%chk=000129046.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129046

0 1
 O   -5.635300      -1.220600      0.5441000    
 O   -5.525800       1.022200      0.8966000    
 N    3.592400      0.1717000     -0.2027000    
 N    4.905200      0.5751000       1.515200    
 C    2.728100      0.4426000      -1.356200    
 C    1.297300      0.5809000     -0.9588000    
 C  -0.8806000     -0.4279000     -0.5614000    
 C   -1.397500      0.8420000     -0.2109000    
 C   0.4690000     -0.5415000     -0.9328000    
 C   0.7889000       1.829700     -0.6142000    
 C    3.918500      -1.049200      0.2801000    
 C  -0.5494000       1.961100     -0.2424000    
 C   -1.728400      -1.547100     -0.5297000    
 C   -2.747200      0.9556000      0.1605000    
 C    4.194600       1.120100      0.5529000    
 C   -3.575200     -0.1671000      0.1859000    
 C   -3.066900      -1.415900     -0.1583000    
 C    4.737700     -0.7770000       1.350500    
 C    3.445200      -2.321700     -0.2914000    
 C   -4.970600     -3.2900002E-02  0.5729000    
 H    2.873000     -0.3462000      -2.101000    
 H    3.096800       1.365100      -1.823100    
 H   0.8617000      -1.511600      -1.227000    
 H    1.423200       2.712200     -0.6300000    
 H  -0.9249000       2.947200      2.3100000E-02
 H   -1.351900      -2.533000     -0.7947000    
 H   -3.146700       1.931800      0.4304000    
 H    4.091600       2.181400      0.3717000    
 H   -3.675800      -2.315600     -0.1519000    
 H    5.216000      -1.484200       2.012800    
 H    3.445600      -2.322200      -1.384400    
 H    4.100300      -3.142100      2.3100000E-02
 H    2.440700      -2.559500      6.9300003E-02
 H   -6.575200      -1.119200      0.8061000    


%chk=000129046-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129046

0 1
O -6.021600 -0.920832 0.071177
O -5.418795 0.749695 1.567179
N 3.767346 0.248602 -0.528231
N 5.475803 1.194815 0.630519
C 2.697078 0.101486 -1.524876
C 1.288518 0.199451 -0.939794
C -1.080319 -0.491958 -0.942130
C -1.360508 0.471244 0.104893
C 0.258134 -0.603589 -1.439282
C 1.005760 1.147808 0.100513
C 4.094783 -0.659624 0.500462
C -0.285651 1.278897 0.607498
C -2.152559 -1.305399 -1.441295
C -2.691930 0.584410 0.607671
C 4.626236 1.345445 -0.401296
C -3.720402 -0.222606 0.099479
C -3.444504 -1.177902 -0.936820
C 5.149056 -0.052124 1.191480
C 3.403067 -1.976954 0.697368
C -5.085273 -0.056259 0.664328
H 2.813524 -0.859011 -2.061016
H 2.845911 0.905218 -2.271517
H 0.467333 -1.339118 -2.227301
H 1.821541 1.760457 0.499781
H -0.495838 2.002863 1.403276
H -1.940900 -2.034257 -2.232327
H -2.925788 1.305699 1.399072
H 4.590306 2.198952 -1.075986
H -4.264210 -1.794297 -1.314450
H 5.688644 -0.439395 2.053351
H 3.495140 -2.635446 -0.188507
H 3.860041 -2.504603 1.550520
H 2.324375 -1.856880 0.911412
H -6.909919 -0.760587 0.489145


