%chk=000154799.chk %nprocshared=8 %mem=21GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000154799 0 1 Cl 1.772400 0.4288000 2.806500 Cl 1.896000 -2.002900 -2.056100 Cl 5.392200 1.922100 -0.8892000 O 0.8941000 -1.504500 0.7100000 O -5.345800 -0.5300000 -0.5906000 O -3.889400 2.646600 -0.1907000 N -4.238800 0.3196000 -0.3298000 C -0.3655000 -1.056800 0.4547000 C -2.947600 -0.1388000 -6.7699999E-02 C 1.953400 -0.6962000 0.3328000 C -0.5544000 0.1775000 -0.1668000 C -1.467700 -1.832100 0.8152000 C -1.845500 0.6366000 -0.4279000 C -2.758700 -1.373000 0.5539000 C 2.445000 0.2394000 1.228400 C 2.499900 -0.8410000 -0.9320000 C 3.512800 1.052600 0.8488000 C 3.567800 -2.7799999E-02 -1.311500 C 4.074300 0.9189000 -0.4211000 C -4.594600 1.660900 -0.3669000 H 0.2522000 0.8299000 -0.4842000 H -1.326300 -2.793900 1.300400 H -1.942100 1.580700 -0.9541000 H -3.605500 -1.989100 0.8452000 H 3.908800 1.791700 1.542200 H 4.006700 -0.1307000 -2.301700 H -5.668700 1.782900 -0.5909000 H -5.230000 -0.6707000 -1.546100 %chk=000154799-Freq.chk %nprocshared=8 %mem=21GB #p freq=noraman PBEPBE/SDD 000154799 0 1 Cl 1.785832 0.416483 2.813920 Cl 1.946132 -1.827949 -2.268833 Cl 5.971392 1.618551 -0.623897 O 0.883061 -1.396994 0.543612 O -5.455546 -0.646630 -0.055415 O -4.283464 2.674971 -0.722949 N -4.437588 0.356487 -0.323637 C -0.425386 -0.881186 0.305159 C -3.079684 -0.044503 -0.100756 C 2.004426 -0.617253 0.238011 C -0.675846 0.394631 -0.240465 C -1.484561 -1.740279 0.658311 C -2.004403 0.817688 -0.447851 C -2.812927 -1.321911 0.459419 C 2.596453 0.226278 1.211065 C 2.667182 -0.754198 -1.007026 C 3.800113 0.915609 0.967048 C 3.872501 -0.082409 -1.288639 C 4.417018 0.744834 -0.287342 C -4.966029 1.630573 -0.548935 H 0.147399 1.065316 -0.505849 H -1.259595 -2.718525 1.091949 H -2.211837 1.808776 -0.854532 H -3.640842 -1.968024 0.760271 H 4.239182 1.558773 1.732984 H 4.366845 -0.205213 -2.254967 H -6.075162 1.589263 -0.560998 H -5.489665 -1.212460 -0.878858