%chk=000087889.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087889

0 1
 O    3.352100       1.809800      1.9400001E-02
 N    1.251700      0.8481000      1.5100000E-02
 C   0.4477000     -0.2761000      5.5999998E-03
 C   -1.015600     -9.4499998E-02  3.1999999E-03
 C    1.013200      -1.495600     -1.5100000E-02
 C   -1.713700     -3.0999999E-02   1.209100    
 C   -1.701600      1.5900001E-02  -1.206300    
 C    2.637100      0.8110000      8.7000001E-03
 C    2.450000      -1.624800     -2.0600000E-02
 C   -3.097600      0.1429000       1.205500    
 C   -3.085600      0.1899000      -1.209900    
 C    3.246100     -0.5489000     -1.0800000E-02
 C   -3.783700      0.2533000     -3.8999999E-03
 H   0.7945000       1.755600      2.7300000E-02
 H   0.4238000      -2.406500     -2.8600000E-02
 H   -1.193000     -0.1145000       2.160000    
 H   -1.171600     -3.0600000E-02  -2.154700    
 H    2.869900      -2.624600     -3.4400001E-02
 H   -3.641200      0.1926000       2.144500    
 H   -3.619800      0.2761000      -2.151500    
 H    4.326100     -0.6326000     -1.5600000E-02
 H   -4.861300      0.3889000     -6.6999998E-03


%chk=000087889-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000087889

0 1
O 3.285927 1.679460 -1.096620
N 1.251970 0.701380 -0.482715
C 0.453603 -0.294764 0.065553
C -1.019669 -0.112724 0.009726
C 1.083143 -1.409501 0.621882
C -1.846030 -0.619742 1.049876
C -1.633360 0.573556 -1.075332
C 2.684998 0.697066 -0.558462
C 2.514537 -1.489805 0.602934
C -3.244815 -0.448825 1.003958
C -3.033070 0.746210 -1.117524
C 3.292146 -0.487697 0.035780
C -3.845205 0.236759 -0.078380
H 0.817402 1.555975 -0.847393
H 0.481258 -2.227699 1.021523
H -1.387506 -1.121100 1.909051
H -1.025610 0.934714 -1.914141
H 3.001063 -2.370552 1.037512
H -3.865752 -0.839226 1.817527
H -3.489736 1.267690 -1.965589
H 4.383798 -0.538810 0.012252
H -4.931592 0.372034 -0.111119


