%chk=000027112.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027112

0 1
 O    1.859100      -1.633500     -0.9396000    
 O   -1.059800      0.1480000       1.928800    
 O   -7.284700      0.3161000     -0.2773000    
 O   -5.829600       1.959400     -0.2377000    
 N    2.591800       1.580900      0.1572000    
 N    3.046700      0.3110000     -0.2477000    
 N  -0.5287000     -0.1069000     -0.3426000    
 N   -6.113200      0.7418000     -0.1317000    
 C   0.7393000      0.3423000     -0.2142000    
 C    1.198200       1.526400      0.2096000    
 C    1.930900     -0.4780000     -0.5544000    
 C  -0.9765000     -0.5114000      -1.692300    
 C    4.371800     -0.1452000     -3.7300002E-02
 C   0.3944000       2.704900      0.6455000    
 C    3.275300       2.761100     -0.3628000    
 C   -1.381900     -0.1757000      0.7854000    
 C   -1.581000      0.6535000      -2.448700    
 C   -2.765500     -0.6494000      0.6117000    
 C    4.834500      -1.291100     -0.6918000    
 C    5.226500      0.5466000      0.8268000    
 C   -3.766300      0.2658000      0.3271000    
 C    6.138700      -1.740500     -0.4844000    
 C    6.530600      9.7400002E-02   1.033900    
 C   -3.040500      -2.001800      0.7367000    
 C    6.986800      -1.046100      0.3783000    
 C   -5.076800     -0.1832000      0.1628000    
 C   -4.351000      -2.450800      0.5729000    
 C   -5.369100      -1.541500      0.2858000    
 H  -0.1336000     -0.9118000      -2.265200    
 H   -1.707300      -1.321200      -1.618900    
 H   0.6161000       2.948500       1.689500    
 H  -0.6825000       2.533200      0.5613000    
 H   0.6232000       3.581100      3.0600000E-02
 H    4.347100       2.614300     -0.5163000    
 H    3.155500       3.600200      0.3307000    
 H    2.852100       3.050800      -1.331700    
 H   -2.435100       1.092100      -1.929500    
 H  -0.8431000       1.449900      -2.593500    
 H   -1.919400      0.3268000      -3.437100    
 H    4.215800      -1.842700      -1.392200    
 H    4.899200       1.418800       1.385500    
 H   -3.512100       1.319900      0.2462000    
 H    6.496400      -2.627400     -0.9992000    
 H    7.188700      0.6328000       1.712200    
 H   -2.252900      -2.716100      0.9596000    
 H    8.002100      -1.396300      0.5400000    
 H   -4.578000      -3.508600      0.6684000    
 H   -6.377900      -1.927600      0.1642000    


%chk=000027112-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000027112

0 1
O 1.979797 -1.465052 -1.414772
O -0.854412 -0.026881 1.959091
O -7.275890 0.023967 -0.973744
O -5.536368 1.172166 -1.898596
N 2.557297 1.564228 0.367658
N 3.013795 0.459025 -0.421455
N -0.612576 -0.105440 -0.372485
N -6.024107 0.329004 -1.049259
C 0.728101 0.369569 -0.280177
C 1.157026 1.520836 0.372622
C 1.887647 -0.357925 -0.799318
C -1.012865 -0.677890 -1.699311
C 4.359655 -0.012208 -0.299951
C 0.325571 2.579696 1.026492
C 3.319159 2.827338 0.259918
C -1.356533 -0.242670 0.807444
C -1.172279 0.395993 -2.791365
C -2.815879 -0.624439 0.716270
C 4.937084 -0.709654 -1.390017
C 5.095098 0.182509 0.897754
C -3.715271 -0.011819 -0.185089
C 6.254782 -1.200957 -1.276683
C 6.419733 -0.295434 0.987499
C -3.317977 -1.530211 1.688530
C 7.006150 -0.987916 -0.097184
C -5.086274 -0.331907 -0.105595
C -4.692104 -1.848911 1.737522
C -5.597694 -1.249029 0.837069
H -0.221913 -1.393823 -1.989085
H -1.945215 -1.246636 -1.563565
H 0.090432 2.274860 2.063492
H -0.638830 2.673055 0.498597
H 0.813517 3.567985 1.036846
H 4.395443 2.604383 0.299177
H 3.070236 3.467847 1.120052
H 3.097736 3.364162 -0.683055
H -1.980155 1.113810 -2.561206
H -0.233715 0.962384 -2.923997
H -1.412483 -0.088407 -3.754863
H 4.348085 -0.876510 -2.294722
H 4.618383 0.669252 1.755258
H -3.385950 0.719563 -0.926835
H 6.696601 -1.747461 -2.116900
H 6.985568 -0.143687 1.913332
H -2.616604 -1.961866 2.409354
H 8.031724 -1.364479 -0.020771
H -5.060314 -2.558335 2.485086
H -6.668911 -1.465284 0.855536


