%chk=000124544.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124544

0 1
 O   -2.529900     -0.4508000       1.240100    
 C   0.3826000       3.075000      -1.172000    
 C    1.433400       1.958700      -1.334200    
 C    1.759100       1.244500     -1.7300000E-02
 C  -0.9471000       2.528500     -0.7085000    
 C   0.1917000       3.814100      -2.499200    
 C   -2.858100       2.409200      0.9800000    
 C   -2.816000       1.669200       2.318600    
 C   -1.544000       2.899900      0.4349000    
 C   -1.974000      0.4027000       2.230900    
 C    2.838700      0.2167000     -0.2122000    
 C   -1.661700      -1.284400      0.5841000    
 C   -1.910400      -1.672900     -0.7278000    
 C   -1.016200      -2.523300      -1.378100    
 C    4.018400      0.1292000      0.4309000    
 C   0.3648000      -2.586700      0.6031000    
 C  -0.5293000      -1.736300       1.253600    
 C   0.1213000      -2.980200     -0.7127000    
 C   -3.132500      -1.181900      -1.435900    
 C   -1.255000      -2.960300      -2.786400    
 C    4.970700     -0.9967000      0.1280000    
 C    4.512100       1.100400       1.465500    
 C    1.581400      -3.074900       1.314400    
 H   0.7635000       3.800400     -0.4410000    
 H    1.086400       1.224600      -2.074500    
 H    2.355300       2.397400      -1.739300    
 H   0.8703000      0.7225000      0.3487000    
 H    2.015500       1.986400      0.7421000    
 H   -1.433700       1.791900      -1.343300    
 H  -0.5356000       4.627300      -2.394900    
 H  -0.1655000       3.141300      -3.287100    
 H    1.136200       4.254900      -2.836200    
 H   -3.505700       3.287200       1.101200    
 H   -3.356300       1.782400      0.2299000    
 H   -2.415900       2.324400       3.100800    
 H   -3.843200       1.406300       2.598600    
 H   -1.041600       3.637400       1.058700    
 H   -2.001200     -0.1114000       3.198800    
 H  -0.9379000      0.6877000       2.011700    
 H    2.597900     -0.5536000     -0.9440000    
 H  -0.3278000      -1.476400       2.288800    
 H   0.8202000      -3.644900      -1.214900    
 H   -2.851600     -0.5048000      -2.249400    
 H   -3.815600     -0.6344000     -0.7793000    
 H   -3.706600      -2.019800      -1.845300    
 H   -2.153900      -3.582000      -2.848500    
 H   -1.362600      -2.095200      -3.448900    
 H  -0.4202000      -3.555300      -3.173200    
 H    5.921400     -0.6004000     -0.2434000    
 H    5.166200      -1.580300       1.033600    
 H    4.578100      -1.683000     -0.6298000    
 H    3.848300       1.949100       1.635500    
 H    4.643500      0.5886000       2.424800    
 H    5.481500       1.509600       1.161000    
 H    2.395700      -3.281900      0.6114000    
 H    1.952800      -2.324800       2.021000    
 H    1.352100      -3.992900       1.864200    


%chk=000124544-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000124544

0 1
O -2.520747 -0.358093 0.635657
C 0.699007 3.720170 -0.697689
C 1.787701 2.645232 -0.986940
C 1.989022 1.628242 0.169316
C -0.676918 3.092097 -0.557375
C 0.691062 4.788733 -1.825111
C -2.899679 2.626526 0.607699
C -3.025395 1.680750 1.835660
C -1.526432 3.258122 0.490442
C -2.077839 0.480805 1.763495
C 2.955207 0.519822 -0.194026
C -1.715850 -1.456170 0.266009
C -2.214109 -2.250182 -0.808606
C -1.438102 -3.363536 -1.231521
C 4.181883 0.251069 0.342089
C 0.283109 -2.866324 0.471069
C -0.489869 -1.759811 0.901952
C -0.204401 -3.656696 -0.593142
C -3.534349 -1.910049 -1.475549
C -1.926071 -4.244238 -2.369448
C 5.017272 -0.913859 -0.168701
C 4.829861 1.047097 1.462144
C 1.610149 -3.176463 1.143943
H 0.952893 4.225217 0.258405
H 1.514032 2.097110 -1.912835
H 2.751481 3.151012 -1.196136
H 1.002077 1.180507 0.408024
H 2.316069 2.171628 1.076453
H -0.997964 2.459936 -1.403170
H -0.047809 5.582574 -1.614884
H 0.427874 4.330435 -2.797735
H 1.687707 5.257699 -1.930903
H -3.670710 3.418561 0.703018
H -3.129732 2.054428 -0.309746
H -2.796271 2.241337 2.764848
H -4.066717 1.316604 1.921745
H -1.205131 3.885495 1.339367
H -2.107044 -0.116661 2.697980
H -1.039223 0.827833 1.588515
H 2.605788 -0.135498 -1.008732
H -0.119274 -1.147724 1.730389
H 0.381054 -4.518520 -0.936014
H -3.398233 -1.702199 -2.554838
H -3.992894 -1.025897 -1.008714
H -4.250365 -2.751512 -1.401422
H -2.905501 -4.705453 -2.136750
H -2.063784 -3.666085 -3.303699
H -1.209900 -5.057365 -2.576555
H 5.994494 -0.562933 -0.557394
H 5.242504 -1.632221 0.645688
H 4.504456 -1.462987 -0.977721
H 4.213934 1.895457 1.802025
H 5.030364 0.398595 2.338664
H 5.810778 1.447826 1.136654
H 2.078810 -4.078337 0.713060
H 2.319801 -2.334542 1.029169
H 1.481927 -3.349562 2.229474


