%chk=000079521.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079521

0 1
 O  -0.7984000      0.3745000     -0.8508000    
 O   -1.793400     -0.2759000       1.126700    
 C   0.4773000     -1.6200000E-02 -0.3404000    
 C   0.7636000      0.8006000      0.9299000    
 C    1.536800      0.2556000      -1.420200    
 C    2.196400      0.6345000       1.436400    
 C    2.967700      9.0899996E-02 -0.9079000    
 C    3.217300      0.9302000      0.3415000    
 C   0.4061000      -1.455800     -2.9899999E-02
 C   -1.854700      0.1875000     -3.7000000E-03
 C   -3.119900      0.6479000     -0.6891000    
 C   0.3478000      -2.628000      0.2224000    
 C   -4.346500      0.4541000      0.1852000    
 H   0.1180000      0.5566000       1.777200    
 H   0.5817000       1.864000      0.7203000    
 H    1.408300       1.278800      -1.799000    
 H    1.377900     -0.3978000      -2.288200    
 H    2.345800     -0.3849000       1.812000    
 H    2.365700       1.309700       2.283300    
 H    3.672700      0.3858000      -1.693600    
 H    3.166600     -0.9646000     -0.6868000    
 H    3.171400       1.994500      7.9599999E-02
 H    4.228200      0.7384000      0.7185000    
 H   -3.013500       1.709600     -0.9353000    
 H   -3.240900      7.4900001E-02  -1.614400    
 H   0.2960000      -3.667600      0.4466000    
 H   -4.257800       1.020600       1.118200    
 H   -5.245300      0.7946000     -0.3380000    
 H   -4.480600     -0.6010000      0.4458000    


%chk=000079521-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079521

0 1
O -0.849440 0.365075 -0.729530
O -2.004148 -0.365825 1.180529
C 0.515042 -0.050930 -0.192506
C 0.859806 0.770059 1.080151
C 1.469732 0.331414 -1.355013
C 2.344649 0.584724 1.478845
C 2.952238 0.141327 -0.957942
C 3.299321 0.946800 0.316800
C 0.529912 -1.507681 0.048359
C -2.004444 0.123190 0.030616
C -3.233101 0.530868 -0.773244
C 0.598829 -2.727983 0.204091
C -4.501938 0.634465 0.092413
H 0.192493 0.475425 1.905811
H 0.667558 1.835679 0.843696
H 1.276232 1.393680 -1.599234
H 1.217177 -0.269112 -2.246793
H 2.512992 -0.467016 1.784120
H 2.558566 1.212400 2.364748
H 3.596220 0.454553 -1.801440
H 3.150981 -0.934472 -0.783254
H 3.215640 2.031722 0.098263
H 4.348974 0.758193 0.612684
H -3.011242 1.479768 -1.294553
H -3.366076 -0.226955 -1.571112
H 0.628734 -3.789431 0.368152
H -4.404480 1.432667 0.848843
H -5.380092 0.859174 -0.538331
H -4.685833 -0.310279 0.631131


