%chk=000117501.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117501

0 1
 O   -1.954500     -0.3800000      0.2985000    
 O   0.6964000       1.662700     -0.2878000    
 O   -3.492000     -0.5252000      -1.408800    
 O    1.145800       3.272300       1.295600    
 N   -4.134600      4.0000002E-03  0.7347000    
 N   0.8596000       3.822100     -0.9186000    
 C   0.4659000     -0.7446000      0.1127000    
 C   0.4822000      -1.823500       1.238600    
 C    1.548500      -1.114600     -0.9578000    
 C  -0.9094000     -0.7081000     -0.6084000    
 C   0.7339000      0.6568000      0.7180000    
 C   0.1850000      -3.251900      0.7953000    
 C    2.963600      -1.190300     -0.4518000    
 C    3.703900      -2.304600     -0.4638000    
 C   -3.214700     -0.3196000     -0.2318000    
 C   0.9206000       2.944400      0.1354000    
 H    1.450000      -1.811600       1.755000    
 H  -0.2574000      -1.550300       2.002800    
 H    1.276000      -2.051700      -1.459400    
 H    1.535100     -0.3582000      -1.754500    
 H   -1.126500      -1.676500      -1.074400    
 H  -0.8935000      3.7599999E-02  -1.413800    
 H  -2.5500000E-02  0.8867000       1.476400    
 H    1.709400      0.6792000       1.218000    
 H   0.2240000      -3.917700       1.664600    
 H   0.9130000      -3.625800      7.2200000E-02
 H  -0.8162000      -3.344500      0.3662000    
 H    3.415700     -0.2757000     -7.8500003E-02
 H    4.723700      -2.289800     -9.5100001E-02
 H    3.311900      -3.243600     -0.8381000    
 H   -3.855600      0.1650000       1.696600    
 H   -5.121400      9.2000000E-02  0.5167000    
 H   0.6699000       3.501800      -1.862300    
 H    1.002400       4.817700     -0.7863000    


%chk=000117501-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117501

0 1
O -1.991552 -0.522524 0.343728
O 0.859257 1.608665 -0.334208
O -3.559545 -0.437489 -1.416752
O 1.095964 3.271375 1.322213
N -4.181554 -0.150943 0.830848
N 1.147139 3.772381 -0.972736
C 0.434764 -0.776460 0.083625
C 0.440659 -1.827100 1.239384
C 1.521964 -1.108333 -1.000766
C -0.917477 -0.736987 -0.659492
C 0.700062 0.595528 0.741975
C -0.000817 -3.254585 0.851973
C 2.952560 -1.031974 -0.511330
C 3.823969 -2.071740 -0.481088
C -3.285052 -0.372658 -0.193050
C 1.039937 2.931506 0.114745
H 1.467257 -1.866347 1.653433
H -0.221409 -1.460884 2.047648
H 1.323358 -2.117079 -1.409060
H 1.395729 -0.388412 -1.834197
H -1.115348 -1.682210 -1.196081
H -0.942232 0.092097 -1.388633
H -0.147284 0.890147 1.385116
H 1.617821 0.580173 1.356472
H 0.080866 -3.924446 1.727281
H 0.629650 -3.682787 0.051566
H -1.052488 -3.279420 0.515484
H 3.300629 -0.039290 -0.187740
H 4.857053 -1.946732 -0.137123
H 3.530309 -3.078656 -0.804833
H -3.864558 -0.101243 1.795764
H -5.161942 -0.022407 0.598410
H 1.075754 3.407882 -1.919356
H 1.281761 4.765453 -0.807121


