%chk=000127590.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127590

0 1
 O   -1.084800     -0.8333000     -0.8695000    
 O   -3.740900      9.8999999E-03 -0.5172000    
 O    2.476200      -2.602400      7.1699999E-02
 N    1.012300      0.7076000      0.3721000    
 N    3.011200      0.2234000     -0.4203000    
 N    1.599800      -1.566500      0.3475000    
 C  -0.3212000      0.5376000      0.9488000    
 C   -1.397800      0.3425000     -0.1206000    
 C   -2.772300      0.1576000      0.5153000    
 C    1.907100     -0.2727000      9.2500001E-02
 C    1.555000       1.901700      2.7100001E-02
 C    2.798500       1.578600     -0.4633000    
 C   -5.043100     -0.1841000      1.5900001E-02
 H  -0.2803000     -0.3036000       1.648800    
 H  -0.5281000       1.437600       1.540800    
 H   -1.408300       1.181100     -0.8265000    
 H   -3.025000       1.026700       1.133400    
 H   -2.781200     -0.7453000       1.137900    
 H    1.041700       2.845500      0.1483000    
 H    3.550700       2.252700     -0.8460000    
 H   -1.789700     -0.9543000      -1.528500    
 H   0.7025000      -1.873900      0.7089000    
 H   -5.744000     -0.2872000     -0.8168000    
 H   -5.343300      0.6777000      0.6198000    
 H   -5.079800      -1.097400      0.6175000    
 H    2.585300      -3.007200      0.9491000    


%chk=000127590-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127590

0 1
O -1.227908 -1.196311 -0.305759
O -3.722013 -0.208878 -0.485473
O 2.532346 -2.605252 -0.111629
N 0.984511 0.707609 0.477946
N 3.026079 0.010824 -0.256207
N 1.475471 -1.714761 0.397528
C -0.369275 0.635142 1.034131
C -1.433721 0.229892 -0.001112
C -2.864204 0.416692 0.528420
C 1.804539 -0.374801 0.179044
C 1.749993 1.870890 0.196638
C 2.988916 1.418630 -0.244484
C -5.129635 -0.279427 -0.089557
H -0.379729 -0.108095 1.855111
H -0.623287 1.624573 1.454439
H -1.306332 0.828120 -0.926917
H -3.111972 1.493845 0.641920
H -2.991512 -0.096017 1.507535
H 1.344409 2.869797 0.335182
H 3.849983 2.005919 -0.552642
H -2.042447 -1.503966 -0.786516
H 0.557211 -2.014763 0.028136
H -5.658073 -0.776014 -0.917498
H -5.552671 0.734450 0.062223
H -5.256192 -0.869872 0.841444
H 3.256012 -1.945926 -0.375202


