%chk=000134876.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134876

0 1
 O   -2.546600       1.698200      0.4935000    
 O    9.702200     -0.1274000     -0.4137000    
 O    8.330000      -1.898800     -3.4200002E-02
 N   -5.059100      -3.024700      1.1100000E-02
 N   -6.157400      -2.849100     -0.5422000    
 C    2.337100       1.070100      0.1667000    
 C    3.485400      6.1799999E-02  0.2492000    
 C   0.9877000      0.3949000      0.4227000    
 C    4.858800      0.6800000     -3.0200001E-02
 C  -0.1631000       1.392400      0.3090000    
 C    6.004800     -0.3352000      2.7799999E-02
 C   -1.505600      0.7369000      0.6054000    
 C    7.360800      0.3020000     -0.2644000    
 C   -5.844300      -1.918100      0.5265000    
 C   -5.432300     -0.5382000      0.1430000    
 C   -3.785400       1.229400      0.1413000    
 C   -4.171400     -6.1600000E-02  0.5017000    
 C    8.487500     -0.6998000     -0.2237000    
 C   -6.307200      0.2762000     -0.5758000    
 C   -4.660500       2.043800     -0.5776000    
 C   -5.921400       1.567300     -0.9361000    
 H    2.497100       1.869200      0.9004000    
 H    2.332500       1.537200     -0.8255000    
 H    3.307000     -0.7478000     -0.4695000    
 H    3.494600     -0.3963000       1.246000    
 H   0.9886000     -5.5100001E-02   1.423000    
 H   0.8399000     -0.4186000     -0.2978000    
 H    5.047100       1.479400      0.6970000    
 H    4.845000       1.149900      -1.021500    
 H  -1.0200000E-02   2.230200       1.000800    
 H  -0.1868000       1.833200     -0.6954000    
 H    6.024900     -0.8052000       1.019100    
 H    5.812700      -1.138800     -0.6944000    
 H   -1.503300      0.3318000       1.624200    
 H   -1.639700     -8.4799998E-02 -0.1105000    
 H    7.350400      0.7580000      -1.260500    
 H    7.569500       1.078800      0.4794000    
 H   -6.346900      -2.089300       1.469900    
 H   -3.523300     -0.7084000       1.086700    
 H   -7.293000     -8.3200000E-02 -0.8591000    
 H   -4.365200       3.050400     -0.8609000    
 H   -6.602800       2.201600      -1.495300    
 H    10.42710     -0.7875000     -0.3821000    


%chk=000134876-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000134876

0 1
O -2.544872 1.546222 -0.179152
O 9.911415 0.128805 -0.028865
O 8.664587 -1.789244 0.364044
N -5.319253 -2.791870 1.364048
N -5.310823 -3.058330 0.098214
C 2.408170 0.934445 -0.074143
C 3.596701 -0.038990 0.090462
C 1.033620 0.242964 0.068132
C 4.971827 0.650860 -0.052376
C -0.148278 1.223507 -0.111520
C 6.154017 -0.329976 0.107813
C -1.500647 0.523453 0.033083
C 7.515799 0.374397 -0.038969
C -6.181917 -1.837045 0.498443
C -5.699079 -0.470367 0.215434
C -3.885117 1.147733 -0.106217
C -4.309306 -0.174389 0.165775
C 8.696079 -0.562765 0.124154
C -6.650013 0.557123 -0.007664
C -4.836276 2.176412 -0.328882
C -6.209811 1.872803 -0.277926
H 2.490002 1.745734 0.678784
H 2.469998 1.424344 -1.068202
H 3.513690 -0.849966 -0.662671
H 3.534514 -0.529988 1.083917
H 0.969908 -0.240072 1.065560
H 0.957331 -0.573420 -0.680118
H 5.055105 1.459773 0.703623
H 5.030993 1.144747 -1.045116
H -0.083009 2.037000 0.636184
H -0.096945 1.698644 -1.109933
H 6.101108 -0.825141 1.096337
H 6.075601 -1.139280 -0.643189
H -1.614425 0.081306 1.045067
H -1.613980 -0.283048 -0.721529
H 7.607663 0.864592 -1.028306
H 7.625854 1.188221 0.704950
H -7.257449 -2.027504 0.530054
H -3.581052 -0.971998 0.337910
H -7.721632 0.330249 0.029291
H -4.477266 3.188541 -0.537131
H -6.943556 2.667505 -0.450714
H 10.665925 -0.511186 0.085341


