%chk=000039521.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039521

0 1
 O    5.897600     -0.7026000     -5.5999998E-03
 O    3.425600      -1.298300     -0.5806000    
 N   -5.095300     -0.3311000      2.7500000E-02
 N   -2.923900      0.3251000     -0.6364000    
 N    2.575900      0.7453000      0.2292000    
 C   -1.542300      0.4311000     -0.4197000    
 C    1.201900      0.6405000      1.1600000E-02
 C   -3.721800     -0.1839000      0.2713000    
 C  -0.7006000     -0.6154000     -0.7889000    
 C   -1.017900       1.581800      0.1644000    
 C   0.6735000     -0.5105000     -0.5730000    
 C   0.3561000       1.686600      0.3802000    
 C   -3.188400     -0.6715000       1.617700    
 C   -5.683900      0.1098000      -1.234800    
 C   -6.005300      -1.000700      0.9500000    
 C    3.573600     -0.1921000     -6.9899999E-02
 C    4.952100      0.2950000      0.3206000    
 C    7.223100     -0.3092000      0.3365000    
 H   -1.104900      -1.515300      -1.245000    
 H   -1.669500       2.401700      0.4546000    
 H    1.263700      -1.360800     -0.8849000    
 H   0.7538000       2.589300      0.8371000    
 H    2.883000       1.615500      0.6587000    
 H   -2.934500      -1.732100       1.531100    
 H   -2.305400     -0.1201000       1.944100    
 H   -3.935500     -0.5481000       2.405200    
 H   -6.764300      0.2659000      -1.145600    
 H   -5.505400     -0.6399000      -2.012000    
 H   -5.253300       1.063100      -1.559200    
 H   -6.968000      -1.231300      0.4807000    
 H   -6.201500     -0.3625000       1.817200    
 H   -5.584600      -1.952500       1.290600    
 H    5.169400       1.217500     -0.2294000    
 H    4.965200      0.4917000       1.398500    
 H    7.903700      -1.119100      6.0800001E-02
 H    7.303500     -0.1345000       1.413700    
 H    7.508100      0.5919000     -0.2150000    


%chk=000039521-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000039521

0 1
O 5.207578 0.599275 0.770723
O 3.549352 -0.697050 -2.200570
N -5.079877 -0.067933 0.294067
N -2.868181 0.128542 -0.424285
N 2.818036 0.194402 -0.131508
C -1.465788 0.099886 -0.302807
C 1.399126 0.144276 -0.230464
C -3.721377 -0.348976 0.462198
C -0.687762 -0.334652 -1.414877
C -0.765987 0.582950 0.844822
C 0.718358 -0.327585 -1.386614
C 0.640780 0.606329 0.876913
C -3.343179 -1.238760 1.645364
C -5.529843 0.726223 -0.860584
C -6.143449 -0.704699 1.079266
C 3.764999 -0.197962 -1.052606
C 5.209852 0.021317 -0.575532
C 6.548940 0.854780 1.292372
H -1.216100 -0.681209 -2.309068
H -1.334833 0.973892 1.696497
H 1.300627 -0.674418 -2.242859
H 1.155408 0.993269 1.766314
H 3.223971 0.571164 0.735789
H -3.883342 -2.201794 1.606748
H -2.263403 -1.448122 1.614773
H -3.572656 -0.760849 2.615730
H -6.191558 1.547762 -0.525175
H -6.087246 0.097277 -1.584450
H -4.639758 1.137275 -1.358873
H -6.561178 -1.600798 0.571527
H -6.969230 0.016719 1.222571
H -5.786690 -1.006282 2.075201
H 5.734190 -0.957381 -0.588128
H 5.715619 0.696479 -1.297731
H 6.414366 1.287356 2.295754
H 7.098738 1.573809 0.650531
H 7.134998 -0.084213 1.370271


