%chk=000100986.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100986

0 1
 O   0.7488000      0.6814000     -0.9151000    
 O   0.6990000       2.827800     -7.3100001E-02
 C   -5.205600     -0.9934000      0.1834000    
 C   -3.759700     -0.6150000      0.6154000    
 C   -2.985900      0.3375000     -0.3314000    
 C    4.720500      -1.227700     -0.2334000    
 C    4.381400     -0.2192000      0.9033000    
 C    2.926700      0.3153000      0.9651000    
 C   -1.467200      0.2974000     -6.9300003E-02
 C   -6.165900      8.2599998E-02  0.7308000    
 C   -5.331600      -1.012400      -1.350500    
 C   -5.635700      -2.356200      0.7463000    
 C    2.742400       1.509300      4.9000001E-03
 C   -3.477800       1.781000     -0.1566000    
 C    6.179200      -1.691500     -3.7000000E-02
 C    3.811200      -2.467000     -0.1551000    
 C    4.598100     -0.6034000      -1.629900    
 C  -0.6379000      0.7818000      -1.254600    
 C    2.569000      0.7838000       2.382400    
 C    1.291300       1.787700     -0.3256000    
 H   -3.744600     -0.2330000       1.644400    
 H   -3.189400      -1.553900      0.6508000    
 H   -3.114800      3.6699999E-02  -1.374700    
 H    4.594000     -0.7215000       1.857800    
 H    5.075400      0.6314000      0.8579000    
 H    2.226900     -0.4876000      0.7178000    
 H   -1.217900      0.8698000      0.8334000    
 H   -1.153300     -0.7319000      0.1492000    
 H   -6.056400      0.1970000       1.815200    
 H   -6.030100       1.062500      0.2735000    
 H   -7.208300     -0.2020000      0.5413000    
 H   -4.590800      -1.681900      -1.801700    
 H   -6.319900      -1.385200      -1.647300    
 H   -5.237100     -1.9500000E-02  -1.800800    
 H   -6.670400      -2.595400      0.4764000    
 H   -4.997400      -3.158700      0.3604000    
 H   -5.563100      -2.368800       1.839600    
 H    3.161700       2.420200      0.4515000    
 H    3.255000       1.397400     -0.9490000    
 H   -2.782000       2.502900     -0.5957000    
 H   -4.428800       1.940300     -0.6687000    
 H   -3.596200       2.043500      0.8999000    
 H    6.872300     -0.8445000     -9.3199998E-02
 H    6.315300      -2.171300      0.9388000    
 H    6.475800      -2.414900     -0.8051000    
 H    2.774700      -2.235800     -0.4197000    
 H    3.816500      -2.899300      0.8516000    
 H    4.148700      -3.244800     -0.8503000    
 H    3.554000     -0.4416000      -1.914300    
 H    5.142800      0.3445000      -1.694700    
 H    5.020200      -1.270500      -2.391400    
 H  -0.8021000      0.1291000      -2.118900    
 H  -0.8966000       1.797700      -1.570600    
 H    3.240700       1.579800       2.721300    
 H    1.541400       1.159000       2.429500    
 H    2.648600     -4.6900000E-02   3.092000    


%chk=000100986-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100986

0 1
O 0.720061 0.938443 -1.046860
O 0.726225 2.892013 0.232937
C -5.320444 -0.937816 0.186949
C -3.793079 -0.627822 0.366561
C -3.105284 0.452268 -0.520126
C 4.935973 -1.290599 -0.140010
C 4.475932 -0.191773 0.875387
C 2.975707 0.232825 0.832467
C -1.572785 0.411114 -0.240211
C -6.220688 0.078382 0.943692
C -5.715098 -0.978253 -1.312778
C -5.575918 -2.343445 0.804757
C 2.792802 1.541836 -0.001817
C -3.659508 1.884730 -0.318618
C 6.472109 -1.464963 0.010313
C 4.246747 -2.643605 0.186018
C 4.616095 -0.891257 -1.605175
C -0.738709 1.123102 -1.315003
C 2.405388 0.420448 2.258946
C 1.335189 1.898553 -0.228250
H -3.613769 -0.373894 1.433671
H -3.249164 -1.579068 0.183342
H -3.259182 0.165780 -1.583028
H 4.708081 -0.569806 1.892294
H 5.112092 0.707663 0.733852
H 2.387500 -0.558327 0.328683
H -1.365006 0.873944 0.744712
H -1.236157 -0.642962 -0.186767
H -5.959478 0.107551 2.018796
H -6.128053 1.102513 0.546122
H -7.284245 -0.218092 0.863224
H -5.075359 -1.685311 -1.875153
H -6.764969 -1.308935 -1.426792
H -5.625699 0.015108 -1.789544
H -6.652104 -2.598629 0.775103
H -5.023360 -3.127599 0.252990
H -5.248399 -2.376443 1.861637
H 3.267639 2.388740 0.524364
H 3.280374 1.420363 -0.985021
H -3.045237 2.634637 -0.849386
H -4.691379 1.983539 -0.696599
H -3.661581 2.155216 0.754282
H 7.004963 -0.527060 -0.237058
H 6.741363 -1.746450 1.046359
H 6.847070 -2.257263 -0.664965
H 3.146714 -2.576550 0.095932
H 4.485779 -2.971159 1.215845
H 4.589987 -3.432562 -0.509740
H 3.528516 -0.786473 -1.774417
H 5.102949 0.066050 -1.873809
H 4.989395 -1.664258 -2.303627
H -0.884989 0.667423 -2.308962
H -0.949818 2.205718 -1.353249
H 2.976911 1.188921 2.814017
H 1.347247 0.740945 2.241022
H 2.465756 -0.524850 2.828891


