%chk=000055477.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055477

0 1
 I   0.8042000       2.531700      0.6579000    
 I   6.0400002E-02  -3.537000      0.3258000    
 I    5.475500      -1.232800     -0.5771000    
 O   -1.583400     -0.1290000      -1.416300    
 O    3.900900       2.060500      -1.287800    
 O    4.462800       2.040700      0.9146000    
 N  -0.6194000     -0.3668000      0.7124000    
 C   -4.165200      0.1589000     -0.4110000    
 C   -5.486900      0.2539000      0.3520000    
 C   -2.987700     -4.6000000E-02  0.5397000    
 C   -6.660800      0.4926000     -0.5971000    
 C   -1.660300     -0.1823000     -0.1933000    
 C   -7.972600      0.6212000      0.1604000    
 C   0.7560000     -0.5328000      0.4238000    
 C    1.585800      0.5775000      0.3455000    
 C    1.255100      -1.812700      0.2228000    
 C    2.940300      0.4047000      6.0400002E-02
 C    2.609500      -1.985500     -6.2100001E-02
 C    3.452000     -0.8768000     -0.1434000    
 C    3.833800       1.560000     -2.7200000E-02
 H   -4.008500       1.072900     -0.9973000    
 H   -4.212900     -0.6714000      -1.126500    
 H   -5.653000     -0.6705000      0.9184000    
 H   -5.431600       1.073000       1.079500    
 H   -2.913800      0.8028000       1.230100    
 H   -3.142600     -0.9538000       1.135300    
 H   -6.491200       1.407200      -1.177100    
 H   -6.736200     -0.3354000      -1.311400    
 H   -8.188500     -0.2894000      0.7281000    
 H   -8.798400      0.7901000     -0.5377000    
 H   -7.941300       1.463000      0.8595000    
 H  -0.8385000     -0.3338000       1.705600    
 H    3.008600      -2.985300     -0.2211000    
 H    4.501100       2.834500      -1.342600    


%chk=000055477-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000055477

0 1
I 0.806342 2.624450 0.546667
I 0.162912 -3.521702 0.912829
I 5.489652 -1.192369 -0.807441
O -1.565435 -1.164937 -1.000999
O 3.923379 2.077411 -1.534478
O 4.506906 2.225907 0.713272
N -0.614475 -0.273539 0.938391
C -4.121810 0.126540 -0.277981
C -5.547900 0.198168 0.309481
C -3.076612 -0.340924 0.759584
C -6.594981 0.694479 -0.713754
C -1.713530 -0.628590 0.128548
C -8.025166 0.743580 -0.134503
C 0.742007 -0.472570 0.560927
C 1.606555 0.636791 0.333486
C 1.294325 -1.775803 0.413879
C 2.963091 0.474650 -0.039728
C 2.629583 -1.962674 0.000406
C 3.454271 -0.841934 -0.221686
C 3.871586 1.667730 -0.204086
H -3.829590 1.120119 -0.672783
H -4.096418 -0.570793 -1.136005
H -5.845191 -0.807037 0.676029
H -5.558783 0.868379 1.195116
H -2.987287 0.396336 1.582465
H -3.423115 -1.289389 1.220934
H -6.304111 1.702674 -1.072853
H -6.576059 0.031441 -1.602316
H -8.351965 -0.259252 0.199759
H -8.753197 1.102894 -0.884684
H -8.077523 1.421217 0.738803
H -0.800009 0.306124 1.760968
H 3.027889 -2.971121 -0.123395
H 4.537859 2.857645 -1.622053


