%chk=000147937.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147937

0 1
 O   -1.135900      -2.514700       1.287600    
 O   0.4724000     -0.4314000       1.436700    
 O    3.299800     -0.9529000      0.6865000    
 O    3.011300     -0.2829000      -1.502500    
 C   -2.231700     -0.5824000      3.2000002E-02
 C   -1.105000      -1.640900      0.1388000    
 C   -1.592900      0.6925000     -0.5183000    
 C  -0.1250000      0.3533000     -0.8228000    
 C   0.1994000     -0.8444000      9.7999997E-02
 C   -2.963500      -1.524400     -0.9506000    
 C   -1.652900      -2.293600      -1.159900    
 C   -1.511400       1.814600      0.5112000    
 C   0.6683000       1.642500     -0.5664000    
 C  -0.3190000       2.665300      4.2399999E-02
 C   -3.102200     -0.3876000       1.258900    
 C    1.364300      -1.690100     -0.3990000    
 C   0.3115000       3.421800       1.215100    
 C  -0.7635000       3.680600      -1.024900    
 C    2.638100     -0.8882000     -0.5071000    
 C    4.537900     -0.2371000      0.7441000    
 H   -2.109800       1.046200      -1.418100    
 H  -3.5500001E-02  5.2999999E-02  -1.874400    
 H   -3.368600      -1.050000      -1.850000    
 H   -3.752000      -2.151800     -0.5177000    
 H   -1.758800      -3.382600      -1.130400    
 H   -1.127700      -2.027200      -2.082800    
 H   -2.443400       2.389400      0.5557000    
 H   -1.308900       1.459700       1.524500    
 H    1.516700       1.470600      0.1033000    
 H    1.091900       2.015500      -1.506600    
 H   -2.538300     -7.1500003E-02   2.140600    
 H   -3.892400      0.3476000       1.070000    
 H   -3.601500      -1.317800       1.557000    
 H    1.166400      -2.122400      -1.386500    
 H    1.550500      -2.542100      0.2670000    
 H  -0.5029000      -3.224600       1.086800    
 H  -0.3540000     -0.3854000       1.942300    
 H   0.6507000       2.734400       1.998300    
 H  -0.4065000       4.113700       1.669000    
 H    1.180200       4.003400      0.8870000    
 H   -1.515800       4.369000     -0.6237000    
 H   -1.197200       3.188000      -1.901500    
 H   8.5199997E-02   4.280800      -1.372100    
 H    5.241400     -0.6374000      8.0000004E-03
 H    4.961200     -0.3702000       1.743200    
 H    4.365600      0.8301000      0.5749000    


%chk=000147937-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000147937

0 1
O -0.904044 -2.327868 1.495480
O 0.623826 -0.247619 1.390057
O 3.567435 -1.290070 0.535052
O 3.110043 -0.046877 -1.378745
C -2.287248 -0.621688 0.016647
C -1.048619 -1.608524 0.224157
C -1.672480 0.740826 -0.411308
C -0.179959 0.458866 -0.815141
C 0.253864 -0.758927 0.060154
C -2.725723 -1.496682 -1.222880
C -1.536465 -2.485654 -0.975475
C -1.556297 1.876931 0.634058
C 0.595433 1.784927 -0.541848
C -0.430641 2.802766 0.074517
C -3.322736 -0.562855 1.144916
C 1.426196 -1.628112 -0.494583
C 0.214590 3.649724 1.195501
C -0.990044 3.744783 -1.026260
C 2.750330 -0.893261 -0.526667
C 4.867122 -0.583921 0.636921
H -2.234960 1.125556 -1.285064
H -0.098517 0.157514 -1.876570
H -2.672540 -0.958911 -2.184995
H -3.727616 -1.950332 -1.129750
H -1.846282 -3.494642 -0.651453
H -0.832395 -2.602621 -1.815675
H -2.507297 2.422036 0.786494
H -1.226435 1.462141 1.604250
H 1.408883 1.603933 0.179264
H 1.055954 2.180582 -1.464211
H -2.903203 -0.120374 2.065252
H -4.192726 0.048218 0.840246
H -3.717425 -1.570173 1.393892
H 1.196632 -1.941022 -1.527911
H 1.523289 -2.524200 0.141958
H -1.789419 -2.635614 1.808458
H 0.424866 -0.987132 2.029494
H 0.616647 2.995772 1.991250
H -0.520525 4.339997 1.653542
H 1.049562 4.260667 0.801942
H -1.770364 4.415211 -0.617181
H -1.433548 3.178941 -1.866776
H -0.182449 4.376696 -1.442140
H 5.454593 -0.723185 -0.286328
H 5.367971 -1.041481 1.501592
H 4.699223 0.494059 0.799467


