%chk=000056826.chk %nprocshared=4 %mem=3GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000056826 0 1 Cl 2.305800 2.887800 6.0000003E-04 Cl -1.349600 0.8428000 2.718700 Cl -1.351000 0.8450000 -2.719000 Cl 4.865500 0.9702000 3.0000001E-04 Cl 1.562300 -3.317100 -8.9999998E-04 Cl -5.486900 -1.273500 6.0000003E-04 O -0.2559000 1.402800 3.0000001E-04 O 4.175200 -1.887200 -9.9999997E-05 C 0.8565000 0.6139000 0.000000 C -1.488000 0.7734000 0.000000 C 2.139600 1.161100 9.9999997E-05 C 0.6889000 -0.7708000 -3.9999999E-04 C -2.092500 0.4642000 1.208100 C -2.092500 0.4641000 -1.207900 C 3.255000 0.3236000 1.9999999E-04 C 1.804400 -1.608400 -3.9999999E-04 C 3.087400 -1.061100 -9.9999997E-05 C -3.334500 -0.1710000 1.208000 C -3.334400 -0.1710000 -1.207900 C -3.955500 -0.4886000 9.9999997E-05 H -0.2776000 -1.263700 -6.0000003E-04 H -3.819700 -0.4198000 2.149500 H -3.819900 -0.4195000 -2.149300 H 4.978400 -1.338500 0.000000 %chk=000056826-Freq.chk %nprocshared=4 %mem=7GB #p freq=noraman PBEPBE/SDD 000056826 0 1 Cl 2.176614 2.920428 0.000605 Cl -1.366911 0.722580 2.777742 Cl -1.366229 0.723209 -2.776836 Cl 4.951637 1.167672 -0.000227 Cl 1.971396 -3.497006 -0.000811 Cl -5.881743 -0.918759 -0.000283 O -0.264442 1.264367 0.000696 O 4.455842 -1.837169 -0.000836 C 0.892460 0.450499 0.000266 C -1.530877 0.656968 0.000428 C 2.136650 1.123664 0.000215 C 0.848208 -0.958514 -0.000040 C -2.215601 0.409849 1.215267 C -2.215300 0.410111 -1.214632 C 3.320614 0.362956 -0.000142 C 2.043983 -1.693947 -0.000409 C 3.306852 -1.057543 -0.000470 C -3.538876 -0.070675 1.234509 C -3.538558 -0.070439 -1.234311 C -4.176308 -0.302097 -0.000004 H -0.110759 -1.482990 0.000009 H -4.051577 -0.253311 2.181443 H -4.051012 -0.252876 -2.181418 H 5.264937 -1.258276 -0.000860