%chk=000104745.chk %nprocshared=4 %mem=7GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000104745 -1 1 O 1.672800 -0.6109000 1.2200000E-02 O 0.4164000 1.295900 -6.0000001E-03 C -0.7023000 -0.7712000 -1.9099999E-02 C -1.981100 4.2900000E-02 1.5100000E-02 C 0.5942000 4.3200001E-02 -2.2000000E-03 H -0.6956000 -1.393100 -0.9219000 H -0.6849000 -1.447700 0.8435000 H -2.033000 0.6607000 0.9177000 H -2.053200 0.7041000 -0.8547000 H -2.852500 -0.6195000 8.2999999E-03 %chk=000104745-Freq.chk %nprocshared=8 %mem=21GB #p freq=noraman PBEPBE/SDD 000104745 -1 1 O 1.705320 -0.625391 0.006358 O 0.464645 1.365587 -0.009244 C -0.717392 -0.793780 -0.015788 C -2.019258 0.031589 0.015359 C 0.604806 0.070722 -0.003986 H -0.677727 -1.435779 -0.920798 H -0.663862 -1.486490 0.849682 H -2.041158 0.667210 0.919167 H -2.046804 0.721356 -0.847405 H -2.927770 -0.610624 -0.000445