%chk=000152027.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152027

0 1
 O   -5.281700      0.8363000      0.1654000    
 O   -3.668800       2.312600      0.3613000    
 N    1.548400      -1.184800      0.3700000    
 N    1.159500      0.8483000     -0.4520000    
 N    3.468400       1.596700     -0.4940000    
 N   -4.062700       1.133100      0.1932000    
 C   0.6144000     -0.2873000     -7.3500000E-02
 C  -0.7935000     -0.6032000     -0.1011000    
 C    2.775300     -0.5872000      0.2705000    
 C    2.504600      0.6760000     -0.2429000    
 C   -1.739400      0.4090000      5.8400001E-02
 C   -1.206800      -1.921800     -0.2890000    
 C    4.069900      -1.000100      0.5661000    
 C   -3.099800      0.1025000      2.9999999E-02
 C   -2.567300      -2.228200     -0.3174000    
 C   -3.513700      -1.216100     -0.1579000    
 C    5.070400     -6.5300003E-02  0.3137000    
 C    4.722700       1.179400     -0.2006000    
 H    1.375000      -2.116700      0.7232000    
 H   -1.401000       1.432500      0.2077000    
 H  -0.4965000      -2.732400     -0.4304000    
 H    4.288400      -1.982400      0.9662000    
 H   -2.889700      -3.254600     -0.4670000    
 H   -4.564800      -1.491900     -0.1863000    
 H    6.109100     -0.3056000      0.5161000    
 H    5.497400       1.915000     -0.4006000    


%chk=000152027-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152027

0 1
O -5.342692 0.936867 -0.183101
O -3.619392 2.430123 -0.176541
N 1.637929 -1.335152 0.102339
N 1.115611 0.892719 0.035880
N 3.430671 1.747330 0.084283
N -4.084994 1.229362 -0.152476
C 0.618171 -0.361672 0.049740
C -0.814811 -0.683084 0.014149
C 2.858903 -0.659481 0.122714
C 2.511473 0.742225 0.080792
C -1.740089 0.391363 -0.049969
C -1.304177 -2.018120 0.041415
C 4.205687 -1.066085 0.169796
C -3.114005 0.100738 -0.084898
C -2.690829 -2.279575 0.005061
C -3.616883 -1.219517 -0.058871
C 5.153839 -0.019938 0.173106
C 4.729297 1.342402 0.130358
H 1.509563 -2.344984 0.121449
H -1.376185 1.422296 -0.071510
H -0.613897 -2.868455 0.092423
H 4.510564 -2.117000 0.202202
H -3.050263 -3.313029 0.026986
H -4.696072 -1.387922 -0.088329
H 6.224693 -0.242023 0.208411
H 5.475688 2.144413 0.133694


