%chk=000039211.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039211

0 1
 O    3.612400     -0.2335000      8.2999999E-03
 O   -2.216000       2.052600      9.1899998E-02
 O   -2.672000     -7.6399997E-02 -0.1886000    
 O   -1.387800      -2.504200      0.5972000    
 N   -1.852400      0.8608000     -4.3699998E-02
 C  -5.2000000E-03 -0.7485000     -0.1800000    
 C  -0.4615000      0.5615000     -3.3000000E-02
 C    1.363800      -1.015900     -0.1662000    
 C   0.4510000       1.604000      0.1278000    
 C    2.276400      2.6799999E-02 -5.4000001E-03
 C    1.819900       1.336700      0.1416000    
 C  -0.9286000      -1.864000     -0.3501000    
 H    1.726200      -2.035000     -0.2803000    
 H   0.1363000       2.637900      0.2455000    
 H    2.521000       2.157500      0.2676000    
 H   -1.178800      -2.120400      -1.393900    
 H    4.095000      0.6023000      0.1287000    


%chk=000039211-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039211

0 1
O 3.620238 -0.311367 0.175101
O -2.208973 2.196948 -0.334633
O -2.784299 0.051269 0.177010
O -0.473535 -3.140035 -0.277221
N -1.905475 0.965273 -0.085009
C -0.034070 -0.765420 -0.146079
C -0.473748 0.592925 -0.079251
C 1.353031 -1.015819 -0.060844
C 0.450027 1.655280 0.042687
C 2.277175 0.042017 0.086119
C 1.825740 1.387666 0.126796
C -0.913376 -1.967769 -0.398597
H 1.703807 -2.050996 -0.119364
H 0.069999 2.679266 0.079479
H 2.537805 2.215226 0.229936
H -1.951772 -1.771609 -0.726553
H 4.207125 0.479344 0.277824


