%chk=000158139.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158139

0 1
 O   0.4905000      0.9852000      0.1990000    
 O    2.307800       2.411400      9.0800002E-02
 C    3.071000     -0.7517000     -0.7068000    
 C    4.060600      0.1344000     -3.0700000E-02
 C    2.649200      0.1068000      0.4494000    
 C    3.105600      -2.227600     -0.4869000    
 C    2.655700     -0.3655000      -2.086700    
 C    5.096700     -0.4550000      0.8385000    
 C    1.814000       1.301100      0.2265000    
 C    6.302100     -0.9337000      0.4755000    
 C    6.805600     -0.9433000     -0.9401000    
 C    7.250200      -1.506200       1.492200    
 C  -0.3992000       2.086100     -1.2700000E-02
 C   -1.811900       1.580400     -1.7300000E-02
 C   -2.393100       1.173200      -1.212600    
 C   -2.526400       1.523900       1.173900    
 C   -4.429800      0.6439000     -2.5699999E-02
 C   -3.706500      0.7035000      -1.217000    
 C   -3.839800       1.054100       1.169800    
 C   -5.833500      0.1409000     -3.0300001E-02
 C   -5.908400      -1.377800      0.1891000    
 C   -7.348600      -1.887700      0.1424000    
 C   -7.411800      -3.396500      0.3196000    
 H    4.400900       1.017600     -0.5623000    
 H    2.442100     -0.3973000       1.389600    
 H    3.887400      -2.690600      -1.098800    
 H    3.288000      -2.504400      0.5572000    
 H    2.147600      -2.677300     -0.7714000    
 H    1.616400     -0.6584000      -2.271500    
 H    3.284400     -0.8690000      -2.829500    
 H    2.736900      0.7103000      -2.276400    
 H    4.845300     -0.4881000       1.897800    
 H    6.089500     -0.5190000      -1.649800    
 H    7.015500      -1.969800      -1.258300    
 H    7.729800     -0.3611000      -1.016000    
 H    7.475600      -2.550800       1.253700    
 H    8.187400     -0.9403000       1.497400    
 H    6.839500      -1.478500       2.506900    
 H  -0.2647000       2.829300      0.7833000    
 H  -0.1667000       2.570900     -0.9692000    
 H   -1.837600       1.212800      -2.145600    
 H   -2.075500       1.838600       2.111000    
 H   -4.154100      0.3843000      -2.154600    
 H   -4.391900       1.010300       2.104800    
 H   -6.315500      0.4027000     -0.9813000    
 H   -6.415400      0.6563000      0.7450000    
 H   -5.315500      -1.890400     -0.5794000    
 H   -5.458700      -1.635300       1.156500    
 H   -7.938800      -1.405800      0.9303000    
 H   -7.807100      -1.620100     -0.8167000    
 H   -8.450800      -3.738900      0.2845000    
 H   -6.858500      -3.908500     -0.4741000    
 H   -6.987500      -3.696200       1.283100    


%chk=000158139-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158139

0 1
O 0.568420 0.463422 -2.846520
O 1.504670 1.874864 -1.230294
C 4.130830 0.132604 -1.789830
C 3.420806 -0.403107 -0.536123
C 2.611204 -0.220576 -1.869152
C 5.062183 -0.782995 -2.584987
C 4.569443 1.595717 -1.788544
C 3.642301 -1.760795 0.023422
C 1.554232 0.816065 -1.912399
C 3.484858 -2.144551 1.326154
C 3.031322 -1.229710 2.449800
C 3.764051 -3.577460 1.749610
C -0.585977 1.425734 -2.995464
C -1.724944 1.095450 -2.057897
C -2.771429 0.231908 -2.467094
C -1.778018 1.659784 -0.756644
C -3.905259 0.500996 -0.297303
C -3.844707 -0.061499 -1.598260
C -2.852420 1.363942 0.107263
C -5.048131 0.169879 0.649915
C -4.694281 -0.957255 1.660955
C -5.859785 -1.277042 2.623444
C -5.514506 -2.389414 3.636893
H 3.179031 0.382366 0.189418
H 2.365464 -1.127758 -2.427835
H 6.061018 -0.822102 -2.110345
H 4.683776 -1.817031 -2.661916
H 5.188086 -0.396315 -3.613323
H 4.656452 1.980112 -2.822894
H 5.562334 1.686744 -1.308757
H 3.856368 2.237252 -1.245434
H 3.966921 -2.530217 -0.692617
H 2.813109 -0.202463 2.117609
H 3.801830 -1.175472 3.244742
H 2.114659 -1.630448 2.926560
H 4.550738 -3.616299 2.529830
H 2.860225 -4.044400 2.190038
H 4.092880 -4.201970 0.900783
H -0.197913 2.443920 -2.820398
H -0.873261 1.294565 -4.050822
H -2.746009 -0.208260 -3.471810
H -0.967858 2.322441 -0.432280
H -4.651402 -0.724877 -1.934262
H -2.884207 1.816434 1.106461
H -5.939993 -0.141841 0.071287
H -5.338666 1.073379 1.222841
H -4.407951 -1.871708 1.103281
H -3.800843 -0.656763 2.245041
H -6.145744 -0.353749 3.168191
H -6.749478 -1.576222 2.032053
H -6.364121 -2.599431 4.312497
H -5.253695 -3.331511 3.118794
H -4.648614 -2.101138 4.262422


