%chk=000125023.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125023

1 1
 O   -2.066700       1.485500      -2.042300    
 N    1.006400      0.7342000      0.7265000    
 N   -1.021000       1.500100      -1.121200    
 C    1.660000     -0.3920000      0.3836000    
 C    3.009700     -0.3033000     -2.3700001E-02
 C  -0.3970000      0.6957000       1.156700    
 C    3.618100      0.9589000     -5.5000000E-02
 C    1.577100       1.945900      0.7006000    
 C    2.897700       2.091200      0.3095000    
 C    1.014100      -1.631300      0.4291000    
 C   -1.321900      0.8499000     -3.6499999E-02
 C    3.688200      -1.479300     -0.3804000    
 C    5.042500       1.142500     -0.4739000    
 C    1.703900      -2.788800      7.1199998E-02
 C   -2.669700      0.2249000      4.2599998E-02
 C    3.036600      -2.713500     -0.3324000    
 C   -3.715100      0.9637000      0.5535000    
 C   -2.826900      -1.071500     -0.3982000    
 C   -4.978800      0.3776000      0.6272000    
 C   -4.090600      -1.657500     -0.3248000    
 C   -5.166600     -0.9329000      0.1878000    
 H  -0.5750000       1.552100       1.820500    
 H  -0.6141000     -0.1820000       1.767400    
 H   0.9754000       2.801200      0.9868000    
 H    3.344700       3.080300      0.2925000    
 H  -2.0199999E-02  -1.764300      0.7195000    
 H    4.726600      -1.466200     -0.7009000    
 H    5.713700      0.5905000      0.1925000    
 H    5.187200      0.8023000      -1.504600    
 H    5.347400       2.194300     -0.4371000    
 H    1.202100      -3.751700      0.1033000    
 H    3.569500      -3.618100     -0.6112000    
 H   -3.574100       1.984100      0.8968000    
 H   -1.996000      -1.639200     -0.8050000    
 H   -5.816500      0.9418000       1.026300    
 H   -4.237100      -2.677400     -0.6683000    
 H   -6.150600      -1.388900      0.2447000    
 H   -1.689200       2.000100      -2.775600    


%chk=000125023-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125023

1 1
O -1.575227 0.640465 -2.649913
N 0.934290 0.894983 0.568423
N -0.783736 0.845583 -1.460380
C 1.672908 -0.286130 0.362534
C 3.084309 -0.176366 0.059542
C -0.520179 0.834539 0.895316
C 3.698809 1.124803 -0.064336
C 1.518560 2.115126 0.428388
C 2.881913 2.255400 0.118553
C 1.055022 -1.566324 0.450699
C -1.414978 0.559927 -0.330890
C 3.832506 -1.385037 -0.119882
C 5.163718 1.283436 -0.382650
C 1.822383 -2.720606 0.263537
C -2.788848 0.075626 -0.066608
C 3.219243 -2.633883 -0.016360
C -3.330676 0.188128 1.252518
C -3.603806 -0.513804 -1.081803
C -4.630214 -0.266988 1.545392
C -4.898476 -0.979465 -0.776193
C -5.420127 -0.857965 0.531869
H -0.792176 1.801081 1.354727
H -0.671856 0.059997 1.664621
H 0.873114 2.983944 0.572154
H 3.291828 3.263491 0.026788
H -0.016573 -1.664991 0.635864
H 4.900824 -1.322445 -0.343304
H 5.796226 0.798853 0.384213
H 5.417474 0.815036 -1.351811
H 5.449330 2.345026 -0.435128
H 1.341668 -3.701618 0.327550
H 3.802666 -3.548590 -0.155336
H -2.758771 0.657079 2.061118
H -3.220540 -0.602040 -2.098117
H -5.029124 -0.158321 2.559088
H -5.505978 -1.432914 -1.566172
H -6.429820 -1.214937 0.759155
H -0.971885 0.948803 -3.375667


