%chk=000002458.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002458

0 1
 O  -0.2702000      0.7419000      -1.718000    
 O  -0.2151000      -1.440700       2.488400    
 N    1.499400     -8.8000000E-02   1.849300    
 C  -0.1784000     -0.7784000      0.1641000    
 C   0.3046000      -2.078500     -0.5000000    
 C   -1.715400     -0.7575000      0.1942000    
 C   0.3137000      0.3765000     -0.7016000    
 C   0.3381000     -0.7827000       1.603700    
 C  -0.1922000      -3.271400      0.3371000    
 C  -0.3081000      -2.166500      -1.909800    
 C   -2.227700      0.5366000      0.8107000    
 C    1.816600      -2.187400     -0.6315000    
 C    1.586400       1.017000     -0.3217000    
 C    2.136700      0.7556000      0.9304000    
 C   -3.729900      0.5511000      0.8400000    
 C    2.227800       1.891800      -1.205400    
 C    2.531600      -2.315500      -1.756100    
 C    3.334600       1.373400       1.304000    
 C    3.425800       2.500300     -0.8308000    
 C   -4.566600       1.072800     -7.6899998E-02
 C    3.978900       2.241500      0.4221000    
 C   -6.066300       1.054100      1.2800000E-02
 C   -4.024300       1.754000      -1.305000    
 H   -2.156500     -0.8121000     -0.8050000    
 H   -2.142800      -1.577800      0.7785000    
 H   5.8800001E-02  -4.204600     -0.1889000    
 H   0.3041000      -3.371400       1.306900    
 H   -1.273600      -3.321500      0.4749000    
 H  -4.9000001E-03  -1.377900      -2.602600    
 H   -1.399400      -2.229200      -1.912300    
 H  -1.1800000E-02  -3.111500      -2.389100    
 H   -1.843800       1.426500      0.3040000    
 H   -1.887800      0.6339000       1.849000    
 H    2.381800      -2.214700      0.2988000    
 H    1.907300     -0.1628000       2.777200    
 H   -4.173300      6.2500000E-02   1.706700    
 H    1.813700       2.108100      -2.186300    
 H    3.611700      -2.408700      -1.692900    
 H    2.105500      -2.325300      -2.750600    
 H    3.775300       1.187000       2.280200    
 H    3.927300       3.177900      -1.515700    
 H    4.910200       2.718300      0.7134000    
 H   -6.493300      0.5080000     -0.8344000    
 H   -6.408800      0.5670000      0.9318000    
 H   -6.461600       2.075000      7.7999998E-03
 H   -4.200600       2.833000      -1.242400    
 H   -2.959200       1.594700      -1.481200    
 H   -4.539800       1.377500      -2.195900    


%chk=000002458-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002458

0 1
O -0.233981 0.679293 -1.790935
O -0.222781 -1.425992 2.537401
N 1.524467 -0.098997 1.856049
C -0.183738 -0.818048 0.143291
C 0.302387 -2.231142 -0.565489
C -1.741163 -0.723933 0.188448
C 0.372615 0.335785 -0.729784
C 0.346000 -0.807781 1.590537
C -0.077018 -3.455564 0.321375
C -0.387427 -2.401420 -1.940522
C -2.267128 0.575782 0.862732
C 1.829765 -2.221199 -0.685973
C 1.627671 1.012152 -0.318267
C 2.181661 0.775257 0.971063
C -3.784682 0.624132 0.869122
C 2.272109 1.924734 -1.191752
C 2.561186 -2.282774 -1.825517
C 3.366450 1.442574 1.371855
C 3.452264 2.582742 -0.803259
C -4.583229 1.171642 -0.093181
C 3.996633 2.336851 0.484890
C -6.098043 1.143090 0.035327
C -4.057056 1.846722 -1.349207
H -2.120120 -0.749024 -0.845588
H -2.140706 -1.595850 0.733757
H 0.206733 -4.375059 -0.222963
H 0.442437 -3.457312 1.293025
H -1.161553 -3.494236 0.521015
H -0.256944 -1.524857 -2.595783
H -1.468842 -2.578566 -1.817270
H 0.036560 -3.288702 -2.445061
H -1.855422 1.454460 0.332082
H -1.902609 0.618848 1.906868
H 2.365765 -2.205069 0.276511
H 1.856227 -0.167371 2.823635
H -4.272680 0.141456 1.729657
H 1.816516 2.094197 -2.172837
H 3.656506 -2.298986 -1.792219
H 2.100904 -2.307838 -2.819182
H 3.787326 1.262535 2.368285
H 3.948749 3.280198 -1.485037
H 4.914308 2.847271 0.797534
H -6.560278 0.599965 -0.813412
H -6.421434 0.656292 0.972165
H -6.517690 2.169171 0.018833
H -4.315351 2.925109 -1.352376
H -2.965306 1.753423 -1.468456
H -4.531556 1.407938 -2.249483


