%chk=000006128.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006128

0 1
 O   -4.944100      -1.069400     -0.8762000    
 O    5.558200      0.1496000      -1.038800    
 C  -0.6332000      0.7753000      0.3577000    
 C   0.1972000     -0.4487000     -0.1473000    
 C   -2.021800      0.7137000     -0.2841000    
 C   -2.777600     -0.5708000      0.1120000    
 C    1.667700     -0.4669000      0.4229000    
 C  -0.5680000      -1.790400      3.6300000E-02
 C   -2.019800      -1.755900     -0.4762000    
 C   9.2600003E-02   2.081000      1.3000000E-02
 C   -3.027400       1.831600     -3.0800000E-02
 C    2.312400      0.9105000      0.2197000    
 C   -4.117800     -0.2402000     -0.5195000    
 C    1.488800       2.111400      0.6219000    
 C   -4.324500       1.261500     -0.6239000    
 C    2.476900      -1.551400     -0.3464000    
 C   -3.037100     -0.7623000       1.617700    
 C    1.698400     -0.7957000       1.932700    
 C    3.982200      -1.428700     -0.1692000    
 C    3.552200       1.095200     -0.2640000    
 C    4.444700     -4.9500000E-02 -0.5574000    
 H  -0.7373000      0.7299000       1.447300    
 H   0.2905000     -0.3155000      -1.237800    
 H   -1.863700      0.7045000      -1.376800    
 H  -0.5768000      -2.076800       1.092900    
 H  -4.7200002E-02  -2.593700     -0.4964000    
 H   -2.015400      -1.698100      -1.572500    
 H   -2.521100      -2.699300     -0.2274000    
 H  -0.4739000       2.939400      0.3921000    
 H   0.1611000       2.200100      -1.076100    
 H   -2.750100       2.768200     -0.5245000    
 H   -3.140800       2.039200       1.038600    
 H    1.411000       2.138200       1.715800    
 H    1.979000       3.047400      0.3268000    
 H   -4.426700       1.531300      -1.679000    
 H   -5.200600       1.577800     -5.3800002E-02
 H    2.255500      -1.479300      -1.420600    
 H    2.171600      -2.557300     -3.3900000E-02
 H   -3.637400      4.8200000E-02   2.044700    
 H   -3.601700      -1.686900       1.789500    
 H   -2.116300     -0.8305000       2.202700    
 H    1.031900     -0.1493000       2.512000    
 H    1.401100      -1.831600       2.126300    
 H    2.703900     -0.6701000       2.351400    
 H    4.480300      -2.157800     -0.8178000    
 H    4.288700      -1.625700      0.8627000    
 H    3.970300       2.086200     -0.4056000    


%chk=000006128-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006128

0 1
O -5.001047 -1.144576 -0.953910
O 5.683718 0.108641 -1.038649
C -0.632614 0.800146 0.375652
C 0.196477 -0.425555 -0.137726
C -2.032991 0.735608 -0.266984
C -2.793295 -0.580302 0.068795
C 1.678822 -0.464519 0.426413
C -0.556177 -1.777796 0.050885
C -2.006082 -1.773086 -0.508725
C 0.094090 2.116847 0.027839
C -3.074950 1.856882 -0.007077
C 2.333674 0.911579 0.202819
C -4.175782 -0.291845 -0.549248
C 1.529911 2.134449 0.604356
C -4.385529 1.240502 -0.575978
C 2.475689 -1.561826 -0.347329
C -3.071359 -0.779248 1.593730
C 1.708142 -0.769036 1.959265
C 4.005778 -1.460336 -0.183882
C 3.607397 1.054116 -0.288893
C 4.521111 -0.073402 -0.562174
H -0.736131 0.744402 1.480032
H 0.301276 -0.267516 -1.236913
H -1.867265 0.717854 -1.370675
H -0.587268 -2.043727 1.124456
H 0.005650 -2.586422 -0.451507
H -1.980313 -1.691439 -1.614014
H -2.507624 -2.729833 -0.271555
H -0.469731 2.983310 0.422813
H 0.136163 2.231257 -1.074989
H -2.812457 2.805376 -0.506023
H -3.169859 2.068942 1.074428
H 1.455765 2.163741 1.712904
H 2.063611 3.053136 0.300383
H -4.552039 1.539813 -1.629202
H -5.302599 1.515660 -0.024851
H 2.230610 -1.477406 -1.425720
H 2.141938 -2.563324 -0.019457
H -3.628178 0.066734 2.035099
H -3.677820 -1.691560 1.735388
H -2.135596 -0.897290 2.165648
H 1.094898 -0.054356 2.535803
H 1.330686 -1.785968 2.166408
H 2.739574 -0.708997 2.349355
H 4.529860 -2.213516 -0.798154
H 4.299502 -1.651997 0.868567
H 4.028262 2.054280 -0.456700


