%chk=000045719.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045719

1 1
 N  -0.7958000     -7.5900003E-02 -1.2500000E-02
 C   0.4935000      0.1371000      0.7676000    
 C  -0.7184000      -1.393400     -0.7706000    
 C   -1.971900     -0.1143000      0.9526000    
 C  -0.9865000       1.066700     -0.9995000    
 C    1.663700      0.1742000     -0.2041000    
 C  -0.5289000      -2.525200      0.2155000    
 C   -2.043700       1.197700       1.703000    
 C   -2.269500      0.8493000      -1.771600    
 C    2.988600      0.3408000      0.5390000    
 C    4.168900      0.3429000     -0.4192000    
 H   0.5937000     -0.6144000       1.555100    
 H   0.4508000       1.119200       1.247600    
 H   -1.681400      -1.570700      -1.258200    
 H   4.2399999E-02  -1.354400      -1.553300    
 H   -2.895900     -0.3688000      0.4278000    
 H   -1.787300     -0.8899000       1.701100    
 H  -0.9392000       2.032200     -0.4902000    
 H  -0.1797000       1.035100      -1.736600    
 H    1.597400       1.013200     -0.9017000    
 H    1.754400     -0.7454000     -0.7863000    
 H  -0.4734000      -3.459900     -0.3580000    
 H   0.4076000      -2.482400      0.7753000    
 H   -1.364300      -2.670900      0.9034000    
 H   -2.905300       1.145600       2.381600    
 H   -1.189100       1.392400       2.354300    
 H   -2.234000       2.068700       1.073000    
 H   -2.383600       1.688700      -2.470100    
 H   -2.270700     -4.0800001E-02  -2.404400    
 H   -3.173000      0.8680000      -1.159100    
 H    3.116000     -0.4744000       1.261000    
 H    2.983200       1.278800       1.106500    
 H    4.090400       1.164800      -1.138000    
 H    4.225100     -0.5976000     -0.9767000    
 H    5.105300      0.4650000      0.1342000    


%chk=000045719-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000045719

1 1
N -0.825152 -0.086469 -0.044764
C 0.542945 0.183607 0.638549
C -0.828499 -1.465760 -0.759249
C -1.934822 -0.085687 1.042579
C -1.080247 1.022314 -1.101746
C 1.788605 0.098324 -0.259684
C -0.461387 -2.668220 0.119165
C -2.164421 1.252294 1.756486
C -2.459461 1.000844 -1.771665
C 3.062245 0.385879 0.581046
C 4.345170 0.331581 -0.274854
H 0.619970 -0.540004 1.468204
H 0.467215 1.193177 1.076567
H -1.843429 -1.590010 -1.171019
H -0.126846 -1.372427 -1.604344
H -2.856472 -0.422360 0.539307
H -1.642930 -0.859939 1.770303
H -0.912045 1.981015 -0.583870
H -0.287474 0.904497 -1.858276
H 1.742867 0.835190 -1.083157
H 1.888699 -0.904546 -0.715979
H -0.501335 -3.569490 -0.517956
H 0.561162 -2.609274 0.527167
H -1.169937 -2.834342 0.947035
H -2.982297 1.104320 2.483909
H -1.288403 1.594458 2.331361
H -2.484023 2.058528 1.075852
H -2.489274 1.834511 -2.495542
H -2.650610 0.078427 -2.344299
H -3.289202 1.162498 -1.064071
H 3.136047 -0.350673 1.406050
H 2.975790 1.384367 1.054285
H 4.323424 1.087146 -1.081371
H 4.476749 -0.661750 -0.741793
H 5.236779 0.529973 0.344274


