%chk=000009143.chk %nprocshared=8 %mem=21GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000009143 0 1 C -1.122800 -0.1643000 1.9999999E-04 C -0.2046000 0.8875000 3.0000001E-04 C -0.8035000 -1.493000 1.9999999E-04 C 1.179300 0.5116000 1.9999999E-04 C -2.489100 -3.6499999E-02 -9.9999997E-05 C 1.525400 -0.8803000 9.9999997E-05 C 0.5229000 -1.874500 1.9999999E-04 C -2.045300 -2.253800 0.000000 C -3.062500 -1.375100 -1.9999999E-04 C -0.7999000 2.175500 1.9999999E-04 C -3.058600 1.220900 -3.0000001E-04 C 2.229200 1.453400 1.9999999E-04 C -2.203600 2.331500 -9.9999997E-05 C 2.877100 -1.256700 -1.9999999E-04 C 3.566400 1.052600 -1.9999999E-04 C 3.889400 -0.2985000 -3.9999999E-04 H 0.7838000 -2.929900 9.9999997E-05 H -2.111400 -3.329000 0.000000 H -4.116700 -1.596300 -3.9999999E-04 H -0.1840000 3.071100 3.0000001E-04 H -4.134900 1.355600 -6.9999998E-04 H 2.021600 2.520700 3.0000001E-04 H -2.627100 3.332900 -3.0000001E-04 H 3.158300 -2.308300 -3.9999999E-04 H 4.355200 1.799300 -3.0000001E-04 H 4.930200 -0.6090000 -6.0000003E-04 %chk=000009143-Freq.chk %nprocshared=8 %mem=31GB #p freq=noraman PBEPBE/SDD 000009143 0 1 C -1.147295 -0.179908 -0.000053 C -0.224345 0.880404 -0.000057 C -0.807529 -1.584658 -0.000076 C 1.196137 0.514417 -0.000068 C -2.568437 -0.030407 -0.000061 C 1.550502 -0.896410 -0.000079 C 0.533584 -1.937171 -0.000087 C -2.089109 -2.320233 -0.000100 C -3.131410 -1.401030 -0.000090 C -0.787795 2.200225 -0.000050 C -3.100078 1.269159 -0.000060 C 2.243620 1.479183 -0.000054 C -2.186747 2.373547 -0.000051 C 2.933444 -1.259351 -0.000081 C 3.593414 1.092984 -0.000065 C 3.942210 -0.286881 -0.000075 H 0.861859 -2.984091 -0.000114 H -2.188256 -3.407605 -0.000112 H -4.197731 -1.638177 -0.000101 H -0.144048 3.086561 -0.000066 H -4.180183 1.454092 -0.000064 H 1.990965 2.544968 -0.000047 H -2.591950 3.392135 -0.000054 H 3.197259 -2.324035 -0.000090 H 4.380595 1.854924 -0.000061 H 4.996123 -0.585243 -0.000083