%chk=000058951.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058951

0 1
 N    2.648300     -0.7623000     -0.3285000    
 N   -2.500900       2.020600      9.8800004E-02
 C    1.466700      0.1114000     -0.4616000    
 C    1.897600       1.483900      -1.013600    
 C    2.999100       2.130100     -0.1788000    
 C    3.700600     -0.1941000      0.5213000    
 C    4.164800       1.165300     -1.8000000E-03
 C   0.6236000      0.2715000      0.8131000    
 C    2.312900      -2.120800      8.8699996E-02
 C  -0.7707000      0.7251000      0.4921000    
 C   -1.871000     -0.1154000      0.2314000    
 C    3.504600      -3.048300     -3.1399999E-02
 C   -1.167200       2.025400      0.4081000    
 C   -2.957300      0.7268000     -1.5200000E-02
 C   -2.067700      -1.509600      0.1771000    
 C   -4.235700      0.2425000     -0.3148000    
 C   -3.340900      -2.008400     -0.1213000    
 C   -4.406800      -1.143900     -0.3633000    
 H   0.8342000     -0.3403000      -1.239100    
 H    1.055000       2.172900      -1.114300    
 H    2.280600       1.341100      -2.034100    
 H    2.612100       2.432100      0.8005000    
 H    3.349100       3.043800     -0.6727000    
 H    4.594100     -0.8256000      0.5375000    
 H    3.357000     -9.5100001E-02   1.558700    
 H    4.673400       1.031100     -0.9652000    
 H    4.899500       1.597000      0.6874000    
 H    1.086000      0.9667000       1.523000    
 H   0.5291000     -0.6726000       1.358800    
 H    1.948500      -2.167900       1.120500    
 H    1.518300      -2.512900     -0.5580000    
 H    4.004700      -2.943900      -1.000400    
 H    4.239300      -2.895900      0.7648000    
 H    3.168800      -4.088400      5.0299998E-02
 H  -0.6386000       2.958800      0.5425000    
 H   -3.069200       2.846900     -2.6799999E-02
 H   -1.247700      -2.197900      0.3613000    
 H   -5.066000      0.9147000     -0.5033000    
 H   -3.498300      -3.082800     -0.1650000    
 H   -5.387300      -1.552900     -0.5935000    


%chk=000058951-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058951

0 1
N 2.695432 -0.803158 -0.135036
N -2.617914 2.102417 0.390929
C 1.458872 -0.002557 -0.360496
C 1.820834 1.297418 -1.120688
C 2.933101 2.104585 -0.409996
C 3.755583 -0.077084 0.601525
C 4.164697 1.207501 -0.149258
C 0.627598 0.290872 0.951715
C 2.452470 -2.180482 0.354693
C -0.774736 0.765951 0.670002
C -1.888342 -0.054263 0.213020
C 3.575102 -3.164480 -0.033698
C -1.263866 2.069530 0.767197
C -3.029168 0.810460 0.046582
C -2.036331 -1.441257 -0.058762
C -4.287242 0.332097 -0.382582
C -3.288020 -1.925747 -0.485295
C -4.401458 -1.047838 -0.647708
H 0.807035 -0.609061 -1.020845
H 0.908433 1.909855 -1.245136
H 2.173471 1.015122 -2.131441
H 2.559725 2.507072 0.554206
H 3.216388 2.979684 -1.025852
H 4.632982 -0.741756 0.697177
H 3.439319 0.187506 1.644493
H 4.621889 0.919886 -1.115883
H 4.930117 1.752710 0.436990
H 1.159968 1.035090 1.572180
H 0.584626 -0.642878 1.547144
H 2.303652 -2.218054 1.464296
H 1.505121 -2.529760 -0.101591
H 3.715629 -3.166942 -1.128599
H 4.539711 -2.897967 0.434845
H 3.318911 -4.189355 0.294623
H -0.749068 2.976114 1.081823
H -3.207074 2.931454 0.381991
H -1.190589 -2.127507 0.066217
H -5.146621 1.001095 -0.505632
H -3.415188 -2.993263 -0.697304
H -5.362447 -1.454307 -0.982644


