%chk=000149784.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149784

0 1
 O  -0.1303000      -4.171100      0.4851000    
 N   0.8716000     -0.6793000     -0.3796000    
 N    1.839100      0.5954000      -1.894500    
 N    1.573400      0.4280000       1.659400    
 N    2.968300       2.365000       1.150800    
 N    3.511500       3.004100      -1.090400    
 C   6.9499999E-02  -1.776700      0.1808000    
 C   -1.423100      -1.673100     -0.2251000    
 C   -2.064200     -0.3361000      0.1718000    
 C   0.6591000      -3.169100     -0.1592000    
 C   -3.555000     -0.3149000     -0.1748000    
 C   -4.244400       1.005300      0.1830000    
 C    1.516900      0.2714000      0.3283000    
 C    2.100900      -3.339800      0.3141000    
 C    1.080600     -0.4631000      -1.699400    
 C   -5.717600       1.115700     -0.2173000    
 C    2.119000       1.064300     -0.6356000    
 C   -6.367200       2.422900      0.2083000    
 C    2.867400       2.146000     -0.1824000    
 C    2.324500       1.505000       1.976700    
 H   0.1022000      -1.659900       1.272900    
 H   -1.525300      -1.814900      -1.308500    
 H   -1.986800      -2.483700      0.2525000    
 H   -1.937500     -0.1715000       1.248500    
 H   -1.568900      0.4931000     -0.3454000    
 H   0.6073000      -3.358200      -1.237100    
 H   -4.064300      -1.135100      0.3459000    
 H   -3.677100     -0.4980000      -1.249500    
 H   -3.694300       1.829200     -0.2892000    
 H   -4.159800       1.159500       1.266300    
 H    2.185200      -3.153300       1.390400    
 H    2.434300      -4.370100      0.1478000    
 H    2.786500      -2.670100     -0.2125000    
 H   0.6693000      -1.088300      -2.480200    
 H   -6.274900      0.2829000      0.2275000    
 H   -5.805000       1.011000      -1.305100    
 H  -8.6300001E-02  -4.015200       1.444100    
 H   -6.332400       2.540200       1.296000    
 H   -5.856700       3.278000     -0.2458000    
 H   -7.415900       2.446100     -0.1039000    
 H    2.426900       1.710300       3.036900    
 H    4.049800       3.783200     -0.7365000    
 H    3.438100       2.842600      -2.085800    


%chk=000149784-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149784

0 1
O -0.135395 -4.109035 0.747665
N 0.816836 -0.629958 -0.388956
N 1.808261 0.721771 -1.964882
N 1.867787 0.307027 1.659844
N 3.400663 2.163137 1.144405
N 3.807012 2.925018 -1.055772
C -0.000665 -1.702095 0.228974
C -1.473588 -1.630931 -0.231054
C -2.196026 -0.337308 0.202448
C 0.629766 -3.108864 -0.026570
C -3.671912 -0.296502 -0.252736
C -4.402742 0.996675 0.172453
C 1.655164 0.243928 0.312395
C 2.129391 -3.180842 0.300782
C 0.952356 -0.297303 -1.745187
C -5.882532 1.037364 -0.272349
C 2.254125 1.070983 -0.676431
C -6.603727 2.335208 0.151008
C 3.162846 2.065182 -0.206911
C 2.752868 1.296338 1.984354
H 0.053287 -1.503028 1.318977
H -1.526417 -1.737796 -1.334785
H -1.986562 -2.515027 0.191593
H -2.150419 -0.245615 1.307433
H -1.663525 0.546168 -0.204634
H 0.446973 -3.410240 -1.074821
H -4.209901 -1.174916 0.161144
H -3.718863 -0.396178 -1.357758
H -3.870049 1.874820 -0.248747
H -4.350743 1.103121 1.276313
H 2.327857 -2.829909 1.331868
H 2.479606 -4.222925 0.203456
H 2.724423 -2.551767 -0.383959
H 0.406119 -0.817332 -2.528550
H -6.414726 0.161741 0.152656
H -5.934654 0.926921 -1.374979
H 0.130598 -4.034795 1.700655
H -6.596203 2.452522 1.251166
H -6.107540 3.223631 -0.283266
H -7.658037 2.340405 -0.181769
H 2.976107 1.414909 3.048949
H 4.445092 3.616059 -0.666925
H 3.641487 2.867138 -2.058196


