%chk=000159191.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159191

0 1
 O  -0.2880000       2.041300      -1.065500    
 O   -4.656600       1.930400      0.2986000    
 O    3.253400      0.9392000      0.6299000    
 O    3.839400      0.6913000      -1.587900    
 N   0.1244000      -2.254100     -4.5699999E-02
 N   -2.993100      0.2921000      0.2256000    
 N   -2.502900       2.345800     -0.4665000    
 C   -1.034500      -2.226400     -0.9427000    
 C  -0.3841000      -1.657400       1.193000    
 C   -1.597900      0.1729000     -0.1677000    
 C   -1.427600     -0.7935000      -1.357400    
 C  -0.6975000     -0.1549000       1.040800    
 C   -2.087900      -2.870100     -3.4499999E-02
 C   -1.654900      -2.492100       1.386400    
 C    1.348400      -1.679000     -0.5716000    
 C   -1.350300       1.618600     -0.6278000    
 C    2.476200      -1.806500      0.4503000    
 C   -3.514500       1.571600      4.6599999E-02
 C    3.781700      -1.225800     -9.2100002E-02
 C    3.639500      0.2304000     -0.4725000    
 C    3.075600       2.344800      0.4273000    
 C    2.651100       2.981500       1.733500    
 H  -0.8738000      -2.842000      -1.834700    
 H   0.2732000      -1.817800       2.053500    
 H  -0.6651000     -0.4110000      -2.048100    
 H   -2.353700     -0.8346000      -1.946800    
 H   -1.161100      0.2090000       1.967700    
 H   0.2512000      0.3907000      0.9604000    
 H   -2.065100      -3.962400     -0.1379000    
 H   -3.107600      -2.543900     -0.2598000    
 H   -2.439700      -1.960400       1.932700    
 H   -1.429900      -3.407700       1.947900    
 H    1.219800     -0.6327000     -0.8633000    
 H    1.635300      -2.224300      -1.479400    
 H   -3.545300     -0.4741000      0.5964000    
 H    2.637100      -2.861800      0.7033000    
 H    2.234200      -1.286600       1.383000    
 H   -2.596100       3.328000     -0.6982000    
 H    4.098200      -1.780900     -0.9828000    
 H    4.585600      -1.315700      0.6466000    
 H    4.020600       2.786500      9.1799997E-02
 H    2.307600       2.511100     -0.3350000    
 H    2.508500       4.059200       1.615200    
 H    1.715600       2.538200       2.090900    
 H    3.402900       2.806700       2.510100    


%chk=000159191-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159191

0 1
O -0.303749 2.217569 -0.777597
O -4.865269 1.832755 0.356621
O 3.215275 0.916954 0.546900
O 4.285582 0.606029 -1.501458
N 0.128920 -2.253475 -0.023787
N -3.086151 0.246449 0.273676
N -2.619444 2.362558 -0.286940
C -1.020075 -2.159652 -0.977730
C -0.466616 -1.708035 1.235978
C -1.643592 0.212438 -0.078170
C -1.350476 -0.676920 -1.335896
C -0.725760 -0.176281 1.130134
C -2.145536 -2.855935 -0.161613
C -1.772649 -2.548425 1.333161
C 1.417726 -1.703011 -0.499052
C -1.400196 1.708939 -0.434953
C 2.553371 -1.879305 0.528094
C -3.677164 1.492455 0.147458
C 3.897346 -1.330704 -0.012289
C 3.835421 0.135223 -0.430879
C 3.026268 2.370731 0.221269
C 2.647620 3.069757 1.522290
H -0.781568 -2.704189 -1.909805
H 0.200927 -1.897079 2.094126
H -0.488361 -0.234714 -1.869414
H -2.219094 -0.626152 -2.018592
H -1.182208 0.208425 2.061440
H 0.245174 0.339479 0.998561
H -2.117237 -3.942714 -0.343310
H -3.151257 -2.503874 -0.454787
H -2.564073 -2.016505 1.891731
H -1.569379 -3.487434 1.873288
H 1.359243 -0.620639 -0.765704
H 1.679239 -2.244645 -1.429956
H -3.627505 -0.566595 0.557147
H 2.663069 -2.951311 0.777434
H 2.306834 -1.340620 1.460665
H -2.773660 3.357221 -0.453482
H 4.235604 -1.899314 -0.895903
H 4.675208 -1.433934 0.768711
H 3.965703 2.753568 -0.214603
H 2.221859 2.438741 -0.531839
H 2.484963 4.145788 1.328974
H 1.712744 2.652943 1.935400
H 3.445225 2.967039 2.278299


