%chk=000032015.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032015

0 1
 O   -3.233200      0.2791000      -1.436100    
 N    3.152500       1.097700     -0.3780000    
 C    1.424500      4.0700000E-02  0.1881000    
 C    1.960900      0.6267000      -1.125500    
 C    2.333700       1.080100      0.8589000    
 C    1.819200      -1.407400      0.4460000    
 C  -8.8000000E-02  0.1550000      0.4459000    
 C    1.075900      -2.336100     -0.5113000    
 C    3.476800       2.467200     -0.7523000    
 C  -0.9913000      0.1656000     -0.6244000    
 C  -0.5782000      0.2500000       1.754600    
 C    1.421500      -3.794000     -0.2568000    
 C   -2.362500      0.2696000     -0.3900000    
 C   -1.949300      0.3541000       1.988800    
 C   -2.841400      0.3639000      0.9166000    
 C   -4.621200      0.3880000      -1.124700    
 H    2.199600     -7.7299997E-02  -1.928400    
 H    1.348000       1.426400      -1.564600    
 H    1.836800       2.027100       1.111600    
 H    2.874200      0.7389000       1.748500    
 H    1.607600      -1.691300       1.485300    
 H    2.899400      -1.550800      0.3110000    
 H    1.308900      -2.096100      -1.553900    
 H  -8.6000003E-03  -2.259700     -0.3982000    
 H    2.616800       3.148000     -0.7428000    
 H    3.908900       2.485700      -1.758700    
 H    4.231600       2.870700     -6.8599999E-02
 H  -0.6395000      8.2400002E-02  -1.649500    
 H   0.1043000      0.2420000       2.600600    
 H    2.492600      -3.972700     -0.3959000    
 H    1.152900      -4.089600      0.7624000    
 H   0.8773000      -4.441000     -0.9521000    
 H   -2.321300      0.4269000       3.006700    
 H   -3.892600      0.4469000       1.170300    
 H   -4.849800       1.339300     -0.6324000    
 H   -4.972800     -0.4735000     -0.5468000    
 H   -5.166900      0.3802000      -2.073800    


%chk=000032015-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000032015

0 1
O -3.321846 0.387896 -1.445881
N 3.068975 1.180518 -0.401655
C 1.333403 0.027374 0.161787
C 1.904546 0.625476 -1.179033
C 2.298342 1.046819 0.884366
C 1.800126 -1.439314 0.400773
C -0.152484 0.192872 0.442638
C 1.127316 -2.496557 -0.502795
C 3.593903 2.499904 -0.772436
C -1.101076 0.242412 -0.600105
C -0.611779 0.256992 1.788688
C 1.665261 -3.918405 -0.232106
C -2.485205 0.352033 -0.315357
C -1.987669 0.369092 2.066811
C -2.942557 0.417381 1.022591
C -4.763815 0.497510 -1.214862
H 2.186038 -0.079957 -1.981050
H 1.243294 1.419973 -1.595268
H 1.766048 1.980224 1.179350
H 2.890980 0.668779 1.737820
H 1.609679 -1.700681 1.462780
H 2.898119 -1.468821 0.251978
H 1.296308 -2.237157 -1.567617
H 0.031677 -2.477232 -0.346470
H 2.811661 3.301156 -0.788803
H 4.052920 2.448119 -1.776572
H 4.380095 2.802263 -0.056778
H -0.794092 0.194694 -1.650012
H 0.111786 0.224280 2.611571
H 2.755454 -3.974088 -0.413127
H 1.485001 -4.216504 0.818282
H 1.175301 -4.665717 -0.883030
H -2.331207 0.422120 3.106350
H -4.006726 0.505912 1.259471
H -5.017630 1.437030 -0.685977
H -5.147071 -0.366962 -0.638108
H -5.215775 0.503268 -2.217713


