%chk=000029756.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029756

0 1
 I   0.5787000       2.830600       1.059300    
 I    1.395600      -3.152400      0.1599000    
 I   -4.225900     -0.7730000     -3.5500001E-02
 O    2.765000      0.3686000      -1.447400    
 O   -1.894200      -3.217600      -1.476100    
 O   -2.199400      -3.761700      0.7096000    
 O   -2.556500       2.650200      -1.631300    
 N    2.006300     -4.1700002E-02  0.7362000    
 N   -2.453100       1.845700      0.5806000    
 C   0.6113000     -0.2061000      0.5632000    
 C    4.346800      0.3326000      0.3721000    
 C    5.451000      0.6351000     -0.6383000    
 C   -1.599900      0.7365000      0.4873000    
 C  -0.2249000      0.8984000      0.6577000    
 C   9.7700000E-02  -1.469400      0.3016000    
 C    2.956000      0.2351000     -0.2433000    
 C   -1.277300      -1.631000      0.1314000    
 C   -2.126000     -0.5283000      0.2243000    
 C    6.825700      0.7264000      8.8999998E-03
 C   -1.829500      -2.958200     -0.1450000    
 C   -2.861800       2.702200     -0.4443000    
 C   -3.785700       3.778000      6.8899997E-02
 H    4.324600       1.119100       1.136600    
 H    4.560400     -0.6172000      0.8776000    
 H    5.468600     -0.1442000      -1.409700    
 H    5.232300       1.579200      -1.151600    
 H    2.301500      2.0199999E-02   1.708200    
 H    6.852300       1.523200      0.7589000    
 H    7.587200      0.9436000     -0.7465000    
 H    7.090100     -0.2162000      0.4986000    
 H   -2.708200       2.101000       1.532200    
 H   -4.615200       3.328500      0.6223000    
 H   -4.191600       4.348800     -0.7709000    
 H   -3.231500       4.453900      0.7262000    
 H   -2.265200      -4.107400      -1.657900    


%chk=000029756-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000029756

0 1
I 0.710345 2.794889 1.239326
I 1.306503 -3.261885 0.331827
I -4.237708 -0.660532 -0.000378
O 2.760382 -0.433176 -1.274730
O -1.956330 -3.199551 -1.539760
O -2.337525 -3.758708 0.686984
O -2.898823 2.124379 -1.645951
N 2.081912 -0.128059 0.940198
N -2.373713 1.980908 0.629066
C 0.683195 -0.251275 0.697495
C 4.493875 -0.001144 0.416087
C 5.309934 0.905377 -0.536950
C -1.564724 0.812441 0.541183
C -0.165070 0.885526 0.777529
C 0.091174 -1.501842 0.369879
C 3.058624 -0.202264 -0.073757
C -1.298079 -1.607278 0.117247
C -2.119651 -0.458853 0.225951
C 6.800388 0.968181 -0.145701
C -1.915540 -2.956507 -0.171051
C -2.986424 2.595953 -0.483646
C -3.788142 3.844024 -0.133857
H 4.515285 0.404131 1.447407
H 4.970792 -1.001812 0.455097
H 5.195215 0.516588 -1.564860
H 4.875017 1.924024 -0.535667
H 2.381221 0.187189 1.866139
H 6.935354 1.365309 0.878423
H 7.362994 1.621997 -0.836227
H 7.263299 -0.036222 -0.181132
H -2.368215 2.496544 1.512643
H -4.819750 3.551877 0.137595
H -3.839063 4.492837 -1.020935
H -3.355430 4.411416 0.709543
H -2.366123 -4.091983 -1.711217


