%chk=000153707.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153707

0 1
 O    5.863000     -0.1481000     -0.7941000    
 N    3.373300     -0.4135000      0.5580000    
 N    2.693100       1.403700       1.993300    
 C   -1.591100      0.6262000     -0.7613000    
 C   -2.516300     -0.2256000     -0.1360000    
 C   0.8752000     -4.3299999E-02 -0.7611000    
 C  -0.3961000      0.1354000      -1.444700    
 C   -3.648700      0.3325000      0.5034000    
 C    4.660100     -0.6234000       1.217900    
 C    1.170700      0.7606000      0.2812000    
 C    2.486800      0.5859000      0.9977000    
 C    1.836200      -1.063800      -1.171500    
 C    3.000200      -1.202500     -0.5215000    
 C   -1.779900       2.008500     -0.7567000    
 C   -2.341800      -1.619100     -0.1308000    
 C   -3.822700       1.726100      0.4984000    
 C   -2.893500       2.557200     -0.1281000    
 C   -4.573800     -0.5194000       1.128600    
 C    5.740300      0.2286000      0.5710000    
 C   -3.271100      -2.450500      0.4952000    
 C   -4.384800      -1.901700       1.123500    
 C  -0.4795000     -0.1539000      -2.762400    
 H    4.939600      -1.683000       1.154100    
 H    4.590200     -0.3878000       2.286100    
 H   0.5193000       1.545600      0.6460000    
 H    1.604700      -1.740800      -1.985900    
 H    3.717200      -1.964900     -0.8042000    
 H   -1.071200       2.676900      -1.240900    
 H   -1.488800      -2.096400     -0.6063000    
 H   -4.685900       2.177200      0.9835000    
 H   -3.040600       3.633400     -0.1252000    
 H   -5.451600     -0.1124000       1.626100    
 H    6.702300      6.7299999E-02   1.066900    
 H    5.488900       1.293100      0.6167000    
 H   -3.124800      -3.526700      0.4922000    
 H   -5.107800      -2.549500       1.610600    
 H   0.3611000     -0.4924000      -3.358300    
 H   -1.415300     -3.1500001E-02  -3.302300    
 H    1.907600       2.047100       2.129700    
 H    6.560600      0.4076000      -1.181500    


%chk=000153707-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153707

0 1
O 5.983165 -0.162364 -0.469855
N 3.180931 -0.631317 0.443605
N 2.544833 0.754885 2.239840
C -1.635762 0.749495 -1.051647
C -2.340234 -0.097667 -0.111505
C 0.822365 -0.049188 -1.009199
C -0.412542 0.272731 -1.786897
C -3.513025 0.423949 0.565993
C 4.419052 -0.926905 1.196572
C 1.018292 0.477643 0.265584
C 2.226216 0.248992 1.051976
C 1.858286 -0.893540 -1.568476
C 2.994651 -1.148555 -0.824387
C -2.115610 2.045187 -1.298599
C -1.944929 -1.451567 0.156359
C -3.955789 1.759823 0.289233
C -3.272795 2.553680 -0.632104
C -4.219356 -0.413540 1.492769
C 5.528009 0.088538 0.910949
C -2.655722 -2.244635 1.059927
C -3.800616 -1.721609 1.740257
C -0.440421 0.200242 -3.151538
H 4.771827 -1.937503 0.924750
H 4.165457 -0.884607 2.268895
H 0.256513 1.121031 0.717971
H 1.750203 -1.356549 -2.550726
H 3.811731 -1.769803 -1.196966
H -1.574641 2.683059 -2.006101
H -1.074949 -1.864129 -0.363600
H -4.841152 2.143943 0.810021
H -3.612157 3.573151 -0.845230
H -5.102127 -0.007375 2.001416
H 6.359211 -0.071806 1.629036
H 5.129215 1.112922 1.039807
H -2.337647 -3.275501 1.250702
H -4.347327 -2.353264 2.449072
H 0.441263 -0.074726 -3.740184
H -1.353989 0.431085 -3.708746
H 1.784093 1.350638 2.613899
H 6.510579 0.607856 -0.795577


