%chk=000034456.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034456

0 1
 I  -4.3600000E-02   2.563800      0.8530000    
 I   -3.485300      -2.300000     -0.5135000    
 I    2.375800      -3.029400      0.2515000    
 O   -4.675500       1.147100      -1.217900    
 O   -2.726800      0.7339000      -2.297500    
 O    2.967600      0.7505000      -1.352400    
 N    2.144600      0.1862000      0.7727000    
 C   -2.712300      0.8321000      0.1466000    
 C   -1.499800     -5.0400000E-02  0.1784000    
 C   -3.812000      0.4594000       1.174800    
 C  -0.2434000      0.4852000      0.4617000    
 C   0.8659000     -0.3490000      0.4874000    
 C   -1.635000      -1.415200     -7.6600000E-02
 C   -3.312200      0.5101000       2.613200    
 C   -3.340300      0.8921000      -1.250100    
 C   0.7428000      -1.708600      0.2350000    
 C  -0.5137000      -2.244200     -4.8200000E-02
 C    4.325000       1.168500      0.5962000    
 C    3.073900      0.6921000     -0.1320000    
 C    5.603800       1.054100     -0.2306000    
 C    5.900600     -0.3784000     -0.6515000    
 H   -2.510600       1.883300      0.3396000    
 H   -4.579700       1.247500       1.127700    
 H   -4.394300     -0.4415000       1.032800    
 H   -2.586500     -0.2838000       2.813600    
 H   -2.846900       1.474600       2.839000    
 H   -4.149400      0.3761000       3.306200    
 H  -0.6191000      -3.308700     -0.2480000    
 H    2.278700      0.4284000       1.752300    
 H    4.161000       2.216600      0.8726000    
 H    4.452300      0.6018000       1.526500    
 H    5.527200       1.680400      -1.127100    
 H    6.444700       1.437800      0.3584000    
 H    5.961300      -1.037700      0.2202000    
 H    6.861200     -0.4224000      -1.174800    
 H    5.137900     -0.7723000      -1.329000    
 H   -5.062200       1.182800      -2.118700    


%chk=000034456-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034456

0 1
I -0.095309 2.566943 0.927483
I -3.499366 -2.381311 -1.004017
I 2.376218 -3.004631 0.051520
O -4.972682 1.300125 -1.034515
O -3.054217 0.967864 -2.291155
O 3.074869 0.134762 -1.412829
N 2.091400 0.259001 0.705242
C -2.917839 0.826136 0.183497
C -1.654313 -0.026090 0.055319
C -3.847555 0.399106 1.361303
C -0.361977 0.479844 0.381392
C 0.831604 -0.302936 0.349302
C -1.688017 -1.387457 -0.367042
C -3.161599 0.517571 2.738378
C -3.611775 0.990673 -1.173868
C 0.710023 -1.665658 -0.027564
C -0.535046 -2.195191 -0.414927
C 4.327024 1.251493 0.397837
C 3.140480 0.489642 -0.207325
C 5.651723 0.972367 -0.345420
C 6.187637 -0.455478 -0.107211
H -2.596767 1.862780 0.418690
H -4.741770 1.045374 1.327183
H -4.203144 -0.634425 1.207266
H -2.270484 -0.132491 2.810252
H -2.840369 1.555321 2.944903
H -3.861180 0.215562 3.538270
H -0.607318 -3.237394 -0.730238
H 2.184289 0.665876 1.639582
H 4.082882 2.332410 0.331893
H 4.430687 1.010878 1.475064
H 5.480065 1.124815 -1.426763
H 6.403814 1.717765 -0.022213
H 6.376520 -0.640145 0.967890
H 7.136960 -0.616163 -0.649480
H 5.462876 -1.208445 -0.465855
H -5.352644 1.464308 -1.940344


