%chk=000052621.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052621

0 1
 N  -0.3695000      0.7295000     -0.5723000    
 N   -2.208900      -1.422300     -5.5900000E-02
 C   -1.774300      0.5044000       1.501800    
 C   -2.875800      0.9281000     -0.6539000    
 C   -2.893200       1.299000      0.8288000    
 C  -0.4206000      0.9231000      0.8841000    
 C   -1.515300       1.343900      -1.258900    
 C   -2.068300      -1.005300       1.346900    
 C   -3.163500     -0.5839000     -0.7958000    
 C   0.8948000       1.208600      -1.124300    
 C   -2.562400      -2.835800     -0.1532000    
 C    2.075100      0.4841000     -0.5336000    
 C    2.680300      0.9831000      0.6113000    
 C    2.541600     -0.6727000      -1.142700    
 C    3.773900      0.3119000       1.158300    
 C    3.635000      -1.344000     -0.5955000    
 C    4.251200     -0.8517000      0.5550000    
 H   -1.757100      0.7457000       2.571800    
 H   -3.668800       1.481700      -1.171700    
 H   -3.864300       1.057500       1.277600    
 H   -2.736800       2.376400      0.9607000    
 H  -0.2307000       1.974000       1.140200    
 H   0.3307000      0.3098000       1.390700    
 H   -1.502400       1.057100      -2.317700    
 H   -1.435400       2.438800      -1.221200    
 H   -1.252700      -1.570800       1.814500    
 H   -2.984500      -1.242600       1.904700    
 H   -4.186800     -0.7800000     -0.4478000    
 H   -3.130500     -0.8476000      -1.860200    
 H    1.012300       2.290800     -0.9740000    
 H   0.9080000       1.059600      -2.212500    
 H   -1.806200      -3.456600      0.3400000    
 H   -2.594400      -3.153400      -1.201300    
 H   -3.535700      -3.050700      0.3022000    
 H    2.329500       1.895600       1.084800    
 H    2.067800      -1.066200      -2.037600    
 H    4.255700      0.6969000       2.052300    
 H    4.006400      -2.250200      -1.064900    
 H    5.103000      -1.373900      0.9807000    


%chk=000052621-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000052621

0 1
N -0.411226 1.102686 -0.300872
N -1.987962 -1.442259 -0.148402
C -2.020961 0.456270 1.523053
C -2.860973 0.855985 -0.776121
C -3.158154 1.125683 0.717373
C -0.675784 1.127136 1.148015
C -1.524934 1.543569 -1.154096
C -2.069553 -1.073266 1.281945
C -2.898299 -0.673235 -1.026676
C 0.914198 1.604442 -0.681110
C -2.112756 -2.893660 -0.356659
C 2.044370 0.648444 -0.290069
C 3.347430 1.136779 -0.027428
C 1.805666 -0.748623 -0.235488
C 4.403782 0.245563 0.272339
C 2.859813 -1.639097 0.067314
C 4.163023 -1.147144 0.319513
H -2.176773 0.620085 2.608162
H -3.651737 1.307755 -1.408190
H -4.141583 0.702705 1.001976
H -3.190580 2.214688 0.917940
H -0.698944 2.180828 1.542602
H 0.158710 0.612497 1.660688
H -1.266959 1.313156 -2.206909
H -1.695099 2.654957 -1.095904
H -1.231795 -1.568522 1.811843
H -3.021216 -1.455041 1.747676
H -3.966014 -1.004925 -0.891880
H -2.624018 -0.892495 -2.077678
H 1.133389 2.621260 -0.259453
H 0.919498 1.722480 -1.784353
H -1.355228 -3.425449 0.247923
H -1.935783 -3.137403 -1.420255
H -3.121249 -3.298303 -0.074831
H 3.537449 2.217898 -0.055844
H 0.782060 -1.101709 -0.420125
H 5.408449 0.635738 0.473319
H 2.667280 -2.717999 0.107224
H 4.979665 -1.839574 0.554835


