%chk=000047671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047671

0 1
 N    1.669200      -1.864300      0.1891000    
 N   0.4704000      -1.202700      0.2353000    
 N  -0.4665000      -1.789700     -0.3486000    
 N   -6.156200       1.862500      0.1483000    
 C    2.719000      -1.320400       1.026400    
 C    3.192900      2.0400001E-02  0.5319000    
 C    4.238600      8.2800001E-02 -0.3787000    
 C    2.577200       1.175400      0.9940000    
 C    2.040700      -2.728700     -0.9179000    
 C    4.677100       1.325400     -0.8368000    
 C    3.016100       2.417700      0.5359000    
 C    4.065800       2.493000     -0.3797000    
 C   -1.640000      -1.036300     -0.2461000    
 C   -1.946000     -8.6000003E-02  -1.220200    
 C   -2.504300      -1.234800      0.8306000    
 C   -3.116800      0.6655000      -1.118000    
 C   -3.675000     -0.4831000      0.9328000    
 C   -3.981600      0.4669000     -4.1499998E-02
 C   -5.180800       1.236600      6.3100003E-02
 H    3.548700      -2.034700       1.090700    
 H    2.323400      -1.228600       2.046200    
 H    4.721200     -0.8203000     -0.7411000    
 H    1.759300       1.129800       1.707500    
 H    2.842300      -3.402500     -0.6014000    
 H    2.385200      -2.111200      -1.751600    
 H    1.193500      -3.341100      -1.237000    
 H    5.494400       1.383700      -1.549700    
 H    2.540200       3.326700      0.8920000    
 H    4.407100       3.460300     -0.7364000    
 H   -1.278800      7.5599998E-02  -2.063100    
 H   -2.274800      -1.973300       1.594400    
 H   -3.341700       1.402300      -1.885500    
 H   -4.338900     -0.6495000       1.778000    


%chk=000047671-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000047671

0 1
N 1.476064 -1.082708 0.365318
N 0.205782 -0.649691 0.553837
N -0.682484 -1.301767 -0.178093
N -7.291807 0.589606 0.438880
C 2.509129 -0.406954 1.171709
C 3.543856 0.338438 0.331391
C 4.927219 0.123269 0.542462
C 3.132903 1.274572 -0.651869
C 1.809849 -2.171663 -0.569079
C 5.889431 0.835672 -0.210598
C 4.091370 1.983284 -1.407829
C 5.473010 1.766956 -1.188300
C -2.017936 -0.839293 0.018076
C -2.413482 0.207818 0.903713
C -3.010574 -1.505836 -0.752379
C -3.764424 0.570190 1.008671
C -4.363844 -1.144338 -0.649024
C -4.757284 -0.099640 0.234583
C -6.140060 0.275960 0.345722
H 3.018386 -1.150449 1.816059
H 1.958721 0.288207 1.830249
H 5.254588 -0.601045 1.299334
H 2.062899 1.443721 -0.823272
H 2.904576 -2.281974 -0.598984
H 1.427237 -1.939884 -1.578535
H 1.333625 -3.115765 -0.246853
H 6.957218 0.661952 -0.037230
H 3.764557 2.705058 -2.164652
H 6.216022 2.318375 -1.774973
H -1.651817 0.720834 1.497458
H -2.690799 -2.306767 -1.426196
H -4.068898 1.373022 1.688177
H -5.122134 -1.661759 -1.244869


