%chk=000090997.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090997

0 1
 N    3.631200      0.2048000     -0.5234000    
 N    6.147500      0.8964000      0.7208000    
 N   2.6000000E-03  0.5652000      -1.318400    
 C    4.856500      0.3600000      -1.317000    
 C    3.682400       1.058400      0.6697000    
 C    6.096500      4.4399999E-02 -0.4735000    
 C    4.921800      0.7418000       1.513800    
 C    2.449500      0.5077000      -1.328400    
 C    1.181700      0.2457000     -0.5209000    
 C   -1.217100      0.3108000     -0.5655000    
 C    7.328600      0.5914000       1.526000    
 C   -2.443800      0.7845000      -1.376700    
 C   -1.301700      -1.148500     -0.1520000    
 C   -3.638800       1.114200     -0.5114000    
 C   -1.891800      -1.469500       1.054900    
 C  -0.7860000      -2.114400     -0.9940000    
 C   -4.555300      0.1191000     -0.2150000    
 C   -3.793200       2.404400     -3.2699998E-02
 C   -1.969400      -2.809400       1.434700    
 C  -0.8636000      -3.454300     -0.6140000    
 C   -1.455300      -3.801900      0.6003000    
 C   -5.657900      0.4231000      0.5834000    
 C   -4.895900       2.708300      0.7657000    
 C   -5.828300       1.717700       1.073700    
 H    4.836300     -0.3295000      -2.169800    
 H    4.935000       1.378300      -1.721700    
 H    3.678400       2.122400      0.3973000    
 H    2.836200      0.8806000       1.338500    
 H    6.093300      -1.018600     -0.1964000    
 H    6.986400      0.2178000      -1.090700    
 H    4.944400       1.431100       2.366800    
 H    4.843600     -0.2766000       1.918700    
 H    2.470600       1.547900      -1.680700    
 H    2.437900     -0.1362000      -2.217600    
 H    1.136500      0.8933000      0.3594000    
 H    1.218600     -0.7888000     -0.1678000    
 H   -1.163500      0.9229000      0.3471000    
 H   3.9400000E-02   1.543100      -1.605100    
 H    8.242600      0.7518000      0.9435000    
 H    7.327900     -0.4428000       1.888700    
 H    7.386500       1.260300       2.392000    
 H   -2.193700       1.691600      -1.945600    
 H   -2.725600      4.1400000E-02  -2.135300    
 H   -2.286000     -0.7053000       1.717900    
 H  -0.3457000      -1.880500      -1.958500    
 H   -4.439200     -0.8898000     -0.5998000    
 H   -3.071200       3.182100     -0.2645000    
 H   -2.428500      -3.079700       2.381100    
 H  -0.4693000      -4.227800      -1.266600    
 H   -1.516900      -4.845300      0.8955000    
 H   -6.384900     -0.3478000      0.8214000    
 H   -5.028200       3.716200       1.148100    
 H   -6.687000       1.954500       1.695100    


%chk=000090997-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090997

0 1
N 3.791922 0.398673 -0.356508
N 6.537935 0.768959 0.517696
N 0.060837 0.676876 -1.019334
C 4.932869 0.215673 -1.289479
C 4.144180 1.404081 0.678574
C 6.188286 -0.228211 -0.522166
C 5.400803 0.965149 1.447618
C 2.528845 0.697670 -1.067594
C 1.275688 0.429894 -0.210970
C -1.230262 0.475625 -0.320165
C 7.788556 0.432031 1.222678
C -2.368333 0.997296 -1.263297
C -1.436570 -0.999931 0.035724
C -3.729847 1.076034 -0.592928
C -2.036354 -1.372098 1.262311
C -1.069500 -2.014714 -0.884100
C -4.661473 0.011576 -0.694729
C -4.088784 2.216633 0.172102
C -2.271764 -2.732943 1.566574
C -1.300758 -3.374454 -0.583251
C -1.905030 -3.739344 0.644099
C -5.917609 0.083971 -0.051148
C -5.342515 2.293700 0.819201
C -6.263098 1.225375 0.708813
H 4.662893 -0.559971 -2.030129
H 5.167676 1.160445 -1.843138
H 4.335457 2.407508 0.217881
H 3.305068 1.506886 1.389256
H 5.996643 -1.237638 -0.075272
H 7.037573 -0.319485 -1.225559
H 5.674749 1.747116 2.181075
H 5.165510 0.026393 2.012308
H 2.505789 1.757913 -1.442507
H 2.469597 0.043630 -1.957278
H 1.294892 1.050471 0.718734
H 1.285776 -0.627026 0.107649
H -1.285801 1.067113 0.628970
H 0.094000 1.601202 -1.473049
H 8.616819 0.354291 0.495293
H 7.732940 -0.533458 1.788150
H 8.038723 1.233868 1.940843
H -2.072396 2.008350 -1.612936
H -2.397599 0.339195 -2.150603
H -2.326234 -0.594135 1.979462
H -0.582360 -1.716852 -1.819944
H -4.396371 -0.879656 -1.275680
H -3.383453 3.054100 0.252704
H -2.737740 -3.005940 2.520337
H -1.006585 -4.150594 -1.299573
H -2.082142 -4.795014 0.880041
H -6.624922 -0.748236 -0.142618
H -5.604153 3.184849 1.401439
H -7.238273 1.283654 1.205526


