%chk=000016188.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016188

0 1
 O    3.369000      -2.383500     -0.6121000    
 O   -6.646200      0.3921000     -0.7061000    
 C    1.679300     -0.8730000      0.3458000    
 C    1.054000      0.4383000     -0.1846000    
 C  -0.3815000      0.6990000      0.3133000    
 C   -1.331200     -0.5041000      0.1062000    
 C   0.6875000      -2.057800      0.1811000    
 C    2.917300      -1.035600     -0.5913000    
 C    1.222600      0.3469000      -1.713600    
 C  -0.7150000      -1.773400      0.7204000    
 C   -2.756000     -0.2126000      0.6774000    
 C    2.380000     -0.6260000      -1.972300    
 C  -0.9753000       1.966000     -0.3198000    
 C    2.070900     -0.7652000       1.833500    
 C   -2.332200       2.293100      0.2905000    
 C   -3.286400       1.129900      0.1935000    
 C   -3.719100      -1.367400      0.3295000    
 C    4.052600     -0.1657000     -0.2214000    
 C   -5.175200      -1.007700      0.5675000    
 C   -4.535200       1.324800     -0.2594000    
 C   -5.535800      0.2347000     -0.2040000    
 C    4.975000      0.5412000      7.9499997E-02
 C    6.029400       1.349500      0.4230000    
 C    6.951400       2.056600      0.7233000    
 H    1.669100       1.285700      0.1534000    
 H  -0.3119000      0.8796000       1.396100    
 H   -1.437700     -0.6761000     -0.9741000    
 H    1.084500      -2.950400      0.6816000    
 H   0.5842000      -2.331700     -0.8759000    
 H    1.442400       1.334500      -2.134500    
 H   0.3220000     -2.1500001E-02  -2.214900    
 H   -1.337000      -2.646000      0.4924000    
 H  -0.6917000      -1.689200       1.812900    
 H   -2.684300     -0.1481000       1.772600    
 H    2.012900      -1.498300      -2.527500    
 H    3.145400     -0.1637000      -2.607200    
 H   -1.086000       1.841000      -1.404000    
 H  -0.2989000       2.814700     -0.1626000    
 H    2.639700      -1.646000       2.151800    
 H    2.681400      0.1207000       2.036300    
 H    1.194600     -0.6861000       2.484000    
 H   -2.736900       3.186100     -0.2011000    
 H   -2.203400       2.550300       1.349600    
 H   -3.478900      -2.253300      0.9279000    
 H   -3.592800      -1.649400     -0.7246000    
 H    4.020100      -2.472400      -1.329400    
 H   -5.374000     -0.8306000       1.629900    
 H   -5.814100      -1.830600      0.2289000    
 H   -4.878200       2.291700     -0.6109000    
 H    7.769600       2.684100      0.9898000    


%chk=000016188-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000016188

0 1
O 3.370172 -2.451888 -0.503711
O -6.830237 0.435428 -0.580012
C 1.676915 -0.866320 0.372379
C 1.053507 0.454310 -0.183665
C -0.392531 0.718904 0.313566
C -1.338753 -0.490245 0.078606
C 0.698565 -2.057370 0.142440
C 2.932449 -1.035506 -0.569291
C 1.230233 0.369239 -1.737454
C -0.720972 -1.774682 0.686341
C -2.780312 -0.223622 0.638890
C 2.400375 -0.631162 -1.988738
C -0.978977 2.006145 -0.306056
C 2.079226 -0.781490 1.859281
C -2.374289 2.315769 0.286371
C -3.323408 1.135532 0.193707
C -3.748515 -1.377109 0.263134
C 4.057337 -0.161812 -0.184734
C -5.227098 -1.040414 0.546663
C -4.619601 1.308963 -0.222295
C -5.649947 0.253145 -0.149277
C 5.038812 0.553989 0.071631
C 6.119155 1.347627 0.365708
C 7.095940 2.065031 0.628227
H 1.680682 1.296528 0.178353
H -0.335372 0.878021 1.415100
H -1.441758 -0.640669 -1.019415
H 1.118288 -2.963464 0.614343
H 0.620816 -2.284329 -0.937850
H 1.449031 1.365093 -2.159469
H 0.307431 0.009392 -2.227736
H -1.357482 -2.650805 0.463017
H -0.700541 -1.674843 1.791610
H -2.685920 -0.185780 1.750989
H 2.044288 -1.553293 -2.482213
H 3.197063 -0.199166 -2.617949
H -1.062972 1.889400 -1.404489
H -0.298888 2.861177 -0.121967
H 2.656392 -1.678143 2.149015
H 2.705362 0.107295 2.056706
H 1.193410 -0.721918 2.515707
H -2.822824 3.205014 -0.193203
H -2.241390 2.566776 1.362043
H -3.471886 -2.296350 0.810000
H -3.630010 -1.596312 -0.817700
H 4.251346 -2.530834 -0.951351
H -5.379934 -0.898804 1.637447
H -5.902382 -1.854058 0.228997
H -4.964934 2.288763 -0.577895
H 7.944137 2.683947 0.856602


