%chk=000097618.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097618

0 1
 O   -3.806000      0.8178000      8.9999998E-04
 O   -3.148800      -1.276800     -3.0000001E-04
 N   -2.896400     -4.7200002E-02  1.9999999E-04
 C   0.7879000     -7.9099998E-02 -9.9999997E-05
 C  -0.5501000      -2.035800     -6.0000003E-04
 C  -0.5032000     -0.5367000     -3.0000001E-04
 C   0.9487000      -2.444000      6.0000003E-04
 C    1.668600      -1.128300      9.9999997E-05
 C    1.154900       1.268200     -1.9999999E-04
 C   -1.542400      0.3776000     -3.9999999E-04
 C    3.027900     -0.8672000      1.9999999E-04
 C   9.8800004E-02   2.198500     -1.9999999E-04
 C    2.536900       1.534400       0.000000    
 C   -1.236300       1.748800     -9.9999997E-05
 C    3.459500      0.4697000      1.9999999E-04
 H   -1.039600      -2.428200      0.8969000    
 H   -1.038200      -2.427600     -0.8991000    
 H    1.194200      -3.027800     -0.8926000    
 H    1.193100      -3.026400      0.8949000    
 H    3.752200      -1.675100      5.0000002E-04
 H   0.3041000       3.265900       0.000000    
 H    2.901800       2.558200       0.000000    
 H   -2.018200       2.505400       0.000000    
 H    4.524600      0.6875000      3.9999999E-04


%chk=000097618-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097618

0 1
O -3.873317 0.944094 0.000215
O -3.269195 -1.257159 -0.000323
N -2.979024 0.008077 -0.000320
C 0.795121 -0.105091 0.000067
C -0.544667 -2.097905 -0.000183
C -0.549302 -0.577142 -0.000080
C 0.976531 -2.499317 0.000324
C 1.736358 -1.177746 0.000198
C 1.164195 1.276488 0.000051
C -1.560161 0.393918 -0.000161
C 3.099643 -0.870939 0.000256
C 0.086815 2.231151 -0.000042
C 2.566474 1.562416 0.000127
C -1.238623 1.797170 -0.000121
C 3.497168 0.508716 0.000215
H -1.088855 -2.493055 0.876107
H -1.088124 -2.492792 -0.877058
H 1.230051 -3.110459 -0.885821
H 1.229541 -3.109854 0.887044
H 3.864291 -1.655070 0.000348
H 0.309313 3.303784 -0.000050
H 2.913190 2.601766 0.000117
H -2.070998 2.505877 -0.000173
H 4.567575 0.744875 0.000262


