%chk=000165852.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165852

0 1
 O    1.867700     -0.4759000     -0.9534000    
 O   0.8225000       2.134900       1.285300    
 O    2.970000       2.306900     -0.3710000    
 O    3.898800      -2.354500     -0.4972000    
 O   -1.602900       2.178800     -0.6808000    
 N  -0.3373000     -0.4959000     -7.7299997E-02
 N   -1.539800      -2.314500      0.4332000    
 N   -3.695100      -1.207200      0.2622000    
 N   -3.637300       1.147800     -0.3268000    
 C    1.464600      0.9348000      0.9057000    
 C   0.8404000      0.3275000     -0.3414000    
 C    2.896600       1.144600      0.4546000    
 C    3.149800     -8.8000000E-02 -0.4077000    
 C    3.709200      -1.261600      0.3843000    
 C   -1.647800     -0.1075000     -0.1102000    
 C  -0.3263000      -1.830600      0.2538000    
 C   -2.351800      -1.244600      0.2066000    
 C   -2.244000       1.172900     -0.3997000    
 C   -4.237300      3.2099999E-02 -2.0199999E-02
 H   0.5508000       1.084500      -1.077300    
 H    1.429400      0.2359000       1.749300    
 H    3.598300       1.277200       1.283100    
 H    3.800900      0.1283000      -1.262300    
 H    3.026800      -1.587300       1.175600    
 H    4.674300      -1.009500      0.8334000    
 H   0.8986000       2.763200      0.5472000    
 H   0.5898000      -2.396500      0.3551000    
 H    3.888800       2.385200     -0.6801000    
 H    3.035400      -2.566100     -0.8918000    
 H   -4.280800      -2.003900      0.4885000    
 H   -5.337700      1.6700000E-02  3.6400001E-02


%chk=000165852-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165852

0 1
O 2.033196 -0.685203 -0.998675
O 1.077374 2.564292 0.280717
O 3.428109 2.139540 -0.695462
O 3.861167 -2.634044 0.096517
O -1.489627 2.343248 -0.022423
N -0.235158 -0.566375 -0.313224
N -1.545181 -2.419609 0.020061
N -3.649186 -1.169340 0.431652
N -3.526288 1.234410 0.327108
C 1.472131 1.190622 0.449507
C 0.959821 0.247555 -0.689765
C 3.021003 1.136784 0.275979
C 3.304852 -0.257025 -0.295639
C 3.654028 -1.334142 0.737452
C -1.534547 -0.089587 -0.041610
C -0.301458 -1.953407 -0.270035
C -2.295393 -1.267665 0.152773
C -2.123621 1.235780 0.074300
C -4.198811 0.105548 0.488681
H 0.701275 0.842915 -1.586441
H 1.169996 0.779192 1.434958
H 3.530587 1.303622 1.246764
H 4.078080 -0.204617 -1.079648
H 2.861910 -1.396714 1.516143
H 4.613747 -1.092063 1.224977
H 0.060670 2.616460 0.159380
H 0.561829 -2.576629 -0.472403
H 2.750747 2.873797 -0.610576
H 3.118345 -2.780637 -0.544491
H -4.210077 -2.012951 0.574255
H -5.274921 0.153943 0.686269


