%chk=000134938.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134938

0 1
 O    5.062900     -0.4064000       1.126600    
 O    4.175900       1.466400      0.1927000    
 N  -0.5830000     -0.5057000     -0.5978000    
 N    1.452800       1.191400      0.1511000    
 C   -2.127100       1.295600     -0.4906000    
 C  -0.8346000      0.7914000     -0.3609000    
 C   -3.253700      0.3976000     -0.8958000    
 C   0.1993000       1.653300      1.9400001E-02
 C    1.704400     -0.1058000     -8.5900001E-02
 C   0.6705000     -0.9677000     -0.4662000    
 C   -2.407900       2.639000     -0.2490000    
 C  -8.8100001E-02   2.995400      0.2595000    
 C   -3.940700     -0.2445000      0.2820000    
 C    2.996800     -0.6101000      4.3800000E-02
 C   -1.382900       3.493600      0.1282000    
 C   0.9579000      -2.309700     -0.7064000    
 C   -4.044700      -1.556500      0.5679000    
 C    3.277800      -1.953500     -0.1979000    
 C    2.252800      -2.808000     -0.5751000    
 C   -4.747300      -2.130600       1.765300    
 C   -3.439700      -2.586100     -0.3492000    
 C    4.098600      0.2607000      0.4383000    
 H   -4.013300      0.9949000      -1.420500    
 H   -2.918800     -0.3024000      -1.664200    
 H   -3.417200       3.028800     -0.3487000    
 H   0.7081000       3.675400      0.5560000    
 H   -4.410900      0.4539000      0.9741000    
 H   -1.586200       4.542500      0.3205000    
 H   0.1616000      -2.989400      -1.003300    
 H    4.282900      -2.357500     -0.1151000    
 H    2.456100      -3.856400     -0.7701000    
 H   -5.179300      -1.344700       2.393500    
 H   -5.560600      -2.792200       1.450200    
 H   -4.046900      -2.703800       2.381000    
 H   -2.836200      -2.201600      -1.169800    
 H   -2.784200      -3.249000      0.2275000    
 H   -4.233900      -3.199600     -0.7887000    
 H    5.800200      0.1852000       1.388800    


%chk=000134938-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000134938

0 1
O 5.291793 -0.450167 1.051744
O 4.414898 1.515671 0.183238
N -0.576985 -0.526519 -0.700818
N 1.498718 1.240484 0.244976
C -2.203774 1.282223 -0.548391
C -0.853320 0.779228 -0.395196
C -3.326469 0.354553 -0.997588
C 0.205976 1.669167 0.093092
C 1.775837 -0.056222 -0.085754
C 0.714979 -0.956356 -0.546016
C -2.443901 2.621245 -0.232547
C -0.106857 3.031071 0.419151
C -4.061749 -0.253774 0.192857
C 3.121203 -0.584077 0.048833
C -1.407801 3.492934 0.250988
C 1.016826 -2.330918 -0.830820
C -4.131358 -1.570566 0.541681
C 3.356455 -1.938878 -0.213858
C 2.310016 -2.811902 -0.656499
C -4.940513 -2.006724 1.753737
C -3.445895 -2.698412 -0.210268
C 4.271904 0.296509 0.410987
H -4.049400 0.941225 -1.598763
H -2.916045 -0.436366 -1.643859
H -3.457433 3.021618 -0.356181
H 0.705905 3.667240 0.780791
H -4.587029 0.476512 0.827956
H -1.654331 4.534341 0.484945
H 0.197102 -2.969075 -1.175448
H 4.370573 -2.327408 -0.086959
H 2.542477 -3.861447 -0.863266
H -5.453704 -1.156815 2.236357
H -5.706587 -2.755419 1.469049
H -4.290596 -2.491579 2.509319
H -2.677796 -2.332369 -0.909614
H -2.950231 -3.385492 0.503462
H -4.185020 -3.303798 -0.772974
H 6.053532 0.164163 1.232858


