%chk=000029224.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029224

0 1
 N  -7.9000004E-02 -6.7900002E-02 -0.4241000    
 N    4.769700     -0.1797000      0.4507000    
 C   -1.807100      -1.104200       1.028700    
 C  -0.8322000      -1.297100     -0.1430000    
 C   -2.618900      -2.384600       1.278200    
 C   -1.534500      -1.803000      -1.412400    
 C   -2.718400      0.1048000      0.7901000    
 C   -3.299600      -2.922400      1.9400001E-02
 C   -2.318000      -3.084500      -1.137300    
 C   -1.927100       1.318100      0.3715000    
 C  -0.6545000       1.185900     -0.2289000    
 C    1.232100     -0.2027000      -1.048600    
 C    2.332500     -0.1228000      1.1100000E-02
 C   -2.513200       2.584300      0.5521000    
 C  -1.6000000E-03   2.378500     -0.6019000    
 C    3.739400     -0.2405000     -0.5789000    
 C   -1.841700       3.738500      0.1668000    
 C  -0.5835000       3.635500     -0.4081000    
 C    6.101000     -0.3159000     -0.1433000    
 C    4.554600      -1.220300       1.457800    
 H   -1.215900     -0.8991000       1.933300    
 H  -0.1139000      -2.070800      0.1643000    
 H   -3.371000      -2.210600       2.056700    
 H   -1.943000      -3.157800       1.666100    
 H  -0.7999000      -1.999000      -2.202500    
 H   -2.211000      -1.037700      -1.812600    
 H   -3.265800      0.3205000       1.716500    
 H   -3.462800     -9.4599999E-02  1.1400000E-02
 H   -1.615500      -3.894300     -0.9042000    
 H   -2.860200      -3.386000      -2.040600    
 H   -4.112600      -2.252200     -0.2822000    
 H   -3.763200      -3.890400      0.2422000    
 H    1.308100      -1.184000      -1.535500    
 H    1.390500      0.5129000      -1.862700    
 H    2.251400      0.8178000      0.5702000    
 H    2.133900     -0.9291000      0.7261000    
 H   -3.500900       2.671200      0.9987000    
 H   0.9890000       2.375100      -1.048000    
 H    3.885000      0.5839000      -1.288400    
 H    3.813200      -1.174000      -1.152900    
 H   -2.298400       4.712200      0.3145000    
 H  -4.8000000E-02   4.531500     -0.7087000    
 H    6.276100      0.4757000     -0.8805000    
 H    6.236500      -1.284800     -0.6378000    
 H    6.877600     -0.2068000      0.6220000    
 H    5.414400      -1.276800       2.136800    
 H    4.418300      -2.213200       1.013900    
 H    3.703000     -0.9899000       2.105300    


%chk=000029224-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029224

0 1
N -0.144172 -0.094946 -0.434385
N 4.845111 -0.173667 0.393114
C -1.954546 -1.097807 0.975812
C -0.935397 -1.321811 -0.172483
C -2.774153 -2.389406 1.233985
C -1.621531 -1.864664 -1.458460
C -2.838712 0.131436 0.662576
C -3.440782 -2.957012 -0.043180
C -2.398058 -3.170848 -1.165827
C -1.990559 1.352536 0.338877
C -0.665549 1.188544 -0.193829
C 1.209216 -0.285384 -0.979020
C 2.333859 -0.192290 0.085470
C -2.493269 2.651244 0.562029
C 0.099187 2.365399 -0.469199
C 3.722549 -0.433839 -0.539607
C -1.740213 3.810866 0.268653
C -0.435479 3.650407 -0.248699
C 6.144021 -0.146670 -0.310560
C 4.870672 -1.094327 1.547346
H -1.373200 -0.862461 1.890817
H -0.219683 -2.100043 0.172615
H -3.541287 -2.186336 2.007572
H -2.099060 -3.164037 1.653943
H -0.854434 -2.039099 -2.238461
H -2.308621 -1.095112 -1.859855
H -3.492806 0.348615 1.528668
H -3.516678 -0.098579 -0.184276
H -1.682949 -3.960958 -0.853068
H -2.891327 -3.534795 -2.087565
H -4.227906 -2.264704 -0.402475
H -3.947641 -3.912120 0.195304
H 1.245985 -1.286183 -1.451849
H 1.401038 0.444106 -1.791743
H 2.325380 0.804278 0.563224
H 2.122793 -0.935701 0.877889
H -3.504573 2.751151 0.978299
H 1.119729 2.284263 -0.853578
H 3.846787 0.252989 -1.401165
H 3.765841 -1.479497 -0.953380
H -2.155292 4.807885 0.448337
H 0.179710 4.529268 -0.475596
H 6.117358 0.612898 -1.112352
H 6.422007 -1.129067 -0.773436
H 6.944669 0.132934 0.397568
H 5.722256 -0.836224 2.201727
H 4.976591 -2.170380 1.249205
H 3.948019 -0.991154 2.142321


