%chk=000076070.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076070

0 1
 O    1.993800      0.5430000      0.3775000    
 O    4.779500      0.8180000      0.4615000    
 O   0.1171000      -3.047500     -8.9400001E-02
 O    1.981200      -1.916000      0.1628000    
 O   -4.203300       1.409300     -6.1700001E-02
 O   -4.116700     -0.7764000     -0.2459000    
 N   0.7330000      -1.965100      5.4900002E-02
 N   -3.554600      0.3361000     -0.1022000    
 C   0.6376000      0.4730000      0.2572000    
 C  -8.8000000E-03 -0.7525000      9.7099997E-02
 C  -0.1049000       1.653100      0.2976000    
 C   -1.397800     -0.7981000     -2.2600001E-02
 C   -2.140300      0.3821000      1.7800000E-02
 C    2.692300       1.303600     -0.6056000    
 C   -1.493900       1.607600      0.1781000    
 C    4.085700      0.7299000     -0.7770000    
 H   0.3831000       2.614700      0.4312000    
 H   -1.904400      -1.752300     -0.1472000    
 H    2.169100       1.275900      -1.569300    
 H    2.751600       2.340900     -0.2575000    
 H   -2.040000       2.546800      0.2164000    
 H    4.650800       1.275800      -1.538100    
 H    4.043900     -0.3268000      -1.055800    
 H    4.837600       1.759300      0.6987000    


%chk=000076070-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076070

0 1
O 2.005934 0.231048 -0.404254
O 4.748568 0.661798 0.761130
O 0.091642 -3.091801 0.759138
O 1.535280 -2.416711 -0.877035
O -4.218526 1.538615 0.239980
O -4.226336 -0.730674 0.502721
N 0.568538 -2.209168 -0.055365
N -3.625310 0.391163 0.288374
C 0.640041 0.326076 -0.294362
C -0.096197 -0.881616 -0.068128
C -0.084824 1.550859 -0.347111
C -1.482638 -0.865403 0.144512
C -2.161913 0.365876 0.084548
C 2.805393 1.462334 -0.602301
C -1.475512 1.574201 -0.166640
C 4.278017 1.047397 -0.567049
H 0.441308 2.490469 -0.530883
H -2.023412 -1.793172 0.348596
H 2.548686 1.897366 -1.589698
H 2.572296 2.193915 0.198207
H -2.041195 2.508599 -0.210490
H 4.882423 1.876348 -0.995421
H 4.416232 0.149310 -1.189705
H 4.793102 1.457572 1.349737


