%chk=000050240.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050240

0 1
 N   -4.597800      0.3869000     -0.6431000    
 C   0.1316000     -4.4500001E-02  7.8199998E-02
 C  -0.8586000     -0.1855000      -1.129900    
 C  -0.6604000     -0.1056000       1.430100    
 C   -3.312700     -0.2819000     -0.4049000    
 C   -2.195100      0.5666000      -1.026500    
 C   -1.806800      -1.122700       1.509300    
 C   -3.153700     -0.5293000       1.098500    
 C   0.9071000       1.307900      0.1136000    
 C    1.169000      -1.195100     -0.1041000    
 C    1.865100       1.529700       1.098600    
 C    1.983300      -1.218900      -1.232500    
 C   0.6368000       2.285000     -0.8400000    
 C    1.274200      -2.190400      0.8629000    
 C   -5.697600     -0.4439000     -0.1842000    
 C    2.559000       2.739300       1.130400    
 C    2.911100      -2.247500      -1.395600    
 C    1.330800       3.494700     -0.8082000    
 C    2.202200      -3.219000      0.6998000    
 C    2.291900       3.721600      0.1770000    
 C    3.020600      -3.247500     -0.4294000    
 H   -1.085500      -1.249800      -1.291600    
 H  -0.3668000      0.1139000      -2.065100    
 H   -1.080700      0.8875000       1.648600    
 H   2.2700001E-02 -0.2835000       2.271100    
 H   -3.326300      -1.248700     -0.9259000    
 H   -2.088900       1.517700     -0.4927000    
 H   -2.494000      0.8246000      -2.052300    
 H   -1.897700      -1.434000       2.558300    
 H   -1.597100      -2.032900      0.9383000    
 H   -3.907000      -1.248900       1.441300    
 H   -3.329100      0.3960000       1.663600    
 H   -4.623100       1.288000     -0.1670000    
 H    2.093500      0.7789000       1.849500    
 H    1.919800     -0.4496000      -1.996700    
 H  -9.4400004E-02   2.169000      -1.629700    
 H   0.6681000      -2.225200       1.759200    
 H   -5.810900     -0.4349000      0.9040000    
 H   -5.618800      -1.476700     -0.5399000    
 H   -6.630500     -4.1000001E-02 -0.5933000    
 H    3.308000       2.915800       1.896700    
 H    3.549200      -2.269300      -2.274100    
 H    1.124000       4.260100      -1.550500    
 H    2.288100      -3.998300       1.451400    
 H    2.832500       4.663300      0.2015000    
 H    3.743200      -4.048200     -0.5562000    


%chk=000050240-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000050240

0 1
N -4.666060 0.337235 -0.646809
C 0.140889 -0.040991 0.110099
C -0.871014 -0.199115 -1.079054
C -0.615289 -0.078525 1.484474
C -3.359846 -0.296702 -0.321569
C -2.231585 0.543629 -0.973109
C -1.779073 -1.099266 1.624036
C -3.156356 -0.528193 1.204335
C 0.910330 1.308504 0.066292
C 1.172819 -1.193873 -0.034090
C 1.977006 1.515557 0.984404
C 2.045248 -1.191826 -1.157890
C 0.590317 2.365393 -0.823013
C 1.279351 -2.272477 0.880475
C -5.877527 -0.456830 -0.369388
C 2.690258 2.731173 1.020296
C 2.979782 -2.226688 -1.365800
C 1.305239 3.586907 -0.793334
C 2.217893 -3.312716 0.677967
C 2.355853 3.778833 0.129636
C 3.070586 -3.298760 -0.446586
H -1.080111 -1.279040 -1.202989
H -0.355187 0.099356 -2.011206
H -1.025593 0.932180 1.672456
H 0.131487 -0.239770 2.285471
H -3.363926 -1.288234 -0.823582
H -2.124715 1.504955 -0.430600
H -2.586872 0.793860 -1.990955
H -1.846918 -1.406030 2.687257
H -1.566392 -2.023673 1.052097
H -3.953477 -1.210033 1.563138
H -3.312346 0.441044 1.726218
H -4.725357 1.286363 -0.251627
H 2.263518 0.703786 1.663723
H 2.005126 -0.355716 -1.866375
H -0.216360 2.248314 -1.552673
H 0.638104 -2.314422 1.766206
H -6.058296 -0.704620 0.704158
H -5.818828 -1.411692 -0.924792
H -6.764505 0.087286 -0.742188
H 3.511408 2.859745 1.734971
H 3.642021 -2.194516 -2.238665
H 1.039202 4.386419 -1.494690
H 2.280529 -4.132987 1.402713
H 2.909905 4.724014 0.151737
H 3.797061 -4.104158 -0.602673


