%chk=000034498.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034498

0 1
 I  -0.2714000      -2.386800      -1.247200    
 I    2.591800       2.593300      0.8731000    
 I   -3.307600       2.751700      7.0600003E-02
 O    3.646100      -1.885900      0.8060000    
 O   -4.662000      -1.611600     -0.1777000    
 O   -3.071000      -1.137700       1.370900    
 N    2.101300     -0.4388000     -0.2357000    
 C   0.8823000      0.2512000     -0.1767000    
 C    2.846300     -0.4452000      -1.529100    
 C   -1.510700      0.3179000     -0.5018000    
 C  -0.3021000     -0.3758000     -0.5633000    
 C   0.8582000       1.571800      0.2718000    
 C   -2.790200     -0.3465000     -0.9152000    
 C   -1.534800       1.638500     -5.3199999E-02
 C  -0.3504000       2.265500      0.3336000    
 C    2.616200      -1.209000      0.8591000    
 C    3.876100      0.6644000      -1.581700    
 C    1.869800      -1.160400       2.172600    
 C   -3.488000      -1.056500      0.2237000    
 H    3.350600      -1.412800      -1.628600    
 H    2.143600     -0.3484000      -2.364000    
 H   -2.647000      -1.056100      -1.733900    
 H   -3.493700      0.3637000      -1.358500    
 H  -0.3693000       3.295600      0.6836000    
 H    3.412800       1.635200      -1.766900    
 H    4.503100      0.6930000     -0.6865000    
 H    4.544100      0.4896000      -2.433200    
 H   0.8184000      -1.421500       2.033900    
 H    1.950600     -0.1680000       2.619700    
 H    2.306100      -1.886400       2.865800    
 H   -5.117800      -2.073800      0.5579000    


%chk=000034498-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000034498

0 1
I -0.228469 -2.327539 -1.164258
I 2.537305 2.729898 1.062508
I -3.441814 2.844422 0.191862
O 3.748409 -1.731355 0.710159
O -4.610192 -1.843214 -0.372554
O -3.151025 -1.258099 1.339907
N 2.130569 -0.345561 -0.206469
C 0.881442 0.348195 -0.110900
C 2.798056 -0.462456 -1.542753
C -1.603981 0.385245 -0.492544
C -0.339258 -0.268310 -0.526847
C 0.793511 1.680388 0.381373
C -2.870412 -0.304512 -0.946313
C -1.612457 1.713737 0.014713
C -0.439273 2.359275 0.453389
C 2.677632 -1.076379 0.870006
C 4.060907 0.406763 -1.694983
C 1.920286 -1.042520 2.190982
C -3.506500 -1.157393 0.149646
H 3.069660 -1.524998 -1.675683
H 2.047259 -0.199478 -2.309104
H -2.688126 -0.962271 -1.814098
H -3.631640 0.429468 -1.267031
H -0.481404 3.378013 0.842589
H 3.832176 1.483812 -1.631800
H 4.796470 0.149336 -0.915656
H 4.520852 0.206747 -2.680934
H 0.855103 -1.305900 2.065863
H 1.969830 -0.039159 2.651906
H 2.395460 -1.765096 2.870416
H -5.028978 -2.390861 0.345709


