%chk=000046831.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046831

0 1
 N  -0.9412000       0.000000     -0.7537000    
 C   0.9916000       1.166600      0.3345000    
 C   0.9916000      -1.166600      0.3348000    
 C    1.173900      1.9999999E-04   1.300800    
 C  -0.4844000       1.258900     -0.1425000    
 C  -0.4843000      -1.258800     -0.1425000    
 C    1.923800      0.7672000     -0.8251000    
 C    1.924000     -0.7674000     -0.8248000    
 C   -1.389800       1.802200      0.9726000    
 C   -1.389900      -1.802300      0.9724000    
 C   -2.315200       0.000000      -1.226400    
 H    1.308600       2.117300      0.7766000    
 H    1.308400      -2.117300      0.7771000    
 H    2.186200      1.9999999E-04   1.724100    
 H   0.4686000      3.0000001E-04   2.134300    
 H  -0.5016000       2.017200     -0.9381000    
 H  -0.5013000      -2.017100     -0.9381000    
 H    2.940500       1.130900     -0.6338000    
 H    1.605400       1.178800      -1.788300    
 H    1.606000      -1.179500      -1.787900    
 H    2.940800      -1.130700     -0.6329000    
 H   -2.388100       2.042700      0.5926000    
 H   -1.507000       1.102200       1.802300    
 H  -0.9747000       2.730500       1.380900    
 H   -2.388300      -2.042800      0.5923000    
 H  -0.9748000      -2.730600       1.380700    
 H   -1.507100      -1.102400       1.802300    
 H   -2.507700     -0.8772000      -1.854200    
 H   -2.507800      0.8770000      -1.854300    
 H   -3.043500       0.000000     -0.4092000    


%chk=000046831-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000046831

0 1
N -0.909768 -0.000041 -0.708906
C 0.997059 1.190668 0.342386
C 0.997080 -1.190639 0.342504
C 1.195602 0.000064 1.316389
C -0.495945 1.283676 -0.086402
C -0.495909 -1.283708 -0.086320
C 1.897947 0.784044 -0.863610
C 1.898020 -0.784127 -0.863481
C -1.408352 1.805829 1.063660
C -1.408319 -1.805843 1.063752
C -2.215482 -0.000078 -1.373409
H 1.297440 2.159951 0.782496
H 1.297455 -2.159879 0.782717
H 2.223930 0.000091 1.725483
H 0.498546 0.000109 2.172274
H -0.551753 2.043713 -0.897932
H -0.551675 -2.043790 -0.897810
H 2.921589 1.180582 -0.724828
H 1.503300 1.190328 -1.811377
H 1.503535 -1.190620 -1.811226
H 2.921689 -1.180536 -0.724512
H -2.461897 1.862965 0.733715
H -1.368930 1.160739 1.958861
H -1.095169 2.824018 1.363902
H -2.461876 -1.862909 0.733830
H -1.095188 -2.824059 1.363952
H -1.368836 -1.160784 1.958971
H -2.301459 -0.894587 -2.020251
H -2.301477 0.894382 -2.020319
H -3.098458 -0.000059 -0.688009


