%chk=000039548.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039548

0 1
 O   0.8945000      5.0099999E-02   1.528600    
 N   -3.706600     -0.5388000      0.1424000    
 C    3.085100     -0.3597000      0.4846000    
 C    3.367700       1.131300      7.6200001E-02
 C    2.633200      0.9387000      -1.274300    
 C    1.520600     -0.4774000      0.3570000    
 C    1.225100      0.4330000     -0.8622000    
 C    3.727600      -1.134800     -0.7018000    
 C    3.366900     -0.2621000      -1.915300    
 C    3.646300     -0.7921000       1.830100    
 C    4.843500       1.553900     -6.9100000E-02
 C    2.730600       2.200900      0.9927000    
 C   0.9569000      -1.888200      0.1800000    
 C  -0.4966000      -1.852100      7.7999998E-03
 C   -1.689300      -1.831800     -0.1344000    
 C   -3.144400      -1.811000     -0.3105000    
 C   -3.134600      0.5775000     -0.6233000    
 C   -5.172400     -0.5585000      3.8300000E-02
 C   -3.675400       1.920000     -0.1291000    
 C   -5.779800      0.7470000      0.5546000    
 C   -5.198900       1.954300     -0.1725000    
 H    2.597200       1.817400      -1.922800    
 H   0.5671000       1.268300     -0.6000000    
 H   0.7589000     -9.7800002E-02  -1.699800    
 H    3.389600      -2.167100     -0.8096000    
 H    4.817000      -1.196800     -0.5937000    
 H    4.270400      5.6899998E-02  -2.445700    
 H    2.739000     -0.8023000      -2.631500    
 H    3.259100     -0.1848000       2.653500    
 H    3.398800      -1.838100       2.039000    
 H    4.737900     -0.7047000       1.848400    
 H    5.327100       1.608600      0.9129000    
 H    5.447700      0.8799000     -0.6797000    
 H    4.916700       2.544100     -0.5339000    
 H    1.642000       2.192500       1.040500    
 H    3.110900       2.114200       2.016100    
 H    2.988500       3.205600      0.6347000    
 H    1.196300      -2.506100       1.053400    
 H    1.372000      -2.390600     -0.6978000    
 H    1.057300     -0.5613000       2.266500    
 H   -3.393900      -2.003500      -1.361800    
 H   -3.572500      -2.632700      0.2770000    
 H   -3.351300      0.4681000      -1.694600    
 H   -2.045700      0.6265000     -0.5158000    
 H   -5.576800      -1.382600      0.6385000    
 H   -5.488500     -0.7255000     -0.9999000    
 H   -3.270900       2.731700     -0.7445000    
 H   -3.334600       2.097700      0.8989000    
 H   -5.587600      0.8411000       1.631000    
 H   -6.867800      0.7258000      0.4250000    
 H   -5.567700       2.880500      0.2814000    
 H   -5.535600       1.949900      -1.216400    


%chk=000039548-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000039548

0 1
O 0.606937 0.558396 0.743045
N -3.830853 -0.587512 0.014328
C 3.010784 -0.236802 0.536788
C 3.585128 1.109068 -0.100151
C 3.214286 0.669111 -1.562505
C 1.532868 -0.287073 -0.052818
C 1.688730 0.392102 -1.452910
C 3.849620 -1.299852 -0.250092
C 3.934745 -0.708660 -1.703512
C 3.082699 -0.371669 2.060012
C 5.107162 1.312033 0.122970
C 2.902771 2.421539 0.363737
C 0.934173 -1.732730 -0.116096
C -0.510219 -1.744525 -0.404357
C -1.726693 -1.716488 -0.606668
C -3.179959 -1.623864 -0.835738
C -3.296400 0.775329 -0.252526
C -5.307496 -0.636527 -0.136176
C -3.918551 1.803255 0.712683
C -5.990026 0.349364 0.833537
C -5.461272 1.786199 0.617186
H 3.475689 1.395485 -2.351147
H 1.097949 1.322741 -1.462439
H 1.314324 -0.249920 -2.269609
H 3.408417 -2.309783 -0.216005
H 4.850686 -1.389116 0.208021
H 4.982570 -0.592142 -2.032519
H 3.430145 -1.348460 -2.451066
H 2.517792 0.436749 2.557442
H 2.673054 -1.340551 2.408365
H 4.130419 -0.320431 2.409497
H 5.325452 1.441773 1.200152
H 5.734864 0.487092 -0.251345
H 5.435626 2.236302 -0.389143
H 1.805798 2.376249 0.339536
H 3.196740 2.656140 1.405056
H 3.245535 3.261835 -0.271151
H 1.118348 -2.248575 0.850557
H 1.463898 -2.318532 -0.888953
H 0.224533 0.019807 1.481570
H -3.360024 -1.433304 -1.928031
H -3.654173 -2.597933 -0.602373
H -3.514560 1.084614 -1.311060
H -2.198520 0.749248 -0.133719
H -5.646401 -1.669826 0.071950
H -5.617296 -0.388526 -1.188339
H -3.522362 2.809754 0.477734
H -3.607337 1.553990 1.745560
H -5.775230 0.029904 1.871618
H -7.086917 0.308089 0.688057
H -5.906399 2.477907 1.357438
H -5.770455 2.143827 -0.387291


