%chk=000163050.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163050

0 1
 O    1.165200      0.1228000      1.1400000E-02
 O   0.1131000      -1.683800     -0.9462000    
 O  -0.7481000     -0.2973000       1.824000    
 N    4.712800      0.3599000     -0.9661000    
 C    3.478900      0.7686000     -0.2742000    
 C    5.162500     -0.7947000     -0.1683000    
 C    2.386000     -0.2611000     -0.6122000    
 C    3.899400      0.7530000       1.198300    
 C    5.019900     -0.2870000       1.266800    
 C    4.237400      -1.984600     -0.4772000    
 C    2.768800      -1.678600     -0.1705000    
 C   8.2500003E-02 -0.6844000     -0.2382000    
 C   -1.169600     -0.1397000      0.4539000    
 C   -2.433600     -0.9619000      0.1910000    
 C   -1.411000       1.342000      0.1571000    
 C   -2.966600     -0.9623000      -1.077400    
 C   -1.864700       2.151700       1.172900    
 C   -2.988200      -1.668700       1.232800    
 C   -1.165400       1.808000      -1.113900    
 C   -4.118400      -1.711500      -1.317200    
 C   -2.084800       3.502300      0.9025000    
 C   -4.140000      -2.417800      0.9930000    
 C   -1.385600       3.158600      -1.384200    
 C   -4.705200      -2.439400     -0.2820000    
 C   -1.845200       4.005800     -0.3759000    
 H    3.153800       1.770900     -0.5736000    
 H    6.198400      -1.060100     -0.4028000    
 H    2.232000     -0.2479000      -1.700600    
 H    3.076000      0.5115000       1.877900    
 H    4.297100       1.731700       1.492800    
 H    5.946000      0.2000000       1.595400    
 H    4.793400      -1.086900       1.979000    
 H    4.552700      -2.863900      9.6699998E-02
 H    4.335000      -2.248200      -1.538600    
 H    5.401800       1.107800     -0.8755000    
 H    2.175200      -2.453800     -0.6616000    
 H    2.581000      -1.800900      0.9042000    
 H  -6.9300003E-02  0.3716000       2.020700    
 H   -2.520000     -0.4270000      -1.906700    
 H   -2.071600       1.777900       2.170500    
 H   -2.578700      -1.675100       2.236900    
 H  -0.8043000       1.171100      -1.914700    
 H   -4.555500      -1.733000      -2.311300    
 H   -2.446100       4.161400       1.686500    
 H   -4.597400      -2.984600       1.798900    
 H   -1.198400       3.550900      -2.379600    
 H   -5.601300      -3.023800     -0.4691000    
 H   -2.017200       5.057300     -0.5866000    


%chk=000163050-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163050

0 1
O 1.270343 0.064020 0.194921
O 0.020052 -0.565389 -1.669388
O -0.726380 0.316668 1.797724
N 4.893257 0.259633 -0.667369
C 3.663318 0.594953 0.117712
C 5.277438 -1.073750 -0.093856
C 2.555207 -0.276211 -0.514480
C 3.981847 0.188689 1.596627
C 5.076025 -0.925259 1.456768
C 4.312035 -2.115002 -0.711313
C 2.836641 -1.783772 -0.352243
C 0.078199 -0.143790 -0.495965
C -1.131381 0.283988 0.389101
C -2.261735 -0.761993 0.264420
C -1.605290 1.696728 -0.054290
C -3.006850 -0.880834 -0.934197
C -2.216318 2.520840 0.924110
C -2.547653 -1.624024 1.349793
C -1.487769 2.172300 -1.383856
C -4.024060 -1.853104 -1.045314
C -2.701806 3.799808 0.578400
C -3.571602 -2.592175 1.238020
C -1.970961 3.456460 -1.725836
C -4.312096 -2.712387 0.040628
C -2.580821 4.274375 -0.748941
H 3.402154 1.660501 0.005818
H 6.319495 -1.314020 -0.366271
H 2.436104 -0.004081 -1.577657
H 3.082032 -0.167633 2.128830
H 4.368563 1.062167 2.151461
H 6.021070 -0.614282 1.937891
H 4.764862 -1.876470 1.925078
H 4.559118 -3.132320 -0.353415
H 4.449580 -2.099344 -1.807964
H 5.630810 0.966408 -0.521186
H 2.140025 -2.367453 -0.978688
H 2.639659 -2.060579 0.701036
H 0.219586 0.618165 1.824456
H -2.796240 -0.219836 -1.779805
H -2.296290 2.147509 1.949397
H -1.969877 -1.518339 2.271116
H -1.020131 1.550053 -2.154753
H -4.592721 -1.937882 -1.978151
H -3.174855 4.425903 1.343571
H -3.788940 -3.251313 2.086392
H -1.869852 3.814679 -2.756606
H -5.104857 -3.464270 -0.046047
H -2.956234 5.268463 -1.016678


