%chk=000067747.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067747

0 1
 O  -5.1899999E-02   2.054900      0.5350000    
 O    1.904700      -2.141800      0.4591000    
 O   -2.542600      -1.718500     -0.5354000    
 N   -1.321300      0.2403000     -0.1829000    
 N  -0.3060000      -1.893500     -0.1010000    
 C    1.138100      7.2400004E-02 -0.1584000    
 C    1.456100      0.2224000      -1.657200    
 C    2.316600      0.6211000      0.6614000    
 C  -0.1177000      0.8947000      0.1249000    
 C   0.9726000      -1.411600      0.1253000    
 C    1.669700       1.674100      -2.021900    
 C    2.095800      0.4045000       2.142300    
 C   -1.468600      -1.154600     -0.3092000    
 C   -2.537200       1.044200     -0.2221000    
 C   -3.208200       1.091400       1.140200    
 H   0.6413000     -0.1800000      -2.272600    
 H    2.351000     -0.3560000      -1.920600    
 H    2.457100       1.697500      0.5162000    
 H    3.256800      0.1371000      0.3680000    
 H   0.7970000       2.304000      -1.832600    
 H    2.545100       2.115900      -1.539800    
 H    1.859400       1.739300      -3.100300    
 H    1.170100      0.8622000       2.502800    
 H    2.083300     -0.6511000       2.425500    
 H    2.917300      0.8658000       2.702300    
 H  -0.4210000      -2.902300     -5.5500001E-02
 H   -2.293100       2.061900     -0.5470000    
 H   -3.230200      0.6207000     -0.9576000    
 H   -3.490300      8.9800000E-02   1.480600    
 H   -2.542900       1.523600       1.894800    
 H   -4.114900       1.702700       1.095200    


%chk=000067747-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000067747

0 1
O -0.156755 2.128657 0.224696
O 1.978908 -2.193038 0.114704
O -2.614470 -1.796657 -0.341991
N -1.387986 0.198850 -0.158593
N -0.302078 -1.927802 -0.140100
C 1.147290 0.101853 -0.209586
C 1.569447 0.281741 -1.736142
C 2.256834 0.637753 0.739829
C -0.157734 0.888185 0.000414
C 1.001049 -1.415788 -0.036714
C 1.907210 1.722159 -2.167128
C 1.963343 0.412331 2.238230
C -1.508919 -1.206074 -0.230735
C -2.656627 0.987414 -0.124623
C -3.218336 1.120764 1.303071
H 0.756102 -0.117107 -2.375198
H 2.448934 -0.372815 -1.886619
H 2.370641 1.718082 0.549608
H 3.201444 0.134457 0.464502
H 1.076396 2.421228 -1.972162
H 2.801018 2.105506 -1.646407
H 2.122283 1.735892 -3.251532
H 1.035157 0.926196 2.548617
H 1.874459 -0.662352 2.479138
H 2.786336 0.820501 2.851737
H -0.406742 -2.947896 -0.127107
H -2.421467 1.979192 -0.542335
H -3.375319 0.468560 -0.779083
H -3.455278 0.130198 1.728033
H -2.498961 1.637102 1.961330
H -4.150081 1.714007 1.281646


