%chk=000123703.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123703

0 1
 O   -3.682500       1.546400     -0.4434000    
 O   -4.108300      -1.178400     -9.8999999E-02
 N    3.341800       1.004600      0.2653000    
 N    1.019700      0.9258000      0.3641000    
 N    2.338900     -0.9325000     -0.3611000    
 C    4.483300      0.2126000     -7.8299999E-02
 C    3.817000      -1.103100     -0.5007000    
 C    2.193600      0.2947000      7.8699999E-02
 C  -0.2716000      0.4002000      0.2471000    
 C   -1.355400       1.238700     -4.2300001E-02
 C  -0.4957000     -0.9718000      0.4174000    
 C   -2.642300      0.7137000     -0.1596000    
 C   -1.782500      -1.496900      0.3002000    
 C   -2.855900     -0.6540000      1.1600000E-02
 H    5.145800      7.0100002E-02  0.7803000    
 H    5.047700      0.6595000     -0.9019000    
 H    4.058800      -1.349000      -1.540100    
 H    4.149100      -1.931900      0.1335000    
 H    3.399800       1.959100      0.5977000    
 H    1.056100       1.926700      0.5336000    
 H   -1.189600       2.305500     -0.1775000    
 H   0.2977000      -1.659900      0.6905000    
 H   -1.944600      -2.561600      0.4453000    
 H   -3.347400       2.455400     -0.5280000    
 H   -4.726300     -0.4543000     -0.3004000    


%chk=000123703-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123703

0 1
O -3.870348 1.538112 0.038243
O -4.231306 -1.150053 0.100253
N 3.413476 1.117830 -0.067077
N 1.025376 0.955497 -0.091715
N 2.459108 -1.002534 -0.169013
C 4.591875 0.222324 0.070258
C 3.943060 -1.194004 -0.174504
C 2.251994 0.298648 -0.098228
C -0.275149 0.381476 -0.048399
C -1.384806 1.273412 -0.029336
C -0.499471 -1.019597 -0.020630
C -2.689392 0.754064 0.017248
C -1.820017 -1.516701 0.032795
C -2.922920 -0.644812 0.051570
H 5.039156 0.298800 1.081929
H 5.368823 0.460423 -0.676529
H 4.248937 -1.604510 -1.155214
H 4.235960 -1.924738 0.600298
H 3.406761 2.013041 0.427008
H 1.064587 1.967462 -0.213053
H -1.225433 2.360830 -0.046198
H 0.363079 -1.688971 -0.051110
H -2.007141 -2.594453 0.054212
H -3.673712 2.504021 -0.000161
H -4.865298 -0.385970 0.100352


