%chk=000005803.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005803

0 1
 I  -5.8200002E-02  -1.529300      -3.054200    
 I  -5.7100002E-02  -1.544100       3.048700    
 I   -2.150600       3.411100      9.8999999E-03
 O   -1.077500      -1.873700     -3.4000000E-03
 O    5.576500       1.912700      5.2700002E-02
 O   -5.064900       1.934800      7.0000002E-03
 O    3.317700       2.117700     -6.4300001E-02
 C    2.867300     -0.5669000     -8.9999998E-04
 C   0.2193000      -1.444400     -2.6000000E-03
 C    4.283100     -9.7700000E-02 -9.9999997E-05
 C    2.205200     -0.7836000      -1.209400    
 C    2.205600     -0.7892000       1.206700    
 C   0.8810000      -1.222400      -1.210200    
 C   0.8815000      -1.227900       1.205900    
 C   -2.069200     -0.9105000     -8.9999998E-04
 C   -1.713300      0.4273000      2.4000001E-03
 C   -3.395700      -1.306700     -1.6000000E-03
 C    4.316600       1.412200      3.5000001E-03
 C   -2.714400       1.398700      5.1000002E-03
 C   -4.396800     -0.3353000      1.2000001E-03
 C   -4.056100       1.017400      4.4000000E-03
 H    4.812600     -0.4628000     -0.8870000    
 H    4.810400     -0.4677000      0.8864000    
 H    2.730400     -0.6053000      -2.145300    
 H    2.730900     -0.6152000       2.143200    
 H  -0.6861000      0.7746000      3.1000001E-03
 H   -3.662400      -2.359200     -4.1000000E-03
 H   -5.439800     -0.6401000      7.9999998E-04
 H    5.581600       2.893500      3.7700001E-02
 H   -4.667600       2.822800      9.1000004E-03


%chk=000005803-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000005803

0 1
I 0.003262 -1.115679 -3.093925
I -0.105371 -1.668391 3.042650
I -2.754638 3.615160 0.257687
O -1.073198 -1.707526 -0.068659
O 5.407307 2.004923 0.426786
O -5.529518 1.748297 0.080061
O 4.635885 1.417438 -1.683370
C 3.017511 -0.562826 0.102281
C 0.257176 -1.260310 -0.008466
C 4.503964 -0.216914 0.175651
C 2.348236 -0.628749 -1.145562
C 2.305629 -0.851274 1.290331
C 0.983651 -0.975905 -1.195344
C 0.939010 -1.198531 1.232946
C -2.136586 -0.758691 -0.022822
C -1.925087 0.631450 0.074267
C -3.439580 -1.298392 -0.084033
C 4.830797 1.116226 -0.486279
C -3.050309 1.481873 0.110116
C -4.545519 -0.434692 -0.047335
C -4.370923 0.969743 0.050265
H 5.089526 -0.989657 -0.359270
H 4.847874 -0.193143 1.220337
H 2.893294 -0.396553 -2.064547
H 2.814711 -0.808770 2.257512
H -0.913386 1.041599 0.118943
H -3.567725 -2.381390 -0.159714
H -5.568123 -0.819302 -0.092978
H 5.613441 2.866162 -0.030404
H -5.301312 2.714625 0.146674


