%chk=000029925.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029925

0 1
 O   -3.683200      -3.264400      0.1905000    
 C   -1.888000       1.213600      -1.012200    
 C   -1.556700       2.649100     -0.5851000    
 C   -2.476100      0.3131000      7.8699999E-02
 C  -0.4828000       2.780500      0.4999000    
 C   -2.803100      -1.100800     -0.4114000    
 C    2.855600      0.7540000      0.3204000    
 C    2.797400     -0.7625000      0.1261000    
 C   0.8501000       2.238800      7.1999997E-02
 C   -3.416200      -1.961200      0.6879000    
 C    1.523500       1.296400      0.7481000    
 C    4.161400      -1.322600     -0.2777000    
 C    4.118200      -2.833900     -0.4370000    
 H  -0.9914000      0.7379000      -1.427600    
 H   -2.609100       1.269100      -1.838000    
 H   -2.474600       3.131500     -0.2267000    
 H   -1.240500       3.210400      -1.474000    
 H   -3.386800      0.7799000      0.4736000    
 H   -1.769800      0.2377000      0.9133000    
 H  -0.8257000       2.305100       1.425900    
 H  -0.3544000       3.845100      0.7317000    
 H   -3.494300      -1.054900      -1.262100    
 H   -1.893700      -1.583800     -0.7902000    
 H    3.193800       1.232400     -0.6067000    
 H    3.592700      0.9993000       1.094300    
 H    2.055900      -1.010200     -0.6443000    
 H    2.465900      -1.243500       1.055300    
 H    1.278800       2.653300     -0.8371000    
 H   -4.360400      -1.531400       1.036500    
 H   -2.742000      -2.049300       1.546000    
 H    1.100200      0.8929000       1.664700    
 H    4.909800      -1.063800      0.4802000    
 H    4.485300     -0.8693000      -1.221900    
 H    3.400100      -3.126400      -1.209800    
 H    3.830500      -3.319400      0.5010000    
 H    5.103000      -3.212900     -0.7274000    
 H   -2.837700      -3.645800     -0.1014000    


%chk=000029925-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029925

0 1
O -3.931980 -3.278167 0.244135
C -1.929222 1.215648 -1.038906
C -1.609296 2.667277 -0.608219
C -2.513103 0.334768 0.089477
C -0.517948 2.790762 0.494336
C -2.938317 -1.066475 -0.407341
C 2.897092 0.760751 0.315027
C 2.897974 -0.777079 0.101206
C 0.830144 2.245415 0.067767
C -3.483713 -1.957858 0.722067
C 1.545375 1.300634 0.733657
C 4.299128 -1.337582 -0.232592
C 4.300649 -2.867284 -0.442332
H -1.006993 0.739125 -1.428858
H -2.650920 1.243808 -1.881161
H -2.537312 3.155921 -0.246646
H -1.278938 3.241422 -1.498325
H -3.389315 0.846559 0.540261
H -1.763938 0.221899 0.899369
H -0.849796 2.282230 1.419925
H -0.413416 3.866728 0.748834
H -3.715185 -0.971611 -1.191289
H -2.065033 -1.565418 -0.880805
H 3.232725 1.264614 -0.613077
H 3.651018 1.000508 1.095768
H 2.190174 -1.032012 -0.713365
H 2.513967 -1.274079 1.016584
H 1.247708 2.667257 -0.862104
H -4.388988 -1.511237 1.168050
H -2.720791 -2.068927 1.524275
H 1.124781 0.876376 1.661172
H 4.999624 -1.074208 0.586345
H 4.684904 -0.836664 -1.143915
H 3.632203 -3.154267 -1.276026
H 3.947220 -3.391584 0.465792
H 5.313441 -3.243616 -0.676758
H -3.168224 -3.729634 -0.196827


