%chk=000174444.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000174444

0 1
 O   -4.400400      -1.456900      0.6478000    
 N    1.414400       2.102500     -0.2129000    
 N   0.3632000      0.2507000      0.2776000    
 N   0.1220000       2.441100     -0.3358000    
 C    3.498100     -0.4680000     -0.6911000    
 C    2.827900      0.1691000      0.3567000    
 C    2.916800     -0.5227000      -2.067600    
 C    1.549200      0.7993000      0.1521000    
 C    4.736100      -1.070900     -0.4676000    
 C    3.404300      0.1989000       1.629100    
 C  -0.4719000       1.286400     -2.8400000E-02
 C   -1.899200       1.129500     -1.7100001E-02
 C    2.044100      -1.755800      -2.276700    
 C    5.307900      -1.039100      0.8043000    
 C    4.642100     -0.4042000       1.852600    
 C   -2.463100     -0.1029000      0.3134000    
 C   -2.722000       2.209800     -0.3360000    
 C   -3.849600     -0.2549000      0.3248000    
 C   -4.672300      0.8256000      6.0000001E-03
 C   -4.108400       2.057900     -0.3246000    
 C   -3.644000      -2.624200      0.3299000    
 C   -4.595500      -3.771100      6.3600004E-02
 H    2.347000      0.3822000      -2.304800    
 H    3.729000     -0.5375000      -2.806500    
 H    5.266300      -1.571600      -1.273600    
 H    2.899300      0.6889000       2.458600    
 H    2.127500       2.799900     -0.3914000    
 H    2.616200      -2.677100      -2.122800    
 H    1.650300      -1.769400      -3.298100    
 H    1.194400      -1.770300      -1.586800    
 H    6.271400      -1.509300      0.9786000    
 H    5.087400     -0.3796000       2.842800    
 H   -1.814300     -0.9294000      0.5902000    
 H   -2.318900       3.184700     -0.5984000    
 H   -5.753000      0.7133000      1.3200000E-02
 H   -4.749400       2.898800     -0.5730000    
 H   -3.037500      -2.484500     -0.5740000    
 H   -2.992700      -2.872900       1.175000    
 H   -4.047700      -4.687500     -0.1737000    
 H   -5.230500      -3.955600      0.9365000    
 H   -5.263500      -3.532500     -0.7707000    


%chk=000174444-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000174444

0 1
O -4.443003 -1.432879 -0.449078
N 1.472001 2.363187 0.510530
N 0.450450 0.434609 0.089689
N 0.121227 2.689603 0.527622
C 3.301643 -0.741378 -0.622359
C 3.007615 0.394591 0.197973
C 2.265732 -1.456465 -1.478091
C 1.671427 1.012388 0.247713
C 4.632466 -1.234888 -0.618912
C 4.040104 0.976452 0.991281
C -0.465643 1.475853 0.267657
C -1.922437 1.291177 0.182439
C 1.572573 -2.616300 -0.712034
C 5.651451 -0.648526 0.160111
C 5.351696 0.466923 0.975543
C -2.433863 -0.004962 -0.091404
C -2.805102 2.384814 0.367233
C -3.831122 -0.197779 -0.181566
C -4.719116 0.893068 0.001853
C -4.198651 2.173797 0.274890
C -3.566182 -2.604328 -0.647212
C -4.477779 -3.794693 -0.932377
H 1.484523 -0.754428 -1.814990
H 2.767164 -1.864238 -2.376882
H 4.866685 -2.099108 -1.252514
H 3.803523 1.813035 1.660150
H 2.161997 3.102075 0.627998
H 2.310921 -3.349079 -0.337895
H 0.866943 -3.147111 -1.377854
H 1.005311 -2.212967 0.143537
H 6.667355 -1.057720 0.135250
H 6.126726 0.924803 1.599164
H -1.719570 -0.821421 -0.224789
H -2.395818 3.377092 0.577933
H -5.795947 0.713333 -0.072987
H -4.887027 3.014139 0.416502
H -2.877731 -2.410689 -1.495625
H -2.959237 -2.769710 0.266686
H -3.873683 -4.706923 -1.089059
H -5.164786 -3.970485 -0.087009
H -5.081836 -3.614161 -1.837917


