%chk=000014349.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014349

0 1
 O  -2.6900001E-02 -0.3569000     -9.6900001E-02
 O   -1.636900      -1.233400       1.286800    
 O   -3.588500       1.576400      0.1483000    
 O   -5.581100      0.5213000     -0.1040000    
 N   -2.155100     -0.3862000     -0.8098000    
 C    2.307000     -0.1907000      0.3831000    
 C   0.9683000     -0.6355000      0.8945000    
 C    3.098400      -1.078500     -0.3371000    
 C    2.743800       1.105400      0.6335000    
 C    4.342800     -0.6651000     -0.8128000    
 C    3.988300       1.518600      0.1577000    
 C    4.787700      0.6334000     -0.5654000    
 C   -3.579300     -0.6280000     -0.7864000    
 C   -1.306600     -0.7093000      0.2281000    
 C   -4.361700      0.5284000     -0.2195000    
 H   0.9835000      -1.710900       1.111600    
 H   0.7227000     -0.1068000       1.824000    
 H    2.760800      -2.091700     -0.5375000    
 H    2.128300       1.803900       1.193800    
 H    4.965000      -1.354200      -1.376400    
 H    4.334600       2.530000      0.3497000    
 H    5.756400      0.9554000     -0.9361000    
 H   -3.781900      -1.515700     -0.1799000    
 H   -3.897400     -0.7934000      -1.819400    
 H   -1.757300      5.9999999E-02  -1.630800    
 H   -4.120600       2.315400      0.5131000    


%chk=000014349-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014349

0 1
O -0.184835 0.099683 1.330824
O -0.725626 -1.841506 0.084969
O -3.992328 1.720399 -0.618755
O -5.092497 0.215220 -2.010609
N -2.078572 0.067610 0.076903
C 2.235979 -0.209517 0.807267
C 1.104488 -0.547069 1.754107
C 2.482365 -1.016320 -0.334322
C 3.063337 0.916147 1.050017
C 3.536715 -0.697168 -1.218285
C 4.118094 1.236484 0.166435
C 4.356916 0.428956 -0.970095
C -3.072332 -0.514182 -0.818731
C -0.978220 -0.662405 0.455746
C -4.154230 0.467961 -1.230217
H 0.931209 -1.635601 1.811519
H 1.270817 -0.127846 2.758956
H 1.833946 -1.879017 -0.524762
H 2.878374 1.542543 1.931548
H 3.720925 -1.325796 -2.096685
H 4.752901 2.107662 0.363411
H 5.176614 0.673642 -1.655208
H -3.575399 -1.387629 -0.356859
H -2.597984 -0.902983 -1.740809
H -2.198616 1.026876 0.404702
H -4.717742 2.335754 -0.908867


