%chk=000154767.chk %nprocshared=8 %mem=21GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000154767 0 1 N 0.7915000 -1.262500 3.9999999E-04 N 1.332100 1.462800 -3.9999999E-04 N -3.931800 -0.3219000 3.9999999E-04 C -0.2095000 -0.3648000 1.9999999E-04 C -1.535100 -0.7926000 3.0000001E-04 C 6.4199999E-02 1.015200 0.000000 C -2.590600 0.1177000 1.9999999E-04 C 2.052600 -0.7945000 9.9999997E-05 C 2.319100 0.5488000 -1.9999999E-04 C -0.9978000 1.916500 -1.9999999E-04 C -2.320800 1.478000 9.9999997E-05 C -1.831900 -2.263100 -1.1000000E-03 C 3.143300 -1.809200 3.0000001E-04 C 3.714900 1.069700 0.000000 H -0.8003000 2.986700 -3.9999999E-04 H -3.124800 2.209100 0.000000 H -0.9383000 -2.894200 -9.9999997E-05 H -2.406500 -2.534200 0.8915000 H -2.403900 -2.533000 -0.8958000 H 3.767500 -1.708000 0.8935000 H 2.730400 -2.823900 3.9999999E-04 H 3.767700 -1.708300 -0.8931000 H 4.252800 0.7380000 0.8936000 H 4.253300 0.7374000 -0.8930000 H 3.721100 2.165100 -3.9999999E-04 H -4.161500 -1.305500 -3.0000001E-04 H -4.679800 0.3593000 -9.9999997E-05 %chk=000154767-Freq.chk %nprocshared=8 %mem=21GB #p freq=noraman PBEPBE/SDD 000154767 0 1 N 0.805562 -1.298296 -0.000234 N 1.358629 1.509561 0.000093 N -3.972005 -0.296426 -0.000438 C -0.240673 -0.380042 -0.000200 C -1.592718 -0.850540 -0.000355 C 0.055419 1.043678 -0.000024 C -2.637600 0.108306 -0.000323 C 2.071572 -0.826806 -0.000101 C 2.357740 0.596889 0.000050 C -1.025939 1.976319 0.000024 C -2.339188 1.518692 -0.000120 C -1.898546 -2.333530 -0.000478 C 3.189797 -1.845400 -0.000055 C 3.778438 1.115935 0.000226 H -0.787444 3.044218 0.000157 H -3.170684 2.234960 -0.000069 H -0.952440 -2.896356 0.000104 H -2.481527 -2.634724 0.894299 H -2.480371 -2.634814 -0.895985 H 3.841019 -1.733893 0.888285 H 2.756905 -2.857682 -0.000220 H 3.841267 -1.733698 -0.888182 H 4.340452 0.769404 0.889018 H 4.340700 0.769332 -0.888377 H 3.757731 2.216883 0.000190 H -4.216399 -1.281913 -0.000841 H -4.721797 0.388542 -0.000544