%chk=000016567.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016567

0 1
 I    3.761100      2.7000001E-03  0.4416000    
 I   -1.519700      -3.056300      0.6340000    
 I   -1.525000       3.052700      0.6330000    
 O   -3.157800     -3.3000000E-03 -0.5809000    
 O   -3.273400     -2.0999999E-03   1.718200    
 O    1.820600       2.902000      -1.783200    
 O    1.831300      -2.895300      -1.784000    
 N    1.633500       2.423300      0.5160000    
 N    1.637600      -2.421000      0.5155000    
 C   0.9333000       1.208400      0.5428000    
 C   0.9354000      -1.207500      0.5429000    
 C   -1.156500     -1.3000000E-03  0.6212000    
 C    1.631300      1.0000000E-03  0.5168000    
 C  -0.4585000      -1.208700      0.5951000    
 C  -0.4606000       1.207300      0.5952000    
 C   -2.619300     -2.6000000E-03  0.6732000    
 C    2.020500       3.165900     -0.6019000    
 C    2.026100      -3.162600     -0.6027000    
 C   -4.587100     -3.3000000E-03 -0.6622000    
 C    2.758700       4.419600     -0.2051000    
 C    2.766600      -4.415100     -0.2063000    
 C   -4.998100     -4.1000000E-03  -2.119200    
 H    1.977000       2.730900       1.423300    
 H    1.767200      -2.852100       1.428300    
 H   -4.980000     -0.8971000     -0.1651000    
 H   -4.979900      0.8910000     -0.1660000    
 H    2.165900       4.993000      0.5133000    
 H    2.937000       5.039400      -1.088300    
 H    3.719300       4.152600      0.2441000    
 H    3.583100      -4.169100      0.4787000    
 H    3.186300      -4.893700      -1.095400    
 H    2.076700      -5.108900      0.2818000    
 H   -6.087100     -4.0000002E-03  -2.218500    
 H   -4.595700      0.8751000      -2.633200    
 H   -4.595800     -0.8838000      -2.632200    


%chk=000016567-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000016567

0 1
I 3.801966 -0.116162 0.820935
I -1.549526 -3.160107 0.524546
I -1.503360 2.977920 0.732164
O -3.218290 0.050365 -0.614659
O -3.338689 -0.149311 1.708741
O 1.031954 3.038232 -1.615912
O 2.650465 -2.446537 -1.458644
N 1.724761 2.350530 0.511744
N 1.641887 -2.602733 0.647204
C 0.989017 1.133172 0.546645
C 0.963728 -1.351461 0.612180
C -1.163502 -0.083661 0.578100
C 1.667608 -0.117621 0.617356
C -0.458159 -1.307090 0.582649
C -0.433173 1.129598 0.570421
C -2.675018 -0.066919 0.651027
C 1.726371 3.236892 -0.586296
C 2.426542 -3.106205 -0.411275
C -4.715124 0.135988 -0.686719
C 2.602839 4.467565 -0.387927
C 3.002184 -4.493900 -0.153942
C -5.074059 0.232098 -2.164450
H 2.440508 2.486801 1.230403
H 1.379978 -3.254623 1.390984
H -5.133012 -0.762609 -0.198144
H -5.026020 1.026624 -0.110797
H 1.990934 5.280225 0.046042
H 2.967843 4.804530 -1.369967
H 3.463764 4.288177 0.280250
H 4.045190 -4.394527 0.199019
H 3.022001 -5.050368 -1.103858
H 2.434960 -5.072577 0.596189
H -6.171136 0.306484 -2.276759
H -4.614572 1.123766 -2.623162
H -4.726859 -0.659553 -2.713288


