%chk=000029739.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029739

0 1
 O   -1.283600      -2.529200     -0.1554000    
 O    2.582600      0.3959000      -1.501100    
 O    1.633100      -2.267600      0.5551000    
 O   0.3941000       1.160100      0.3040000    
 O    4.072900       2.403400      2.8500000E-02
 C  -0.6221000      -1.517000      0.5938000    
 C   0.7668000      -1.232800      7.1199998E-02
 C    2.625300      0.4286000     -5.5900000E-02
 C    1.312400      0.1092000      0.6059000    
 C   -1.806500      -1.197700     -0.2467000    
 C   0.7894000      -1.247100      -1.470300    
 C    3.947400      3.0099999E-02  0.5978000    
 C    3.542700       1.410300      0.4808000    
 C  -0.7399000      -1.656700       2.052600    
 C    2.169000     -0.8716000      -2.010000    
 C   -3.174800      -1.023400      0.2946000    
 C   -3.559500      0.4035000      0.6063000    
 C   0.8657000       2.410600      0.7814000    
 C   -4.229700       1.266600     -0.1805000    
 C   -4.581000       2.678800      0.1934000    
 C   -4.704200      0.8458000      -1.545600    
 H    1.439500      5.6100000E-02   1.695800    
 H   -1.722200     -0.6976000      -1.198600    
 H   0.1032000     -0.5043000      -1.886400    
 H   0.5252000      -2.233200      -1.869000    
 H    4.752700     -0.3115000     -3.9000001E-02
 H    3.924800     -0.4059000       1.587500    
 H   0.1047000      -2.183800       2.505300    
 H  -0.8094000     -0.6729000       2.529200    
 H   -1.625800      -2.226300       2.352300    
 H    2.920500      -1.626900      -1.753100    
 H    2.136300     -0.7986000      -3.101800    
 H   -3.886600      -1.468200     -0.4101000    
 H   -3.330000      -1.606300       1.209600    
 H    1.907700      -2.059000       1.463300    
 H   -3.236400      0.7558000       1.584800    
 H    1.496700       2.899000      3.5300002E-02
 H    1.352600       2.338600       1.759300    
 H  -9.7000003E-03   3.056400      0.9068000    
 H   -4.116600       3.385400     -0.5019000    
 H   -5.666000       2.821600      0.1669000    
 H   -4.235200       2.926400       1.202300    
 H   -4.229000     -5.9000000E-02  -1.930400    
 H   -5.787700      0.6887000      -1.533900    
 H   -4.484200       1.634100      -2.274800    


%chk=000029739-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000029739

0 1
O -1.159539 -2.592247 0.084943
O 2.919721 0.489787 -1.405776
O 1.653664 -2.238197 0.440588
O 0.650499 1.281787 0.473502
O 4.552159 2.168453 1.073287
C -0.569872 -1.280079 0.639078
C 0.842774 -1.061419 0.039533
C 2.940818 0.363271 0.028735
C 1.565264 0.156248 0.680618
C -1.788051 -1.240868 -0.237445
C 0.865577 -0.904508 -1.501131
C 4.188435 -0.400972 0.681437
C 4.060210 1.081561 0.737032
C -0.669080 -1.152145 2.148235
C 2.302836 -0.722239 -2.010249
C -3.199721 -0.982803 0.269755
C -3.511468 0.504226 0.223858
C 1.147366 2.563160 0.992918
C -4.553432 1.120815 -0.405419
C -4.710149 2.632452 -0.341845
C -5.635642 0.408775 -1.197940
H 1.714522 -0.029515 1.766307
H -1.643136 -0.955087 -1.286838
H 0.280458 -0.009067 -1.776926
H 0.409146 -1.795892 -1.972908
H 4.929569 -0.810631 -0.017776
H 3.994850 -1.032941 1.556199
H 0.167882 -1.687440 2.630458
H -0.633324 -0.088981 2.445696
H -1.608339 -1.589490 2.519969
H 2.922758 -1.607141 -1.764450
H 2.328679 -0.533411 -3.095277
H -3.905852 -1.566151 -0.348437
H -3.299440 -1.365153 1.303314
H 1.094983 -3.033402 0.227258
H -2.791311 1.137195 0.764758
H 2.018789 2.924363 0.417610
H 1.430711 2.479509 2.063015
H 0.310051 3.270167 0.885395
H -4.701050 3.074577 -1.358095
H -5.680099 2.912611 0.115324
H -3.904225 3.105418 0.245261
H -5.486287 -0.681117 -1.261424
H -6.630012 0.587267 -0.742466
H -5.686492 0.807651 -2.230380


