%chk=000040036.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040036

0 1
 N   -2.085400      -1.987100      -1.736500    
 C    2.947200       2.180400     -0.5619000    
 C    2.403300       1.056000      -1.442700    
 C    4.287400       1.857400      9.6299998E-02
 C    4.243800      0.7214000       1.116600    
 C    1.728000     -3.9500002E-02 -0.6549000    
 C    3.912100     -0.6421000      0.5109000    
 C    2.436800     -0.8370000      0.2626000    
 C   0.3561000     -0.2744000     -0.8509000    
 C  -0.3065000      -1.280100     -0.1485000    
 C    1.755300      -1.849000      0.9609000    
 C   -1.763500      -1.509600     -0.3696000    
 C   0.3934000      -2.067700      0.7577000    
 C   -2.622300     -0.2972000      8.2000000E-03
 C   -2.941100     -0.1058000       1.331600    
 C   -3.039000      0.5489000     -0.9919000    
 C   -3.722800      0.9972000       1.675200    
 C   -3.820400       1.652000     -0.6483000    
 C   -4.162300       1.876300      0.6853000    
 H    3.099600       3.063100      -1.196000    
 H    2.212700       2.466100      0.2011000    
 H    3.194600      0.6245000      -2.067800    
 H    1.680900       1.496400      -2.142000    
 H    4.643200       2.761100      0.6069000    
 H    5.031300       1.628800     -0.6771000    
 H    3.544000      0.9683000       1.924600    
 H    5.239400      0.6553000       1.573700    
 H    4.265600      -1.414300       1.206400    
 H    4.466500     -0.8071000     -0.4211000    
 H  -0.1857000      0.3368000      -1.569000    
 H    2.284300      -2.477200       1.673900    
 H   -2.093600      -2.329500      0.2846000    
 H  -0.1032000      -2.857200       1.315300    
 H   -3.071200      -2.246500      -1.778500    
 H   -1.565700      -2.845100      -1.920600    
 H   -2.601700     -0.7852000       2.107100    
 H   -2.776400      0.4131000      -2.035800    
 H   -3.988600       1.172100       2.713600    
 H   -4.159300       2.338900      -1.418200    
 H   -4.769800       2.735800      0.9531000    


%chk=000040036-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000040036

0 1
N -2.024414 -1.772625 -1.905202
C 3.051313 2.103148 -0.848067
C 2.541820 0.836327 -1.595487
C 4.343347 1.887089 -0.024412
C 4.230833 0.873698 1.139352
C 1.789171 -0.155336 -0.718329
C 3.902622 -0.581340 0.694688
C 2.435999 -0.825997 0.365480
C 0.420455 -0.408982 -0.967786
C -0.332579 -1.310527 -0.176800
C 1.681594 -1.732158 1.148799
C -1.825270 -1.550956 -0.457722
C 0.314988 -1.977803 0.886247
C -2.689968 -0.368698 0.020465
C -3.147705 -0.327006 1.360788
C -3.024672 0.697355 -0.850606
C -3.915892 0.762647 1.827893
C -3.797540 1.786057 -0.387840
C -4.244286 1.825225 0.953446
H 3.251443 2.892584 -1.600288
H 2.244345 2.486629 -0.192841
H 3.416244 0.341859 -2.070319
H 1.876517 1.153803 -2.420277
H 4.672990 2.863881 0.383874
H 5.148530 1.548805 -0.711277
H 3.463871 1.213766 1.863083
H 5.197727 0.862615 1.681707
H 4.203183 -1.276948 1.501066
H 4.539027 -0.826004 -0.182502
H -0.081075 0.095824 -1.801496
H 2.175657 -2.257899 1.975445
H -2.123518 -2.433700 0.159589
H -0.243555 -2.690240 1.506475
H -2.998606 -1.944177 -2.173038
H -1.373295 -2.449490 -2.312785
H -2.897089 -1.148949 2.043860
H -2.677988 0.650822 -1.888467
H -4.261725 0.781588 2.867897
H -4.051660 2.603755 -1.072565
H -4.843840 2.669657 1.312254


