%chk=000094413.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094413

0 1
 O   -1.870100      -1.866100     -0.1471000    
 O   -2.947700      0.7015000     -0.2192000    
 N    1.060900      0.3527000      0.2774000    
 C   0.2742000     -0.8168000      0.1377000    
 C    2.512700      0.2855000      0.4639000    
 C   0.4347000       1.589200      0.2133000    
 C   -1.073000     -0.7501000     -2.0300001E-02
 C   0.9752000      -2.153600      0.1835000    
 C    3.242900      0.2790000     -0.8632000    
 C  -0.8752000       1.787600      4.8999999E-02
 C   -1.734600      0.5911000     -7.5000003E-02
 H    2.855400       1.147500       1.051700    
 H    2.801900     -0.5878000       1.059400    
 H    1.108000       2.434700      0.3085000    
 H    1.247000      -2.400500       1.215100    
 H    1.883800      -2.155100     -0.4239000    
 H   0.3872000      -2.983300     -0.2162000    
 H    2.936300     -0.5514000      -1.505000    
 H    3.052900       1.205100      -1.416700    
 H    4.322600      0.2017000     -0.7012000    
 H   -1.319100       2.773400      5.7000001E-03
 H   -1.411900      -2.647900      0.1952000    


%chk=000094413-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094413

0 1
O -1.949311 -1.812155 -0.085903
O -3.054503 0.704816 -0.269823
N 1.073602 0.338209 0.306674
C 0.289543 -0.829743 0.169676
C 2.553027 0.284600 0.445182
C 0.467955 1.586377 0.237027
C -1.091604 -0.708301 0.009566
C 0.985997 -2.176227 0.234749
C 3.291199 0.312961 -0.910112
C -0.889138 1.740224 0.045935
C -1.793460 0.599034 -0.092150
H 2.856999 1.154753 1.054335
H 2.830205 -0.613409 1.021687
H 1.139877 2.442464 0.349923
H 1.197755 -2.493128 1.274358
H 1.939112 -2.178290 -0.320878
H 0.370574 -2.965444 -0.233643
H 3.022159 -0.553783 -1.539104
H 3.040086 1.228190 -1.474279
H 4.384422 0.295449 -0.748395
H -1.326585 2.741339 0.005778
H -1.473811 -2.661536 0.091998


