%chk=000099442.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099442

0 1
 O   -1.256100      -2.468700     -0.5440000    
 O   -1.131800       2.071200      0.4909000    
 N  -0.7590000     -0.2206000      5.7999999E-03
 C   -3.021000     -0.8993000     -0.2127000    
 C   0.6728000     -0.2824000      7.0400000E-02
 C   -1.573200      -1.318900     -0.2615000    
 C   -2.908000      0.5579000      3.1700000E-02
 C   -1.489400      0.9424000      0.1957000    
 C    1.438200      0.8290000     -0.2863000    
 C    2.830500      0.7684000     -0.2239000    
 C    1.304000      -1.454800      0.4899000    
 C    3.459300     -0.4039000      0.1956000    
 C    2.696200      -1.515500      0.5525000    
 C   -3.909400       1.438400      0.1010000    
 C    3.646900       1.956800     -0.6049000    
 H   -3.522300      -1.417700      0.6088000    
 H   -3.497700      -1.118900      -1.171800    
 H   0.9759000       1.741900     -0.6503000    
 H   0.7448000      -2.328600      0.8094000    
 H    4.543000     -0.4643000      0.2489000    
 H    3.186000      -2.425500      0.8864000    
 H   -4.937800       1.116100     -2.5699999E-02
 H   -3.735400       2.493200      0.2830000    
 H    3.795300       1.978600      -1.689100    
 H    3.154200       2.885300     -0.2968000    
 H    4.628600       1.938900     -0.1194000    


%chk=000099442-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099442

0 1
O -1.178190 -2.501662 -0.660795
O -1.076840 2.053072 0.596188
N -0.760415 -0.245089 -0.004405
C -3.044143 -0.890147 -0.348466
C 0.679189 -0.302189 0.086881
C -1.586184 -1.355155 -0.369622
C -2.977474 0.565933 0.055027
C -1.539686 0.937268 0.257717
C 1.452408 0.807482 -0.329803
C 2.864915 0.775113 -0.239060
C 1.306445 -1.465708 0.595656
C 3.487480 -0.391865 0.271350
C 2.713075 -1.500867 0.679390
C -3.981768 1.458351 0.233478
C 3.689846 1.963049 -0.703465
H -3.616114 -1.513535 0.362375
H -3.489399 -1.048863 -1.347048
H 0.954996 1.704743 -0.707286
H 0.709579 -2.325533 0.906496
H 4.580459 -0.430241 0.349981
H 3.205787 -2.396859 1.071887
H -5.033852 1.189552 0.092055
H -3.747099 2.486566 0.531153
H 3.839771 1.938152 -1.800276
H 3.193086 2.919136 -0.461935
H 4.688728 1.968297 -0.233873


