%chk=000025874.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025874

0 1
 N   -2.789400       1.302200      0.2983000    
 N    3.058000       3.028700       1.111800    
 C    1.639100       1.218600     -0.2098000    
 C   0.1548000       1.733400     -0.2319000    
 C    2.203700       1.133600      -1.691500    
 C  -0.5220000       1.843500       1.150500    
 C   -1.992000       2.263900       1.058900    
 C   -2.727000     -2.6200000E-02  0.9240000    
 C   -4.178100       1.767600      0.1772000    
 C    1.690100     -0.1888000      0.4302000    
 C   -3.516100      -1.055300      0.1134000    
 C   -5.014700      0.7970000     -0.6580000    
 C   -4.962000     -0.6147000     -8.5299999E-02
 C    3.665300      0.6620000      -1.785100    
 C    2.069000       2.456500      -2.469400    
 C    1.003500      -1.238400     -0.1430000    
 C    2.437900       2.230400      0.5406000    
 C    2.448400     -0.2922000       1.570500    
 C    1.090900      -2.501000      0.4902000    
 C    2.534700      -1.534000       2.192800    
 C   0.2340000      -1.107200      -1.310300    
 C    1.860900      -2.632200       1.657300    
 C   0.4059000      -3.595400     -6.2700003E-02
 C  -0.4402000      -2.205100      -1.845700    
 C  -0.3546000      -3.446700      -1.223000    
 H   0.1581000       2.760800     -0.6253000    
 H  -0.5114000       1.210700     -0.9079000    
 H    1.689800      0.4241000      -2.328900    
 H  -0.4039000      0.9302000       1.739000    
 H  -4.9000001E-03   2.618900       1.730800    
 H   -2.038500       3.246500      0.5723000    
 H   -2.390500       2.390700       2.074000    
 H   -3.112300      6.6000000E-03   1.951700    
 H   -1.707100     -0.4129000      0.9701000    
 H   -4.200000       2.747000     -0.3159000    
 H   -4.637200       1.890400       1.167100    
 H   -3.046600      -1.191700     -0.8677000    
 H   -3.491000      -2.026800      0.6198000    
 H   -6.054200       1.141900     -0.6959000    
 H   -4.643100      0.7865000      -1.690500    
 H   -5.479400      -1.311600     -0.7536000    
 H   -5.487700     -0.6394000      0.8771000    
 H    3.798800     -0.3296000      -1.342200    
 H    3.983200      0.5900000      -2.831600    
 H    4.347300       1.356200      -1.283900    
 H    2.569200       3.286700      -1.961800    
 H    2.521100       2.365700      -3.464100    
 H    1.020700       2.724000      -2.630400    
 H    2.996500      0.5122000       2.042200    
 H    3.126400      -1.650300       3.096400    
 H   5.3599998E-02 -0.2175000      -1.884900    
 H    1.942300      -3.593300       2.160700    
 H   0.4582000      -4.575200      0.4075000    
 H   -1.038200      -2.091700      -2.745600    
 H  -0.8814000      -4.300500      -1.639100    


%chk=000025874-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000025874

0 1
N -2.870880 1.291020 0.392803
N 2.969153 3.138948 0.968107
C 1.591785 1.194839 -0.260722
C 0.087931 1.660414 -0.135671
C 2.097336 1.205838 -1.777030
C -0.506958 1.526554 1.280511
C -1.971867 2.014528 1.330646
C -3.124924 -0.112168 0.813435
C -4.146615 2.024536 0.183736
C 1.848520 -0.193867 0.399931
C -3.967803 -0.866958 -0.234792
C -5.017337 1.341180 -0.890084
C -5.297824 -0.130704 -0.510138
C 3.600579 0.855196 -1.880636
C 1.805416 2.544186 -2.495423
C 1.184968 -1.411646 -0.044372
C 2.377001 2.243451 0.446138
C 2.765873 -0.283285 1.457832
C 1.512743 -2.667154 0.619411
C 3.077855 -1.515652 2.105104
C 0.208776 -1.477129 -1.101405
C 2.463472 -2.692672 1.690590
C 0.880581 -3.886783 0.204404
C -0.393109 -2.678969 -1.481061
C -0.056109 -3.902830 -0.827677
H 0.030116 2.722461 -0.439411
H -0.552473 1.105601 -0.840257
H 1.531663 0.408527 -2.293331
H -0.437081 0.480085 1.629817
H 0.080818 2.133293 1.997926
H -1.998660 3.086739 1.051681
H -2.342906 1.946304 2.386284
H -3.657150 -0.137313 1.802880
H -2.157368 -0.626628 0.947729
H -3.904969 3.059083 -0.125494
H -4.734517 2.092555 1.139025
H -3.382669 -0.941069 -1.172614
H -4.155767 -1.897855 0.122325
H -5.964134 1.902866 -1.008205
H -4.481756 1.377960 -1.858864
H -5.865866 -0.638343 -1.312831
H -5.930014 -0.160083 0.401790
H 3.829612 -0.120829 -1.418959
H 3.902058 0.808601 -2.942869
H 4.223212 1.624496 -1.386926
H 2.291748 3.391643 -1.977603
H 2.208514 2.505318 -3.523844
H 0.724899 2.757017 -2.570375
H 3.270861 0.623281 1.806055
H 3.803693 -1.521389 2.924995
H -0.091454 -0.569591 -1.625442
H 2.693055 -3.649718 2.173575
H 1.151548 -4.814351 0.722998
H -1.133093 -2.680899 -2.289173
H -0.532583 -4.839834 -1.135122


