%chk=000097824.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097824

0 1
 O    3.024000       1.052000     -0.7318000    
 O    3.393400      -1.380200      0.5675000    
 N  -0.5246000      0.3733000      0.1766000    
 C  -0.8357000     -0.6181000     -0.8626000    
 C   -1.658300       1.281200      0.4011000    
 C   -2.059000      -1.453100     -0.4804000    
 C   -2.908400      0.5084000      0.8245000    
 C   -3.266500     -0.5681000     -0.1938000    
 C   0.6743000       1.131000     -0.1815000    
 C    1.901200      0.2429000     -0.3798000    
 C    2.259700     -0.5694000      0.8603000    
 H  -2.3700001E-02  -1.339100     -0.9931000    
 H   -1.007300     -0.1318000      -1.831900    
 H   -1.876500       1.865500     -0.5027000    
 H   -1.412100       1.993500       1.198000    
 H   -1.829800      -2.056800      0.4071000    
 H   -2.298300      -2.152500      -1.289600    
 H   -3.749800       1.200800      0.9416000    
 H   -2.738400      4.3000001E-02   1.803800    
 H   -3.602400     -9.4499998E-02  -1.124500    
 H   -4.098900      -1.175700      0.1777000    
 H   0.8996000       1.859900      0.6088000    
 H   0.5124000       1.725300      -1.091500    
 H    1.781900     -0.4234000      -1.238900    
 H    1.447000      -1.225400       1.184700    
 H    2.537600      8.4899999E-02   1.692700    
 H    3.188400       1.669200      1.6000000E-03
 H    3.141400      -1.987300     -0.1491000    


%chk=000097824-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097824

0 1
O 3.036681 1.005123 -0.876712
O 3.568271 -0.901687 1.161748
N -0.555351 0.302467 -0.079900
C -1.082584 -0.465605 -1.238498
C -1.618795 1.138154 0.536653
C -2.237608 -1.393506 -0.811152
C -2.790295 0.263279 1.026618
C -3.365623 -0.583282 -0.132092
C 0.667017 1.074356 -0.418326
C 1.934681 0.207825 -0.322196
C 2.264887 -0.194456 1.123265
H -0.260431 -1.061068 -1.676501
H -1.446365 0.229832 -2.041602
H -2.011504 1.898898 -0.189535
H -1.177292 1.691548 1.386291
H -1.845369 -2.148901 -0.102588
H -2.623346 -1.932837 -1.697709
H -3.574675 0.910097 1.464793
H -2.421328 -0.407206 1.827176
H -3.834591 0.089639 -0.880148
H -4.160758 -1.258142 0.237363
H 0.772434 1.916492 0.291614
H 0.627483 1.518165 -1.441073
H 1.804477 -0.719614 -0.927691
H 1.448275 -0.803159 1.554795
H 2.429352 0.705012 1.740525
H 3.877194 0.595988 -0.535288
H 3.446362 -1.821910 0.814972


