%chk=000164632.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164632

0 1
 O   -3.401800      -2.042000      0.4170000    
 O    3.405700       2.038900      0.4241000    
 O   -3.114800     -0.2812000       1.818200    
 O    3.113900      0.2739000       1.819000    
 N   -1.716200      0.7239000     -0.5669000    
 N    1.719700     -0.7164000     -0.5701000    
 C  -0.6940000     -0.3108000     -0.5759000    
 C   0.6946000      0.3215000     -0.5790000    
 C   -3.053300      0.1309000     -0.5616000    
 C    3.052000     -0.1295000     -0.5623000    
 C   -4.124600       1.225000     -0.6009000    
 C    4.120600      -1.226100     -0.6052000    
 C   -3.175500     -0.7299000      0.6794000    
 C    3.176100      0.7266000      0.6819000    
 C   -5.538400      0.6577000     -0.6080000    
 C    5.535900     -0.6624000     -0.6097000    
 H  -0.7601000     -0.9548000      0.3088000    
 H  -0.8078000     -0.9472000      -1.463100    
 H   0.7645000      0.9676000      0.3037000    
 H   0.8075000      0.9544000      -1.468600    
 H   -3.176400     -0.5038000      -1.449000    
 H    3.179500      0.5086000      -1.446700    
 H   -1.609300       1.323100      -1.385000    
 H    1.609800      -1.315500      -1.387800    
 H   -3.990100       1.841000      -1.498900    
 H   -4.022000       1.893700      0.2633000    
 H    3.985200      -1.838600      -1.505500    
 H    4.016300      -1.897800      0.2565000    
 H   -5.683000     -2.4100000E-02  -1.452100    
 H   -6.267400       1.469200     -0.7004000    
 H   -5.760300      0.1157000      0.3163000    
 H    5.682700      2.2000000E-02  -1.451400    
 H    6.262900      -1.475600     -0.7046000    
 H    5.758800     -0.1244000      0.3166000    
 H   -3.495000      -2.568600       1.239300    
 H    3.500000       2.562500       1.248300    


%chk=000164632-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000164632

0 1
O -2.896017 -0.841400 1.845519
O 2.896008 0.835116 1.846888
O -4.053430 1.164329 1.668249
O 4.053055 -1.170314 1.662990
N -1.792599 0.570288 -0.594351
N 1.792307 -0.568180 -0.597476
C -0.671096 -0.377526 -0.539361
C 0.670841 0.379347 -0.539607
C -3.161375 0.052306 -0.389809
C 3.161191 -0.051293 -0.391332
C -4.189390 0.822479 -1.244315
C 4.188992 -0.819000 -1.248291
C -3.456948 0.218164 1.110817
C 3.456699 -0.222205 1.108725
C -5.633107 0.299764 -1.092084
C 5.633000 -0.297907 -1.093455
H -0.747568 -0.969934 0.388702
H -0.685759 -1.107577 -1.391487
H 0.748416 0.970282 0.389314
H 0.684310 1.110797 -1.390565
H -3.219061 -1.031525 -0.634150
H 3.219169 1.033280 -0.632123
H -1.727135 1.279114 -1.331216
H 1.726531 -1.275815 -1.335405
H -3.871253 0.742660 -2.303097
H -4.151206 1.891938 -0.960748
H 3.871297 -0.735051 -2.306882
H 4.149938 -1.889461 -0.968637
H -5.702377 -0.774886 -1.346139
H -6.318395 0.848845 -1.762102
H -5.993770 0.437852 -0.058095
H 5.703164 0.777620 -1.343502
H 6.318216 -0.845003 -1.765173
H 5.993117 -0.440062 -0.059816
H -3.022379 -0.667839 2.818463
H 3.022314 0.658297 2.819252


