%chk=000122965.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122965

0 1
 O   0.9217000     -0.9109000      0.7812000    
 O    2.963700      -1.555600     -0.9911000    
 O   -4.676300      0.7639000      -1.509900    
 O   -5.270200      6.3199997E-02  0.4839000    
 N   -4.393100      0.2833000     -0.3860000    
 C    1.881600      2.7700000E-02  0.4420000    
 C  -0.3769000     -0.6192000      0.4962000    
 C    2.891000     -0.3115000     -0.4413000    
 C  -0.7146000     -8.5199997E-02 -0.7474000    
 C   -1.370100     -0.8545000       1.447000    
 C    1.802500       1.290100       1.003500    
 C   -3.038200     -2.1500001E-02 -8.9400001E-02
 C    3.852600      0.6427000     -0.7743000    
 C   -2.045200      0.2138000      -1.040200    
 C   -2.700800     -0.5556000       1.154200    
 C    2.764300       2.244100      0.6705000    
 C    3.789300       1.920400     -0.2183000    
 C    3.718700      -2.535200     -0.2806000    
 H   3.4899998E-02  9.0899996E-02  -1.514200    
 H   -1.112500      -1.269900       2.417500    
 H    1.016200       1.552000       1.705400    
 H    4.653600      0.3978000      -1.466600    
 H   -2.272000      0.6251000      -2.020500    
 H   -3.447400     -0.7520000       1.919300    
 H    2.716400       3.238200       1.105300    
 H    4.538300       2.663000     -0.4771000    
 H    3.294700      -2.701100      0.7147000    
 H    4.765300      -2.225800     -0.1968000    
 H    3.674900      -3.473500     -0.8402000    


%chk=000122965-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122965

0 1
O 1.145317 -0.447356 1.165651
O 3.080754 -1.443390 -0.908600
O -4.603151 0.314142 -1.538943
O -5.108104 -1.080953 0.196335
N -4.271373 -0.381591 -0.499986
C 2.143467 0.386552 0.558136
C -0.177788 -0.370433 0.702535
C 3.056496 -0.146037 -0.393981
C -0.570063 0.379853 -0.435548
C -1.122933 -1.124326 1.444805
C 2.236179 1.729690 0.981928
C -2.855976 -0.378478 -0.084293
C 4.041264 0.725886 -0.931521
C -1.919801 0.373017 -0.829664
C -2.469463 -1.129882 1.051462
C 3.221427 2.580891 0.443073
C 4.121025 2.070780 -0.525695
C 2.490981 -2.571695 -0.160923
H 0.168938 0.954607 -1.000157
H -0.782255 -1.686362 2.318764
H 1.524331 2.088753 1.732838
H 4.735093 0.307711 -1.667167
H -2.260077 0.935652 -1.702908
H -3.225016 -1.696460 1.601435
H 3.288216 3.621540 0.774357
H 4.892213 2.718063 -0.956161
H 1.392864 -2.589980 -0.263602
H 2.763890 -2.529526 0.907461
H 2.925947 -3.465970 -0.632828


