%chk=000087905.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087905

2 1
 O    5.597800       1.416500      0.4102000    
 O   -5.597900       1.416500     -0.4102000    
 N    7.192600     -0.6964000     -0.1353000    
 N   -7.192500     -0.6964000      0.1352000    
 C   0.7233000      0.3813000      1.7200001E-02
 C  -0.7233000      0.3814000     -1.7300000E-02
 C    5.733100     -0.8998000     -0.2093000    
 C   -5.733000     -0.8998000      0.2093000    
 C    3.512200      0.3813000      8.2699999E-02
 C   -3.512200      0.3813000     -8.2699999E-02
 C    4.966100      0.3816000      0.1163000    
 C   -4.966100      0.3815000     -0.1163000    
 C    1.413100       1.548100      0.3465000    
 C   -1.413000       1.548100     -0.3465000    
 C    1.427900     -0.7855000     -0.2792000    
 C   -1.427900     -0.7855000      0.2792000    
 C    2.807600       1.548100      0.3791000    
 C   -2.807600       1.548000     -0.3791000    
 C    2.822400     -0.7854000     -0.2464000    
 C   -2.822300     -0.7854000      0.2464000    
 C    7.800600     -0.9077000       1.031700    
 C   -7.800600     -0.9077000      -1.031700    
 C    7.832000     -0.3111000      -1.239100    
 C   -7.832100     -0.3111000       1.239100    
 C    9.878100     -0.3216000      5.0000002E-04
 C   -9.878100     -0.3216000     -3.9999999E-04
 C    9.172400     -0.7240000       1.130500    
 C   -9.172500     -0.7240000      -1.130500    
 C    9.204700     -0.1117000      -1.199200    
 C   -9.204700     -0.1117000       1.199200    
 C    11.35280     -0.1136000      7.5599998E-02
 C   -11.35280     -0.1136000     -7.5599998E-02
 H    5.496200      -1.236200      -1.224700    
 H    5.470000      -1.689800      0.5027000    
 H   -5.496100      -1.236200       1.224800    
 H   -5.469900      -1.689800     -0.5026000    
 H   0.9069000       2.471500      0.6145000    
 H  -0.9070000       2.471500     -0.6144000    
 H   0.9346000      -1.708700     -0.5706000    
 H  -0.9345000      -1.708700      0.5707000    
 H    3.322100       2.467800      0.6448000    
 H   -3.322000       2.467700     -0.6449000    
 H    3.329300      -1.713700     -0.4900000    
 H   -3.329200      -1.713800      0.4900000    
 H    7.193600      -1.213500       1.875100    
 H   -7.193700      -1.214300      -1.874800    
 H    7.249300     -0.1587000      -2.139300    
 H   -7.249500     -0.1595000       2.139600    
 H    9.674100     -0.8909000       2.078400    
 H   -9.674700     -0.8942000      -2.077600    
 H    9.731800      0.2057000      -2.093400    
 H   -9.732400      0.2023000       2.094300    
 H    11.83180     -0.3293000     -0.8856000    
 H    11.57260      0.9223000      0.3523000    
 H    11.80830     -0.7791000      0.8168000    
 H   -11.67920      0.6598000      0.6280000    
 H   -11.65480      0.2155000      -1.075700    
 H   -11.87610      -1.045500      0.1600000    


%chk=000087905-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087905

2 1
O 5.686557 1.224877 0.794440
O -5.673769 1.249764 -0.750866
N 7.358242 -0.764545 -0.034578
N -7.358349 -0.747067 0.028854
C 0.744884 0.113943 0.083481
C -0.739933 0.117403 -0.023111
C 5.907793 -1.075658 0.014797
C -5.906950 -1.057008 0.007120
C 3.599454 0.124122 0.267585
C -3.593666 0.139070 -0.217942
C 5.077017 0.197994 0.387243
C -5.070144 0.217876 -0.347715
C 1.448659 1.288888 0.480487
C -1.438119 1.298050 -0.412980
C 1.500723 -1.056812 -0.212887
C -1.501079 -1.052420 0.263201
C 2.847766 1.294692 0.575586
C -2.836812 1.309536 -0.513297
C 2.904006 -1.053910 -0.127869
C -2.904034 -1.043921 0.172815
C 8.008456 -0.400709 1.124920
C -7.983930 -0.376591 -1.142020
C 8.027653 -0.740095 -1.239653
C -8.051116 -0.722302 1.220630
C 10.085655 -0.013962 -0.121011
C -10.084794 0.011253 0.062962
C 9.358764 -0.039866 1.101173
C -9.332702 -0.009859 -1.144041
C 9.374607 -0.378877 -1.301183
C -9.397611 -0.355705 1.256557
C 11.531031 0.401460 -0.170823
C -11.542370 0.384575 0.077454
H 5.598055 -1.473247 -0.964796
H 5.727861 -1.862117 0.770852
H -5.615163 -1.455009 0.992160
H -5.712404 -1.842745 -0.745980
H 0.893318 2.193574 0.747327
H -0.878606 2.202762 -0.670867
H 0.989155 -1.965061 -0.547287
H -0.993986 -1.964747 0.593313
H 3.384567 2.194550 0.892205
H -3.369226 2.213592 -0.825323
H 3.440704 -1.976761 -0.374950
H -3.445051 -1.966302 0.412083
H 7.424460 -0.420541 2.045689
H -7.380484 -0.391003 -2.050288
H 7.457186 -1.022062 -2.127049
H -7.497894 -1.003536 2.119118
H 9.843039 0.228911 2.043532
H -9.795344 0.269657 -2.094130
H 9.873022 -0.381482 -2.274108
H -9.913688 -0.353086 2.220238
H 12.062802 -0.053447 -1.022285
H 11.603632 1.500889 -0.291811
H 12.065296 0.145527 0.758949
H -11.848933 0.811304 1.046351
H -11.789626 1.103533 -0.720803
H -12.166981 -0.515048 -0.093171


