%chk=000128109.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128109

0 1
 O   -1.883400      -1.622400      0.8953000    
 O   -2.679500     -0.4705000     -0.9805000    
 N  -0.3710000       1.525800     -0.5491000    
 C   -1.914300     -0.3413000      0.2352000    
 C  -0.4743000      0.1129000     -0.1255000    
 C   -2.617400      0.6487000       1.167900    
 C   -2.522400       2.072800      0.6346000    
 C   -1.070900       2.454500      0.3473000    
 C   0.5189000     -0.1227000       1.026100    
 C   -2.327700      -2.554700     -8.6999997E-02
 C   -3.301300      -1.750900     -0.8994000    
 C  -0.7427000       1.733300      -1.946600    
 C    1.927000     -0.2048000      0.5180000    
 C    2.454400      -1.436300      0.1432000    
 C    2.695300      0.9512000      0.4246000    
 C    3.764300      -1.512800     -0.3297000    
 C    4.005200      0.8746000     -4.8599999E-02
 C    4.539700     -0.3575000     -0.4258000    
 H  -0.1450000     -0.5219000     -0.9617000    
 H   -2.174700      0.5975000       2.170700    
 H   -3.673600      0.3771000       1.285200    
 H   -3.128900       2.173900     -0.2731000    
 H   -2.943900       2.766800       1.371100    
 H   -1.036500       3.471800     -6.3100003E-02
 H  -0.5265000       2.521100       1.296500    
 H   0.3063000      -1.065400       1.545100    
 H   0.4440000      0.6366000       1.813500    
 H   -2.775500      -3.432200      0.3854000    
 H   -1.461400      -2.864300     -0.6816000    
 H   -3.477200      -2.160100      -1.897100    
 H   -4.259100      -1.632500     -0.3816000    
 H  -0.5020000       2.757500      -2.253500    
 H   -1.805200       1.566900      -2.144000    
 H  -0.1633000       1.075100      -2.603400    
 H    1.859000      -2.342800      0.2105000    
 H    2.294200       1.916500      0.7206000    
 H    4.180300      -2.471900     -0.6242000    
 H    4.609500       1.773900     -0.1221000    
 H    5.559600     -0.4171000     -0.7940000    


%chk=000128109-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128109

0 1
O -1.903236 -1.718933 0.760693
O -2.707147 -0.366764 -1.020380
N -0.461522 1.603888 -0.514566
C -1.909808 -0.324770 0.243843
C -0.471949 0.165286 -0.134742
C -2.596198 0.573778 1.282055
C -2.583955 2.047771 0.811548
C -1.131226 2.481828 0.477054
C 0.546846 -0.133940 1.010595
C -2.416607 -2.593284 -0.317207
C -3.401767 -1.670978 -1.052315
C -0.801251 1.895410 -1.924860
C 1.984153 -0.231079 0.519675
C 2.688120 -1.460568 0.605500
C 2.652434 0.892594 -0.037790
C 4.022363 -1.570033 0.149297
C 3.984261 0.785289 -0.497059
C 4.676613 -0.445333 -0.403956
H -0.168835 -0.416174 -1.025502
H -2.054687 0.471222 2.242719
H -3.626375 0.208410 1.445926
H -3.224046 2.148680 -0.085236
H -3.005003 2.703249 1.598313
H -1.115521 3.514601 0.083173
H -0.535693 2.487133 1.413039
H 0.253287 -1.087243 1.484853
H 0.462482 0.654118 1.783856
H -2.885738 -3.464278 0.167339
H -1.592350 -2.921388 -0.980502
H -3.562021 -1.929188 -2.111231
H -4.373278 -1.611949 -0.522301
H -0.574396 2.957428 -2.135866
H -1.861105 1.695588 -2.196047
H -0.163087 1.277610 -2.581736
H 2.186599 -2.336518 1.036305
H 2.102938 1.836320 -0.123838
H 4.550089 -2.527876 0.228112
H 4.484696 1.662421 -0.924441
H 5.711920 -0.525929 -0.755122


