%chk=000131230.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131230

0 1
 O   -2.197100      -2.355400      0.3083000    
 O    1.677300       1.970600      0.3984000    
 O    4.111100      -2.314700      0.8380000    
 O    2.869900      0.9197000       2.063200    
 N   -5.206500     -0.3619000     -0.4381000    
 C   -4.838800       1.010300     -6.1999999E-02
 C   -6.624100     -0.6283000     -0.1566000    
 C   -5.685500       2.035400     -0.8183000    
 C   -7.529100      0.3432000     -0.9156000    
 C   -7.174800       1.792300     -0.6016000    
 C   -4.356600      -1.328100      0.2575000    
 C   -2.993100      -1.420900     -0.4086000    
 C  -0.8416000      -2.154000      0.2911000    
 C  -6.2700003E-02  -2.559400       1.374800    
 C  -0.2408000      -1.545600     -0.8110000    
 C    1.918100      -1.748000      0.2545000    
 C    1.317200      -2.356500       1.356500    
 C    1.139100      -1.342600     -0.8292000    
 C    3.356900      -1.536800      0.2349000    
 C    3.989200     -0.3973000     -0.4959000    
 C    3.684100      0.9261000     -0.1777000    
 C   0.6738000       2.352800       1.345300    
 C    4.901400     -0.6775000      -1.513200    
 C    4.291200       1.969200     -0.8770000    
 C    2.735500       1.251100      0.8795000    
 C    5.508400      0.3656000      -2.212500    
 C    5.203400       1.689000      -1.894500    
 C    1.050900       3.691400       1.961500    
 C  -0.6769000       2.410200      0.6481000    
 H   -4.960000       1.164800       1.018500    
 H   -3.792300       1.222700     -0.3021000    
 H   -6.883200      -1.646200     -0.4727000    
 H   -6.827500     -0.5585000      0.9202000    
 H   -5.458000       1.981000      -1.890600    
 H   -5.425200       3.047300     -0.4874000    
 H   -7.432000      0.1690000      -1.994900    
 H   -8.576500      0.1541000     -0.6546000    
 H   -7.434300       2.014900      0.4406000    
 H   -7.762300       2.468600      -1.232000    
 H   -4.800300      -2.332400      0.2152000    
 H   -4.257000      -1.099900       1.327100    
 H   -2.519300     -0.4340000     -0.4054000    
 H   -3.100600      -1.764900      -1.444600    
 H  -0.5258000      -3.032700       2.236300    
 H  -0.8056000      -1.243400      -1.687800    
 H    1.906600      -2.674500       2.212600    
 H    1.581500     -0.8832000      -1.708900    
 H   0.5933000       1.599600       2.139200    
 H    5.146400      -1.704300      -1.772500    
 H    4.066700       3.005800     -0.6383000    
 H    6.218500      0.1475000      -3.004900    
 H    5.676700       2.501100      -2.438500    
 H    1.160200       4.459700       1.188000    
 H   0.2967000       4.024000       2.681200    
 H    2.015000       3.625600       2.476600    
 H  -0.6617000       3.133300     -0.1748000    
 H   -1.475100       2.686400       1.343700    
 H  -0.9188000       1.438500      0.2066000    


%chk=000131230-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131230

0 1
O -2.629886 -1.894856 0.809682
O 3.153370 3.025594 0.699945
O 3.798462 -2.137542 1.076126
O 2.765830 0.998212 1.788599
N -5.966417 -0.930854 -0.561786
C -6.261511 0.454936 -0.111611
C -7.214473 -1.715645 -0.747809
C -7.147432 1.193204 -1.135634
C -8.133085 -1.048127 -1.791796
C -8.455298 0.409353 -1.388629
C -4.969896 -1.612275 0.297130
C -3.547851 -1.239138 -0.143111
C -1.257002 -1.707675 0.635498
C -0.425677 -2.369558 1.580164
C -0.680177 -0.921942 -0.395860
C 1.563430 -1.449630 0.470887
C 0.965366 -2.242652 1.492393
C 0.722159 -0.796689 -0.464960
C 3.049246 -1.363951 0.405170
C 3.692054 -0.416028 -0.599751
C 3.730902 1.002017 -0.453312
C 2.664092 3.767538 1.921336
C 4.315360 -1.004108 -1.727507
C 4.364602 1.799246 -1.442858
C 3.170595 1.631602 0.780563
C 4.939825 -0.206090 -2.710691
C 4.959309 1.201631 -2.571568
C 3.815035 3.870934 2.932006
C 2.167054 5.116437 1.398352
H -6.780709 0.445710 0.884009
H -5.308849 0.999313 0.025280
H -6.938853 -2.733143 -1.081871
H -7.776498 -1.820960 0.218319
H -6.586220 1.295432 -2.084590
H -7.368491 2.212103 -0.763367
H -7.618369 -1.055826 -2.772136
H -9.062669 -1.640350 -1.894850
H -9.067757 0.407900 -0.462863
H -9.058348 0.904081 -2.173177
H -5.090029 -2.705892 0.195230
H -5.093466 -1.370696 1.379744
H -3.391368 -0.142250 -0.114980
H -3.357316 -1.603285 -1.170856
H -0.899679 -2.967203 2.364645
H -1.305446 -0.415938 -1.136904
H 1.623907 -2.743785 2.208919
H 1.163866 -0.193046 -1.265621
H 1.838605 3.168853 2.349296
H 4.309050 -2.094587 -1.826152
H 4.389330 2.883041 -1.302417
H 5.412109 -0.681102 -3.577593
H 5.445642 1.824531 -3.329823
H 4.675016 4.403726 2.488714
H 3.480731 4.431766 3.824200
H 4.140600 2.869533 3.258900
H 2.992142 5.683858 0.932554
H 1.761412 5.715437 2.233774
H 1.369674 4.978635 0.648249


