%chk=000116999.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116999

0 1
 O    2.612100       2.378300      0.2970000    
 O    3.454400     -0.8050000      -1.168800    
 O   -2.893600       1.960100      -1.115200    
 O   0.9136000      -2.727500      5.9999999E-02
 O   -3.441600      -1.179600      8.0300003E-02
 N    1.815300      0.1272000      0.1910000    
 N   -1.715500      0.3983000      0.1667000    
 N   0.3109000       1.799600      0.2471000    
 N   -1.265400      -1.931400      7.0000000E-02
 C  -0.3573000      0.6010000      0.1888000    
 C   0.5416000     -0.3889000      0.1555000    
 C    1.714800       1.550700      0.2512000    
 C   0.1237000      -1.791800      9.1100000E-02
 C   -2.238600     -0.9102000      0.1046000    
 C    3.045900     -0.6212000      0.1729000    
 C   -2.620300       1.540400      0.2077000    
 H  -0.1268000       2.711500      0.2763000    
 H    2.942200      -1.581300      0.6832000    
 H    3.817100     -3.3900000E-02  0.6817000    
 H   -2.199000       2.365800      0.7894000    
 H   -3.565100       1.241000      0.6730000    
 H   -1.619800      -2.882900      2.5200000E-02
 H    4.295900      -1.291500      -1.147900    
 H   -3.507900       2.711500      -1.056500    


%chk=000116999-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116999

0 1
O 2.569602 2.579996 0.307506
O 3.297057 -1.284954 -0.979734
O -2.444504 2.588234 -0.508327
O 1.046003 -2.737733 -0.167807
O -3.408033 -1.260233 -0.045041
N 1.870334 0.275833 0.211703
N -1.725283 0.375383 0.176962
N 0.267069 1.859429 0.284960
N -1.157436 -1.924337 -0.075018
C -0.363454 0.633485 0.215471
C 0.612343 -0.362154 0.163161
C 1.701953 1.677074 0.269277
C 0.261999 -1.740219 -0.025628
C -2.182833 -0.967893 0.010352
C 3.181822 -0.420998 0.161107
C -2.709858 1.466279 0.374648
H -0.185495 2.770744 0.192398
H 3.307725 -0.978389 1.111441
H 3.946016 0.365649 0.072075
H -2.602379 1.882388 1.389555
H -3.706375 1.012622 0.240686
H -1.475746 -2.890302 -0.204489
H 2.706832 -2.082990 -0.826273
H -2.770759 2.403284 -1.424685


