%chk=000124450.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124450

0 1
 O   -1.045700      -1.764500      -2.566300    
 O    6.784400     -0.7725000     -0.5363000    
 O    4.811100     -0.7798000      -1.658600    
 N   -1.404900      0.4228000      -1.854400    
 N   -2.604600      -3.097300       1.846800    
 C  -0.7132000      3.7900001E-02   1.013000    
 C    1.339300       1.245700       1.795100    
 C   -1.276300       1.294000      0.4981000    
 C    2.839500      0.9370000       1.853800    
 C   -1.450300      -1.209600      0.8430000    
 C   -1.631500       1.442900     -0.8563000    
 C   0.4918000      2.5500000E-02   1.608700    
 C    3.388700      0.3427000      0.5505000    
 C   -1.838200      -1.630900     -0.4238000    
 C   -1.378900     -0.9782000      -1.672400    
 C   -1.483600       2.350800       1.409400    
 C    4.887000      4.4900000E-02  0.6327000    
 C   -2.163600       2.690600      -1.250600    
 C   -1.863400      -1.970700       1.936200    
 C   -1.195900      0.8951000      -3.230900    
 C   -2.602700      -2.797000     -0.5487000    
 C   -2.020600       3.563300      0.9911000    
 C   -2.359700       3.733800     -0.3416000    
 C   -2.957600      -3.480800      0.6032000    
 C    5.448700     -0.5456000     -0.6417000    
 H    1.192300       1.982900      0.9985000    
 H    1.069500       1.716100       2.748300    
 H    3.041700      0.2473000       2.683100    
 H    3.378700       1.865600       2.079300    
 H   0.8909000     -0.9093000       1.998700    
 H    3.199400       1.038900     -0.2762000    
 H    2.856900     -0.5842000      0.3039000    
 H   -1.252400       2.231600       2.466000    
 H    5.432100      0.9719000      0.8431000    
 H    5.074700     -0.6675000       1.444000    
 H   -2.463300       2.878500      -2.278800    
 H   -1.614400      -1.681200       2.953500    
 H  -0.7110000      0.1337000      -3.848800    
 H  -0.5484000       1.778100      -3.237100    
 H   -2.167700       1.119900      -3.681500    
 H   -2.917900      -3.175500      -1.516000    
 H   -2.178800       4.366500       1.704100    
 H   -2.781700       4.675400     -0.6804000    
 H   -3.550900      -4.387600      0.5495000    
 H    7.157700      -1.146100      -1.363000    


%chk=000124450-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124450

0 1
O -0.869266 -2.145655 -2.368073
O 5.611272 0.227715 -1.951494
O 3.469150 1.065253 -2.246494
N -0.601970 0.037322 -1.621613
N -3.212398 -2.840280 1.995315
C -0.688747 -0.069312 1.347485
C 1.332702 0.870526 2.658865
C -1.003070 1.175437 0.579805
C 2.747536 0.534516 2.097603
C -1.616902 -1.200985 1.074920
C -0.992760 1.187385 -0.845926
C 0.301502 -0.172947 2.285583
C 2.822796 0.683480 0.562537
C -1.869296 -1.676231 -0.243111
C -1.089124 -1.271010 -1.468159
C -1.372829 2.358092 1.271102
C 4.230109 0.382293 0.015295
C -1.306044 2.389641 -1.534265
C -2.320087 -1.824347 2.145730
C 0.211299 0.283356 -2.843894
C -2.796088 -2.736897 -0.407664
C -1.690764 3.547100 0.583381
C -1.649816 3.560034 -0.829287
C -3.445904 -3.277181 0.718676
C 4.344598 0.605010 -1.479708
H 1.036609 1.870645 2.295002
H 1.397186 0.929568 3.764050
H 3.030045 -0.496724 2.393624
H 3.483735 1.214234 2.573171
H 0.418532 -1.148448 2.782882
H 2.530447 1.711855 0.275495
H 2.087473 0.010384 0.083329
H -1.415772 2.327501 2.365464
H 4.993569 1.019372 0.505958
H 4.533520 -0.660954 0.229176
H -1.289063 2.404513 -2.627826
H -2.159345 -1.470970 3.170957
H 0.705028 -0.659303 -3.119768
H 0.970739 1.050537 -2.630935
H -0.419724 0.589348 -3.699431
H -2.964043 -3.145209 -1.407839
H -1.969395 4.447725 1.140202
H -1.896354 4.472413 -1.382891
H -4.169828 -4.092494 0.616179
H 5.657943 0.388788 -2.933210


