman PBEPBE/SDD 000023435 0 1 O -2.514577 0.020393 0.811941 N 1.236520 -0.011951 -0.086825 C -0.249227 0.003507 -0.346676 C -1.056301 -0.097663 0.991906 C -0.636045 -1.177226 -1.270990 C -0.626268 1.318943 -1.079874 C 1.787854 -1.240929 0.524391 C 1.811144 1.191325 0.552049 H -0.691129 0.669312 1.708576 H -0.924371 -1.095232 1.443690 H -1.723925 -1.153210 -1.456073 H -0.408242 -2.158283 -0.819299 H -0.097732 -1.100657 -2.232116 H 0.087753 1.498816 -1.902376 H -1.634346 1.232313 -1.522426 H -0.618116 2.201818 -0.413011 H 1.473924 -2.134776 -0.037039 H 1.512503 -1.388775 1.598139 H 2.891721 -1.192963 0.474153 H 2.913847 1.123682 0.499187 H 1.540555 1.323442 1.629853 H 1.512900 2.102661 0.010346 H -2.726444 0.948954 0.541374