%chk=000002005.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002005

0 1
 O    4.852200      -1.117100      0.4065000    
 O    4.201600      0.4152000      -1.138100    
 O   -3.987900      0.1440000      -1.225900    
 N   -2.738600     -1.5300000E-02  0.7330000    
 C   0.2193000      0.4574000      0.5893000    
 C  -0.8568000       1.356400     -2.4000000E-02
 C    1.559500      0.5266000     -0.1453000    
 C   -2.183500       1.311300      0.7258000    
 C    2.600100     -0.3776000      0.5151000    
 C    3.941700     -0.2936000     -0.1758000    
 C   -3.598200     -0.4894000     -0.2484000    
 C   -4.009500      -1.917900     -1.2300000E-02
 H  -0.1254000     -0.5837000      0.5905000    
 H   0.3679000      0.7430000       1.638200    
 H   -1.015400       1.062100      -1.069100    
 H  -0.4966000       2.392200     -3.6699999E-02
 H    1.422700      0.2316000      -1.192900    
 H    1.920000       1.562700     -0.1535000    
 H   -2.897400       1.998100      0.2585000    
 H   -2.047900       1.617800       1.768200    
 H    2.739500     -8.2500003E-02   1.561000    
 H    2.262200      -1.419200      0.4794000    
 H   -2.474300     -0.6330000       1.495100    
 H   -4.845600      -2.173800     -0.6689000    
 H   -3.166000      -2.579500     -0.2276000    
 H   -4.325400      -2.055800       1.025800    
 H    5.725600      -1.068300     -3.7400000E-02


%chk=000002005-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000002005

0 1
O 5.027761 -1.052589 0.498867
O 4.392196 0.507909 -1.098542
O -4.159515 0.258316 -1.146869
N -2.796174 -0.091387 0.706370
C 0.289913 0.440905 0.608711
C -0.814329 1.267146 -0.087132
C 1.645854 0.530854 -0.125608
C -2.176195 1.244680 0.646519
C 2.739275 -0.305444 0.565928
C 4.088522 -0.207288 -0.119528
C -3.755804 -0.498169 -0.211461
C -4.299508 -1.912620 -0.014496
H -0.024827 -0.622332 0.667009
H 0.411422 0.795486 1.655012
H -0.964666 0.903419 -1.121832
H -0.486694 2.323956 -0.165607
H 1.527991 0.190244 -1.172127
H 1.972827 1.586505 -0.184327
H -2.890648 1.896323 0.113686
H -2.058880 1.626868 1.679646
H 2.875809 0.012340 1.619127
H 2.458796 -1.375791 0.612844
H -2.497584 -0.743762 1.431795
H -5.393697 -1.859682 0.119810
H -4.112193 -2.501269 -0.929177
H -3.859313 -2.442150 0.848640
H 5.903462 -0.960770 0.033242


