%chk=000072901.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072901

0 1
 O   -4.497200     -0.9066000       0.000000    
 N   0.2432000      -1.365500     -3.0000001E-04
 N   0.3699000       1.449100     -3.9999999E-04
 C  -0.9342000     -0.6584000       0.000000    
 C    1.493400     -0.7350000     -3.9999999E-04
 C  -0.7787000      0.8349000     -9.9999997E-05
 C    1.546900      0.6716000     -3.0000001E-04
 C   -2.157300      -1.202800      1.9999999E-04
 C    2.679700      -1.476900     -1.9999999E-04
 C   -2.021200       1.643500     -9.9999997E-05
 C    2.790100       1.312900      1.9999999E-04
 C   -3.387200     -0.3860000      5.0000002E-04
 C   -3.229300       1.079400      9.9999997E-05
 C    3.913400     -0.8264000      3.0000001E-04
 C    3.968500      0.5661000      6.0000003E-04
 H   0.2003000      -2.376600     -3.9999999E-04
 H   -2.289000      -2.280500      1.9999999E-04
 H    2.650400      -2.563600     -3.0000001E-04
 H   -1.919000       2.723600     -3.9999999E-04
 H    2.847200       2.398500      3.9999999E-04
 H   -4.128500       1.685000     -9.9999997E-05
 H    4.832000      -1.405800      5.0000002E-04
 H    4.930200       1.071000      1.0000000E-03


%chk=000072901-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072901

0 1
O -4.597898 -0.935934 -0.000004
N 0.246502 -1.343779 0.000004
N 0.396304 1.476399 0.000028
C -0.953374 -0.617033 -0.000081
C 1.505296 -0.745896 0.000069
C -0.795023 0.856281 -0.000060
C 1.557059 0.694341 0.000074
C -2.202467 -1.216275 -0.000188
C 2.702407 -1.506298 0.000138
C -2.008276 1.655936 0.000024
C 2.826172 1.336842 0.000166
C -3.423113 -0.414538 -0.000436
C -3.248730 1.064084 -0.000078
C 3.941876 -0.841384 0.000208
C 4.009247 0.580979 0.000217
H 0.189436 -2.365627 -0.000012
H -2.322766 -2.306194 -0.000165
H 2.659193 -2.602081 0.000150
H -1.873436 2.742312 0.000194
H 2.836764 2.430852 0.000182
H -4.170724 1.656675 0.000025
H 4.866386 -1.428908 0.000267
H 4.982764 1.080747 0.000277


