%chk=000137509.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137509

0 1
 O   -2.005600      -1.868300     -3.7599999E-02
 N    2.229200     -8.4299996E-02 -6.0600001E-02
 N   -1.837000      0.4309000      1.7200001E-02
 N   8.7300003E-02 -0.9902000     -4.9899999E-02
 C   0.8616000      6.2899999E-02 -3.4800000E-02
 C   0.3045000       1.439900      1.0500000E-02
 C   -1.023200       1.540000      3.3399999E-02
 C    3.107000       1.071700     -4.4100001E-02
 C    2.847300      -1.381500      0.1445000    
 C   -1.291100     -0.8643000     -2.4300000E-02
 C   -3.280000      0.6432000      4.5600001E-02
 H   0.9219000       2.326200      2.9200001E-02
 H   -1.513300       2.506700      6.7800000E-02
 H    2.903400       1.735300     -0.8915000    
 H    4.160500      0.7827000     -0.1301000    
 H    3.005200       1.627400      0.8943000    
 H    2.363800      -2.152500     -0.4651000    
 H    2.775900      -1.671700       1.197800    
 H    3.906000      -1.380100     -0.1362000    
 H   -3.571600       1.233600     -0.8288000    
 H   -3.543600       1.183600      0.9604000    
 H   -3.824600     -0.3043000      2.7600000E-02


%chk=000137509-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137509

0 1
O -2.066853 -1.870495 -0.001801
N 2.260073 -0.052863 0.059955
N -1.858153 0.474595 -0.000593
N 0.099619 -0.964099 0.028422
C 0.890362 0.136619 0.039050
C 0.335378 1.478461 0.030857
C -1.043722 1.581754 0.010695
C 3.186881 1.088977 0.075788
C 2.830811 -1.411802 0.072551
C -1.279124 -0.881380 0.008474
C -3.328324 0.609869 -0.022673
H 0.946990 2.380142 0.039947
H -1.543703 2.556028 0.003238
H 3.069766 1.727863 -0.821148
H 4.218974 0.705280 0.084473
H 3.050834 1.719157 0.976393
H 1.994328 -2.126296 0.057896
H 3.437956 -1.571308 0.984280
H 3.471168 -1.573158 -0.815822
H -3.661068 1.138358 -0.933902
H -3.686751 1.151696 0.870744
H -3.741842 -0.410499 -0.021526


