%chk=000065846.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065846

0 1
 O   0.6189000       2.463300      0.1263000    
 O   -2.064400      -2.544800       2.201900    
 N    4.848100      0.7661000      0.4330000    
 N  -0.5146000      0.4250000     -0.1214000    
 N   -2.903200     -0.6129000       1.334700    
 N   0.3988000      -1.266600      -1.519400    
 C    1.955400      0.5377000      7.3700003E-02
 C    2.589200      0.7842000       1.441700    
 C    2.877400       1.037300      -1.036900    
 C    4.008200      0.2165000       1.506200    
 C    4.286300      0.4599000     -0.8898000    
 C   0.6320000       1.234400      8.9999998E-04
 C    6.214200      0.2540000      0.5396000    
 C   -1.819600       1.013800     -0.1975000    
 C  -0.4499000     -0.9477000     -0.5022000    
 C   -2.928500      0.5163000      0.5012000    
 C   -1.207300      -1.926100      0.1313000    
 C   -1.989900       2.190300     -0.9587000    
 C   -2.056400      -1.694200       1.311300    
 C   -4.144000       1.226600      0.4798000    
 C   -1.090600      -3.254900     -0.3047000    
 C   -3.210300       2.865800      -1.003400    
 C   -4.287700       2.388100     -0.2741000    
 C   0.4801000      -2.553500      -1.921000    
 C  -0.2422000      -3.578600      -1.352600    
 H    1.890100     -0.5466000      4.9999999E-03
 H    1.974900      0.3271000       2.227600    
 H    2.623500       1.859100       1.664900    
 H    2.936500       2.133800      -1.026200    
 H    2.469400      0.7615000      -2.016900    
 H    4.435500      0.4774000       2.482200    
 H    3.969900     -0.8795000       1.451000    
 H    4.260000     -0.6241000      -1.062900    
 H    4.917900      0.8985000      -1.671900    
 H    6.652100      0.5245000       1.506900    
 H    6.853800      0.7010000     -0.2295000    
 H    6.257600     -0.8360000      0.4339000    
 H   -1.173300       2.591500      -1.555400    
 H   -3.653100     -0.6707000       2.020000    
 H   -5.001300      0.8680000       1.046800    
 H   -1.659700      -4.051700      0.1686000    
 H   -3.311700       3.765800      -1.602400    
 H   -5.237400       2.913700     -0.2915000    
 H    1.168000      -2.739800      -2.738600    
 H  -0.1448000      -4.599500      -1.702200    


%chk=000065846-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065846

0 1
O 0.508703 2.508674 0.127721
O -2.021223 -2.632750 2.169757
N 4.890157 0.692985 0.480483
N -0.538068 0.455518 -0.245105
N -2.632268 -0.514048 1.492013
N 0.283243 -1.165886 -1.788747
C 1.959791 0.547822 0.159060
C 2.627761 0.990630 1.490568
C 2.908172 0.892651 -1.023179
C 4.020810 0.348021 1.629259
C 4.293277 0.257084 -0.803449
C 0.617378 1.258926 -0.006659
C 6.267564 0.197148 0.653743
C -1.851827 1.066151 -0.263979
C -0.472028 -0.911100 -0.681222
C -2.863573 0.574724 0.600944
C -1.181509 -1.925618 0.021865
C -2.121458 2.161309 -1.113946
C -1.949528 -1.713498 1.294395
C -4.131926 1.210153 0.621742
C -1.070113 -3.257257 -0.451665
C -3.381899 2.792526 -1.085161
C -4.386632 2.318850 -0.208895
C 0.366744 -2.452262 -2.227705
C -0.296202 -3.530127 -1.596075
H 1.817258 -0.548808 0.184311
H 1.999604 0.698228 2.354106
H 2.720225 2.090710 1.493897
H 3.013315 1.991266 -1.085783
H 2.472271 0.523305 -1.968981
H 4.505487 0.711965 2.554827
H 3.906675 -0.766323 1.731421
H 4.195784 -0.862967 -0.846176
H 4.973433 0.556713 -1.623249
H 6.696282 0.604936 1.586995
H 6.895603 0.539406 -0.188602
H 6.335621 -0.920728 0.702857
H -1.326131 2.529699 -1.765922
H -3.178735 -0.515837 2.360380
H -4.915434 0.823700 1.284392
H -1.574500 -4.050172 0.109055
H -3.575449 3.651612 -1.735005
H -5.367653 2.804470 -0.179498
H 0.986223 -2.611626 -3.117416
H -0.197325 -4.546177 -1.988071


