%chk=000051576.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051576

0 1
 O   0.9942000      0.3926000     -0.7981000    
 O  -1.5400000E-02  -2.575600      0.7425000    
 O    3.111600       1.890900     -0.6014000    
 O    4.114400      0.5742000      0.9769000    
 C  -5.5199999E-02 -0.6023000     -0.6980000    
 C   -1.373700      9.9999998E-03 -0.2471000    
 C   0.5144000      -1.553100      0.3338000    
 C  -0.1520000      -1.286200      -2.064200    
 C    1.818600      -1.099800      0.7997000    
 C    1.983500      8.2000000E-03  8.8299997E-02
 C   -2.465800     -0.8121000      3.3399999E-02
 C   -1.491800       1.393900     -0.1142000    
 C   -3.674300     -0.2510000      0.4461000    
 C   -2.700300       1.955000      0.2987000    
 C   -3.791500       1.132500      0.5788000    
 C    3.183200      0.8229000      0.2249000    
 H  -0.8660000      -2.116700      -2.060100    
 H  -0.4616000     -0.5713000      -2.835400    
 H   0.8206000      -1.685100      -2.376100    
 H    2.449800      -1.571200       1.529700    
 H   -2.402300      -1.891000     -7.3899999E-02
 H  -0.6650000       2.064400     -0.3284000    
 H   -4.524900     -0.8911000      0.6615000    
 H   -2.792500       3.032400      0.4007000    
 H   -4.732800       1.569500      0.8992000    
 H    3.906300       2.462200     -0.5338000    


%chk=000051576-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051576

0 1
O 1.028790 0.392874 -0.778465
O -0.059733 -2.815349 0.562040
O 3.123869 2.041034 -0.462958
O 4.166069 0.602372 1.046130
C -0.059741 -0.666820 -0.727757
C -1.352000 -0.005458 -0.236783
C 0.505280 -1.722699 0.283062
C -0.185818 -1.259957 -2.141910
C 1.782807 -1.191438 0.764288
C 2.012376 0.002246 0.117385
C -2.427826 -0.823627 0.193245
C -1.506364 1.402406 -0.260632
C -3.645631 -0.233716 0.596038
C -2.727572 1.985705 0.146389
C -3.800928 1.171791 0.573359
C 3.204418 0.877471 0.293471
H -0.923880 -2.079878 -2.116000
H -0.530622 -0.488007 -2.849159
H 0.780133 -1.666540 -2.487832
H 2.442791 -1.661695 1.489605
H -2.303349 -1.911290 0.231029
H -0.674717 2.031126 -0.591135
H -4.470350 -0.871942 0.931710
H -2.839017 3.075581 0.128324
H -4.746745 1.626846 0.887644
H 3.939260 2.591165 -0.307589


