%chk=000148184.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148184

0 1
 O   -1.602800       2.094000      -1.367500    
 N   -2.442500      0.4601000      7.9000004E-02
 N    2.706000      -1.231700      -1.206000    
 N    3.884900      0.1419000      0.9019000    
 C   -4.180900      -1.808500      0.4858000    
 C   -4.499800     -0.7336000     -0.5538000    
 C   -2.676600      -1.895700      0.7442000    
 C   -3.883500      0.6074000     -0.1649000    
 C   -2.093700     -0.5298000       1.098600    
 C   -1.432900       1.205500     -0.5340000    
 C  -4.1200001E-02  0.9284000     -0.1568000    
 C   0.6925000     -2.4900001E-02 -0.8554000    
 C   0.5423000       1.615200      0.8941000    
 C    2.014200     -0.3066000     -0.5180000    
 C    2.611100      0.3889000      0.5494000    
 C    1.864300       1.340600       1.239800    
 C    3.978800      -1.464200     -0.8377000    
 C    4.559800     -0.7871000      0.2012000    
 H   -4.699400      -1.574100       1.423500    
 H   -4.556400      -2.779400      0.1442000    
 H   -4.103400      -1.048200      -1.527300    
 H   -5.584800     -0.6288000     -0.6627000    
 H   -2.481000      -2.606600       1.554500    
 H   -2.179200      -2.281500     -0.1544000    
 H   -4.043200       1.344200     -0.9587000    
 H   -4.338100      0.9964000      0.7532000    
 H   -2.524300     -0.1758000       2.043900    
 H   -1.025400     -0.6498000       1.275500    
 H   0.2266000     -0.5619000      -1.680400    
 H  -1.4100000E-02   2.362900       1.452100    
 H    2.313500       1.885800       2.067600    
 H    4.512800      -2.213600      -1.408100    
 H    5.583100     -0.9663000      0.5058000    


%chk=000148184-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148184

0 1
O -1.812581 2.440753 -0.482169
N -2.440394 0.339327 0.314551
N 2.515205 -1.600379 -0.668276
N 4.180132 0.478808 0.455706
C -4.291451 -1.915717 0.127572
C -4.479430 -0.633181 -0.718141
C -2.801192 -2.120830 0.492351
C -3.863381 0.597378 -0.015126
C -2.228389 -0.854217 1.166930
C -1.490015 1.300100 -0.007766
C -0.022640 0.979037 0.168064
C 0.553450 -0.214506 -0.285370
C 0.816055 2.024027 0.689676
C 1.965467 -0.407706 -0.205669
C 2.801849 0.636808 0.353918
C 2.195207 1.854234 0.795563
C 3.852939 -1.720735 -0.557909
C 4.680373 -0.687992 0.002539
H -4.884787 -1.827598 1.061675
H -4.679445 -2.797109 -0.416106
H -3.995450 -0.761253 -1.705910
H -5.554246 -0.443268 -0.900497
H -2.682999 -2.982428 1.176647
H -2.218587 -2.343853 -0.423398
H -3.901478 1.499228 -0.646244
H -4.418210 0.814487 0.922796
H -2.757844 -0.687614 2.130886
H -1.158701 -0.967624 1.394833
H -0.043788 -1.014586 -0.734300
H 0.340466 2.964867 0.983162
H 2.845843 2.635429 1.199964
H 4.299766 -2.654342 -0.917851
H 5.764956 -0.826345 0.076500


