%chk=000125429.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125429

0 1
 O  -0.7045000     -0.6772000      0.7604000    
 O   0.2023000       1.883800      -1.590500    
 O   -1.682800       2.150200      0.3797000    
 O   -2.861500      -2.448000      0.5015000    
 O   0.9591000       1.688900       1.493700    
 O    3.419400      -1.639300     -0.4749000    
 N    1.158700      -1.062700     -0.6200000    
 N    2.500100      0.1728000      0.6558000    
 C   0.2734000     -6.1600000E-02 -7.6499999E-02
 C  -0.4661000      0.7209000      -1.149900    
 C   -1.794400       1.023200     -0.4853000    
 C   -2.017400     -0.2168000      0.3724000    
 C    1.252400      0.7335000      0.7891000    
 C   -2.713000      -1.346300     -0.3765000    
 C    2.474200     -0.9213000     -0.1789000    
 H  -0.6414000      8.5199997E-02  -2.026500    
 H   -2.606100       1.222500      -1.191100    
 H   -2.559000      8.8999998E-03   1.297900    
 H   0.8525000      -1.816600      -1.227000    
 H   -2.135200      -1.688100      -1.240900    
 H   -3.706700      -1.039800     -0.7160000    
 H    3.330700      0.5095000       1.129100    
 H   0.3181000       2.479800     -0.8320000    
 H   -1.592400       2.938500     -0.1822000    
 H   -1.972700      -2.708000      0.7990000    


%chk=000125429-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000125429

0 1
O -0.565465 -0.708534 0.501352
O -0.437591 2.430208 -0.150365
O -2.720153 1.703985 -1.290411
O -3.009369 -2.015413 1.419062
O 1.401788 1.451600 1.619396
O 3.394200 -1.847946 -1.090018
N 1.239179 -0.821602 -1.105723
N 2.687420 -0.206916 0.503023
C 0.462805 0.059757 -0.240121
C -0.300097 1.216412 -0.955401
C -1.747697 0.651977 -1.106114
C -1.927948 -0.138475 0.213102
C 1.555807 0.539927 0.763072
C -2.900793 -1.312234 0.141164
C 2.528654 -1.073979 -0.637094
H 0.174595 1.475817 -1.916315
H -1.832543 -0.012203 -1.986318
H -2.200154 0.544407 1.039588
H 0.825199 -1.400940 -1.834772
H -2.588073 -2.000509 -0.674387
H -3.913492 -0.932822 -0.075404
H 3.567162 -0.143304 1.016985
H 0.093691 2.365405 0.699448
H -2.399311 2.469956 -0.734500
H -2.100118 -2.302574 1.691153


