%chk=000130632.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130632

0 1
 O   -1.497500       2.688500      8.2699999E-02
 O    5.914900     -0.1048000     -3.0600000E-02
 O   -3.938300       1.632500     -0.4886000    
 O   8.2400002E-02  -2.823500       1.475200    
 C    3.641600     -0.5021000     -0.8298000    
 C    2.308800     -0.5664000     -5.1700000E-02
 C    1.959900      0.6854000      0.6452000    
 C    4.720900      0.1893000      3.2299999E-02
 C    4.199100      -1.879700      -1.258000    
 C    3.452000      0.3362000      -2.112000    
 C  -0.5608000      0.4908000      0.4267000    
 C  -0.7749000     -0.8911000      0.4474000    
 C    1.586100      -1.697200      4.9699999E-02
 C   0.6993000       1.128600      0.8285000    
 C   -3.102200     -0.5774000     -0.1528000    
 C   -4.439800      -1.165400     -0.4593000    
 C    3.029300       1.539900       1.157700    
 C   0.2962000      -1.852500      0.7591000    
 C   -2.042100      -1.423200      0.1650000    
 C   -1.646300       1.328100      0.1161000    
 C    4.322300       1.313000      0.9135000    
 C   -2.904000      0.7988000     -0.1799000    
 C   -5.031400      -1.934100      0.7366000    
 C   -4.411400      -2.073000      -1.702900    
 C   -1.124100       3.262600      -1.164900    
 C   -4.739800       2.096900      0.5948000    
 H    4.376000      -2.525900     -0.3900000    
 H    3.521600      -2.397400      -1.946600    
 H    5.158000      -1.778900      -1.781000    
 H    4.392500      0.4200000      -2.669700    
 H    2.707600     -0.1188000      -2.775700    
 H    3.123300       1.359400      -1.897000    
 H    1.930600      -2.627900     -0.3893000    
 H   0.5592000       2.077500       1.348000    
 H   -5.160500     -0.3742000     -0.6952000    
 H    2.765200       2.381800       1.792800    
 H   -2.188500      -2.500700      0.1834000    
 H    5.100300       1.936500       1.338000    
 H   -5.076300      -1.297200       1.626900    
 H   -6.050000      -2.268600      0.5115000    
 H   -4.439600      -2.820700      0.9884000    
 H   -3.792000      -2.963000      -1.548600    
 H   -5.422400      -2.412100      -1.953800    
 H   -4.013500      -1.533000      -2.569400    
 H  -0.1723000       2.851700      -1.516200    
 H   -1.005700       4.340500      -1.023800    
 H   -1.902500       3.094000      -1.915600    
 H   -5.125600       1.264400       1.191000    
 H   -5.586800       2.650500      0.1804000    
 H   -4.160700       2.772400       1.232000    


%chk=000130632-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130632

0 1
O -1.608642 2.730203 0.220280
O 6.147019 0.087436 0.412002
O -4.207383 1.645187 -0.064541
O -0.069320 -3.198828 -0.099273
C 3.998382 -0.679151 -0.525148
C 2.493793 -0.550331 -0.171796
C 1.989907 0.784863 0.185334
C 4.912381 0.325723 0.238496
C 4.577886 -2.105546 -0.364950
C 4.137298 -0.249611 -2.038096
C -0.596417 0.502086 0.038102
C -0.800918 -0.914671 -0.119081
C 1.713843 -1.685118 -0.275414
C 0.656103 1.191684 0.246358
C -3.266866 -0.601557 -0.257244
C -4.664483 -1.194788 -0.422877
C 2.963610 1.811805 0.567036
C 0.274959 -1.961782 -0.134970
C -2.117236 -1.415290 -0.273099
C -1.773678 1.336735 0.045216
C 4.317496 1.604988 0.640446
C -3.076798 0.798342 -0.069210
C -4.994298 -2.188235 0.724256
C -4.815749 -1.880474 -1.807763
C -1.976338 3.555486 -0.957695
C -4.470840 2.344367 1.217580
H 4.332197 -2.534307 0.622470
H 4.210389 -2.789026 -1.149568
H 5.675654 -2.046197 -0.443974
H 5.198084 -0.307453 -2.339813
H 3.546342 -0.937624 -2.668024
H 3.777301 0.780214 -2.209561
H 2.235332 -2.625386 -0.483657
H 0.504522 2.249619 0.497087
H -5.384962 -0.358546 -0.375798
H 2.554131 2.787594 0.859079
H -2.207788 -2.500743 -0.382047
H 5.001004 2.377174 1.008570
H -4.923464 -1.701036 1.713799
H -6.021965 -2.578072 0.604952
H -4.302473 -3.050464 0.721997
H -4.117666 -2.731255 -1.912690
H -5.843799 -2.268702 -1.928717
H -4.616089 -1.170828 -2.630528
H -1.306244 3.321415 -1.806048
H -1.832746 4.599060 -0.639600
H -3.028014 3.376435 -1.241357
H -4.695364 1.607215 2.011148
H -5.353994 2.972961 1.028662
H -3.605997 2.964924 1.510170


