%chk=000098080.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098080

0 1
 O    2.306700      -3.777100      -1.600400    
 O    2.066300     -0.3387000       2.626100    
 O   -1.939400      -2.284100      0.2673000    
 N   0.9695000      -1.974300      8.1200004E-02
 C    1.684000      -3.117500      0.6493000    
 C   0.5271000      -2.156600      -1.301400    
 C    2.815200      -3.521900     -0.2887000    
 C    1.709000      -2.602200      -2.154100    
 C   0.5921000     -0.9011000      0.8337000    
 C    1.681200     -0.1014000       1.485100    
 C  -0.6485000     -0.4288000       1.047800    
 C    2.296400       1.016100      0.7298000    
 C   -1.866200      -1.079500      0.4808000    
 C   -3.039600     -0.2154000      0.2056000    
 C    1.849200       1.286400     -0.5484000    
 C    3.299200       1.754900       1.326300    
 C    3.442500       3.098300     -0.6767000    
 C    2.428000       2.338000      -1.258900    
 C    3.878100       2.806600      0.6159000    
 C   -2.832000       1.107600     -0.1302000    
 C   -4.305800     -0.7594000      0.2929000    
 C   -5.224600       1.392900     -0.3073000    
 C   -3.935800       1.920100     -0.3892000    
 C   -5.409600      5.2999999E-02  3.3900000E-02
 C    4.061800       4.222100      -1.436900    
 C   -6.404800       2.262100     -0.5836000    
 H   0.9758000      -3.947900      0.7579000    
 H    2.089600      -2.898200       1.643000    
 H   9.2000000E-02  -1.245700      -1.725900    
 H  -0.2336000      -2.944600      -1.333900    
 H    3.586800      -2.744400     -0.3440000    
 H    3.290800      -4.439600      7.1300000E-02
 H    1.371500      -2.843000      -3.167100    
 H    2.466300      -1.812800      -2.232900    
 H  -0.8039000      0.4653000       1.646100    
 H    1.059500      0.7359000      -1.043100    
 H    3.654500       1.545400       2.330800    
 H    2.080200       2.556000      -2.265300    
 H    4.669100       3.390300       1.079400    
 H   -1.841800       1.542300     -0.2257000    
 H   -4.466300      -1.799300      0.5616000    
 H   -3.778800       2.960800     -0.6606000    
 H   -6.408700     -0.3695000      0.1004000    
 H    4.404300       5.014300     -0.7623000    
 H    4.917800       3.858500      -2.013900    
 H    3.341900       4.677400      -2.125400    
 H   -7.276400       1.941400     -2.9000000E-03
 H   -6.202100       3.302700     -0.3083000    
 H   -6.658700       2.223600      -1.647600    


%chk=000098080-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000098080

0 1
O 2.073532 -4.658331 -1.507450
O 2.556022 -0.789260 2.147045
O -1.933045 -2.203509 0.507535
N 1.109303 -2.352890 -0.020736
C 2.149777 -3.259592 0.539352
C 0.239672 -3.015254 -1.021250
C 2.957484 -3.928861 -0.584440
C 1.105619 -3.718955 -2.088290
C 0.865821 -1.068198 0.417749
C 1.981178 -0.303563 1.120898
C -0.352481 -0.377412 0.314493
C 2.360804 1.049403 0.602914
C -1.699913 -0.955025 0.299811
C -2.864755 -0.015895 0.095357
C 2.052567 1.483387 -0.715154
C 3.121769 1.905851 1.445531
C 3.242268 3.606620 -0.330347
C 2.491799 2.742806 -1.170800
C 3.545350 3.165517 0.987799
C -2.733145 1.298055 -0.427737
C -4.166962 -0.487521 0.410574
C -5.170432 1.644578 -0.303428
C -3.869067 2.111617 -0.623005
C -5.296864 0.329229 0.219595
C 3.732876 4.951161 -0.832431
C -6.393223 2.512449 -0.540317
H 1.627010 -4.044165 1.123010
H 2.802004 -2.708196 1.230946
H -0.382404 -2.252368 -1.516811
H -0.450498 -3.714927 -0.516537
H 3.543018 -3.167368 -1.145415
H 3.643366 -4.684539 -0.168028
H 0.463237 -4.322264 -2.750837
H 1.646131 -2.957932 -2.695008
H -0.295293 0.702583 0.475705
H 1.478979 0.831523 -1.382712
H 3.363590 1.557606 2.455215
H 2.252747 3.062633 -2.192018
H 4.118044 3.821346 1.654404
H -1.746750 1.687455 -0.703932
H -4.258606 -1.505233 0.804285
H -3.747209 3.122567 -1.031190
H -6.292392 -0.051927 0.478582
H 3.770645 5.698176 -0.020326
H 4.757172 4.865915 -1.245197
H 3.087322 5.346219 -1.635780
H -7.183769 2.309661 0.203673
H -6.144184 3.587096 -0.493315
H -6.828315 2.318731 -1.540481


