%chk=000034499.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034499

0 1
 I  -0.3913000      -2.402800      -1.127000    
 I    2.229200       2.647600       1.136100    
 I   -3.571000       2.736700     -0.2133000    
 O    3.187600      -1.829600       1.438600    
 O   -4.867400      -1.643200     -0.4859000    
 O   -3.429900      -1.121400       1.192100    
 N    1.864200     -0.4121000      5.5100001E-02
 C    2.687900     -0.4304000      -1.121900    
 C   0.5855000      0.2986000     -1.7500000E-02
 C    4.088500      0.1095000     -0.8587000    
 C  -0.4990000     -0.3777000     -0.4947000    
 C   -1.712800      0.3065000     -0.5608000    
 C   0.5659000       1.597900      0.4001000    
 C    2.193600      -1.124400       1.247400    
 C   -1.787200       1.636400     -0.1466000    
 C    4.961100      0.1141000      -2.105800    
 C   -2.943900     -0.3781000      -1.075600    
 C  -0.6480000       2.282100      0.3340000    
 C    1.226700     -0.9406000       2.394700    
 C   -3.739500      -1.069000      9.7000003E-03
 H    2.211600      0.1371000      -1.930500    
 H    2.775900      -1.472700      -1.450400    
 H    4.055300       1.134500     -0.4944000    
 H    4.598200     -0.4786000     -8.8799998E-02
 H   -2.720700      -1.104300      -1.861200    
 H   -3.608200      0.3159000      -1.598100    
 H    4.520800      0.7397000      -2.888700    
 H    5.955300      0.5087000      -1.873600    
 H    5.081100     -0.8994000      -2.501700    
 H  -0.7063000       3.319400      0.6573000    
 H   0.2164000      -1.256200       2.127100    
 H    1.224300      8.7099999E-02   2.758300    
 H    1.546400      -1.577100       3.227400    
 H   -5.386100      -2.093000      0.2147000    


%chk=000034499-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000034499

0 1
I -0.350953 -2.362725 -1.038961
I 2.192524 2.667528 1.493031
I -3.593017 2.908707 -0.226838
O 3.338309 -1.812576 1.373156
O -4.858040 -1.679815 -0.759496
O -3.541646 -1.140115 1.078725
N 1.896144 -0.417511 0.209626
C 2.745825 -0.568426 -1.012478
C 0.664476 0.307774 0.116172
C 4.006647 0.323106 -1.027051
C -0.502420 -0.289697 -0.454668
C -1.744089 0.391264 -0.602123
C 0.542561 1.650917 0.570305
C 2.267660 -1.138153 1.365000
C -1.786678 1.732286 -0.130202
C 4.887117 0.003545 -2.254854
C -2.961953 -0.284344 -1.189862
C -0.669007 2.360810 0.453315
C 1.329686 -1.066690 2.562393
C -3.767949 -1.052728 -0.143762
H 2.111672 -0.351804 -1.891926
H 3.056645 -1.628307 -1.062487
H 3.716682 1.389960 -1.036928
H 4.575445 0.143773 -0.097355
H -2.688325 -0.999742 -1.985079
H -3.645238 0.449420 -1.653495
H 4.337200 0.166017 -3.201791
H 5.784982 0.646832 -2.273813
H 5.227300 -1.048701 -2.236052
H -0.737928 3.388838 0.813006
H 0.279267 -1.261497 2.283671
H 1.375642 -0.070514 3.039343
H 1.658632 -1.819326 3.293825
H -5.382973 -2.176905 -0.074947


