%chk=000108581.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108581

0 1
 O    5.630400     -0.1869000      0.2800000    
 O    6.753400       1.693400     -0.4551000    
 C   0.7251000     -0.9754000      4.7699999E-02
 C    1.889800     -1.6700000E-02 -0.2218000    
 C  -0.6357000     -0.4117000     -0.3755000    
 C    3.253400     -0.5868000      0.1819000    
 C   -1.793500      -1.380100     -0.1084000    
 C    4.392800      0.3778000     -0.1281000    
 C   -3.119300     -0.8581000     -0.5842000    
 C   -4.169400     -0.6518000      0.2248000    
 C   -5.442000     -0.1528000     -0.2440000    
 C    6.739600      0.5821000      5.6800000E-02
 C   -6.491800      5.3399999E-02  0.5652000    
 C   -7.819800      0.5657000      8.9199997E-02
 C    7.964700     -0.1367000      0.5352000    
 C   -7.877700       2.084600      0.1363000    
 H   0.6987000      -1.216500       1.117400    
 H   0.9052000      -1.917100     -0.4855000    
 H    1.906700      0.2327000      -1.290100    
 H    1.715700      0.9211000      0.3200000    
 H  -0.6037000     -0.1666000      -1.444800    
 H  -0.8186000      0.5296000      0.1582000    
 H    3.258900     -0.8244000       1.252900    
 H    3.433100      -1.536800     -0.3365000    
 H   -1.598500      -2.328100     -0.6248000    
 H   -1.830200      -1.610600      0.9635000    
 H    4.423600      0.5799000      -1.205400    
 H    4.232800       1.322500      0.4053000    
 H   -3.205900     -0.6542000      -1.649300    
 H   -4.076700     -0.8621000       1.287300    
 H   -5.538600      5.3700000E-02  -1.307000    
 H   -6.402800     -0.1398000       1.631900    
 H   -8.612400      0.1403000      0.7151000    
 H   -8.014400      0.2264000     -0.9353000    
 H    7.888300     -0.3243000       1.609200    
 H    8.845300      0.4855000      0.3517000    
 H    8.081100      -1.075100     -1.2600000E-02
 H   -8.859800       2.435000     -0.1972000    
 H   -7.714200       2.455700       1.153700    
 H   -7.120600       2.532700     -0.5161000    


%chk=000108581-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108581

0 1
O 5.738953 -0.212406 0.300311
O 6.937291 1.553126 -0.638035
C 0.788146 -0.923001 0.088328
C 1.962664 0.000898 -0.304517
C -0.581629 -0.406815 -0.405966
C 3.329743 -0.530940 0.186958
C -1.755123 -1.342171 -0.003596
C 4.474956 0.397815 -0.215152
C -3.089448 -0.888862 -0.549087
C -4.185240 -0.574976 0.206013
C -5.469859 -0.134776 -0.339007
C 6.918191 0.482964 0.011549
C -6.570768 0.162578 0.415262
C -7.904719 0.620882 -0.129264
C 8.114945 -0.242707 0.589821
C -8.335689 2.002617 0.430954
H 0.762121 -1.034249 1.192311
H 0.966679 -1.938579 -0.322814
H 1.983265 0.115550 -1.408275
H 1.785456 1.014409 0.111117
H -0.559861 -0.303548 -1.510665
H -0.770611 0.607107 -0.000463
H 3.317936 -0.639249 1.288676
H 3.514625 -1.538395 -0.233213
H -1.524507 -2.362048 -0.381466
H -1.805408 -1.417922 1.100678
H 4.560463 0.507628 -1.312299
H 4.370413 1.407900 0.222968
H -3.161706 -0.804433 -1.646100
H -4.115365 -0.657107 1.302305
H -5.537871 -0.046551 -1.434885
H -6.499827 0.076734 1.512291
H -8.687096 -0.122439 0.133191
H -7.864442 0.661202 -1.234779
H 8.008015 -0.340172 1.684035
H 9.033910 0.312720 0.354032
H 8.178112 -1.263198 0.174154
H -9.329234 2.294202 0.043343
H -8.395277 1.980673 1.535217
H -7.609205 2.785038 0.147669


