%chk=000089173.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089173

1 1
 O    3.307400      0.2309000     -0.7048000    
 O    2.564500     -0.8064000       1.217100    
 N   -1.448900      0.4685000      0.1227000    
 C   -1.780000     -0.2562000      -1.198200    
 C   -2.601100      0.1254000       1.089300    
 C   -2.883400      -1.230200     -0.8356000    
 C   -3.677800     -0.4734000      0.2060000    
 C  -0.1239000     -2.3300000E-02  0.6845000    
 C   -1.370400       1.970400     -0.1038000    
 C    1.002400      0.3036000     -0.2842000    
 C    2.358200     -0.1730000      0.1911000    
 C    4.653100     -0.1363000     -0.3840000    
 H  -0.9236000     -0.7870000      -1.611500    
 H   -2.139000      0.4906000      -1.915200    
 H   -2.920000       1.027300       1.620500    
 H   -2.232900     -0.6133000       1.810000    
 H   -2.461200      -2.146300     -0.4056000    
 H   -3.489300      -1.508400      -1.702600    
 H   -4.271600      0.3194000     -0.2643000    
 H   -4.357800      -1.121100      0.7664000    
 H  -0.2075000      -1.106000      0.8384000    
 H   2.7400000E-02  0.4575000       1.658400    
 H  -0.7419000       2.181800     -0.9726000    
 H   -2.382800       2.334700     -0.3078000    
 H  -0.9805000       2.443800      0.8020000    
 H   0.8670000     -0.1317000      -1.275800    
 H    1.110300       1.388100     -0.3923000    
 H    4.952100      0.3148000      0.5669000    
 H    5.306700      0.2439000      -1.173500    
 H    4.748800      -1.225500     -0.3430000    


%chk=000089173-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000089173

1 1
O 3.487695 0.452577 -0.393423
O 2.324200 -1.347254 0.532077
N -1.455518 0.491528 0.051761
C -1.819510 -0.396076 -1.190602
C -2.513684 0.117440 1.140217
C -2.980583 -1.304939 -0.737267
C -3.692071 -0.476640 0.358002
C -0.047318 0.175749 0.587493
C -1.583172 1.971145 -0.294154
C 1.105116 0.622242 -0.327917
C 2.351522 -0.212211 0.002586
C 4.785592 -0.261448 -0.190925
H -0.920636 -0.947957 -1.502994
H -2.124424 0.286398 -1.999538
H -2.741996 1.017999 1.730825
H -2.049234 -0.639677 1.793610
H -2.598934 -2.253057 -0.319422
H -3.641521 -1.553902 -1.582563
H -4.327582 0.312865 -0.082091
H -4.330688 -1.093364 1.010020
H 0.007262 -0.916777 0.738049
H 0.028987 0.659115 1.577398
H -0.943515 2.205634 -1.157329
H -2.632550 2.189801 -0.544597
H -1.273077 2.573978 0.573658
H 0.878465 0.438732 -1.396913
H 1.352546 1.691064 -0.228186
H 4.937822 -0.456947 0.882448
H 5.542415 0.428874 -0.584401
H 4.778691 -1.212291 -0.747323


