%chk=000159880.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159880

0 1
 O   -2.196700       1.011900     -0.6483000    
 N   0.6145000       1.610000      9.2500001E-02
 N    2.253600      0.1116000      9.2900001E-02
 N   0.9244000      -1.858100     -0.1496000    
 N   -1.909200      -1.037800      0.3480000    
 C   8.6000003E-03  0.3928000     -4.2199999E-02
 C    1.040400     -0.5163000     -3.9500002E-02
 C    1.961800       1.391000      0.1698000    
 C   -1.399400      0.1776000     -0.1557000    
 C  -3.2299999E-02   2.899800      0.1454000    
 C    2.046500      -2.797100     -0.1446000    
 C   -3.312200      -1.385600      0.3311000    
 H    2.678500       2.193500      0.2798000    
 H   0.7049000       3.664300      0.4050000    
 H  -0.4561000       3.115000     -0.8385000    
 H  -0.8117000       2.872000      0.9110000    
 H   2.4700001E-02  -2.290800     -0.3390000    
 H   -1.290100      -1.660800      0.8560000    
 H    2.719200      -2.594500     -0.9836000    
 H    1.670500      -3.819900     -0.2416000    
 H    2.604600      -2.722000      0.7937000    
 H   -3.405000      -2.467300      0.4499000    
 H   -3.764700      -1.070200     -0.6123000    
 H   -3.805400     -0.8751000       1.162000    


%chk=000159880-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159880

0 1
O -2.304775 1.166909 -0.328799
N 0.620809 1.614553 0.045675
N 2.254137 0.031394 0.095924
N 0.898842 -1.992013 -0.083762
N -1.952006 -1.069290 0.277351
C -0.037853 0.361943 -0.022792
C 1.012271 -0.595915 -0.009382
C 1.971598 1.357213 0.133668
C -1.500240 0.213453 -0.044460
C -0.008391 2.944934 0.067450
C 2.126952 -2.805850 -0.015942
C -3.382551 -1.387767 0.315969
H 2.714657 2.147027 0.218082
H 0.789654 3.706038 0.072566
H -0.656604 3.074476 -0.811673
H -0.637434 3.063382 0.965197
H 0.175711 -2.335391 -0.722726
H -1.279127 -1.727281 0.684790
H 2.807243 -2.630737 -0.873440
H 1.845782 -3.872420 0.018406
H 2.682829 -2.552620 0.900616
H -3.595547 -2.324148 -0.231610
H -3.921686 -0.554724 -0.162865
H -3.754871 -1.489165 1.353959


