%chk=000110592.chk %nprocshared=4 %mem=7GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000110592 0 1 S 0.3194000 1.126700 -2.6000000E-03 O -1.448400 -0.9352000 2.6000000E-03 O 3.271000 1.100200 5.5000000E-03 C 1.337600 -0.3665000 1.7000000E-03 C -1.293400 0.4027000 -1.3000000E-03 C 2.817800 -4.3299999E-02 1.3000000E-03 C -2.486800 1.058000 -3.3000000E-03 C 3.745100 -1.232700 -6.0999999E-03 C -3.472400 4.2199999E-02 -6.0000003E-04 C -2.789900 -1.152000 3.0000000E-03 H 1.119900 -0.9556000 0.8980000 H 1.120200 -0.9596000 -0.8921000 H -2.650200 2.126500 -6.3999998E-03 H 4.784100 -0.8914000 -2.7999999E-03 H 3.570300 -1.839000 0.8861000 H 3.571600 -1.826900 -0.9067000 H -4.545800 0.1650000 -1.2000001E-03 H -3.095700 -2.188000 6.0000001E-03 %chk=000110592-Freq.chk %nprocshared=12 %mem=21GB #p freq=noraman PBEPBE/SDD 000110592 0 1 S 0.363317 1.230810 -0.002252 O -1.425611 -0.910341 0.000898 O 3.286442 1.135088 0.000033 C 1.365384 -0.370989 0.000829 C -1.290309 0.492831 -0.000977 C 2.858976 -0.047048 -0.001047 C -2.541945 1.091891 -0.001543 C 3.788563 -1.255922 -0.004636 C -3.516822 0.016779 -0.000013 C -2.820641 -1.176455 0.001434 H 1.100047 -0.967993 0.892100 H 1.098231 -0.973236 -0.886267 H -2.744580 2.160485 -0.002882 H 4.836703 -0.918649 -0.000558 H 3.603300 -1.892973 0.880972 H 3.607627 -1.883561 -0.897866 H -4.599716 0.127580 0.000011 H -3.094566 -2.227196 0.002865