%chk=000045750.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045750

0 1
 O   -2.038600       1.753500     -0.4033000    
 O    4.027300     -0.3462000      5.5799998E-02
 O   -2.124700      -1.690300      0.4131000    
 N   -1.452400      0.4918000     -0.1073000    
 C  -7.3899999E-02  0.2808000     -6.6200003E-02
 C   0.4505000     -0.9697000     -0.3933000    
 C   0.7800000       1.320500      0.3021000    
 C    1.828700      -1.180500     -0.3518000    
 C    2.158100       1.109600      0.3435000    
 C    2.682500     -0.1408000      1.6600000E-02
 C   -2.391800     -0.5201000      0.1395000    
 C   -3.845700     -0.1085000      5.1300000E-02
 H  -0.1612000      -1.793800     -0.7445000    
 H   0.3897000       2.300400      0.5644000    
 H    2.226500      -2.155200     -0.6216000    
 H    2.818300       1.923100      0.6319000    
 H   -4.059500      0.6765000      0.7818000    
 H   -4.075500      0.2441000     -0.9579000    
 H   -4.484700     -0.9689000      0.2715000    
 H   -1.993700       1.735900      -1.374800    
 H    4.213200      -1.266200     -0.1991000    


%chk=000045750-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000045750

0 1
O -1.945954 1.741803 -0.094762
O 4.137402 -0.202208 0.005876
O -2.265081 -1.837402 0.078048
N -1.509303 0.353466 -0.134196
C -0.084417 0.163101 -0.079709
C 0.502257 -1.113470 -0.295972
C 0.752654 1.284541 0.168894
C 1.904695 -1.251225 -0.266649
C 2.151911 1.139302 0.189422
C 2.733135 -0.129087 -0.029766
C -2.534432 -0.602100 0.000112
C -3.953376 -0.054939 0.025803
H -0.136691 -1.981216 -0.460466
H 0.305202 2.260467 0.370991
H 2.345135 -2.243627 -0.429062
H 2.802985 1.996186 0.384818
H -4.093484 0.655815 0.857547
H -4.200267 0.483549 -0.906717
H -4.636084 -0.909586 0.142280
H -1.848326 2.073200 -1.032884
H 4.445137 -1.130571 -0.141907


