%chk=000078941.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078941

0 1
 O   1.9400001E-02 -0.6594000      1.1300000E-02
 O   -1.459500     -0.7578000      -1.756800    
 C    2.408700     -0.2296000     -3.5200000E-02
 C    1.075100     -0.1427000     -0.7974000    
 C    2.416500      0.7109000       1.179500    
 C   0.7629000       2.247200      2.2500001E-02
 C   0.7527000       1.302300      -1.189900    
 C    2.094000       2.149400      0.7786000    
 C    2.716400      -1.662000      0.4051000    
 C   0.4975000       3.686700     -0.4155000    
 C    2.675900      -2.608600     -0.7911000    
 C    4.074000      -1.727500       1.099100    
 C   -1.223300     -0.6538000     -0.5611000    
 C   -2.265100     -0.4999000      0.5236000    
 C   -3.682500     -0.4622000     -4.5200001E-02
 C   -4.724700     -0.3460000       1.066100    
 C   -6.138200     -0.3470000      0.5064000    
 H    3.201300      0.1069000     -0.7195000    
 H    1.134000     -0.7292000      -1.721700    
 H    3.398500      0.7287000       1.662700    
 H    1.693400      0.3710000       1.931500    
 H  -4.4199999E-02   1.954800      0.7061000    
 H  -0.2127000       1.388600      -1.698800    
 H    1.506800       1.641100      -1.913300    
 H    2.057900       2.775200       1.678500    
 H    2.907500       2.540500      0.1539000    
 H    1.964000      -2.006600       1.126400    
 H  -0.4695000       3.765900     -0.9232000    
 H   0.4771000       4.358000      0.4495000    
 H    1.271700       4.043800      -1.103200    
 H    1.657700      -2.757700      -1.162900    
 H    3.046000      -3.601300     -0.5099000    
 H    3.300200      -2.245200      -1.614500    
 H    4.054800      -1.255100       2.085600    
 H    4.371300      -2.769200       1.266600    
 H    4.858300      -1.253800      0.4988000    
 H   -2.164400      -1.346200       1.212300    
 H   -2.061900      0.4291000       1.067400    
 H   -3.781000      0.3836000     -0.7371000    
 H   -3.868500      -1.371300     -0.6308000    
 H   -4.561600      0.5773000       1.634000    
 H   -4.617000      -1.181800       1.767300    
 H   -6.290000      0.4947000     -0.1768000    
 H   -6.343900      -1.273700     -3.8600001E-02
 H   -6.867400     -0.2614000       1.318200    


%chk=000078941-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078941

0 1
O -0.138926 0.163722 0.106975
O -1.497522 -0.380610 -1.713890
C 2.294255 -0.106835 -0.022959
C 1.045836 0.348170 -0.812989
C 2.583073 0.884386 1.138123
C 1.385579 2.796409 -0.087558
C 1.100098 1.821651 -1.254663
C 2.669223 2.350902 0.653467
C 2.199154 -1.592429 0.450678
C 1.485287 4.251932 -0.588314
C 1.880378 -2.563489 -0.714643
C 3.500007 -2.051739 1.155922
C -1.354886 -0.190195 -0.482744
C -2.441716 -0.303082 0.576014
C -3.759526 -0.892361 0.035878
C -4.857018 -0.962098 1.120738
C -6.179922 -1.552015 0.585934
H 3.139318 -0.041340 -0.747027
H 0.867445 -0.291614 -1.694758
H 3.529913 0.611374 1.638521
H 1.776199 0.791994 1.892720
H 0.540217 2.724217 0.628582
H 0.154032 2.081540 -1.766720
H 1.908431 1.916018 -2.010917
H 2.856095 3.020815 1.516107
H 3.536992 2.464990 -0.031875
H 1.367918 -1.650202 1.183063
H 0.557297 4.567337 -1.101531
H 1.663785 4.951600 0.249795
H 2.321833 4.365846 -1.305306
H 0.892177 -2.374381 -1.169932
H 1.879950 -3.608543 -0.352796
H 2.645068 -2.487393 -1.512812
H 3.701743 -1.485980 2.082255
H 3.432035 -3.120994 1.429754
H 4.374427 -1.932783 0.485836
H -2.047111 -0.907291 1.415418
H -2.612727 0.709954 0.993737
H -4.111229 -0.282864 -0.818147
H -3.571039 -1.905088 -0.370389
H -5.042053 0.054992 1.523781
H -4.496200 -1.573764 1.973101
H -6.577795 -0.940027 -0.245191
H -6.029052 -2.578565 0.202242
H -6.952842 -1.595466 1.375017


