%chk=000085858.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085858

0 1
 O    1.272100       2.020600     -1.1900000E-02
 O   -2.963000      0.2321000     -0.1840000    
 N  -0.8591000       1.080400      0.1333000    
 N   -1.233300      -1.236300      0.1307000    
 C    1.109400     -0.4214000     -2.8100001E-02
 C   0.5385000      0.9128000      0.4895000    
 C   0.1550000      -1.528600      0.4460000    
 C    2.508100     -0.6624000      0.5662000    
 C    1.235600     -0.4354000      -1.565400    
 C   -1.763400      3.8100000E-02  2.3600001E-02
 H   0.5860000      0.9533000       1.583900    
 H   0.4002000      -2.495700     -6.6999998E-03
 H   0.2036000      -1.650200       1.534700    
 H    2.908100      -1.632500      0.2503000    
 H    3.216600      0.1103000      0.2480000    
 H    2.480200     -0.6565000       1.661700    
 H    1.582600      -1.413500      -1.918100    
 H   0.2811000     -0.2292000      -2.060300    
 H    1.957700      0.3107000      -1.915400    
 H   -1.218600       2.027500      6.9899999E-02
 H   -1.875800      -2.019500      6.3500002E-02
 H   0.9429000       2.197600     -0.9092000    


%chk=000085858-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085858

0 1
O 1.251831 2.093967 -0.099033
O -3.014040 0.232373 -0.246300
N -0.875721 1.053899 0.228266
N -1.229746 -1.261207 0.004346
C 1.115820 -0.431805 -0.020631
C 0.565702 0.940808 0.489027
C 0.135057 -1.526580 0.480993
C 2.513443 -0.663863 0.594525
C 1.200584 -0.446743 -1.567643
C -1.786391 0.013631 -0.014441
H 0.798395 1.057370 1.565746
H 0.463007 -2.511824 0.102751
H 0.170851 -1.568899 1.592431
H 2.972036 -1.585564 0.191235
H 3.179017 0.185424 0.360069
H 2.461262 -0.761475 1.695699
H 1.484122 -1.454184 -1.921759
H 0.235108 -0.187330 -2.036754
H 1.976475 0.253858 -1.926759
H -1.301468 1.974347 0.354169
H -1.885160 -2.025021 -0.155917
H 1.034315 2.121016 -1.067819


