%chk=000085126.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085126

0 1
 O    2.289300       1.328900      1.3000000E-03
 N    1.147900     -0.7341000      3.9999999E-04
 C  -0.1983000     -0.3676000      8.9999998E-04
 C  -0.5545000      0.9811000      1.9999999E-04
 C   -1.188300      -1.350400      7.9999998E-04
 C   -1.900400       1.347200     -6.0000003E-04
 C   -2.534400     -0.9842000     -9.9999997E-05
 C   -2.890300      0.3645000     -7.9999998E-04
 C    2.272300      0.1023000     -8.9999998E-04
 C    3.556900     -0.6877000     -1.2000001E-03
 H   0.1540000       1.797600       0.000000    
 H  -0.9256000      -2.405200      1.0000000E-03
 H    1.325100      -1.736500      6.0000003E-04
 H   -2.179100       2.397100     -1.2000001E-03
 H   -3.305300      -1.749100     -3.9999999E-04
 H   -3.938300      0.6495000     -1.5000000E-03
 H    3.617300      -1.294700      0.9066000    
 H    4.411300     -6.0000001E-03 -3.0800000E-02
 H    3.592400      -1.338500     -0.8794000    


%chk=000085126-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085126

0 1
O 2.312434 1.342133 -0.004009
N 1.165364 -0.710782 -0.003615
C -0.199605 -0.300165 -0.002014
C -0.601319 1.063231 -0.000602
C -1.186162 -1.324944 -0.001698
C -1.978605 1.374925 0.001032
C -2.556146 -0.995080 0.000018
C -2.963350 0.360094 0.001372
C 2.322520 0.077331 -0.003379
C 3.616237 -0.742279 0.001137
H 0.161070 1.844200 -0.000960
H -0.878783 -2.379938 -0.002681
H 1.314629 -1.723210 -0.004156
H -2.280567 2.428740 0.002031
H -3.303208 -1.796976 0.000322
H -4.027791 0.618183 0.002639
H 3.695057 -1.360175 0.915403
H 4.468295 -0.047557 -0.029576
H 3.671931 -1.413530 -0.876364


