%chk=000163806.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163806

0 1
 O    3.380500       1.056900       1.002100    
 O    3.670000      -1.524500     -0.5357000    
 C   0.2905000       1.249200     -0.1002000    
 C    1.510800      0.3920000     -0.3211000    
 C  -0.9178000      0.6796000      0.5931000    
 C   0.6936000      0.8550000      -1.499400    
 C  -0.9432000     -0.8601000      0.7668000    
 C   -2.223900       1.054000     -0.1367000    
 C   -3.109800     -0.2024000     -0.1044000    
 C   -2.075100      -1.337300     -0.1504000    
 C    1.442600      -1.022700      5.3300001E-02
 C   0.5012000       2.702000      0.2249000    
 C   0.3377000      -1.611400      0.5387000    
 C    2.840500      0.9982000     -9.7599998E-02
 C   -4.049100     -0.2604000      -1.312200    
 C   -3.948100     -0.2500000       1.184000    
 C    2.599500      -1.918000     -0.1053000    
 H  -0.9567000       1.105900       1.606000    
 H    1.112800       1.608700      -2.157500    
 H   8.3800003E-02  0.1330000      -2.031700    
 H   -1.238600      -1.067900       1.804900    
 H   -2.709000       1.914500      0.3389000    
 H   -2.019000       1.347500      -1.173800    
 H   -1.704400      -1.481000      -1.174000    
 H   -2.491900      -2.294300      0.1838000    
 H   0.7571000       2.823500       1.283200    
 H    1.299100       3.165900     -0.3655000    
 H  -0.4101000       3.278100      3.0300001E-02
 H   0.3243000      -2.668900      0.7914000    
 H    3.346300       1.400100     -0.9923000    
 H   -3.491500     -0.2329000      -2.255100    
 H   -4.641500      -1.182000      -1.305200    
 H   -4.742300      0.5880000      -1.312900    
 H   -4.501600      -1.193000       1.255600    
 H   -3.334000     -0.1562000       2.085200    
 H   -4.678100      0.5672000       1.204000    
 H    2.454200      -2.971700      0.1872000    


%chk=000163806-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000163806

0 1
O 3.636381 0.798806 0.995772
O 3.626614 -1.644798 -0.877250
C 0.321158 1.289459 -0.115988
C 1.603235 0.384901 -0.280295
C -0.920127 0.691531 0.579628
C 0.765076 0.841441 -1.503406
C -0.960629 -0.866281 0.787405
C -2.241366 1.040086 -0.191481
C -3.161181 -0.218544 -0.118456
C -2.117317 -1.374499 -0.135101
C 1.487372 -1.053704 0.113720
C 0.515956 2.768637 0.236383
C 0.329099 -1.605214 0.587645
C 2.919267 1.053431 -0.001954
C -4.129128 -0.300306 -1.320658
C -3.977295 -0.227720 1.202013
C 2.620232 -1.962416 -0.188825
H -0.945984 1.159376 1.582797
H 1.207942 1.595997 -2.164592
H 0.211109 0.055370 -2.025716
H -1.284960 -1.060854 1.831542
H -2.741635 1.936666 0.217776
H -1.998729 1.253488 -1.250481
H -1.739593 -1.519775 -1.166727
H -2.539457 -2.337158 0.207968
H 0.748747 2.896466 1.309911
H 1.327980 3.240262 -0.343506
H -0.413690 3.327458 0.020618
H 0.314217 -2.684853 0.804529
H 3.213875 1.849097 -0.733360
H -3.576849 -0.308987 -2.279231
H -4.746166 -1.217637 -1.275269
H -4.817860 0.565489 -1.334278
H -4.547104 -1.170127 1.307756
H -3.332674 -0.119075 2.093580
H -4.701397 0.608354 1.213498
H 2.503684 -2.999769 0.216431


