%chk=000093005.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093005

0 1
 O  -0.3646000      -1.534500       1.134600    
 O    1.804300       1.370400     -0.7285000    
 O    1.210000      0.6907000       1.281300    
 N    1.029800      0.8150000      6.2300000E-02
 C  -0.2335000      0.2696000     -0.4926000    
 C  -0.2560000      -1.247500     -0.2580000    
 C   -1.391800      0.9984000      0.1963000    
 C   0.9580000      -1.972900     -0.8317000    
 C   -2.756300      0.6109000     -0.3638000    
 H  -0.2328000      0.4852000      -1.568200    
 H   -1.148800      -1.663100     -0.7390000    
 H   -1.396700      0.8278000       1.280100    
 H   -1.266300       2.081300      6.2300000E-02
 H   0.8244000      -3.056700     -0.7396000    
 H    1.101500      -1.734400      -1.889900    
 H    1.874600      -1.734200     -0.2822000    
 H   -3.534800       1.240700      7.8699999E-02
 H   -2.788200      0.7460000      -1.449500    
 H   -3.004100     -0.4295000     -0.1343000    
 H  -0.4081000      -2.500800       1.233300    


%chk=000093005-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093005

0 1
O -0.591340 -1.756477 1.051674
O 1.804088 1.483558 -0.577769
O 1.354972 0.326268 1.333364
N 1.062953 0.713710 0.129580
C -0.258659 0.210783 -0.463486
C -0.324343 -1.343272 -0.326851
C -1.421524 0.958139 0.235896
C 0.907795 -2.057487 -0.915237
C -2.784002 0.630743 -0.410669
H -0.202081 0.490560 -1.530286
H -1.225459 -1.656596 -0.883290
H -1.435148 0.672912 1.302534
H -1.228093 2.046060 0.174663
H 0.763509 -3.147306 -0.832123
H 1.051179 -1.804540 -1.982364
H 1.832196 -1.795443 -0.368884
H -3.573741 1.256100 0.041528
H -2.780409 0.831461 -1.498490
H -3.062882 -0.424365 -0.247957
H 0.131590 -1.372408 1.619766


