%chk=000079394.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079394

0 1
 O   -4.486900      0.9825000     -5.0000002E-04
 O    3.967300     -0.3912000     -2.9000000E-03
 N    1.942900      0.8150000      6.9999998E-04
 C  -0.4071000      0.1213000      3.9999999E-04
 C   -1.352200     -0.9321000       0.000000    
 C   0.9633000     -0.1857000      1.0000000E-03
 C  -0.8602000       1.450700      5.0000002E-04
 C  -0.8991000      -2.261400       0.000000    
 C   -2.722600     -0.6252000     -5.0000002E-04
 C    1.395700      -1.512200      8.9999998E-04
 C   0.4663000      -2.548100      3.9999999E-04
 C   -3.155000      0.7012000     -6.0000003E-04
 C   -2.225600       1.737100     -9.9999997E-05
 C    3.332300      0.6584000      3.9999999E-04
 C    4.040900       1.989700      3.0000001E-04
 H  -0.1924000       2.305800      8.9999998E-04
 H   -1.607700      -3.087100     -3.0000001E-04
 H   -3.462400      -1.423900     -8.9999998E-04
 H    2.425400      -1.834500      1.7000000E-03
 H   0.8017000      -3.581300      6.0000003E-04
 H   -2.551000       2.774100       0.000000    
 H    1.621100       1.776200      1.1000000E-03
 H    3.777100       2.549400     -0.9014000    
 H    5.123100       1.833300      1.7100001E-02
 H    3.752600       2.564100      0.8852000    
 H   -4.605400       1.948000     -3.0000001E-04


%chk=000079394-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000079394

0 1
O -4.556566 0.973660 -0.000581
O 4.039865 -0.379840 0.000888
N 1.994441 0.788486 0.002385
C -0.373870 0.108580 0.000777
C -1.369822 -0.948859 -0.000187
C 1.031781 -0.259843 0.001238
C -0.845119 1.463046 0.001121
C -0.947966 -2.319716 -0.000736
C -2.760423 -0.615105 -0.000615
C 1.408122 -1.613163 0.000609
C 0.410282 -2.632121 -0.000414
C -3.174083 0.716854 -0.000188
C -2.207082 1.770727 0.000670
C 3.392975 0.706188 0.002126
C 4.079292 2.075082 -0.000690
H -0.148415 2.310277 0.001660
H -1.707077 -3.109473 -0.001384
H -3.512995 -1.409759 -0.001311
H 2.468284 -1.869529 0.001181
H 0.732822 -3.679063 -0.000763
H -2.534837 2.818425 0.000953
H 1.621563 1.738292 0.002998
H 3.820870 2.652309 -0.908097
H 5.167392 1.919315 0.018560
H 3.791219 2.673479 0.883724
H -4.738553 1.945851 -0.000222


