%chk=000170127.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170127

0 1
 O    3.627100       3.045200      0.7019000    
 O   -5.318400      0.5865000     -0.7245000    
 N    1.814200       1.059100     -0.1945000    
 N   -2.755100     -0.1568000      0.2314000    
 N  -0.4621000      0.4529000      1.7500000E-02
 N    3.724600      -1.942800     -0.2175000    
 C   0.8255000      5.0299998E-02 -6.9399998E-02
 C   0.2440000      -2.251100      7.9599999E-02
 C   -1.389700     -0.5234000      0.1363000    
 C    1.227200      -1.275600     -4.3600000E-02
 C   -1.091900      -1.876200      0.1718000    
 C    1.495200       2.448500     -0.2300000    
 C   -3.191400       1.201300      0.2069000    
 C   0.5815000      -3.707000      0.1162000    
 C    2.762300       3.268400     -0.4047000    
 C   -4.701300       1.265000      0.3623000    
 C    2.608400      -1.644600     -0.1397000    
 H   -1.877300      -2.619900      0.2674000    
 H    2.683800      0.7720000     -0.6324000    
 H    1.007300       2.736900      0.7086000    
 H   0.8103000       2.667700      -1.056900    
 H   -3.368200     -0.8539000      0.6429000    
 H   -2.908000       1.659600     -0.7481000    
 H   -2.722800       1.772300       1.016300    
 H    1.228800      -3.930400      0.9709000    
 H  -0.3136000      -4.330900      0.2170000    
 H    1.083200      -4.008900     -0.8091000    
 H    2.525600       4.335900     -0.4411000    
 H    3.296800       3.001800      -1.322500    
 H   -5.043700       2.304100      0.3527000    
 H   -5.034400      0.8002000       1.296200    
 H    3.827800       2.094300      0.7310000    
 H   -5.007600     -0.3346000     -0.7112000    


%chk=000170127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170127

0 1
O 2.558863 3.204163 0.744237
O -2.393652 2.167962 -0.790429
N 1.307026 0.941358 -0.784699
N -2.808306 -0.429801 1.035571
N -0.756539 0.210509 0.082727
N 3.476305 -1.862097 -1.113910
C 0.513812 -0.086940 -0.318897
C 0.188886 -2.473227 0.249996
C -1.544214 -0.781618 0.607265
C 1.027906 -1.434593 -0.266165
C -1.096502 -2.137231 0.698561
C 0.889219 2.352602 -0.903306
C -3.312843 0.954124 1.186584
C 0.698009 -3.896898 0.313513
C 2.089324 3.276957 -0.642081
C -3.606815 1.697423 -0.140350
C 2.353677 -1.692559 -0.721238
H -1.752448 -2.904934 1.120188
H 2.187706 0.671037 -1.233279
H 0.102900 2.550714 -0.157911
H 0.456821 2.559920 -1.903746
H -3.409668 -1.190565 1.350064
H -2.575450 1.550523 1.759604
H -4.238821 0.887749 1.787018
H 1.635928 -3.958283 0.895325
H -0.043484 -4.568789 0.775670
H 0.928359 -4.277429 -0.698947
H 1.784328 4.325052 -0.792345
H 2.916587 3.050708 -1.352868
H -4.219556 2.591348 0.085600
H -4.196620 1.030625 -0.807863
H 2.691584 2.249457 0.979121
H -1.664221 1.488635 -0.561309


