%chk=000156553.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156553

0 1
 O    2.086900      0.3732000     -0.2633000    
 O    4.805200      0.3273000      0.3946000    
 N   0.7470000      0.5439000      0.1065000    
 N    1.549000      -2.359500      -1.218600    
 C   -2.349600      0.2157000      1.7200001E-02
 C   -3.707000     -0.1274000      0.2239000    
 C   -1.373300     -0.7933000      5.1399998E-02
 C   -2.008500       1.557500     -0.2181000    
 C   -4.048100      -1.469300      0.4588000    
 C   -1.730300      -2.121400      0.2862000    
 C   -4.683300      0.8815000      0.1893000    
 C   -3.065100      -2.458900      0.4894000    
 C   -2.991700       2.546900     -0.2491000    
 C   -4.326500       2.209700     -4.5800000E-02
 C   4.6000000E-02 -0.5178000     -0.1528000    
 C    2.787100       1.567700      4.8500001E-02
 C    4.242800       1.404900     -0.3443000    
 C   0.8828000      -1.536900     -0.7427000    
 C    6.104300      0.1194000      6.9899999E-02
 C    7.032200     -0.3634000      0.8989000    
 H   -1.001600       1.898900     -0.4193000    
 H   -5.085200      -1.755900      0.6213000    
 H  -0.9962000      -2.920700      0.3387000    
 H   -5.732800      0.6407000      0.3451000    
 H   -3.342300      -3.492200      0.6767000    
 H   -2.716500       3.580400     -0.4398000    
 H   -5.091500       2.980300     -7.1800001E-02
 H    2.343100       2.409700     -0.4944000    
 H    2.710000       1.749900       1.126900    
 H    4.788900       2.332600     -0.1341000    
 H    4.298700       1.182600      -1.417900    
 H    6.354000      0.3648000     -0.9541000    
 H    8.052000     -0.5093000      0.5614000    
 H    6.787400     -0.6190000       1.923800    


%chk=000156553-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156553

0 1
O 2.319422 0.489759 -0.814163
O 5.116118 1.354479 0.107802
N 0.912510 0.586885 -0.511225
N 1.942300 -2.741334 -0.693692
C -2.035307 0.218851 0.134312
C -3.410545 -0.157448 0.420517
C -1.063570 -0.845394 -0.083564
C -1.726229 1.619932 0.088435
C -3.786565 -1.538709 0.484108
C -1.491497 -2.189749 -0.007034
C -4.397042 0.859421 0.641942
C -2.839509 -2.539825 0.273641
C -2.712114 2.587669 0.310567
C -4.060255 2.212121 0.589291
C 0.373392 -0.630439 -0.387040
C 2.895733 1.853145 -0.920438
C 4.398730 1.674145 -1.129799
C 1.217645 -1.801244 -0.553828
C 5.094879 0.003148 0.513309
C 5.713339 -0.394226 1.649216
H -0.700645 1.923473 -0.123761
H -4.830438 -1.793106 0.701893
H -0.766697 -2.994591 -0.168560
H -5.427026 0.550210 0.855798
H -3.121528 -3.596176 0.322084
H -2.444396 3.649469 0.270381
H -4.820564 2.981591 0.760636
H 2.435790 2.369066 -1.785492
H 2.687400 2.413649 0.007975
H 4.827538 2.633327 -1.466643
H 4.584806 0.905494 -1.907199
H 4.554893 -0.687035 -0.149546
H 5.690778 -1.448336 1.934764
H 6.236556 0.314378 2.297713


