%chk=000003734.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003734

0 1
 I   -1.874500      -2.262400       1.417300    
 I   -1.418700       3.607900     -0.1998000    
 I    3.553500      6.8400003E-02 -0.1283000    
 O    1.332000      -4.738500      -2.471500    
 O    4.114300      -3.762600      0.6516000    
 O   -5.520000     -0.7430000       1.520600    
 O   -5.165200      0.2137000      -2.651400    
 O    1.750200      -2.357100       1.945700    
 O   -3.159700       1.139300       1.873900    
 O    4.378000       4.969700      0.1330000    
 O    3.218200       2.873700       1.257300    
 N    1.350900      -2.951000     -0.2598000    
 N   -3.541900      0.5802000     -0.3433000    
 N    1.642300       2.639600     -0.4712000    
 C    1.913900      -4.279700     -0.1801000    
 C   -4.982100      0.7311000     -0.3067000    
 C   0.6827000     -0.7703000      0.5890000    
 C   -1.285700      0.6303000      0.5596000    
 C  -0.6894000     -0.6108000      0.7828000    
 C   0.8622000       1.552200     -5.1700000E-02
 C  -0.5099000       1.711700      0.1423000    
 C    1.458500      0.3113000      0.1718000    
 C    1.308600      -2.072600      0.8236000    
 C   -2.746700      0.8012000      0.7677000    
 C    1.181200      -5.215300      -1.139000    
 C    3.409300      -4.239200     -0.4891000    
 C   -5.640300     -0.5822000      0.1117000    
 C   -5.493500       1.190800      -1.670000    
 C    2.731500       3.222300      0.1853000    
 C    3.312800       4.392000     -0.6049000    
 C    3.827600       3.949300      -1.966500    
 H    1.767300      -4.645800      0.8436000    
 H   -5.220700       1.505300      0.4331000    
 H    1.004200      -2.631200      -1.160200    
 H   -3.110700      0.2640000      -1.207600    
 H    1.582400      -6.232300      -1.081600    
 H   0.1111000      -5.245800     -0.9073000    
 H    3.788800      -5.243700     -0.7043000    
 H    3.635800      -3.587100      -1.339500    
 H   -5.181900      -1.446700     -0.3807000    
 H   -6.710600     -0.5713000     -0.1198000    
 H   -6.579600       1.327100      -1.658600    
 H   -5.023300       2.136500      -1.960300    
 H    1.157600       3.269900      -1.108000    
 H    2.530100       5.150500     -0.7190000    
 H   0.8526000      -5.355300      -3.050400    
 H    5.058700      -3.754200      0.4201000    
 H   -5.951600      -1.583800       1.749500    
 H   -5.503000      0.5407000      -3.502500    
 H    4.605500       3.185300      -1.858500    
 H    4.285300       4.792400      -2.495200    
 H    3.031900       3.539800      -2.595800    
 H    4.653500       5.777600     -0.3330000    


%chk=000003734-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003734

0 1
I -1.661364 -2.460084 1.195980
I -1.238934 3.272563 -1.035498
I 3.814260 -0.203165 -0.509688
O 2.221125 -5.093600 2.276807
O 0.604770 -5.181190 -1.770777
O -4.273325 0.464117 -3.427947
O -5.559933 1.829208 0.510228
O 1.929880 -2.445741 1.969473
O -3.086014 1.056968 1.224898
O 2.709917 4.531113 -2.345112
O 3.023132 2.914971 0.939349
N 1.756867 -3.230376 -0.249180
N -3.343912 0.068050 -0.901812
N 1.879060 2.395011 -1.053932
C 2.312290 -4.609288 -0.187506
C -4.814577 0.074099 -1.126321
C 0.931597 -1.014176 0.285153
C -1.113635 0.350209 0.000077
C -0.472044 -0.850821 0.393341
C 1.106936 1.301519 -0.582797
C -0.307771 1.411793 -0.474652
C 1.705236 0.060777 -0.221030
C 1.592597 -2.308439 0.748820
C -2.618890 0.528956 0.163698
C 3.076947 -4.964232 1.107896
C 1.171911 -5.601442 -0.472966
C -5.114844 0.983231 -2.329946
C -5.678115 0.437614 0.102524
C 2.757211 3.143468 -0.269642
C 3.428255 4.290584 -1.068990
C 3.572325 5.559555 -0.220569
H 3.036421 -4.684248 -1.026355
H -5.084739 -0.962531 -1.420919
H 1.326674 -3.019864 -1.156269
H -2.820591 -0.213280 -1.738280
H 3.536897 -5.957000 0.954762
H 3.886472 -4.223913 1.270175
H 1.584706 -6.628697 -0.535592
H 0.423050 -5.553917 0.339834
H -4.867620 2.032248 -2.080102
H -6.190932 0.908321 -2.586753
H -6.734833 0.292038 -0.185669
H -5.444019 -0.255571 0.935423
H 1.718736 2.792053 -1.991540
H 4.424443 3.923205 -1.378764
H 2.009120 -4.150253 2.551458
H -0.230711 -5.676390 -1.952073
H -4.309376 1.075891 -4.202811
H -4.689425 1.882668 1.008750
H 2.581699 5.984672 0.031999
H 4.166148 6.318733 -0.757474
H 4.073210 5.313470 0.729866
H 2.077213 5.283013 -2.215647


