%chk=000129215.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129215

0 1
 O    3.345100       1.481700     -0.8345000    
 O   -3.841300      -1.597100     -0.4915000    
 O   -4.693100      0.2321000      0.8261000    
 C    4.136300     -0.4840000      0.3638000    
 C    3.063800      9.7000003E-02 -0.6119000    
 C    1.606400     -3.9200000E-02 -0.1270000    
 C    4.072200      0.1812000       1.751600    
 C    5.543100     -0.2275000     -0.2216000    
 C    3.961100      -2.004900      0.5300000    
 C   0.5591000      0.5640000      -1.078300    
 C  -0.8518000      0.5078000     -0.5487000    
 C   -1.638100     -0.6021000     -0.8309000    
 C   -1.334200       1.575700      0.2144000    
 C   -2.921700     -0.6078000     -0.3248000    
 C   -3.408200      0.4367000      0.4275000    
 C   -2.637900       1.544700      0.7151000    
 C   -4.960900      -1.058400      0.2408000    
 H    3.156600     -0.4006000      -1.585000    
 H    1.363900      -1.094800      3.8100000E-02
 H    1.494800      0.4675000      0.8391000    
 H    3.126100     -2.7300000E-02   2.260800    
 H    4.195900       1.267200       1.691600    
 H    4.870700     -0.1983000       2.400500    
 H    6.321400     -0.6736000      0.4084000    
 H    5.637700     -0.6633000      -1.222600    
 H    5.762200      0.8430000     -0.2986000    
 H    3.023600      -2.252400       1.038100    
 H    3.962600      -2.510300     -0.4421000    
 H    4.773500      -2.433400       1.128200    
 H   0.8090000       1.609700      -1.299100    
 H   0.6065000      4.5699999E-02  -2.045100    
 H    3.074700       1.978800     -4.4399999E-02
 H   -1.266700      -1.432600      -1.420700    
 H  -0.7040000       2.435200      0.4274000    
 H   -3.024900       2.365300       1.308400    
 H   -5.226200      -1.758600       1.041300    
 H   -5.813700     -0.9643000     -0.4413000    


%chk=000129215-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129215

0 1
O 3.384665 1.696053 -0.564654
O -3.723370 -1.788795 -0.061200
O -4.784647 0.182870 0.803859
C 4.160352 -0.513090 0.370563
C 3.083456 0.243899 -0.485293
C 1.614480 0.046223 -0.050041
C 4.180915 0.002517 1.834767
C 5.548936 -0.266695 -0.279081
C 3.866251 -2.037730 0.361718
C 0.614601 0.639814 -1.081563
C -0.828643 0.578173 -0.602189
C -1.535645 -0.663320 -0.633103
C -1.470537 1.735399 -0.091775
C -2.845197 -0.675576 -0.153159
C -3.470149 0.483750 0.354009
C -2.806185 1.710055 0.400540
C -5.027244 -1.217612 0.369306
H 3.198127 -0.085455 -1.537210
H 1.398681 -1.030251 0.082780
H 1.445782 0.526518 0.935611
H 3.203677 -0.126134 2.336256
H 4.465787 1.071376 1.887030
H 4.931124 -0.558276 2.422148
H 6.352225 -0.713468 0.336405
H 5.598514 -0.722584 -1.286442
H 5.741454 0.814444 -0.388467
H 2.974568 -2.296364 0.960968
H 3.708864 -2.409398 -0.669410
H 4.724731 -2.589548 0.787786
H 0.907334 1.685225 -1.288746
H 0.725446 0.082955 -2.033687
H 3.217534 2.088937 0.330649
H -1.069436 -1.572097 -1.026049
H -0.922854 2.684509 -0.082166
H -3.292234 2.607349 0.791993
H -5.407432 -1.797770 1.224409
H -5.720333 -1.213100 -0.493461


