%chk=000006944.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006944

0 1
 O    2.228700       1.481600     -1.7000000E-03
 O    2.369800     -0.7091000      3.9999999E-04
 N    1.694700      0.3473000     -1.9999999E-04
 C  -0.3641000     -0.9836000      3.9999999E-04
 C   0.2754000      0.2560000      1.4000000E-03
 C   -1.757400      -1.049600     -7.9999998E-04
 C  -0.4784000       1.429600      1.3000000E-03
 C   0.4142000      -2.259800     -9.9999997E-05
 C   -2.511300      0.1240000     -8.9999998E-04
 C   -1.871700       1.363600      9.9999997E-05
 H   -2.273600      -2.006100     -1.7000000E-03
 H  -1.8200001E-02   2.414500      1.7000000E-03
 H    1.011500      -2.376100     -0.9104000    
 H    1.011700      -2.376600      0.9101000    
 H  -0.2681000      -3.120100     -1.9999999E-04
 H   -3.596100      7.2800003E-02 -1.9000000E-03
 H   -2.459300       2.277100     -1.9999999E-04


%chk=000006944-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000006944

0 1
O 2.216483 1.624562 -0.000462
O 2.492949 -0.629796 0.000778
N 1.741176 0.421508 0.000591
C -0.352445 -1.036072 -0.000202
C 0.262175 0.254038 0.000268
C -1.773867 -1.044559 -0.000682
C -0.491998 1.453887 0.000342
C 0.377992 -2.364657 -0.000295
C -2.539762 0.139810 -0.000605
C -1.896034 1.399421 -0.000065
H -2.283839 -2.014195 -0.001106
H 0.044742 2.405757 0.000685
H 1.037764 -2.467846 -0.878716
H 1.037194 -2.468273 0.878483
H -0.351390 -3.192465 -0.000769
H -3.633385 0.079359 -0.000972
H -2.479955 2.325020 0.000027


