%chk=000051946.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051946

1 1
 N    1.353900     -2.3499999E-02  0.2103000    
 C    1.769800      -1.313300      0.9116000    
 C    1.790600       1.197500       1.015000    
 C    2.052900      2.7100001E-02  -1.146700    
 C  -0.1708000     -5.5999998E-03  7.6700002E-02
 C    1.326700      -2.558100      0.2217000    
 C    1.457200       2.503600      0.3790000    
 C    3.541000      6.3100003E-02  -1.069900    
 C  -0.8874000     -5.5700000E-02   1.225300    
 C  -0.6755000      5.9099998E-02  -1.178700    
 C   -2.276800     -3.9500002E-02   1.103700    
 C   -2.065000      7.5300001E-02  -1.300200    
 C   -2.865600      2.6100000E-02 -0.1590000    
 C   -4.351000      4.4000000E-02 -0.2889000    
 H    2.855400      -1.302700       1.048700    
 H    1.361700      -1.289000       1.929100    
 H    1.324100       1.136600       2.005200    
 H    2.865000       1.116000       1.211000    
 H    1.752400     -0.8451000      -1.737300    
 H    1.724400      0.9238000      -1.684000    
 H    1.592600      -3.425800      0.8370000    
 H   0.2461000      -2.612600      6.4900003E-02
 H    1.822900      -2.709200     -0.7408000    
 H    1.701800       3.316800       1.072500    
 H    2.038600       2.696900     -0.5267000    
 H   0.3961000       2.610600      0.1375000    
 H    3.946500      9.3800001E-02  -2.089000    
 H    3.936300      0.9516000     -0.5717000    
 H    3.979200     -0.8243000     -0.6074000    
 H  -0.4592000     -0.1077000       2.218600    
 H  -0.1246000      9.4599999E-02  -2.107100    
 H   -2.890100     -7.6600000E-02   2.000200    
 H   -2.513400      0.1274000      -2.289100    
 H   -4.671600     -0.4301000      -1.222900    
 H   -4.826100     -0.5077000      0.5294000    
 H   -4.716900       1.075400     -0.2754000    


%chk=000051946-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051946

1 1
N 1.381618 -0.021671 0.189561
C 1.801636 -1.314598 0.959167
C 1.824178 1.196707 1.060000
C 2.095815 0.028591 -1.185814
C -0.140717 -0.003020 0.027991
C 1.479593 -2.618670 0.226351
C 1.506250 2.560899 0.444746
C 3.627368 0.031505 -1.129983
C -0.937692 -0.025437 1.196341
C -0.758177 0.030818 -1.240058
C -2.342374 -0.011775 1.089245
C -2.168225 0.043720 -1.329107
C -2.989365 0.026865 -0.174521
C -4.499314 0.070022 -0.281584
H 2.880971 -1.216759 1.160575
H 1.273215 -1.271074 1.924753
H 1.309063 1.076740 2.026284
H 2.904634 1.071111 1.238233
H 1.735799 -0.845511 -1.749706
H 1.729106 0.936230 -1.689264
H 1.705167 -3.457553 0.907984
H 0.412429 -2.689634 -0.042433
H 2.091416 -2.766474 -0.679186
H 1.748700 3.337125 1.191699
H 2.106904 2.780906 -0.453828
H 0.436563 2.664174 0.196944
H 3.993478 0.058334 -2.171708
H 4.044555 0.918046 -0.624171
H 4.049928 -0.876367 -0.668332
H -0.496214 -0.056045 2.198077
H -0.187702 0.044399 -2.170352
H -2.944142 -0.031974 2.004219
H -2.633189 0.067081 -2.320656
H -4.855161 -0.391447 -1.218009
H -4.983478 -0.448438 0.563086
H -4.861436 1.115971 -0.273943


