%chk=000039129.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039129

0 1
 O    3.367000      0.1013000      0.4870000    
 O   -3.195700       1.845800     -9.2399999E-02
 O    1.845900      0.2479000      -1.240900    
 C  -0.3021000     -0.3064000      0.5245000    
 C    1.096900     -0.2020000       1.029700    
 C   -1.104300      0.8325000      0.4522000    
 C  -0.8085000      -1.542800      0.1236000    
 C   -2.412900      0.7348000     -2.1100000E-02
 C   -2.116900      -1.640500     -0.3496000    
 C   -2.919100     -0.5017000     -0.4220000    
 C    2.114700      7.5099997E-02 -5.9799999E-02
 C    4.435100      0.3559000     -0.4312000    
 H    1.164800      0.6009000       1.773900    
 H    1.377700      -1.135200       1.533200    
 H  -0.7153000       1.799700      0.7610000    
 H  -0.1931000      -2.437200      0.1729000    
 H   -2.510800      -2.603100     -0.6623000    
 H   -3.936600     -0.5912000     -0.7928000    
 H   -4.068000       1.594800     -0.4418000    
 H    4.475500     -0.4295000      -1.192000    
 H    5.373700      0.3502000      0.1292000    
 H    4.309100       1.338600     -0.8955000    


%chk=000039129-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000039129

0 1
O 2.940991 0.653395 0.181939
O -3.140019 1.954730 0.234623
O 2.572384 -1.621166 -0.156025
C -0.254776 -0.330203 0.635131
C 1.092859 -0.336928 1.361659
C -1.100774 0.795659 0.735389
C -0.667971 -1.455171 -0.127743
C -2.355530 0.796144 0.083359
C -1.921054 -1.441785 -0.775155
C -2.776842 -0.320769 -0.675135
C 2.254864 -0.543264 0.396995
C 4.068793 0.581090 -0.781240
H 1.241264 0.606421 1.909278
H 1.121141 -1.173988 2.083659
H -0.807581 1.679687 1.310654
H -0.004567 -2.321492 -0.219134
H -2.239939 -2.309472 -1.363041
H -3.751980 -0.318467 -1.179575
H -3.995411 1.866168 -0.254324
H 4.812627 -0.160084 -0.444015
H 4.492123 1.594925 -0.793046
H 3.696499 0.292471 -1.778453


