%chk=000117735.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117735

0 1
 O   -1.226800       2.483200     -0.9720000    
 O   -1.583600       1.858700       1.180400    
 O    2.208300      -1.010400      -1.016100    
 O   -1.981200      -1.374000      -1.141800    
 N  -0.4952000     -0.6216000      0.4852000    
 N    3.488400     -0.1741000      0.7019000    
 C  -4.0800001E-02  0.5659000     -0.1936000    
 C    1.399000      0.9297000      0.1629000    
 C   -1.015800       1.688100      0.1095000    
 C    2.385300     -0.1880000     -0.1205000    
 C   -1.430900      -1.493300     -5.0299998E-02
 C   -1.706800      -2.664200      0.8545000    
 H  -0.1046000      0.3583000      -1.269900    
 H    1.456800       1.198200       1.225700    
 H    1.719100       1.811400     -0.4051000    
 H  -0.1518000     -0.7917000       1.426400    
 H   -2.534500      -3.254700      0.4522000    
 H  -0.8154000      -3.294200      0.9207000    
 H   -1.979400      -2.311100       1.853100    
 H    4.219900     -0.8704000      0.6044000    
 H    3.618500      0.5238000       1.427200    
 H   -1.869800       3.198600     -0.7796000    


%chk=000117735-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117735

0 1
O -0.754591 2.707637 -0.899681
O -2.094184 1.706667 0.714914
O 2.301869 -0.673970 -1.283590
O -1.614426 -1.619944 -1.198393
N -0.525317 -0.650510 0.612842
N 3.496718 -0.138301 0.631621
C -0.087586 0.508998 -0.156673
C 1.328346 0.983422 0.250489
C -1.098715 1.660015 -0.034766
C 2.398028 -0.024464 -0.205264
C -1.305249 -1.648078 0.027653
C -1.738605 -2.771694 0.961745
H -0.057317 0.195818 -1.218686
H 1.383894 1.170167 1.340965
H 1.530976 1.942872 -0.260536
H -0.423520 -0.631403 1.628505
H -2.840073 -2.835973 0.959244
H -1.352563 -3.729092 0.571603
H -1.389456 -2.643701 2.001000
H 4.259662 -0.753210 0.347584
H 3.578115 0.383935 1.502021
H -1.437306 3.429010 -0.837398


