%chk=000011398.chk %nprocshared=8 %mem=31GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000011398 0 1 N 3.592600 0.5058000 -0.4643000 C 1.348500 -0.5142000 -9.6500002E-02 C -0.1417000 -0.2089000 -6.3100003E-02 C 2.152700 0.7478000 -0.4681000 C 1.806200 -1.136100 1.229300 C -1.030900 -1.176700 -0.4843000 C -0.5598000 1.026800 0.3870000 C -2.397100 -0.8966000 -0.4541000 C -1.926000 1.306900 0.4173000 C -2.844600 0.3451000 -3.1999999E-03 H 1.527300 -1.255200 -0.8889000 H 1.854100 1.102700 -1.461600 H 1.999500 1.570200 0.2348000 H 2.835300 -1.503900 1.169800 H 1.175500 -1.990800 1.499500 H 1.747200 -0.4117000 2.049500 H -0.6915000 -2.146900 -0.8345000 H 0.1051000 1.793900 0.7625000 H 3.913100 0.3292000 0.4867000 H 4.075900 1.350800 -0.7674000 H -3.112500 -1.645900 -0.7805000 H -2.276000 2.270200 0.7771000 H -3.908400 0.5623000 2.2600001E-02 %chk=000011398-Freq.chk %nprocshared=8 %mem=21GB #p freq=noraman PBEPBE/SDD 000011398 0 1 N 3.602206 0.275811 -0.693569 C 1.366149 -0.545700 0.112553 C -0.130886 -0.242536 0.060580 C 2.166388 0.591663 -0.595991 C 1.882669 -0.776409 1.554308 C -0.981236 -0.974185 -0.808355 C -0.705751 0.795995 0.841878 C -2.362557 -0.685427 -0.894829 C -2.084858 1.090514 0.758012 C -2.920286 0.350889 -0.111497 H 1.561450 -1.467401 -0.469249 H 1.769986 0.706801 -1.622034 H 1.952920 1.550628 -0.063337 H 2.939267 -1.100276 1.537278 H 1.296889 -1.562176 2.063477 H 1.811619 0.144614 2.164096 H -0.554626 -1.779955 -1.419146 H -0.075302 1.372165 1.529733 H 4.124688 0.367376 0.181142 H 4.086898 0.708933 -1.482694 H -3.001010 -1.268077 -1.569060 H -2.509382 1.894316 1.370889 H -3.990734 0.577238 -0.174584