%chk=000071902.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071902

0 1
 O  -0.2036000       1.789400       1.550800    
 O  -0.8485000      -1.733800     -0.3918000    
 O   -3.053900       2.193400       1.447500    
 C    1.320800      0.3941000      0.3883000    
 C   0.3838000     -0.4553000       1.284800    
 C    2.672900     -0.3654000      0.2925000    
 C  -1.0500000E-02  -1.826900      0.7702000    
 C    3.782900      0.3896000     -0.5263000    
 C   0.8495000      0.7455000      -1.056200    
 C    2.379200      -1.788400     -0.2953000    
 C  -0.7755000      0.4659000       1.584200    
 C    1.209000       1.674100       1.227200    
 C    1.288700      -2.591600      0.4320000    
 C    3.245800      0.8149000      -1.911200    
 C    1.898800       1.526300      -1.854900    
 C  -0.7704000      -2.655500       1.829600    
 C   -1.890800      0.2675000      0.5904000    
 C    4.295100       1.627300      0.2445000    
 C    5.026000     -0.5064000     -0.7467000    
 C   -1.871400     -0.8113000     -0.3152000    
 C   -2.976400       1.153000      0.5689000    
 C   -2.900800     -0.9685000      -1.246300    
 C   -4.009400      0.9827000     -0.3535000    
 C   -3.969400     -7.3600002E-02  -1.262000    
 C   -5.071600     -0.2472000      -2.251500    
 H   0.9160000     -0.6103000       2.239600    
 H    3.061500     -0.5183000       1.309800    
 H  -6.0300000E-02   1.354900      -1.047000    
 H   0.6068000     -0.1564000      -1.624900    
 H    3.289800      -2.396800     -0.2545000    
 H    2.109700      -1.723000      -1.354500    
 H   -1.164000      0.2817000       2.593400    
 H    1.767900       1.607700       2.168200    
 H    1.495900       2.595500      0.7193000    
 H    1.052600      -3.476500     -0.1726000    
 H    1.740500      -2.957900       1.364300    
 H    3.139300     -6.6699997E-02  -2.556300    
 H    3.972200       1.465000      -2.415700    
 H    1.530200       1.672100      -2.877700    
 H    2.024100       2.531200      -1.438400    
 H   -1.016200      -3.648000       1.433600    
 H  -0.1781000      -2.784900       2.741700    
 H   -1.723100      -2.196400       2.112400    
 H    4.592100       1.359600       1.264700    
 H    5.173300       2.061600     -0.2484000    
 H    3.561000       2.429500      0.3069000    
 H    5.845300      5.8800001E-02  -1.206700    
 H    5.393200     -0.9099000      0.2035000    
 H    4.817300      -1.345800      -1.417900    
 H   -2.866200      -1.792100      -1.955700    
 H   -4.843500       1.680400     -0.3611000    
 H   -2.266300       2.218700       2.013900    
 H   -4.840200      0.2996000      -3.171000    
 H   -5.217800      -1.304100      -2.499000    
 H   -6.022700      0.1223000      -1.853300    


%chk=000071902-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071902

0 1
O -0.228226 1.759301 1.703568
O -0.855207 -1.827775 -0.367241
O -2.867248 2.348745 1.290203
C 1.311894 0.388246 0.419944
C 0.395992 -0.511923 1.338953
C 2.679015 -0.369338 0.289621
C 0.035748 -1.914593 0.839943
C 3.779990 0.405447 -0.531962
C 0.787424 0.743036 -1.010313
C 2.378237 -1.778354 -0.330441
C -0.808847 0.364789 1.656278
C 1.212991 1.682130 1.280620
C 1.332558 -2.637713 0.422707
C 3.198994 0.838507 -1.912789
C 1.836119 1.558535 -1.808174
C -0.732289 -2.735145 1.900765
C -1.880647 0.225111 0.596698
C 4.277741 1.646276 0.262760
C 5.027004 -0.491756 -0.768933
C -1.897672 -0.870923 -0.305846
C -2.906674 1.200104 0.487115
C -2.949539 -1.029773 -1.233069
C -3.968300 1.046774 -0.428148
C -3.996302 -0.076136 -1.292192
C -5.116818 -0.231265 -2.307296
H 0.977695 -0.659346 2.273028
H 3.087184 -0.529678 1.314692
H -0.142364 1.332467 -0.931156
H 0.527889 -0.172190 -1.567609
H 3.314771 -2.363081 -0.362972
H 2.051984 -1.656727 -1.378699
H -1.227726 0.193591 2.666049
H 1.848956 1.638334 2.187818
H 1.406032 2.617417 0.734165
H 1.061782 -3.518700 -0.189803
H 1.789427 -3.026433 1.355150
H 3.081569 -0.058865 -2.553475
H 3.935049 1.490496 -2.424994
H 1.440194 1.747833 -2.824671
H 1.973474 2.557892 -1.348840
H -0.891339 -3.763238 1.531171
H -0.167694 -2.787532 2.849672
H -1.721613 -2.291185 2.108168
H 4.690398 1.343126 1.244204
H 5.085641 2.154949 -0.296579
H 3.489653 2.394019 0.445483
H 5.843327 0.107422 -1.214604
H 5.403735 -0.917736 0.181342
H 4.819281 -1.326279 -1.461218
H -2.936726 -1.895194 -1.902986
H -4.745458 1.816153 -0.470639
H -1.923329 2.495965 1.599632
H -4.861795 0.273234 -3.259595
H -5.308331 -1.293662 -2.538826
H -6.057002 0.215943 -1.940082


