%chk=000106455.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106455

0 1
 O   -1.590100     -0.5817000     -0.2282000    
 O   -2.548000      0.9645000       1.224900    
 C    2.129700     -6.4300001E-02  0.1025000    
 C    2.764500       1.105700     -0.6627000    
 C    3.036200      -1.302500      5.4000001E-02
 C    4.173500       1.412000     -0.1587000    
 C    4.444800     -0.9913000      0.5560000    
 C    5.067200      0.1769000     -0.2019000    
 C   0.7674000     -0.3788000     -0.4391000    
 C  -0.3549000     -0.2911000      0.2804000    
 C   -2.621000      0.1266000      0.3390000    
 C   -3.875100     -0.2981000     -0.3249000    
 C   -5.043200      0.2472000      3.8300000E-02
 C   -6.351100     -0.1251000     -0.5796000    
 H    2.038100      0.2388000       1.155400    
 H    2.143200       2.004200     -0.5605000    
 H    2.810200      0.8751000      -1.735400    
 H    3.098600      -1.684800     -0.9736000    
 H    2.607300      -2.107700      0.6635000    
 H    4.119100       1.788100      0.8702000    
 H    4.616700       2.208800     -0.7666000    
 H    5.078100      -1.879100      0.4490000    
 H    4.406300     -0.7536000       1.626200    
 H    5.237300     -0.1144000      -1.245700    
 H    6.047000      0.4150000      0.2271000    
 H   0.6994000     -0.6814000      -1.481700    
 H  -0.3494000     -1.6000001E-02   1.326100    
 H   -3.820200      -1.052700      -1.102200    
 H   -5.082500       1.002200      0.8189000    
 H   -6.241200     -0.8886000      -1.356300    
 H   -6.813900      0.7573000      -1.031800    
 H   -7.028000     -0.5138000      0.1873000    


%chk=000106455-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000106455

0 1
O -1.606927 -0.152030 -0.353522
O -2.717800 0.593403 1.580687
C 2.183194 0.064361 0.087062
C 2.945759 1.125244 -0.761244
C 2.993629 -1.265464 0.127557
C 4.386375 1.346196 -0.242418
C 4.434838 -1.044146 0.645274
C 5.180634 0.019317 -0.195126
C 0.789502 -0.163133 -0.456028
C -0.339142 0.091451 0.244602
C -2.769372 0.137962 0.413008
C -3.969420 -0.181155 -0.382915
C -5.220375 0.010706 0.124424
C -6.503982 -0.282329 -0.602162
H 2.106585 0.449365 1.126561
H 2.381894 2.077532 -0.756547
H 2.984108 0.779927 -1.816008
H 3.032515 -1.691277 -0.897239
H 2.463345 -2.002315 0.760606
H 4.344171 1.781347 0.777648
H 4.908084 2.083869 -0.882709
H 4.989938 -2.002259 0.633875
H 4.395239 -0.710112 1.702980
H 5.316103 -0.361816 -1.228736
H 6.193048 0.193459 0.218143
H 0.704334 -0.554929 -1.480112
H -0.380414 0.481463 1.267727
H -3.802216 -0.575346 -1.390351
H -5.295764 0.411580 1.146539
H -6.327242 -0.681274 -1.615174
H -7.121445 0.633225 -0.688541
H -7.113197 -1.015423 -0.037959


