%chk=000077143.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077143

0 1
 O    2.920200       3.403300      0.1632000    
 O    3.173600      -3.237700      2.7200000E-02
 O   -4.643000      0.2496000      0.7387000    
 N    1.485300      2.5200000E-02 -1.0000000E-03
 N   -4.076900     -0.1818000     -0.2767000    
 C    2.200000       1.198900     -0.4621000    
 C    2.235000      -1.088400      0.5456000    
 C   7.7699997E-02 -2.7100001E-02 -7.0699997E-02
 C    2.186300       2.271600      0.6136000    
 C    2.406900      -2.167300     -0.5101000    
 C  -0.6011000      -1.161000      0.3755000    
 C  -0.6359000       1.055200     -0.5859000    
 C   -1.993300      -1.212900      0.3064000    
 C   -2.028100       1.003300     -0.6549000    
 C   -2.706700     -0.1308000     -0.2087000    
 H    1.836200       1.572700      -1.426800    
 H    3.246700      0.9412000     -0.6756000    
 H    1.804300      -1.481000       1.474800    
 H    3.233700     -0.7527000      0.8578000    
 H    2.663100       1.907700       1.530000    
 H    1.179000       2.603300      0.8802000    
 H    2.945000      -1.775300      -1.379800    
 H    1.458900      -2.575400     -0.8710000    
 H  -0.1067000      -2.033100      0.7886000    
 H  -0.1691000       1.963600     -0.9503000    
 H   -2.506600      -2.104800      0.6591000    
 H   -2.568900       1.855900      -1.060000    
 H    2.477800       3.739400     -0.6349000    
 H    2.679700      -3.600200      0.7824000    


%chk=000077143-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077143

0 1
O 3.199311 3.365553 0.084504
O 3.487697 -3.173809 0.008913
O -4.948369 0.692531 -0.402148
N 1.412244 0.011651 0.008723
N -4.269826 -0.332089 0.012105
C 2.148395 1.189161 -0.496400
C 2.240054 -1.091129 0.539078
C 0.019542 -0.052315 -0.001245
C 2.319402 2.299271 0.573866
C 2.536971 -2.188496 -0.516867
C -0.677731 -1.231404 0.434269
C -0.772231 1.067730 -0.447690
C -2.075461 -1.278468 0.426820
C -2.165440 1.007877 -0.462215
C -2.840908 -0.167973 -0.021978
H 1.651237 1.596882 -1.397046
H 3.156415 0.867645 -0.812986
H 1.759025 -1.536927 1.430712
H 3.206836 -0.678110 0.877591
H 2.835957 1.892904 1.459266
H 1.333003 2.691455 0.895771
H 3.045325 -1.745531 -1.389336
H 1.597951 -2.664518 -0.865842
H -0.123545 -2.111616 0.769831
H -0.281742 1.988880 -0.774644
H -2.614247 -2.173819 0.757035
H -2.771207 1.856681 -0.799923
H 2.724971 3.908689 -0.594448
H 3.039471 -3.749309 0.678882


