%chk=000043205.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043205

0 1
 I   -8.469100      -2.262000      5.2900001E-02
 O    2.646600      0.2150000     -1.9000000E-03
 O   0.4540000      0.5193000     -1.4300000E-02
 O    1.828000       2.369700      2.0800000E-02
 C    6.397200     -3.5000001E-03  3.7500001E-02
 C    7.405800      -1.155000     -3.0000000E-03
 C    4.942300     -0.4689000      5.2000000E-03
 C    8.861600     -0.6903000      5.4200001E-02
 C    3.978400      0.7103000      1.4000000E-02
 C   -1.949300      0.5038000     -3.3700000E-02
 C   -3.219400       1.352400     -4.8200000E-02
 C    9.822800      -1.863700     -6.1999999E-02
 C  -0.6974000       1.369700     -1.2300000E-02
 C   -4.460900      0.4983000     -2.4100000E-02
 C   -5.039600      7.5400002E-02  -1.220800    
 C   -5.031100      0.1303000       1.194600    
 C    1.657200       1.158100      3.5999999E-03
 C   -6.188400     -0.7154000      -1.198800    
 C   -6.179900     -0.6604000       1.216600    
 C   -6.758600      -1.083200      1.9900000E-02
 H    6.583600      0.6629000     -0.8140000    
 H    6.566500      0.5887000      0.9454000    
 H    7.245700      -1.734000     -0.9211000    
 H    7.210800      -1.833900      0.8365000    
 H    4.734000      -1.119000      0.8639000    
 H    4.760100      -1.081300     -0.8866000    
 H    9.045100     -0.1605000      0.9959000    
 H    9.057800      1.6500000E-02 -0.7603000    
 H    4.131900       1.313300      0.9168000    
 H    4.145200       1.337800     -0.8693000    
 H   -3.229300       2.032700      0.8131000    
 H   -3.233700       1.995700     -0.9374000    
 H   -1.919100     -0.1584000     -0.9087000    
 H   -1.940500     -0.1638000      0.8378000    
 H    10.85790      -1.511000     -1.6400000E-02
 H    9.685300      -2.391600      -1.011000    
 H    9.670600      -2.577500      0.7539000    
 H  -0.6852000       1.992600      0.8898000    
 H  -0.6707000       2.015000     -0.8982000    
 H   -4.603300      0.3542000      -2.176300    
 H   -4.588100      0.4520000       2.133300    
 H   -6.622800      -1.034500      -2.142800    
 H   -6.607600     -0.9362000       2.177200    


%chk=000043205-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000043205

0 1
I -8.409890 -2.612011 -0.000077
O 2.651751 0.323375 -0.011796
O 0.444254 0.630001 -0.016628
O 1.832502 2.527760 0.011627
C 6.467187 0.035683 0.007953
C 7.407626 -1.190967 -0.011485
C 4.973664 -0.367018 -0.013048
C 8.906249 -0.813269 0.014911
C 4.052862 0.851461 0.003096
C -1.972333 0.608458 -0.012393
C -3.295713 1.425479 -0.008889
C 9.834066 -2.047562 -0.006934
C -0.749919 1.525557 -0.011360
C -4.517569 0.519055 -0.006856
C -5.089776 0.065265 -1.222053
C -5.086266 0.066211 1.210342
C 1.663422 1.285910 -0.004132
C -6.192568 -0.819105 -1.231819
C -6.189034 -0.818151 1.224013
C -6.732050 -1.256421 -0.002951
H 6.693620 0.683030 -0.864738
H 6.678743 0.643404 0.912298
H 7.199259 -1.797967 -0.916984
H 7.179093 -1.841481 0.858241
H 4.743928 -1.004809 0.861842
H 4.759259 -0.970409 -0.915781
H 9.114426 -0.208178 0.920893
H 9.134259 -0.161967 -0.853484
H 4.186544 1.467527 0.911597
H 4.194506 1.498127 -0.882612
H -3.310449 2.084432 0.881364
H -3.314238 2.085801 -0.898055
H -1.939522 -0.047313 -0.901951
H -1.937460 -0.051643 0.873873
H 10.899736 -1.754379 0.013365
H 9.666706 -2.652100 -0.918258
H 9.645749 -2.699580 0.866797
H -0.708511 2.169332 0.887213
H -0.711474 2.175114 -0.905947
H -4.674733 0.405430 -2.178720
H -4.668439 0.407143 2.165523
H -6.620672 -1.155673 -2.180473
H -6.614396 -1.153951 2.174176


