%chk=000138944.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138944

0 1
 O    8.932700      -1.101700      8.4799998E-02
 O   -8.932700      -1.101600     -8.4600002E-02
 O    3.360100       2.101200      0.9435000    
 O   -3.360300       2.101400     -0.9433000    
 N    3.505900      2.0700000E-02 -0.1314000    
 N   -3.505800      2.0600000E-02  0.1312000    
 C    1.383700       1.144100      0.1759000    
 C   -1.383800       1.144200     -0.1763000    
 C   0.6918000     -6.3800000E-02  8.7800004E-02
 C  -0.6919000     -6.3699998E-02 -8.8399999E-02
 C   0.6919000       2.352100      8.8299997E-02
 C  -0.6919000       2.352200     -8.7899998E-02
 C    2.826100       1.144300      0.3594000    
 C   -2.826200       1.144400     -0.3595000    
 C    4.892000     -0.2657000     -7.5700000E-02
 C   -4.892000     -0.2657000      7.5700000E-02
 C    5.360800      -1.445300     -0.6281000    
 C   -5.360600      -1.445400      0.6280000    
 C    5.746500      0.6400000      0.5291000    
 C   -5.746600      0.6401000     -0.5288000    
 C    7.601000     -0.8263000      3.1300001E-02
 C   -7.600900     -0.8263000     -3.1099999E-02
 C    6.725600      -1.727800     -0.5743000    
 C   -6.725500      -1.727900      0.5741000    
 C    7.111400      0.3576000      0.5830000    
 C   -7.111500      0.3576000     -0.5827000    
 C    9.366000      -2.329500     -0.4986000    
 C   -9.365900      -2.329700      0.4988000    
 H    1.181700      -1.028500      0.1811000    
 H   -1.181700      -1.028400     -0.1821000    
 H    1.212300       3.304400      0.1506000    
 H   -1.212300       3.304500     -0.1498000    
 H    2.969900     -0.6834000     -0.6312000    
 H   -2.969700     -0.6835000      0.6308000    
 H    4.686900      -2.153800      -1.101700    
 H   -4.686600      -2.154100       1.101300    
 H    5.446100       1.574900      0.9777000    
 H   -5.446300       1.575100     -0.9772000    
 H    7.038300      -2.665000      -1.021900    
 H   -7.038000      -2.665300       1.021600    
 H    7.789600       1.062800       1.056000    
 H   -7.789800       1.062900      -1.055500    
 H    10.45150      -2.385000     -0.3663000    
 H    8.936400      -3.194300      1.8300001E-02
 H    9.173800      -2.352700      -1.576600    
 H   -9.173400      -2.352900       1.576800    
 H   -10.45140      -2.385100      0.3665000    
 H   -8.936200      -3.194300     -1.8400000E-02


%chk=000138944-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138944

0 1
O 9.190548 -1.042410 0.110681
O -9.190499 -1.042476 -0.110769
O 3.452236 2.134757 0.876421
O -3.452212 2.134835 -0.876113
N 3.631721 0.021468 -0.137544
N -3.631683 0.021428 0.137608
C 1.418083 1.033598 0.147880
C -1.418053 1.033606 -0.147696
C 0.701487 -0.189595 0.072599
C -0.701450 -0.189591 -0.072559
C 0.697972 2.254887 0.081146
C -0.697950 2.254893 -0.080817
C 2.913084 1.117893 0.336714
C -2.913054 1.117913 -0.336522
C 5.035291 -0.219582 -0.067054
C -5.035251 -0.219628 0.067083
C 5.529869 -1.402183 -0.672118
C -5.529821 -1.402303 0.672007
C 5.947265 0.662197 0.580078
C -5.947230 0.662219 -0.579951
C 7.805027 -0.838298 0.009207
C -7.804980 -0.838361 -0.009264
C 6.904078 -1.718324 -0.640149
C -6.904026 -1.718454 0.639994
C 7.315433 0.346220 0.613713
C -7.315396 0.346232 -0.613629
C 9.740195 -2.253446 -0.501472
C -9.740138 -2.253587 0.501238
H 1.219647 -1.152392 0.162495
H -1.219603 -1.152381 -0.162570
H 1.259749 3.190387 0.164582
H -1.259732 3.190398 -0.164143
H 3.096919 -0.682182 -0.651177
H -3.096877 -0.682278 0.651160
H 4.837727 -2.089338 -1.176703
H -4.837675 -2.089511 1.176515
H 5.571742 1.578948 1.037042
H -5.571714 1.579026 -1.036806
H 7.251461 -2.639079 -1.117561
H -7.251403 -2.639267 1.117298
H 8.028807 1.013374 1.106909
H -8.028773 1.013436 -1.106751
H 10.820985 -2.211404 -0.302144
H 9.312368 -3.166883 -0.043379
H 9.563766 -2.268796 -1.594994
H -9.563717 -2.269063 1.594761
H -10.820927 -2.211534 0.301908
H -9.312298 -3.166968 0.043045


