%chk=000154238.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154238

0 1
 O   0.1274000      0.5839000     -0.1078000    
 O   -1.348300       2.351300      0.6855000    
 O   -3.305100      0.3394000      0.8841000    
 O   -1.988800       2.681300      -1.515500    
 N   -1.143300      0.9952000      0.3587000    
 C    2.444000      0.4429000      0.4199000    
 C    1.088600      0.8731000      0.8988000    
 C   -1.882100      -1.319200      0.1321000    
 C    2.889700     -0.8477000      0.6832000    
 C    3.242500       1.338500     -0.2825000    
 C   -2.168700      8.0899999E-02  0.4922000    
 C    4.149800      -1.247600      0.2384000    
 C    4.502600      0.9386000     -0.7274000    
 C   -1.404900      -2.184900       1.102400    
 C   -2.095600      -1.741300      -1.169900    
 C    4.956200     -0.3544000     -0.4669000    
 C   -1.133400      -3.509900      0.7613000    
 C   -1.824200      -3.066300      -1.510900    
 C   -1.343100      -3.950500     -0.5454000    
 C   -1.785200       3.086700     -0.3791000    
 C   -1.978100       4.510000      4.8700001E-02
 H   0.8308000      0.3475000       1.827300    
 H    1.105200       1.947600       1.121500    
 H    2.268400      -1.552300       1.229300    
 H    2.898200       2.347400     -0.4930000    
 H   -1.237900      -1.848500       2.121800    
 H   -2.469400      -1.058200      -1.927300    
 H    4.502700      -2.254700      0.4404000    
 H    5.130300       1.633800      -1.277100    
 H    5.937200     -0.6659000     -0.8136000    
 H  -0.7580000      -4.198200       1.512900    
 H   -1.987000      -3.409400      -2.528400    
 H   -1.131300      -4.982100     -0.8111000    
 H   -2.719500       4.559200      0.8502000    
 H   -2.343500       5.097000     -0.7988000    
 H   -1.024700       4.930200      0.3788000    


%chk=000154238-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000154238

0 1
O 0.286095 0.771678 0.150050
O -1.245890 2.444502 0.919439
O -3.215438 0.592653 0.991556
O -1.974600 2.274360 -1.330007
N -0.933390 1.011048 0.879512
C 2.689631 0.497696 0.323323
C 1.457341 0.831066 1.122667
C -1.828724 -1.303790 0.386645
C 3.108628 -0.850382 0.182603
C 3.436060 1.522853 -0.310845
C -2.072511 0.144698 0.704518
C 4.256006 -1.167993 -0.576689
C 4.583348 1.207903 -1.071845
C -2.764543 -2.214726 0.951870
C -0.819556 -1.794908 -0.483768
C 4.995706 -0.138624 -1.205209
C -2.674804 -3.593845 0.679164
C -0.747440 -3.176882 -0.768091
C -1.662992 -4.080717 -0.182599
C -1.842207 2.956464 -0.308107
C -2.255352 4.384623 -0.058401
H 1.254340 0.099658 1.924065
H 1.482648 1.852401 1.541335
H 2.533209 -1.648293 0.668174
H 3.114028 2.566234 -0.209977
H -3.559931 -1.817437 1.590633
H -0.115510 -1.102243 -0.947962
H 4.574615 -2.211381 -0.676380
H 5.154348 2.006647 -1.557638
H 5.887344 -0.383715 -1.793074
H -3.394895 -4.286162 1.128667
H 0.022953 -3.544615 -1.454886
H -1.596400 -5.152139 -0.402878
H -3.265987 4.383299 0.389000
H -2.291660 4.933342 -1.011551
H -1.572970 4.880127 0.649483


