%chk=000132787.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132787

0 1
 O    3.230500       1.478500      0.4338000    
 O    6.079200       1.108200      0.1912000    
 N   -1.298500     -0.3681000     -0.1887000    
 N    1.544300     -0.6218000     -7.1599998E-02
 C   -2.613200      6.1999999E-02  0.2624000    
 C   -3.343100      0.9461000     -0.7701000    
 C   -3.552300      -1.126300      0.5545000    
 C  -0.4383000      0.7928000     -0.4493000    
 C  -0.6706000      -1.240200      0.8114000    
 C   0.9292000      0.3551000     -0.9790000    
 C   0.6899000      -1.745300      0.3245000    
 C   -4.772000      0.6891000     -0.4031000    
 C   -4.890700     -0.4865000      0.3485000    
 C    2.931900     -0.7926000     -0.1323000    
 C   -5.889000       1.427800     -0.7550000    
 C   -6.128700     -0.9472000      0.7635000    
 C    3.798000      0.2746000      0.1070000    
 C   -7.140700      0.9772000     -0.3299000    
 C   -7.259700     -0.2015000      0.4237000    
 C    3.449700      -2.048800     -0.4485000    
 C    5.179100      9.2500001E-02  3.9999999E-04
 C    4.829900      -2.237000     -0.5281000    
 C    5.696500      -1.167100     -0.3026000    
 C    4.187300       2.386100      0.9875000    
 C    5.451100       2.392400      0.1499000    
 H   -2.520000      0.6463000       1.193000    
 H   -3.168200      0.6181000      -1.801200    
 H   -3.081600       2.003200     -0.6607000    
 H   -3.437800      -1.497700       1.577600    
 H   -3.430100      -1.946100     -0.1628000    
 H  -0.3033000       1.391500      0.4617000    
 H  -0.8755000       1.448400      -1.210200    
 H   -1.278900      -2.129000       1.010300    
 H  -0.5441000     -0.7094000       1.765000    
 H   0.8086000     -0.1121000      -1.965800    
 H    1.538200       1.249300      -1.139000    
 H    1.151700      -2.315200       1.140700    
 H   0.5450000      -2.423700     -0.5261000    
 H   -5.800700       2.332400      -1.346800    
 H   -6.224200      -1.863600       1.335800    
 H   -8.033100       1.540300     -0.5895000    
 H   -8.243000     -0.5390000      0.7399000    
 H    2.810500      -2.902400     -0.6549000    
 H    5.230700      -3.215900     -0.7750000    
 H    6.769600      -1.320400     -0.3764000    
 H    4.390600       2.090900       2.024300    
 H    3.733200       3.381800      0.9983000    
 H    5.241000       2.646100     -0.8966000    
 H    6.163800       3.124300      0.5426000    


%chk=000132787-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000132787

0 1
O 3.352370 1.576135 0.256746
O 6.223463 1.113769 0.042368
N -1.326588 -0.326861 -0.111031
N 1.569689 -0.603414 -0.005251
C -2.677926 0.052979 0.373930
C -3.415688 1.042381 -0.584809
C -3.651201 -1.164480 0.491540
C -0.430192 0.850288 -0.270762
C -0.667917 -1.318822 0.777399
C 0.925234 0.429364 -0.856400
C 0.688095 -1.768086 0.204909
C -4.885430 0.731127 -0.344446
C -5.020828 -0.538815 0.276005
C 2.967033 -0.818131 -0.102546
C -6.024084 1.495761 -0.665125
C -6.295774 -1.054095 0.580969
C 3.884929 0.275618 0.018806
C -7.308475 0.980603 -0.357053
C -7.443329 -0.285344 0.261763
C 3.520993 -2.121905 -0.257320
C 5.283652 0.055053 -0.057154
C 4.917719 -2.329952 -0.286177
C 5.811119 -1.246227 -0.198112
C 4.355488 2.525540 0.779112
C 5.622310 2.454743 -0.076288
H -2.616447 0.538622 1.384420
H -3.131034 0.805489 -1.631010
H -3.164163 2.101408 -0.397634
H -3.568436 -1.697836 1.455089
H -3.419690 -1.886957 -0.318491
H -0.257329 1.364808 0.708686
H -0.901771 1.571857 -0.960241
H -1.316285 -2.207184 0.873064
H -0.501940 -0.898811 1.802882
H 0.761866 0.023961 -1.881769
H 1.584506 1.306699 -0.921182
H 1.162854 -2.455853 0.926805
H 0.510882 -2.324505 -0.745957
H -5.923534 2.478044 -1.141898
H -6.404435 -2.033103 1.062659
H -8.203493 1.566939 -0.594794
H -8.441805 -0.670255 0.498862
H 2.853298 -2.979017 -0.376759
H 5.308826 -3.346219 -0.402911
H 6.896007 -1.375156 -0.242053
H 4.587292 2.271542 1.831841
H 3.878195 3.517403 0.728084
H 5.379701 2.659732 -1.137598
H 6.394475 3.159264 0.273133


