%chk=000072740.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072740

0 1
 O    4.685700       1.202900     -8.5100003E-02
 O   -4.923800      -1.011800     -0.2088000    
 C   -1.269900       2.179200      0.5830000    
 C  -6.0999999E-03   2.582600     -0.1766000    
 C   -1.755000      0.8134000      0.1599000    
 C   0.6330000      0.1362000     -0.1481000    
 C    1.037400       1.492300     -0.1282000    
 C  -0.8147000     -0.1878000     -0.1811000    
 C    1.639900     -0.8450000     -0.1203000    
 C   -3.129900      0.5346000      0.1641000    
 C    2.397800       1.835200     -0.1216000    
 C    2.993500     -0.4956000     -9.7800002E-02
 C   -1.311500      -1.450100     -0.5517000    
 C    3.372000      0.8423000     -0.1030000    
 C   -3.591700     -0.7267000     -0.1986000    
 C   -2.684100      -1.715900     -0.5605000    
 C   -4.130700       1.572900      0.5672000    
 C    1.404400      -2.279800      4.8099998E-02
 C    4.075700      -1.534600     -5.6100000E-02
 C    1.378000      -2.944500       1.215300    
 H   -2.015000       2.959800      0.4007000    
 H   -1.071800       2.153100       1.662200    
 H   0.3854000       3.510500      0.2567000    
 H  -0.2427000       2.782500      -1.229500    
 H    2.687500       2.883600     -0.1283000    
 H  -0.6992000      -2.250000     -0.9405000    
 H   -3.029600      -2.699000     -0.8706000    
 H   -4.202300       2.347200     -0.2037000    
 H   -5.136400       1.167800      0.7170000    
 H   -3.849100       2.032300       1.521000    
 H    1.337800      -2.852800     -0.8747000    
 H    4.182700      -1.934700      0.9575000    
 H    3.876500      -2.353400     -0.7560000    
 H    5.051400      -1.137300     -0.3557000    
 H    4.750200       2.173400     -9.0700001E-02
 H   -5.049700      -1.935500     -0.4860000    
 H    1.242900      -4.020400       1.230300    
 H    1.486800      -2.429700       2.163900    


%chk=000072740-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072740

0 1
O 4.780553 1.222880 -0.501044
O -4.942323 -0.983976 -0.336631
C -1.173773 2.076547 0.790395
C -0.039731 2.531513 -0.157894
C -1.717243 0.741413 0.299803
C 0.695903 0.102415 -0.099377
C 1.058092 1.480561 -0.196418
C -0.763806 -0.216824 -0.174270
C 1.746286 -0.876407 0.001760
C -3.114309 0.483234 0.259496
C 2.408364 1.859706 -0.313109
C 3.115725 -0.495561 -0.161545
C -1.250581 -1.404508 -0.777934
C 3.420032 0.876749 -0.341509
C -3.549422 -0.743185 -0.307928
C -2.628833 -1.671841 -0.846121
C -4.137543 1.472224 0.792080
C 1.512738 -2.304457 0.366380
C 4.248581 -1.504653 -0.079135
C 0.711435 -2.750428 1.370724
H -1.969157 2.839519 0.829180
H -0.766386 1.977140 1.818344
H 0.375456 3.502538 0.169558
H -0.464086 2.683357 -1.172576
H 2.666512 2.924919 -0.391050
H -0.546752 -2.126322 -1.197640
H -2.986403 -2.595927 -1.319448
H -4.167333 2.395843 0.181777
H -5.143906 1.027913 0.775232
H -3.907925 1.772752 1.830779
H 2.115227 -3.045796 -0.178616
H 4.212612 -2.071891 0.868734
H 4.198627 -2.242438 -0.903490
H 5.220525 -0.993834 -0.144142
H 4.875452 2.201594 -0.606367
H -5.128977 -1.862318 -0.750956
H 0.637036 -3.818829 1.602682
H 0.104729 -2.066422 1.973976


