%chk=000108995.chk %nprocshared=4 %mem=3GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000108995 0 1 Cl -4.220500 -1.142200 6.1200000E-02 O 2.190600 4.4000000E-03 0.1858000 O -0.5608000 0.1652000 -0.3271000 O -2.435800 1.084500 0.6485000 C 1.625700 1.151000 -0.4387000 C 0.1973000 1.322200 4.0800001E-02 C 3.526000 -0.2181000 -0.2449000 C 4.070500 -1.446800 0.4518000 C -1.877000 0.1802000 4.3499999E-02 C -2.516000 -1.100300 -0.4210000 H 2.213900 2.039900 -0.1859000 H 1.635400 1.004900 -1.525100 H -0.2465000 2.213400 -0.4164000 H 0.1811000 1.417700 1.132700 H 3.545600 -0.3711000 -1.329800 H 4.145200 0.6513000 2.9000000E-03 H 5.100000 -1.647900 0.1423000 H 4.047400 -1.315800 1.538700 H 3.455300 -2.323700 0.2240000 H -2.013600 -1.954600 3.9299998E-02 H -2.469900 -1.164300 -1.510800 %chk=000108995-Freq.chk %nprocshared=4 %mem=3GB #p freq=noraman PBEPBE/SDD 000108995 0 1 Cl -3.454024 -0.556477 -1.950707 O 2.287775 0.060709 0.234226 O -0.659500 0.131216 -0.251161 O -2.359419 0.776818 1.213152 C 1.543922 1.135657 -0.419761 C 0.189831 1.248670 0.255972 C 3.582023 -0.204353 -0.413993 C 4.259406 -1.333496 0.360803 C -1.924081 0.027127 0.310390 C -2.690363 -1.121427 -0.319333 H 2.084919 2.103485 -0.311088 H 1.413649 0.929822 -1.504590 H -0.312624 2.202025 0.011092 H 0.283428 1.161239 1.352149 H 3.415863 -0.492259 -1.476016 H 4.205661 0.718188 -0.401785 H 5.238346 -1.577903 -0.090066 H 4.420165 -1.039207 1.412164 H 3.630208 -2.239912 0.347851 H -3.529186 -1.416620 0.322586 H -2.032100 -1.963402 -0.570084