%chk=000129241.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129241

0 1
 O   0.2924000      0.8533000       1.190500    
 O   0.3398000     -0.3222000      -2.066400    
 O    2.172800       2.142600       1.330700    
 N    1.668600      0.8503000     -0.5367000    
 C  -0.1528000     -0.2069000      0.3105000    
 C   0.4132000      -1.567000      0.8233000    
 C    1.942300      -1.688500       1.077000    
 C    2.871000      -1.737500     -0.1635000    
 C   0.5930000      0.1088000     -0.9526000    
 C    3.707200     -0.4614000     -0.4301000    
 C    2.969400      0.6906000      -1.139200    
 C   -1.656700     -0.1027000      0.1363000    
 C    1.457300       1.377000      0.7009000    
 C   -2.240100       1.108900     -0.2488000    
 C   -2.471600      -1.217500      0.3599000    
 C   -3.622600       1.204800     -0.4083000    
 C   -3.853900      -1.121800      0.2003000    
 C   -4.429400      8.9400001E-02 -0.1839000    
 H   0.1289000      -2.373400      0.1342000    
 H  -6.3600004E-02  -1.784600       1.789100    
 H    2.074700      -2.648100       1.596800    
 H    2.279100     -0.9322000       1.793900    
 H    3.599900      -2.537500      2.6400000E-02
 H    2.325200      -2.045000      -1.062000    
 H    4.110100     -0.1004000      0.5247000    
 H    4.575400     -0.7295000      -1.044800    
 H    3.539100       1.619400      -1.034300    
 H    2.850500      0.4562000      -2.202400    
 H   -1.628000       1.988900     -0.4291000    
 H   -2.069200      -2.179800      0.6584000    
 H   -4.070700       2.147700     -0.7076000    
 H   -4.482800      -1.990100      0.3746000    
 H   -5.505800      0.1639000     -0.3083000    


%chk=000129241-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129241

0 1
O 0.349348 1.208961 0.778245
O 0.477539 -0.994435 -2.079228
O 2.336291 2.434864 0.531636
N 1.739272 0.669143 -0.955497
C -0.163403 -0.074236 0.174375
C 0.354177 -1.259637 1.067450
C 1.890619 -1.335443 1.329364
C 2.858878 -1.749451 0.159724
C 0.641664 -0.191776 -1.131359
C 3.767108 -0.627235 -0.438472
C 3.073601 0.308952 -1.470538
C -1.676330 -0.023718 0.076630
C 1.570044 1.538324 0.152645
C -2.414409 0.881435 0.878309
C -2.361181 -0.928093 -0.775402
C -3.825894 0.883388 0.825325
C -3.772606 -0.919366 -0.824077
C -4.510036 -0.017247 -0.022804
H -0.001399 -2.195351 0.594441
H -0.167210 -1.165483 2.038826
H 2.001107 -2.085092 2.136625
H 2.232329 -0.382564 1.778492
H 3.545329 -2.518025 0.562620
H 2.295238 -2.250208 -0.650655
H 4.176542 -0.016032 0.389215
H 4.633983 -1.092887 -0.946507
H 3.661181 1.225991 -1.639896
H 2.914590 -0.202725 -2.434648
H -1.882114 1.586345 1.523326
H -1.791770 -1.613902 -1.411087
H -4.389676 1.590025 1.444481
H -4.295061 -1.614992 -1.490070
H -5.605053 -0.013827 -0.061990


