%chk=000147110.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147110

0 1
 O   -1.721000       1.033000      0.5415000    
 O   0.9014000      -1.352700     -0.7122000    
 O   -3.603600      -1.764700     -0.8091000    
 O    3.835800      2.0999999E-03   1.041000    
 O    4.862500      -1.288300     -0.5716000    
 C  -0.6939000      0.4427000     -0.2595000    
 C  -0.1568000     -0.9274000      0.1583000    
 C   -2.165700      0.2697000     -0.5885000    
 C   0.2694000     -0.9866000       1.632700    
 C   -1.328400      -1.871300     -8.9900002E-02
 C   -2.402500      -1.179200     -0.5059000    
 C    1.581500     -0.2488000       1.866800    
 C    2.641300     -0.7533000      0.8957000    
 C    2.138000     -0.6652000     -0.5378000    
 C    4.882500     -0.3728000      0.2396000    
 C   -4.597600     -0.9244000     -0.5629000    
 C    6.083500      0.4982000      0.5410000    
 C    6.189800       1.721400     -0.3830000    
 C    6.269000       1.306200      -1.854200    
 C    4.988500       2.644700     -0.1702000    
 C   -5.497300     -0.1621000     -0.3397000    
 C   -6.526300      0.7090000     -8.4200002E-02
 C   -7.426700       1.470800      0.1396000    
 C   -8.523400       2.398800      0.4123000    
 H  -7.7000000E-02   1.069600     -0.8814000    
 H   -2.539500      0.7931000      -1.460100    
 H   0.4197000      -2.034400       1.927500    
 H  -0.5053000     -0.5797000       2.293500    
 H   -1.289000      -2.942900      4.2399999E-02
 H    1.441600      0.8324000       1.742100    
 H    1.920900     -0.3892000       2.899800    
 H    2.851600      -1.802000       1.147000    
 H    2.034600      0.3809000     -0.8495000    
 H    2.808000      -1.114400      -1.269900    
 H    6.052400      0.8052000       1.593700    
 H    6.976200     -0.1315000      0.4419000    
 H    7.104000       2.268300     -0.1222000    
 H    5.341200      0.8426000      -2.204700    
 H    6.456300       2.181600      -2.485700    
 H    7.089200      0.5989000      -2.015100    
 H    4.051400       2.192600     -0.5104000    
 H    4.879900       2.910600      0.8865000    
 H    5.123200       3.575400     -0.7325000    
 H   -8.757000       2.421800       1.481000    
 H   -8.260800       3.414100      0.1004000    
 H   -9.428000       2.101500     -0.1265000    


%chk=000147110-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147110

0 1
O -1.761969 0.653486 1.871057
O 0.639024 -0.847745 -0.753232
O -3.869814 -1.402130 -0.238327
O 3.935167 0.025433 0.890218
O 5.077517 -1.177647 -0.752641
C -0.821543 0.553880 0.694713
C -0.238776 -0.867894 0.452694
C -2.291663 0.515267 0.429306
C 0.513685 -1.446340 1.676925
C -1.463744 -1.685662 0.074985
C -2.573441 -0.902963 0.057385
C 1.866318 -0.734754 1.913925
C 2.709786 -0.792200 0.637337
C 1.941316 -0.180082 -0.550707
C 5.073997 -0.277896 0.119627
C -4.923780 -0.584148 -0.211279
C 6.231519 0.628707 0.490338
C 6.548654 1.701995 -0.605902
C 7.116943 1.068961 -1.896819
C 5.321205 2.594723 -0.905299
C -5.983063 0.054314 -0.230776
C -7.139895 0.790692 -0.238930
C -8.188764 1.454370 -0.247662
C -9.431010 2.232812 -0.259728
H -0.209593 1.441781 0.509806
H -2.895702 1.356094 0.081177
H 0.685791 -2.525952 1.502134
H -0.134121 -1.348046 2.565104
H -1.426235 -2.760042 -0.109004
H 1.703120 0.323375 2.195017
H 2.408129 -1.213341 2.748611
H 3.016452 -1.825607 0.390443
H 1.813739 0.909224 -0.374503
H 2.478374 -0.334745 -1.499235
H 5.998494 1.130831 1.444414
H 7.126024 -0.006295 0.630359
H 7.337313 2.344452 -0.162144
H 6.388367 0.378446 -2.356745
H 7.364899 1.855076 -2.633961
H 8.037375 0.492156 -1.690036
H 4.522119 2.015714 -1.406201
H 4.898569 3.028894 0.019344
H 5.602962 3.424399 -1.578911
H -9.828137 2.373537 0.762957
H -9.270908 3.234441 -0.701017
H -10.211103 1.724729 -0.857216


