%chk=000052010.chk %nprocshared=8 %mem=31GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000052010 1 1 N -1.234100 -9.9999997E-05 -2.0800000E-02 C 1.266500 -0.2203000 0.3047000 C 2.633300 -0.6151000 -0.1616000 C 2.270600 0.8359000 -3.9000001E-02 C 0.1035000 -0.4345000 -0.6026000 C -1.188700 1.486800 0.3005000 C -2.338200 -0.2669000 -1.033600 C -1.512800 -0.7859000 1.252400 H 1.079300 -0.4346000 1.346900 H 2.744600 -1.023500 -1.158600 H 3.319500 -1.025600 0.5690000 H 2.706600 1.398800 0.7773000 H 2.147300 1.402700 -0.9535000 H 1.2300000E-02 -1.503700 -0.8324000 H 0.2272000 9.6900001E-02 -1.554800 H -0.9370000 2.032000 -0.6140000 H -2.177000 1.788200 0.6612000 H -0.4414000 1.669000 1.077600 H -2.362200 -1.340100 -1.244400 H -3.290600 5.9200000E-02 -0.6052000 H -2.118100 0.2984000 -1.944100 H -1.372800 -1.851200 1.047100 H -0.8559000 -0.4461000 2.056100 H -2.550600 -0.5967000 1.545700 %chk=000052010-Freq.chk %nprocshared=8 %mem=31GB #p freq=noraman PBEPBE/SDD 000052010 1 1 N -1.234753 -0.008028 -0.025104 C 1.311423 -0.418455 0.322740 C 2.699439 -0.441517 -0.357022 C 2.189019 0.852305 0.268746 C 0.110832 -0.597827 -0.574409 C -1.135703 1.506661 0.133734 C -2.339662 -0.338563 -1.026838 C -1.573671 -0.638485 1.322575 H 1.268690 -0.946832 1.280881 H 2.741015 -0.504238 -1.448707 H 3.493551 -0.992787 0.151105 H 2.647546 1.191523 1.201242 H 1.900571 1.661732 -0.409277 H -0.100255 -1.669096 -0.747829 H 0.268127 -0.108866 -1.552682 H -0.917132 1.956158 -0.847064 H -2.096625 1.887764 0.512959 H -0.328552 1.741191 0.840394 H -2.436030 -1.431696 -1.112664 H -3.289620 0.092480 -0.675270 H -2.077748 0.089871 -2.006460 H -1.578078 -1.734353 1.217985 H -0.822315 -0.335028 2.064498 H -2.568769 -0.290315 1.640367