%chk=000068066.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068066

0 1
 O  -0.2621000      0.2337000      0.5809000    
 O    3.677000      -2.370400     -0.1963000    
 O   -2.610500      -1.924300     -0.4400000    
 O    5.954200     -0.1898000      0.9363000    
 O   -6.488000      0.7113000      0.5406000    
 O  -0.5238000      0.4042000      -1.729600    
 O    5.821000     -2.1600001E-02  -1.355500    
 O   -6.570000      -1.836500      0.3642000    
 C    1.699300      -1.089600      0.1918000    
 C    1.117100      0.1452000      0.3741000    
 C    3.222300       1.247600      0.1567000    
 C    3.838800      1.0400000E-02 -3.0900000E-02
 C    3.077300      -1.158100     -1.3300000E-02
 C    1.844300       1.316000      0.3617000    
 C   -2.428500      0.4552000     -0.2959000    
 C   -3.026100       1.697200     -8.1200004E-02
 C   -3.194900     -0.7084000     -0.2299000    
 C   0.8812000      -2.341000      0.2113000    
 C    4.011800       2.516100      0.1428000    
 C   -1.001900      0.3691000     -0.5899000    
 C   -4.558900     -0.6301000      5.0799999E-02
 C   -4.390100       1.775400      0.1995000    
 C   -5.156600      0.6119000      0.2655000    
 C    5.279800     -6.5499999E-02 -0.2456000    
 C   -2.230900       2.960600     -0.1453000    
 C   -5.362700      -1.845500      0.1202000    
 C    7.381200     -0.2729000      0.8568000    
 H    1.348500       2.271100      0.5102000    
 H   0.5220000      -2.569700     -0.7967000    
 H    1.458200      -3.197000      0.5771000    
 H   2.2900000E-02  -2.251600      0.8851000    
 H    4.751900       2.516600      0.9497000    
 H    4.522300       2.640600     -0.8179000    
 H    3.373500       3.394800      0.2864000    
 H   -4.866100       2.738400      0.3687000    
 H   -1.456500       2.965600      0.6287000    
 H   -1.761500       3.070600      -1.128500    
 H   -2.857000       3.845300      1.4500000E-02
 H    4.633800      -2.267800     -0.3219000    
 H   -4.850600      -2.805500     -5.5799998E-02
 H   -1.703700      -1.814500     -0.7660000    
 H   -6.893500     -0.1599000      0.6579000    
 H    7.787000      0.6376000      0.4062000    
 H    7.675800      -1.154500      0.2799000    
 H    7.773800     -0.3689000       1.872400    


%chk=000068066-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068066

0 1
O -0.199949 0.576027 0.483126
O 3.670691 -2.214015 1.257740
O -2.996098 -1.358499 -1.986797
O 6.265705 0.701261 -0.314452
O -6.684893 0.826490 0.198898
O -0.666698 -0.920366 -1.225020
O 5.951169 -1.365917 0.656290
O -7.048754 -0.777592 -1.728191
C 1.735233 -0.895988 0.854975
C 1.209500 0.306417 0.360970
C 3.394138 1.226070 -0.255505
C 3.996851 0.010365 0.227444
C 3.152810 -1.032783 0.776937
C 1.995157 1.348920 -0.173054
C -2.519389 0.184109 -0.125390
C -3.062763 1.078854 0.877878
C -3.431866 -0.495828 -1.018417
C 0.886642 -2.002085 1.435315
C 4.169391 2.385963 -0.854025
C -1.098239 -0.105098 -0.335562
C -4.842319 -0.293020 -0.926580
C -4.451840 1.267885 0.957896
C -5.344335 0.605391 0.079372
C 5.442214 -0.273570 0.211710
C -2.202070 1.835775 1.871375
C -5.773573 -0.963717 -1.813379
C 7.718583 0.384066 -0.322576
H 1.497555 2.254550 -0.530161
H 0.529266 -2.676099 0.634378
H 1.478234 -2.606703 2.139441
H 0.000700 -1.597884 1.955331
H 4.905974 2.796751 -0.142130
H 4.744328 2.075654 -1.743220
H 3.475597 3.191668 -1.146752
H -4.878205 1.937688 1.708935
H -1.581147 1.152612 2.475805
H -1.495312 2.512916 1.361328
H -2.837198 2.430033 2.547854
H 4.695391 -2.180369 1.145666
H -5.368313 -1.649795 -2.577632
H -1.959778 -1.404008 -1.927902
H -7.161721 0.248010 -0.531850
H 7.905650 -0.522180 -0.921134
H 8.077302 0.221224 0.706717
H 8.187479 1.268220 -0.775851


