%chk=000065945.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065945

0 1
 N  -0.3286000     -0.4444000      -1.097400    
 N   0.8090000       1.574800       1.122100    
 N    2.387200       1.227400     -0.4964000    
 C   0.7639000     -0.5707000     -0.1289000    
 C   0.1099000      -1.179300       1.192200    
 C   -1.478500     -0.4302000     -0.2934000    
 C    1.847400      -1.488100     -0.6843000    
 C   -1.334600     -0.8453000       1.003100    
 C  -0.6486000      0.5407000      -2.124500    
 C    1.352700      0.7845000      0.1629000    
 C   -2.605800      0.1221000     -0.8429000    
 C   -2.226400      0.5850000      -2.209200    
 C    2.973500      -1.692100      0.3250000    
 C   -2.449200     -0.8187000       1.809500    
 C   -3.741200      0.1624000     -6.7699999E-02
 C    1.547000       2.800400       1.198700    
 C   -3.658700     -0.3231000       1.261300    
 C    2.614200       2.579800      0.1091000    
 C    4.066900      -2.585200     -0.2392000    
 H   0.5200000     -0.7661000       2.118100    
 H   0.2063000      -2.271300       1.214700    
 H    2.254000      -1.091600      -1.624300    
 H    1.411200      -2.463000     -0.9416000    
 H  -0.2094000      0.2737000      -3.090800    
 H  -0.2810000       1.536300      -1.845500    
 H   -2.591900     -0.1182000      -2.964500    
 H   -2.576400       1.596900      -2.430300    
 H    2.591200      -2.163800       1.237000    
 H    3.437600     -0.7503000      0.6307000    
 H   -2.407300      -1.141100       2.843900    
 H  -1.4700000E-02   1.393700       1.680700    
 H   -4.670700      0.5741000     -0.4448000    
 H    2.002800       2.932800       2.184200    
 H   0.9152000       3.663700      0.9706000    
 H   -4.545900     -0.2883000       1.890200    
 H    2.538600       3.343800     -0.6720000    
 H    3.622100       2.621700      0.5352000    
 H    3.670100      -3.568600     -0.5107000    
 H    4.517700      -2.137600      -1.130700    
 H    4.857800      -2.732500      0.5031000    


%chk=000065945-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065945

0 1
N -0.345726 -0.505751 -1.024119
N 0.609422 1.649504 1.058093
N 2.464840 1.301620 -0.254482
C 0.840866 -0.624601 -0.071741
C 0.142386 -1.283486 1.212170
C -1.488939 -0.445426 -0.227723
C 1.947920 -1.510695 -0.680048
C -1.329096 -0.861876 1.097180
C -0.568813 0.468287 -2.143248
C 1.355390 0.787888 0.246402
C -2.600658 0.173516 -0.804721
C -2.152361 0.585177 -2.215747
C 3.101476 -1.872139 0.283115
C -2.466262 -0.738619 1.924285
C -3.736219 0.295570 0.024477
C 1.238520 2.989189 1.087465
C -3.660603 -0.178533 1.371454
C 2.555766 2.713473 0.265366
C 4.149346 -2.778933 -0.397509
H 0.634944 -0.969623 2.147611
H 0.238967 -2.384100 1.133698
H 2.375035 -0.985853 -1.555255
H 1.457316 -2.433673 -1.047193
H -0.134968 0.107277 -3.089664
H -0.115008 1.454096 -1.902533
H -2.545984 -0.120843 -2.973010
H -2.469943 1.600568 -2.510447
H 2.702520 -2.385501 1.181306
H 3.585206 -0.938720 0.624248
H -2.447010 -1.039377 2.978385
H -0.321757 1.438718 1.416021
H -4.660224 0.766780 -0.330593
H 1.448915 3.317405 2.121974
H 0.593964 3.751299 0.606349
H -4.542351 -0.080045 2.014691
H 2.673004 3.411523 -0.582269
H 3.458008 2.803980 0.898129
H 3.695647 -3.727313 -0.743905
H 4.589271 -2.275366 -1.278707
H 4.974591 -3.031095 0.293695


