%chk=000119048.chk %nprocshared=4 %mem=3GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000119048 0 1 Cl 0.1897000 -2.181300 0.5907000 Cl -4.763000 -0.4521000 -0.6316000 O 0.8083000 0.7541000 0.7842000 O 2.966700 -0.6159000 -1.552000 O 3.753100 -1.026300 0.5410000 C 1.548800 1.530600 -0.1548000 C 3.026500 1.209700 -1.7800000E-02 C -0.4801000 0.4516000 0.4577000 C -0.9036000 -0.8716000 0.3339000 C -1.381000 1.495100 0.2453000 C -2.228000 -1.151400 -2.3000001E-03 C -2.705400 1.215300 -9.1100000E-02 C -3.129000 -0.1080000 -0.2149000 C 3.297100 -0.2498000 -0.2882000 H 1.211000 1.328200 -1.179300 H 1.386400 2.592800 5.9799999E-02 H 3.632500 1.813700 -0.7006000 H 3.361400 1.420800 1.004400 H -1.069500 2.531100 0.3468000 H -2.559600 -2.183100 -9.9500000E-02 H -3.396900 2.038400 -0.2521000 H 3.139100 -1.567800 -1.714200 %chk=000119048-Freq.chk %nprocshared=4 %mem=3GB #p freq=noraman PBEPBE/SDD 000119048 0 1 Cl -0.285213 -2.356023 1.368878 Cl -5.131609 -0.183602 -0.257475 O 0.851267 0.210958 0.430149 O 3.178446 0.020844 -1.874305 O 4.473646 -0.860804 -0.159589 C 1.590359 1.409655 -0.008552 C 3.064773 1.121643 0.275193 C -0.529123 0.190808 0.236303 C -1.218566 -0.982706 0.645542 C -1.280951 1.251855 -0.329768 C -2.610824 -1.106632 0.501406 C -2.681179 1.144041 -0.483125 C -3.326312 -0.032261 -0.065609 C 3.646939 -0.013829 -0.551679 H 1.423348 1.581314 -1.088182 H 1.249263 2.290658 0.571421 H 3.651899 2.035081 0.055678 H 3.216406 0.870921 1.337225 H -0.783242 2.168780 -0.656398 H -3.119512 -2.018410 0.823910 H -3.253594 1.965984 -0.921242 H 3.578279 -0.734174 -2.384380