%chk=000102566.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102566

0 1
 O   -3.477700     -0.3070000     -0.6632000    
 O   -4.694700     -0.6975000       1.261200    
 C    2.289200     -0.6999000      0.9948000    
 C    3.597200     -0.5893000      0.1419000    
 C    2.121600      0.5020000      -1.122000    
 C    1.250300      3.7300002E-02  7.7399999E-02
 C    3.467100      0.8121000     -0.4682000    
 C    3.534400      -1.446700      -1.136000    
 C    2.477100     -0.7259000      -1.982500    
 C   0.5027000       1.209600      0.7099000    
 C    1.852400      -2.151800       1.254700    
 C    2.516000     -4.6100002E-02   2.373500    
 C  -0.4330000       1.938600     -0.2687000    
 C   -1.513600       1.040500     -0.8995000    
 C   -1.054400       3.154900      0.4258000    
 C   -2.575800      0.5204000      6.2600002E-02
 C   -4.497100     -0.8552000      6.4000003E-02
 C   -5.361600      -1.696000     -0.8257000    
 H    4.513400     -0.7515000      0.7155000    
 H    1.725400       1.307500      -1.736800    
 H   0.5069000     -0.6877000     -0.2730000    
 H    4.255500       1.037200      -1.195500    
 H    3.423800       1.622900      0.2629000    
 H    3.292700      -2.497300     -0.9607000    
 H    4.500700      -1.422500      -1.654900    
 H    2.909900     -0.4196000      -2.941700    
 H    1.609500      -1.360000      -2.190300    
 H  -7.4800000E-02  0.8498000       1.569800    
 H    1.214100       1.946500       1.100700    
 H    1.553900      -2.672300      0.3395000    
 H    2.659700      -2.726600       1.721600    
 H   0.9862000      -2.181200       1.926000    
 H    2.859400      0.9897000       2.304500    
 H    1.602100     -5.8300000E-02   2.977300    
 H    3.281800     -0.5947000       2.935100    
 H   0.1525000       2.355800      -1.093800    
 H   -1.061700      0.2025000      -1.442000    
 H   -2.027100       1.615600      -1.683100    
 H   -1.752200       3.673000     -0.2404000    
 H   -1.592600       2.874000       1.336900    
 H  -0.2767000       3.871700      0.7120000    
 H   -2.111500     -7.1099997E-02  0.8589000    
 H   -3.136200       1.350100      0.5061000    
 H   -4.770400      -2.507600      -1.257200    
 H   -5.796900      -1.075500      -1.613000    
 H   -6.173500      -2.131700     -0.2363000    


%chk=000102566-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102566

0 1
O -3.414185 -0.344776 -0.649036
O -4.242994 -1.178848 1.363787
C 2.190319 -0.684242 0.975057
C 3.553286 -0.709766 0.180193
C 2.228453 0.544112 -1.183186
C 1.255185 0.168313 -0.013336
C 3.585722 0.716814 -0.443344
C 3.452166 -1.580425 -1.107011
C 2.501664 -0.734129 -2.034036
C 0.536645 1.384504 0.619975
C 1.586083 -2.087358 1.232173
C 2.433316 -0.027230 2.362093
C -0.474876 2.125309 -0.305011
C -1.566003 1.198776 -0.919396
C -1.099386 3.325132 0.450794
C -2.396816 0.440143 0.117580
C -4.289926 -1.124079 0.113699
C -5.262525 -1.858719 -0.785132
H 4.408743 -0.977855 0.825317
H 1.892476 1.406371 -1.784256
H 0.475408 -0.515456 -0.406144
H 4.437477 0.866119 -1.132071
H 3.586319 1.533930 0.298285
H 3.074103 -2.598576 -0.914576
H 4.454375 -1.688019 -1.562425
H 2.998454 -0.477193 -2.987908
H 1.564776 -1.267263 -2.281139
H 0.001107 1.059057 1.535527
H 1.286472 2.126652 0.961347
H 1.303345 -2.600448 0.295873
H 2.296549 -2.738223 1.777590
H 0.670279 -2.003681 1.848784
H 2.904921 0.968601 2.289422
H 1.493274 0.086085 2.931939
H 3.105045 -0.671134 2.961548
H 0.091006 2.538794 -1.165616
H -1.098954 0.465009 -1.602911
H -2.250323 1.812711 -1.536517
H -1.811224 3.877857 -0.190550
H -1.643077 2.997950 1.357302
H -0.315384 4.034147 0.775697
H -1.794437 -0.268139 0.714558
H -2.931788 1.110187 0.813636
H -4.713730 -2.507455 -1.489591
H -5.842712 -1.138015 -1.386976
H -5.944628 -2.466843 -0.173911


