%chk=000154467.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154467

0 1
 O    4.534400      -1.382800     -0.3316000    
 O    4.477900      0.8996000       1.735800    
 O   -6.367400     -3.4000002E-02 -0.1255000    
 C    1.561700      0.5805000     -0.1610000    
 C    2.122800     -0.8142000     -0.5461000    
 C    3.561100     -0.3898000     -0.1481000    
 C   4.2199999E-02  0.6614000     -0.3413000    
 C    2.071600      0.7910000       1.308300    
 C    2.413000       1.539400      -1.037800    
 C    3.419600      5.2400000E-02   1.322000    
 C    3.803300      0.8705000      -1.019700    
 C    1.429500      -1.923000      0.2736000    
 C  -0.6997000     -0.4603000      0.4487000    
 C  -0.1034000      -1.857200      0.1378000    
 C    2.011200      -1.222100      -2.038200    
 C  -0.5383000       2.018900      6.4400002E-02
 C   -2.213400     -0.3548000      0.2586000    
 C   -1.994100       2.114000     -0.3824000    
 C   -2.808500      0.8775000     -9.0800002E-02
 C   -3.057100      -1.451000      0.5131000    
 C   -4.205100      0.9674000     -0.2277000    
 C   -4.443500      -1.345500      0.3814000    
 C   -5.017600     -0.1379000      6.5000001E-03
 H  -0.1703000      0.5209000      -1.411600    
 H    1.409900      0.3422000       2.053700    
 H    2.167200       1.852700       1.562600    
 H    2.456000       2.555600     -0.6315000    
 H    2.029400       1.611600      -2.061200    
 H    3.413900     -0.8037000       2.004400    
 H    4.144500      0.6135000      -2.028400    
 H    4.570000       1.535900     -0.6100000    
 H    1.669700      -1.871800       1.339500    
 H    1.781000      -2.910800     -4.9899999E-02
 H  -0.5510000     -0.2870000       1.523100    
 H  -0.4068000      -2.175100     -0.8667000    
 H  -0.5155000      -2.604600      0.8260000    
 H    2.456600     -0.5118000      -2.737400    
 H    2.515400      -2.181000      -2.206000    
 H   0.9704000      -1.337500      -2.354200    
 H   2.3399999E-02   2.844300     -0.3863000    
 H  -0.4767000       2.147500       1.152500    
 H    4.281200      -2.154400      0.2028000    
 H   -2.024000       2.288300      -1.465600    
 H   -2.452900       2.984000      0.1030000    
 H    4.269000       1.209000       2.633600    
 H   -2.654900      -2.409600      0.8264000    
 H   -4.653400       1.915300     -0.5192000    
 H   -5.067900      -2.212900      0.5785000    
 H   -6.589900      0.8752000     -0.3901000    


%chk=000154467-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000154467

0 1
O 4.639596 -1.410551 -0.382262
O 4.577514 0.847203 1.736931
O -6.489322 -0.099565 -0.029767
C 1.546787 0.596154 -0.172443
C 2.119465 -0.822572 -0.550170
C 3.595347 -0.427937 -0.141026
C 0.021593 0.691259 -0.358792
C 2.062444 0.783958 1.304245
C 2.441395 1.542090 -1.040598
C 3.429981 0.024306 1.335968
C 3.848361 0.843549 -0.998185
C 1.400993 -1.924982 0.273202
C -0.717060 -0.435454 0.430656
C -0.142906 -1.843487 0.098851
C 2.053658 -1.220125 -2.044548
C -0.575695 2.061830 0.030804
C -2.242406 -0.328192 0.252414
C -2.041654 2.155166 -0.436516
C -2.858270 0.905362 -0.113544
C -3.088596 -1.441345 0.508368
C -4.269598 0.987681 -0.209205
C -4.490399 -1.364102 0.411581
C -5.083267 -0.135347 0.049753
H -0.184649 0.532931 -1.441869
H 1.358681 0.384591 2.055333
H 2.224270 1.853694 1.528072
H 2.478832 2.565040 -0.625792
H 2.052184 1.621713 -2.072749
H 3.378454 -0.867960 1.999648
H 4.203130 0.542622 -1.997669
H 4.624206 1.469300 -0.531367
H 1.630729 -1.846045 1.353559
H 1.749222 -2.926457 -0.050760
H -0.512134 -0.256857 1.511253
H -0.431363 -2.116167 -0.934936
H -0.600990 -2.603712 0.759322
H 2.306455 -0.395488 -2.729895
H 2.780124 -2.034136 -2.226293
H 1.051932 -1.586271 -2.327709
H 0.009595 2.884387 -0.422496
H -0.518549 2.188539 1.131094
H 4.642383 -2.069839 0.356885
H -2.055841 2.311336 -1.535882
H -2.532595 3.044348 0.005214
H 4.510582 1.037890 2.705939
H -2.647784 -2.401704 0.793958
H -4.729974 1.946892 -0.488492
H -5.129145 -2.229267 0.611444
H -6.801217 0.801518 -0.293528


