%chk=000040660.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040660

0 1
 O    1.076800     -0.5895000      0.6399000    
 O   -1.694700      -2.250200       1.536400    
 O   -1.172300      -2.804200     -0.6053000    
 C    1.404300       2.204800      0.2575000    
 C   0.1006000       1.507300      4.8400000E-02
 C  -1.3700000E-02  0.1313000      0.2470000    
 C   -1.239700     -0.5030000      4.5699999E-02
 C   -1.011000       2.249100     -0.3513000    
 C    1.334800       3.254400       1.381800    
 C    1.936400       2.854100      -1.033300    
 C   -2.351300      0.2389000     -0.3541000    
 C   -2.236800       1.614900     -0.5526000    
 C    1.897100      -1.132700     -0.3910000    
 C    3.037200      -1.911700      0.2470000    
 C   -3.677700     -0.4119000     -0.5773000    
 C   -1.355500      -1.942100      0.2564000    
 C    3.965300      -2.509500     -0.7951000    
 H    2.173700       1.492900      0.5767000    
 H  -0.9468000       3.321600     -0.5125000    
 H   0.9797000       2.802300       2.314600    
 H    2.326200       3.680400       1.571300    
 H   0.6611000       4.080900       1.131600    
 H    1.290100       3.667300      -1.380500    
 H    2.935600       3.272100     -0.8685000    
 H    2.010000       2.116600      -1.840100    
 H   -3.092600       2.208100     -0.8638000    
 H    2.298800     -0.3259000      -1.014600    
 H    1.305200      -1.796300      -1.031400    
 H    3.604000      -1.252200      0.9152000    
 H    2.628700      -2.706600      0.8824000    
 H   -3.602800      -1.180300      -1.353900    
 H   -4.042800     -0.8667000      0.3493000    
 H   -4.434800      0.3082000     -0.9066000    
 H    4.414200      -1.727300      -1.415600    
 H    4.774500      -3.063600     -0.3092000    
 H    3.425900      -3.201000      -1.450300    
 H   -1.770700      -3.218900       1.670800    


%chk=000040660-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000040660

0 1
O 1.110831 -0.612080 0.639293
O -2.330023 -2.379929 1.168974
O -0.565289 -2.847651 -0.248549
C 1.465416 2.259300 0.223747
C 0.128133 1.544970 0.016058
C -0.002978 0.142121 0.201713
C -1.266273 -0.510595 0.075805
C -1.038544 2.263786 -0.337970
C 1.364439 3.322121 1.350463
C 1.979995 2.897650 -1.094060
C -2.434802 0.233789 -0.265353
C -2.285827 1.624706 -0.483631
C 2.004691 -1.131406 -0.436823
C 3.086035 -1.969342 0.246371
C -3.803064 -0.407204 -0.424925
C -1.313476 -1.990803 0.279759
C 4.093393 -2.539011 -0.776793
H 2.197317 1.500139 0.554748
H -0.971530 3.346923 -0.495980
H 1.028493 2.864360 2.297831
H 2.349924 3.793205 1.523440
H 0.649640 4.124426 1.087445
H 1.288672 3.682592 -1.454514
H 2.968956 3.366939 -0.936386
H 2.078268 2.143709 -1.896522
H -3.167031 2.212254 -0.765137
H 2.446612 -0.274819 -0.989382
H 1.399978 -1.746886 -1.128524
H 3.609740 -1.343870 0.994305
H 2.593279 -2.791088 0.797505
H -3.770648 -1.293200 -1.084856
H -4.194910 -0.751104 0.547852
H -4.517129 0.313862 -0.857500
H 4.613313 -1.730785 -1.325429
H 4.861824 -3.150418 -0.271146
H 3.587016 -3.182212 -1.520495
H -2.307439 -3.372850 1.253668


